*HEADER    TRANSFERASE                             10-DEC-12   2M1Z              
*TITLE     SOLUTION STRUCTURE OF UNCHARACTERIZED PROTEIN LMO0427                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LMO0427 PROTEIN;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES EGD-E;                   
*SOURCE   3 ORGANISM_TAXID: 169963;                                              
*SOURCE   4 STRAIN: ATCC BAA-679 / EGD-E;                                        
*SOURCE   5 GENE: LMO0427;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PBR322                                    
*KEYWDS    HOMOLOG PTS SYSTEM IIB COMPONENT, TRANSFERASE                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.ZHANG, J.WINSOR, I.RADHAKRISHNAN, W.ANDERSON                        
*REVDAT   1   26-DEC-12 2M1Z    0                                                


 ASSI {    1}
   (( segid "    " and resid 34   and name HD21))
   (( segid "    " and resid 34   and name HB2 ))
      4.100     2.100     1.900 peak     1 spectrum    1 weight  0.10000E+01 volume  0.17959E-03 ppm1      5.713 ppm2      2.826 CV     1
 ASSI {    2}
   (( segid "    " and resid 34   and name HD21))
   (( segid "    " and resid 32   and name HB2 ))
      4.200     2.200     1.800 peak     2 spectrum    1 weight  0.10000E+01 volume  0.10589E-03 ppm1      5.718 ppm2      2.356 CV     1
 ASSI {    3}
   (( segid "    " and resid 34   and name HD21))
   (  segid "    " and resid 96   and name HG2%)
      4.100     2.100     1.900 peak     3 spectrum    1 weight  0.10000E+01 volume  0.29565E-03 ppm1      5.720 ppm2      0.732 CV     1
 OR {    3}
   (( segid "    " and resid 34   and name HD21))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {    4}
   (( segid "    " and resid 34   and name HD21))
   (( segid "    " and resid 34   and name HB3 ))
      4.000     2.000     2.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.38290E-03 ppm1      5.720 ppm2      2.107 CV     1
 ASSI {    7}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HD3 ))
      3.400     1.400     1.400 peak     7 spectrum    1 weight  0.10000E+01 volume  0.15248E-02 ppm1      6.303 ppm2      4.400 CV     1
 ASSI {   10}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      2.500     0.800     0.800 peak    10 spectrum    1 weight  0.10000E+01 volume  0.40832E-02 ppm1      6.303 ppm2      7.436 CV     1
 ASSI {   12}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.000     1.000 peak    12 spectrum    1 weight  0.10000E+01 volume  0.20501E-02 ppm1      6.304 ppm2      3.313 CV     1
 ASSI {   14}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HG12))
      3.100     1.200     1.200 peak    14 spectrum    1 weight  0.10000E+01 volume  0.43119E-02 ppm1      6.304 ppm2      1.694 CV     1
 ASSI {   15}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      3.300     1.300     1.300 peak    15 spectrum    1 weight  0.10000E+01 volume  0.33292E-02 ppm1      6.304 ppm2      0.864 CV     1
 OR {   15}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI {   16}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      3.800     1.800     1.800 peak    16 spectrum    1 weight  0.10000E+01 volume  0.43373E-03 ppm1      6.305 ppm2      7.869 CV     1
 ASSI {   17}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HG13))
      2.700     0.900     0.900 peak    17 spectrum    1 weight  0.10000E+01 volume  0.20077E-02 ppm1      6.306 ppm2      0.527 CV     1
 ASSI {   21}
   (( segid "    " and resid 41   and name HE21))
   (  segid "    " and resid 46   and name HD1%)
      3.500     1.600     1.600 peak    21 spectrum    1 weight  0.10000E+01 volume  0.63450E-03 ppm1      6.693 ppm2      0.777 CV     1
 ASSI {   22}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 69   and name HA  ))
      6.000     5.100     0.000 peak    22 spectrum    1 weight  0.10000E+01 volume  0.91492E-04 ppm1      6.695 ppm2      3.324 CV     1
 ASSI {   23}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 41   and name HG3 ))
      3.500     1.600     1.600 peak    23 spectrum    1 weight  0.10000E+01 volume  0.48711E-03 ppm1      6.695 ppm2      2.366 CV     1
 ASSI {   24}
   (( segid "    " and resid 41   and name HE21))
   (  segid "    " and resid 69   and name HG2%)
      4.400     2.400     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.49981E-03 ppm1      6.695 ppm2      0.382 CV     1
 ASSI {   25}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 41   and name HE22))
      2.200     0.600     0.600 peak    25 spectrum    1 weight  0.10000E+01 volume  0.50744E-02 ppm1      6.696 ppm2      9.374 CV     1
 ASSI {   27}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.700     1.800     1.800 peak    27 spectrum    1 weight  0.10000E+01 volume  0.44475E-03 ppm1      6.831 ppm2      3.985 CV     1
 ASSI {   28}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.800     1.800     1.800 peak    28 spectrum    1 weight  0.10000E+01 volume  0.44729E-03 ppm1      6.832 ppm2      4.158 CV     1
 ASSI {   29}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HG3 ))
      3.900     1.900     1.900 peak    29 spectrum    1 weight  0.10000E+01 volume  0.58113E-03 ppm1      6.833 ppm2      2.365 CV     1
 OR {   29}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI {   30}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      4.200     2.200     1.800 peak    30 spectrum    1 weight  0.10000E+01 volume  0.60147E-03 ppm1      6.833 ppm2      2.926 CV     1
 ASSI {   31}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HD3 ))
      3.000     1.100     1.100 peak    31 spectrum    1 weight  0.10000E+01 volume  0.44390E-02 ppm1      6.833 ppm2      2.543 CV     1
 ASSI {   32}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.900     1.000     1.000 peak    32 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      6.834 ppm2      3.766 CV     1
 ASSI {   33}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.100     1.200     1.200 peak    33 spectrum    1 weight  0.10000E+01 volume  0.11775E-02 ppm1      6.834 ppm2      2.012 CV     1
 OR {   33}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB3 ))
 ASSI {   34}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
      2.800     1.000     1.000 peak    34 spectrum    1 weight  0.10000E+01 volume  0.27786E-02 ppm1      6.834 ppm2      1.591 CV     1
 ASSI {   35}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG3 ))
      3.400     1.400     1.400 peak    35 spectrum    1 weight  0.10000E+01 volume  0.21602E-02 ppm1      6.834 ppm2      1.466 CV     1
 ASSI {   36}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      3.500     1.500     1.500 peak    36 spectrum    1 weight  0.10000E+01 volume  0.22618E-02 ppm1      6.834 ppm2      0.909 CV     1
 ASSI {   38}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB3 ))
      2.500     0.800     0.800 peak    38 spectrum    1 weight  0.10000E+01 volume  0.34479E-02 ppm1      6.835 ppm2      0.585 CV     1
 ASSI {   39}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      3.100     1.200     1.200 peak    39 spectrum    1 weight  0.10000E+01 volume  0.12283E-02 ppm1      6.835 ppm2      9.956 CV     1
 ASSI {   40}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HE  ))
      2.300     0.700     0.700 peak    40 spectrum    1 weight  0.10000E+01 volume  0.56422E-02 ppm1      6.836 ppm2      7.216 CV     1
 ASSI {   41}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HD2 ))
      3.500     1.500     1.500 peak    41 spectrum    1 weight  0.10000E+01 volume  0.68279E-03 ppm1      6.836 ppm2      3.294 CV     1
 ASSI {   42}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      3.800     1.800     1.800 peak    42 spectrum    1 weight  0.10000E+01 volume  0.66839E-03 ppm1      6.838 ppm2      8.377 CV     1
 ASSI {   45}
   (( segid "    " and resid 71   and name HD21))
   (  segid "    " and resid 46   and name HD1%)
      5.300     3.500     0.700 peak    45 spectrum    1 weight  0.10000E+01 volume  0.24059E-03 ppm1      6.846 ppm2      0.794 CV     1
 ASSI {   47}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 71   and name HB3 ))
      4.000     2.000     2.000 peak    47 spectrum    1 weight  0.10000E+01 volume  0.26092E-03 ppm1      6.848 ppm2      2.722 CV     1
 ASSI {   48}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 71   and name HD22))
      1.900     0.400     0.400 peak    48 spectrum    1 weight  0.10000E+01 volume  0.14232E-01 ppm1      6.849 ppm2      7.844 CV     1
 ASSI {   49}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 71   and name HB2 ))
      4.100     2.200     1.900 peak    49 spectrum    1 weight  0.10000E+01 volume  0.18553E-03 ppm1      6.849 ppm2      2.910 CV     1
 ASSI {   50}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 48   and name HB2 ))
      4.700     2.700     1.300 peak    50 spectrum    1 weight  0.10000E+01 volume  0.39477E-03 ppm1      6.855 ppm2      3.399 CV     1
 ASSI {   53}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 48   and name HB3 ))
      4.700     2.700     1.300 peak    53 spectrum    1 weight  0.10000E+01 volume  0.42187E-03 ppm1      6.856 ppm2      2.835 CV     1
 ASSI {   54}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 37   and name HD3 ))
      3.400     1.400     1.400 peak    54 spectrum    1 weight  0.10000E+01 volume  0.45915E-03 ppm1      6.856 ppm2      1.468 CV     1
 OR {   54}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 37   and name HD2 ))
 ASSI {   55}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 38   and name HN  ))
      3.600     1.600     1.600 peak    55 spectrum    1 weight  0.10000E+01 volume  0.25753E-03 ppm1      6.858 ppm2      8.752 CV     1
 ASSI {   56}
   (( segid "    " and resid 23   and name HE21))
   (( segid "    " and resid 23   and name HE22))
      2.200     0.600     0.600 peak    56 spectrum    1 weight  0.10000E+01 volume  0.58113E-02 ppm1      6.916 ppm2      7.354 CV     1
 ASSI {   57}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 97   and name HN  ))
      4.600     2.600     1.400 peak    57 spectrum    1 weight  0.10000E+01 volume  0.16519E-03 ppm1      6.960 ppm2      8.727 CV     1
 ASSI {   58}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 97   and name HD22))
      1.900     0.400     0.400 peak    58 spectrum    1 weight  0.10000E+01 volume  0.15164E-01 ppm1      6.965 ppm2      7.195 CV     1
 ASSI {   59}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 97   and name HB3 ))
      3.900     1.900     1.900 peak    59 spectrum    1 weight  0.10000E+01 volume  0.75990E-03 ppm1      6.966 ppm2      2.572 CV     1
 ASSI {   63}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 52   and name HG3 ))
      3.100     3.100     2.900 peak    63 spectrum    1 weight  0.10000E+01 volume  0.19145E-02 ppm1      6.976 ppm2      2.220 CV     1
 ASSI {   64}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 56   and name HD22))
      1.900     0.400     0.400 peak    64 spectrum    1 weight  0.10000E+01 volume  0.13554E-01 ppm1      6.980 ppm2      7.513 CV     1
 ASSI {   65}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 53   and name HA  ))
      3.600     1.700     1.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.45745E-03 ppm1      6.982 ppm2      4.012 CV     1
 ASSI {   67}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      4.200     2.200     1.800 peak    67 spectrum    1 weight  0.10000E+01 volume  0.13554E-02 ppm1      7.066 ppm2      5.683 CV     1
 ASSI {   68}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.700     0.900     0.900 peak    68 spectrum    1 weight  0.10000E+01 volume  0.22280E-02 ppm1      7.067 ppm2      4.513 CV     1
 ASSI {   69}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      3.400     1.400     1.400 peak    69 spectrum    1 weight  0.10000E+01 volume  0.77175E-03 ppm1      7.067 ppm2      3.991 CV     1
 ASSI {   70}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      2.400     0.700     0.700 peak    70 spectrum    1 weight  0.10000E+01 volume  0.75649E-02 ppm1      7.067 ppm2      2.253 CV     1
 ASSI {   71}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      2.400     0.700     0.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.43712E-02 ppm1      7.067 ppm2      0.901 CV     1
 ASSI {   72}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      2.000     0.500     0.500 peak    72 spectrum    1 weight  0.10000E+01 volume  0.51758E-02 ppm1      7.067 ppm2      7.759 CV     1
 ASSI {   73}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB3 ))
      3.800     1.800     1.800 peak    73 spectrum    1 weight  0.10000E+01 volume  0.59298E-03 ppm1      7.067 ppm2      2.768 CV     1
 ASSI {   74}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      2.900     1.100     1.100 peak    74 spectrum    1 weight  0.10000E+01 volume  0.28294E-02 ppm1      7.068 ppm2      0.745 CV     1
 ASSI {   75}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      4.200     2.200     1.800 peak    75 spectrum    1 weight  0.10000E+01 volume  0.31598E-03 ppm1      7.068 ppm2      5.165 CV     1
 ASSI {   76}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.200     2.200     1.800 peak    76 spectrum    1 weight  0.10000E+01 volume  0.60488E-03 ppm1      7.068 ppm2      2.961 CV     1
 ASSI {   77}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.200     1.300     1.300 peak    77 spectrum    1 weight  0.10000E+01 volume  0.15333E-02 ppm1      7.069 ppm2      4.865 CV     1
 ASSI {   78}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      4.000     2.000     2.000 peak    78 spectrum    1 weight  0.10000E+01 volume  0.56673E-03 ppm1      7.069 ppm2      1.224 CV     1
 ASSI {   79}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      3.300     3.300     2.700 peak    79 spectrum    1 weight  0.10000E+01 volume  0.39392E-03 ppm1      7.069 ppm2      8.075 CV     1
 ASSI {   80}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 12   and name HB% )
      4.200     2.200     1.800 peak    80 spectrum    1 weight  0.10000E+01 volume  0.40069E-03 ppm1      7.069 ppm2      1.453 CV     1
 ASSI {   81}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      2.400     2.400     3.600 peak    81 spectrum    1 weight  0.10000E+01 volume  0.24398E-02 ppm1      7.073 ppm2      1.775 CV     1
 ASSI {   82}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HB3 ))
      4.500     2.500     1.500 peak    82 spectrum    1 weight  0.10000E+01 volume  0.81241E-03 ppm1      7.136 ppm2      2.592 CV     1
 ASSI {   83}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.900     1.100     1.100 peak    83 spectrum    1 weight  0.10000E+01 volume  0.17790E-02 ppm1      7.137 ppm2      4.428 CV     1
 ASSI {   85}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.300     1.400     1.400 peak    85 spectrum    1 weight  0.10000E+01 volume  0.10081E-02 ppm1      7.137 ppm2      3.896 CV     1
 ASSI {   87}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HG12))
      2.500     0.800     0.800 peak    87 spectrum    1 weight  0.10000E+01 volume  0.28633E-02 ppm1      7.137 ppm2      1.644 CV     1
 ASSI {   88}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      2.900     1.000     1.000 peak    88 spectrum    1 weight  0.10000E+01 volume  0.27447E-02 ppm1      7.137 ppm2      0.985 CV     1
 ASSI {   90}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HG13))
      2.700     0.900     0.900 peak    90 spectrum    1 weight  0.10000E+01 volume  0.44305E-02 ppm1      7.138 ppm2      1.167 CV     1
 ASSI {   91}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      2.100     0.600     0.600 peak    91 spectrum    1 weight  0.10000E+01 volume  0.59640E-02 ppm1      7.138 ppm2      7.996 CV     1
 ASSI {   92}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 103  and name HD1%)
      3.400     1.400     1.400 peak    92 spectrum    1 weight  0.10000E+01 volume  0.21094E-02 ppm1      7.139 ppm2      0.822 CV     1
 ASSI {   93}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      4.100     2.100     1.900 peak    93 spectrum    1 weight  0.10000E+01 volume  0.35410E-03 ppm1      7.139 ppm2      0.630 CV     1
 ASSI {   94}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      2.600     0.800     0.800 peak    94 spectrum    1 weight  0.10000E+01 volume  0.26685E-02 ppm1      7.141 ppm2      7.321 CV     1
 ASSI {   96}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.900     1.900     1.900 peak    96 spectrum    1 weight  0.10000E+01 volume  0.51336E-03 ppm1      7.143 ppm2      2.901 CV     1
 ASSI {   97}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.600     0.800     0.800 peak    97 spectrum    1 weight  0.10000E+01 volume  0.33038E-02 ppm1      7.144 ppm2      7.673 CV     1
 ASSI {   98}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      2.900     1.000     1.000 peak    98 spectrum    1 weight  0.10000E+01 volume  0.21687E-02 ppm1      7.145 ppm2      3.585 CV     1
 ASSI {   99}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.400     0.700     0.700 peak    99 spectrum    1 weight  0.10000E+01 volume  0.54981E-02 ppm1      7.145 ppm2      2.106 CV     1
 ASSI {  100}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB3 ))
      2.600     0.900     0.900 peak   100 spectrum    1 weight  0.10000E+01 volume  0.41595E-02 ppm1      7.145 ppm2      1.755 CV     1
 OR {  100}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  102}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      2.400     0.700     0.700 peak   102 spectrum    1 weight  0.10000E+01 volume  0.64549E-02 ppm1      7.145 ppm2      0.873 CV     1
 OR {  102}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  105}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      4.200     2.200     1.800 peak   105 spectrum    1 weight  0.10000E+01 volume  0.36597E-03 ppm1      7.146 ppm2      8.729 CV     1
 ASSI {  106}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HG3 ))
      3.900     1.900     1.900 peak   106 spectrum    1 weight  0.10000E+01 volume  0.58369E-03 ppm1      7.147 ppm2      1.271 CV     1
 ASSI {  107}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 91   and name HB3 ))
      3.700     1.700     1.700 peak   107 spectrum    1 weight  0.10000E+01 volume  0.60568E-03 ppm1      7.151 ppm2      2.550 CV     1
 ASSI {  109}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 97   and name HB3 ))
      5.200     3.300     0.800 peak   109 spectrum    1 weight  0.10000E+01 volume  0.26092E-03 ppm1      7.195 ppm2      2.574 CV     1
 ASSI {  110}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 94   and name HA  ))
      4.400     2.400     1.600 peak   110 spectrum    1 weight  0.10000E+01 volume  0.61587E-03 ppm1      7.197 ppm2      3.923 CV     1
 ASSI {  111}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 97   and name HN  ))
      5.400     3.700     0.600 peak   111 spectrum    1 weight  0.10000E+01 volume  0.12961E-03 ppm1      7.197 ppm2      8.722 CV     1
 ASSI {  113}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 97   and name HB2 ))
      4.200     2.200     1.800 peak   113 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      7.198 ppm2      2.774 CV     1
 ASSI {  114}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 93   and name HB3 ))
      3.500     1.600     1.600 peak   114 spectrum    1 weight  0.10000E+01 volume  0.53455E-03 ppm1      7.198 ppm2      2.000 CV     1
 ASSI {  115}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.100     1.100 peak   115 spectrum    1 weight  0.10000E+01 volume  0.13385E-02 ppm1      7.202 ppm2      4.600 CV     1
 ASSI {  117}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HG12))
      2.600     0.800     0.800 peak   117 spectrum    1 weight  0.10000E+01 volume  0.34140E-02 ppm1      7.203 ppm2      1.258 CV     1
 ASSI {  118}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.300     0.700     0.700 peak   118 spectrum    1 weight  0.10000E+01 volume  0.60317E-02 ppm1      7.204 ppm2      5.659 CV     1
 ASSI {  119}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.600     0.900     0.900 peak   119 spectrum    1 weight  0.10000E+01 volume  0.27955E-02 ppm1      7.204 ppm2      5.438 CV     1
 ASSI {  120}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HG13))
      2.900     1.000     1.000 peak   120 spectrum    1 weight  0.10000E+01 volume  0.18214E-02 ppm1      7.204 ppm2      0.777 CV     1
 ASSI {  121}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 36   and name HD1%)
      4.600     2.700     1.400 peak   121 spectrum    1 weight  0.10000E+01 volume  0.58284E-03 ppm1      7.204 ppm2      0.530 CV     1
 ASSI {  123}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 6    and name HB  ))
      4.300     2.300     1.700 peak   123 spectrum    1 weight  0.10000E+01 volume  0.55824E-03 ppm1      7.206 ppm2      2.187 CV     1
 ASSI {  124}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      4.600     2.700     1.400 peak   124 spectrum    1 weight  0.10000E+01 volume  0.14994E-03 ppm1      7.207 ppm2      4.167 CV     1
 ASSI {  125}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB3 ))
      3.800     1.800     1.800 peak   125 spectrum    1 weight  0.10000E+01 volume  0.77260E-03 ppm1      7.207 ppm2      2.974 CV     1
 ASSI {  126}
   (( segid "    " and resid 97   and name HD22))
   (( segid "    " and resid 97   and name HA  ))
      4.800     2.900     1.200 peak   126 spectrum    1 weight  0.10000E+01 volume  0.21009E-03 ppm1      7.207 ppm2      4.430 CV     1
 ASSI {  127}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.800     1.800     1.800 peak   127 spectrum    1 weight  0.10000E+01 volume  0.50573E-03 ppm1      7.208 ppm2      8.921 CV     1
 ASSI {  128}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      3.700     1.700     1.700 peak   128 spectrum    1 weight  0.10000E+01 volume  0.57265E-03 ppm1      7.208 ppm2      6.825 CV     1
 ASSI {  129}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB3 ))
      3.100     1.200     1.200 peak   129 spectrum    1 weight  0.10000E+01 volume  0.24313E-02 ppm1      7.209 ppm2      1.662 CV     1
 ASSI {  130}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.000     1.100     1.100 peak   130 spectrum    1 weight  0.10000E+01 volume  0.18891E-02 ppm1      7.209 ppm2      4.376 CV     1
 ASSI {  131}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB3 ))
      2.300     0.600     0.600 peak   131 spectrum    1 weight  0.10000E+01 volume  0.94033E-02 ppm1      7.209 ppm2      2.630 CV     1
 OR {  131}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  132}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      2.500     0.800     0.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.43373E-02 ppm1      7.209 ppm2      7.667 CV     1
 ASSI {  133}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      3.900     1.900     1.900 peak   133 spectrum    1 weight  0.10000E+01 volume  0.27532E-03 ppm1      7.209 ppm2      3.223 CV     1
 ASSI {  134}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 78   and name HD2 ))
      3.400     1.500     1.500 peak   134 spectrum    1 weight  0.10000E+01 volume  0.11606E-02 ppm1      7.209 ppm2      1.534 CV     1
 OR {  134}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 78   and name HD3 ))
 ASSI {  135}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.700     1.700     1.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.50403E-03 ppm1      7.210 ppm2      3.774 CV     1
 ASSI {  138}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD3 ))
      3.300     1.400     1.400 peak   138 spectrum    1 weight  0.10000E+01 volume  0.88947E-03 ppm1      7.218 ppm2      2.526 CV     1
 ASSI {  139}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HG2 ))
      3.400     1.400     1.400 peak   139 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      7.221 ppm2      1.596 CV     1
 ASSI {  141}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HD2 ))
      3.000     1.100     1.100 peak   141 spectrum    1 weight  0.10000E+01 volume  0.96573E-03 ppm1      7.223 ppm2      3.297 CV     1
 ASSI {  142}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.500     1.500     1.500 peak   142 spectrum    1 weight  0.10000E+01 volume  0.18637E-02 ppm1      7.223 ppm2      2.918 CV     1
 ASSI {  143}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 71   and name HB3 ))
      2.900     1.100     1.100 peak   143 spectrum    1 weight  0.10000E+01 volume  0.14147E-02 ppm1      7.223 ppm2      2.719 CV     1
 ASSI {  144}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HB2 ))
      4.200     2.200     1.800 peak   144 spectrum    1 weight  0.10000E+01 volume  0.10505E-02 ppm1      7.223 ppm2      0.903 CV     1
 ASSI {  145}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HB3 ))
      2.800     1.000     1.000 peak   145 spectrum    1 weight  0.10000E+01 volume  0.16096E-02 ppm1      7.225 ppm2      0.586 CV     1
 ASSI {  146}
   (( segid "    " and resid 74   and name HE  ))
   (( segid "    " and resid 74   and name HG3 ))
      3.200     1.200     1.200 peak   146 spectrum    1 weight  0.10000E+01 volume  0.17875E-02 ppm1      7.226 ppm2      1.467 CV     1
 ASSI {  147}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      4.300     2.300     1.700 peak   147 spectrum    1 weight  0.10000E+01 volume  0.33123E-03 ppm1      7.237 ppm2      7.865 CV     1
 ASSI {  149}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.900     1.100     1.100 peak   149 spectrum    1 weight  0.10000E+01 volume  0.16350E-02 ppm1      7.239 ppm2      3.316 CV     1
 ASSI {  150}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HG2 ))
      4.500     2.600     1.500 peak   150 spectrum    1 weight  0.10000E+01 volume  0.47355E-03 ppm1      7.239 ppm2      2.021 CV     1
 OR {  150}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HG3 ))
 ASSI {  151}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.400     0.700     0.700 peak   151 spectrum    1 weight  0.10000E+01 volume  0.48881E-02 ppm1      7.240 ppm2      4.734 CV     1
 ASSI {  152}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      2.600     0.900     0.900 peak   152 spectrum    1 weight  0.10000E+01 volume  0.33547E-02 ppm1      7.240 ppm2      1.777 CV     1
 ASSI {  153}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      2.500     0.800     0.800 peak   153 spectrum    1 weight  0.10000E+01 volume  0.48967E-02 ppm1      7.240 ppm2      0.843 CV     1
 ASSI {  154}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      4.000     2.000     2.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.37867E-03 ppm1      7.240 ppm2      5.434 CV     1
 ASSI {  155}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      4.400     2.500     1.600 peak   155 spectrum    1 weight  0.10000E+01 volume  0.42696E-03 ppm1      7.240 ppm2      1.039 CV     1
 ASSI {  156}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.300     1.400     1.400 peak   156 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      7.241 ppm2      2.512 CV     1
 ASSI {  157}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      3.500     1.600     1.600 peak   157 spectrum    1 weight  0.10000E+01 volume  0.69213E-03 ppm1      7.241 ppm2      8.079 CV     1
 ASSI {  158}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      4.400     2.400     1.600 peak   158 spectrum    1 weight  0.10000E+01 volume  0.36427E-03 ppm1      7.241 ppm2      5.689 CV     1
 ASSI {  162}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 87   and name HB% )
      3.800     1.800     1.800 peak   162 spectrum    1 weight  0.10000E+01 volume  0.12622E-02 ppm1      7.250 ppm2      1.470 CV     1
 ASSI {  163}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      3.900     1.900     1.900 peak   163 spectrum    1 weight  0.10000E+01 volume  0.50151E-03 ppm1      7.328 ppm2      8.228 CV     1
 ASSI {  165}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      2.200     0.600     0.600 peak   165 spectrum    1 weight  0.10000E+01 volume  0.90644E-02 ppm1      7.329 ppm2      1.997 CV     1
 ASSI {  168}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 103  and name HG13))
      4.500     2.500     1.500 peak   168 spectrum    1 weight  0.10000E+01 volume  0.47777E-03 ppm1      7.329 ppm2      1.168 CV     1
 ASSI {  169}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HG  ))
      2.700     0.900     0.900 peak   169 spectrum    1 weight  0.10000E+01 volume  0.34394E-02 ppm1      7.330 ppm2      0.825 CV     1
 OR {  169}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  174}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.100     1.200     1.200 peak   174 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      7.421 ppm2      2.399 CV     1
 ASSI {  176}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 34   and name HD21))
      4.500     2.600     1.500 peak   176 spectrum    1 weight  0.10000E+01 volume  0.36003E-03 ppm1      7.422 ppm2      5.715 CV     1
 ASSI {  177}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.800     1.000     1.000 peak   177 spectrum    1 weight  0.10000E+01 volume  0.24906E-02 ppm1      7.423 ppm2      4.239 CV     1
 ASSI {  178}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
      2.600     0.900     0.900 peak   178 spectrum    1 weight  0.10000E+01 volume  0.30836E-02 ppm1      7.423 ppm2      2.842 CV     1
 ASSI {  180}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.800     1.800     1.800 peak   180 spectrum    1 weight  0.10000E+01 volume  0.60654E-03 ppm1      7.423 ppm2      0.727 CV     1
 OR {  180}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI {  181}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.100     1.200     1.200 peak   181 spectrum    1 weight  0.10000E+01 volume  0.18637E-02 ppm1      7.424 ppm2      4.021 CV     1
 ASSI {  183}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HG2 ))
      3.500     1.600     1.600 peak   183 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      7.424 ppm2      1.482 CV     1
 OR {  183}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HG3 ))
 ASSI {  184}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      4.400     2.400     1.600 peak   184 spectrum    1 weight  0.10000E+01 volume  0.36681E-03 ppm1      7.429 ppm2      1.218 CV     1
 ASSI {  186}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.500     0.800     0.800 peak   186 spectrum    1 weight  0.10000E+01 volume  0.37443E-02 ppm1      7.437 ppm2      3.030 CV     1
 ASSI {  187}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.600     0.800     0.800 peak   187 spectrum    1 weight  0.10000E+01 volume  0.39561E-02 ppm1      7.437 ppm2      7.885 CV     1
 ASSI {  189}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HG13))
      4.400     2.400     1.600 peak   189 spectrum    1 weight  0.10000E+01 volume  0.45660E-03 ppm1      7.437 ppm2      0.530 CV     1
 ASSI {  190}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB3 ))
      3.500     1.500     1.500 peak   190 spectrum    1 weight  0.10000E+01 volume  0.21263E-02 ppm1      7.438 ppm2      2.499 CV     1
 ASSI {  191}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      3.300     1.400     1.400 peak   191 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      7.438 ppm2      9.380 CV     1
 ASSI {  192}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      2.600     0.800     0.800 peak   192 spectrum    1 weight  0.10000E+01 volume  0.35749E-02 ppm1      7.438 ppm2      8.145 CV     1
 ASSI {  193}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.900     1.900     1.900 peak   193 spectrum    1 weight  0.10000E+01 volume  0.43712E-03 ppm1      7.438 ppm2      3.868 CV     1
 ASSI {  196}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.700     0.900     0.900 peak   196 spectrum    1 weight  0.10000E+01 volume  0.31090E-02 ppm1      7.439 ppm2      4.208 CV     1
 ASSI {  198}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      4.900     3.000     1.100 peak   198 spectrum    1 weight  0.10000E+01 volume  0.21094E-03 ppm1      7.439 ppm2      3.532 CV     1
 ASSI {  200}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB3 ))
      2.300     2.300     3.700 peak   200 spectrum    1 weight  0.10000E+01 volume  0.16011E-01 ppm1      7.440 ppm2      1.808 CV     1
 ASSI {  203}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.400     1.400     1.400 peak   203 spectrum    1 weight  0.10000E+01 volume  0.94033E-03 ppm1      7.442 ppm2      3.311 CV     1
 ASSI {  204}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 56   and name HD21))
      4.000     2.000     2.000 peak   204 spectrum    1 weight  0.10000E+01 volume  0.47777E-03 ppm1      7.443 ppm2      7.001 CV     1
 ASSI {  205}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 52   and name HG2 ))
      4.700     2.800     1.300 peak   205 spectrum    1 weight  0.10000E+01 volume  0.10928E-03 ppm1      7.514 ppm2      2.293 CV     1
 ASSI {  207}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 53   and name HA  ))
      4.700     2.800     1.300 peak   207 spectrum    1 weight  0.10000E+01 volume  0.25414E-03 ppm1      7.516 ppm2      4.027 CV     1
 ASSI {  208}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 52   and name HG3 ))
      4.800     2.900     1.200 peak   208 spectrum    1 weight  0.10000E+01 volume  0.13385E-03 ppm1      7.516 ppm2      2.164 CV     1
 ASSI {  210}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 56   and name HB2 ))
      4.100     2.100     1.900 peak   210 spectrum    1 weight  0.10000E+01 volume  0.76583E-03 ppm1      7.517 ppm2      2.868 CV     1
 ASSI {  211}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 56   and name HA  ))
      4.800     2.800     1.200 peak   211 spectrum    1 weight  0.10000E+01 volume  0.22957E-03 ppm1      7.518 ppm2      4.401 CV     1
 ASSI {  213}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HG2 ))
      2.900     2.900     3.100 peak   213 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      7.534 ppm2      1.414 CV     1
 ASSI {  214}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.600     0.900     0.900 peak   214 spectrum    1 weight  0.10000E+01 volume  0.41001E-02 ppm1      7.538 ppm2      4.512 CV     1
 ASSI {  215}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      3.600     1.600     1.600 peak   215 spectrum    1 weight  0.10000E+01 volume  0.47016E-03 ppm1      7.538 ppm2      7.069 CV     1
 ASSI {  216}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.800     1.000     1.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.26685E-02 ppm1      7.539 ppm2      4.079 CV     1
 ASSI {  217}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
      2.400     0.700     0.700 peak   217 spectrum    1 weight  0.10000E+01 volume  0.69379E-02 ppm1      7.539 ppm2      1.664 CV     1
 OR {  217}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB3 ))
 ASSI {  218}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.200     1.300     1.300 peak   218 spectrum    1 weight  0.10000E+01 volume  0.15587E-02 ppm1      7.539 ppm2      0.905 CV     1
 ASSI {  219}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.300     2.300     1.700 peak   219 spectrum    1 weight  0.10000E+01 volume  0.48455E-03 ppm1      7.539 ppm2      8.324 CV     1
 ASSI {  220}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 44   and name HG2%)
      3.500     1.500     1.500 peak   220 spectrum    1 weight  0.10000E+01 volume  0.11267E-02 ppm1      7.559 ppm2      1.163 CV     1
 ASSI {  221}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA2 ))
      2.700     0.900     0.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.28888E-02 ppm1      7.561 ppm2      3.818 CV     1
 ASSI {  223}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      4.000     2.000     2.000 peak   223 spectrum    1 weight  0.10000E+01 volume  0.42187E-03 ppm1      7.562 ppm2      8.475 CV     1
 ASSI {  224}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 42   and name HA2 ))
      3.700     1.700     1.700 peak   224 spectrum    1 weight  0.10000E+01 volume  0.46338E-03 ppm1      7.562 ppm2      3.999 CV     1
 ASSI {  225}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      3.500     1.500     1.500 peak   225 spectrum    1 weight  0.10000E+01 volume  0.12283E-02 ppm1      7.562 ppm2      4.971 CV     1
 ASSI {  226}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      4.800     2.900     1.200 peak   226 spectrum    1 weight  0.10000E+01 volume  0.26177E-03 ppm1      7.563 ppm2      4.163 CV     1
 ASSI {  227}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      3.200     1.300     1.300 peak   227 spectrum    1 weight  0.10000E+01 volume  0.45660E-03 ppm1      7.568 ppm2      1.492 CV     1
 ASSI {  229}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB  ))
      2.700     0.900     0.900 peak   229 spectrum    1 weight  0.10000E+01 volume  0.29650E-02 ppm1      7.597 ppm2      4.121 CV     1
 ASSI {  230}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.100     1.200     1.200 peak   230 spectrum    1 weight  0.10000E+01 volume  0.12707E-02 ppm1      7.597 ppm2      3.527 CV     1
 ASSI {  233}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.700     1.700     1.700 peak   233 spectrum    1 weight  0.10000E+01 volume  0.67009E-03 ppm1      7.602 ppm2      8.150 CV     1
 ASSI {  234}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HG13))
      2.600     0.900     0.900 peak   234 spectrum    1 weight  0.10000E+01 volume  0.32191E-02 ppm1      7.603 ppm2      1.279 CV     1
 ASSI {  235}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB3 ))
      2.400     0.700     0.700 peak   235 spectrum    1 weight  0.10000E+01 volume  0.61331E-02 ppm1      7.603 ppm2      3.837 CV     1
 OR {  235}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI {  236}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.100     1.200     1.200 peak   236 spectrum    1 weight  0.10000E+01 volume  0.13724E-02 ppm1      7.603 ppm2      2.514 CV     1
 ASSI {  237}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      2.600     0.900     0.900 peak   237 spectrum    1 weight  0.10000E+01 volume  0.29311E-02 ppm1      7.603 ppm2      7.237 CV     1
 ASSI {  238}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      4.500     2.500     1.500 peak   238 spectrum    1 weight  0.10000E+01 volume  0.44221E-03 ppm1      7.603 ppm2      4.279 CV     1
 ASSI {  239}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 87   and name HB% )
      4.100     2.100     1.900 peak   239 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      7.603 ppm2      1.467 CV     1
 ASSI {  240}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.800     1.000     1.000 peak   240 spectrum    1 weight  0.10000E+01 volume  0.27108E-02 ppm1      7.604 ppm2      3.954 CV     1
 ASSI {  241}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.700     1.700     1.700 peak   241 spectrum    1 weight  0.10000E+01 volume  0.45237E-03 ppm1      7.604 ppm2      2.866 CV     1
 ASSI {  243}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      2.400     0.700     0.700 peak   243 spectrum    1 weight  0.10000E+01 volume  0.60232E-02 ppm1      7.604 ppm2      1.874 CV     1
 ASSI {  244}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HG12))
      2.900     1.000     1.000 peak   244 spectrum    1 weight  0.10000E+01 volume  0.27786E-02 ppm1      7.604 ppm2      1.563 CV     1
 ASSI {  245}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
      3.100     1.200     1.200 peak   245 spectrum    1 weight  0.10000E+01 volume  0.30582E-02 ppm1      7.604 ppm2      0.891 CV     1
 ASSI {  246}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      2.700     0.900     0.900 peak   246 spectrum    1 weight  0.10000E+01 volume  0.27701E-02 ppm1      7.604 ppm2      7.994 CV     1
 ASSI {  247}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.600     0.900     0.900 peak   247 spectrum    1 weight  0.10000E+01 volume  0.29734E-02 ppm1      7.604 ppm2      4.021 CV     1
 ASSI {  248}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.500     1.500     1.500 peak   248 spectrum    1 weight  0.10000E+01 volume  0.75564E-03 ppm1      7.604 ppm2      3.308 CV     1
 ASSI {  249}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 84   and name HB3 ))
      3.100     1.200     1.200 peak   249 spectrum    1 weight  0.10000E+01 volume  0.18807E-02 ppm1      7.604 ppm2      1.866 CV     1
 ASSI {  250}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      2.500     0.800     0.800 peak   250 spectrum    1 weight  0.10000E+01 volume  0.45491E-02 ppm1      7.604 ppm2      0.850 CV     1
 ASSI {  251}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      2.400     0.700     0.700 peak   251 spectrum    1 weight  0.10000E+01 volume  0.48033E-02 ppm1      7.604 ppm2      7.870 CV     1
 ASSI {  252}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.900     1.900     1.900 peak   252 spectrum    1 weight  0.10000E+01 volume  0.10928E-02 ppm1      7.605 ppm2      4.748 CV     1
 ASSI {  253}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 88   and name HD3 ))
      4.400     2.400     1.600 peak   253 spectrum    1 weight  0.10000E+01 volume  0.44305E-03 ppm1      7.606 ppm2      4.397 CV     1
 ASSI {  255}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.600     1.700     1.700 peak   255 spectrum    1 weight  0.10000E+01 volume  0.64042E-03 ppm1      7.631 ppm2      4.400 CV     1
 ASSI {  256}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HG1%)
      2.600     0.900     0.900 peak   256 spectrum    1 weight  0.10000E+01 volume  0.39561E-02 ppm1      7.632 ppm2      0.957 CV     1
 ASSI {  257}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      3.200     1.300     1.300 peak   257 spectrum    1 weight  0.10000E+01 volume  0.18976E-02 ppm1      7.632 ppm2      1.091 CV     1
 ASSI {  261}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      3.400     1.500     1.500 peak   261 spectrum    1 weight  0.10000E+01 volume  0.84715E-03 ppm1      7.634 ppm2      3.951 CV     1
 ASSI {  262}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA1 ))
      2.900     1.000     1.000 peak   262 spectrum    1 weight  0.10000E+01 volume  0.25583E-02 ppm1      7.634 ppm2      3.637 CV     1
 ASSI {  263}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      2.200     0.600     0.600 peak   263 spectrum    1 weight  0.10000E+01 volume  0.67602E-02 ppm1      7.634 ppm2      3.170 CV     1
 ASSI {  264}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      2.800     1.000     1.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.22957E-02 ppm1      7.634 ppm2      1.878 CV     1
 ASSI {  265}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.500     2.600     1.500 peak   265 spectrum    1 weight  0.10000E+01 volume  0.50151E-03 ppm1      7.634 ppm2      9.351 CV     1
 ASSI {  266}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HG13))
      4.100     2.100     1.900 peak   266 spectrum    1 weight  0.10000E+01 volume  0.56422E-03 ppm1      7.634 ppm2      1.284 CV     1
 ASSI {  267}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
      4.600     2.700     1.400 peak   267 spectrum    1 weight  0.10000E+01 volume  0.35495E-03 ppm1      7.636 ppm2      4.757 CV     1
 ASSI {  268}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      4.800     2.900     1.200 peak   268 spectrum    1 weight  0.10000E+01 volume  0.19738E-03 ppm1      7.637 ppm2      3.162 CV     1
 ASSI {  269}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      4.600     2.600     1.400 peak   269 spectrum    1 weight  0.10000E+01 volume  0.40493E-03 ppm1      7.637 ppm2      8.140 CV     1
 ASSI {  270}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.700     1.700     1.700 peak   270 spectrum    1 weight  0.10000E+01 volume  0.28718E-03 ppm1      7.639 ppm2      2.204 CV     1
 ASSI {  271}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      3.700     1.700     1.700 peak   271 spectrum    1 weight  0.10000E+01 volume  0.42950E-03 ppm1      7.640 ppm2      4.518 CV     1
 ASSI {  272}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      2.500     0.800     0.800 peak   272 spectrum    1 weight  0.10000E+01 volume  0.44136E-02 ppm1      7.640 ppm2      0.635 CV     1
 ASSI {  273}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak   273 spectrum    1 weight  0.10000E+01 volume  0.12199E-02 ppm1      7.641 ppm2      4.399 CV     1
 ASSI {  274}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB3 ))
      3.700     1.700     1.700 peak   274 spectrum    1 weight  0.10000E+01 volume  0.12876E-02 ppm1      7.641 ppm2      1.947 CV     1
 ASSI {  275}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.400     0.700     0.700 peak   275 spectrum    1 weight  0.10000E+01 volume  0.46762E-02 ppm1      7.641 ppm2      9.348 CV     1
 ASSI {  276}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.800     1.800     1.800 peak   276 spectrum    1 weight  0.10000E+01 volume  0.82511E-03 ppm1      7.641 ppm2      8.282 CV     1
 ASSI {  277}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HA1 ))
      4.100     2.100     1.900 peak   277 spectrum    1 weight  0.10000E+01 volume  0.84459E-03 ppm1      7.641 ppm2      3.625 CV     1
 ASSI {  279}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
      3.200     1.300     1.300 peak   279 spectrum    1 weight  0.10000E+01 volume  0.16180E-02 ppm1      7.642 ppm2      2.064 CV     1
 ASSI {  280}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      3.400     1.400     1.400 peak   280 spectrum    1 weight  0.10000E+01 volume  0.10844E-02 ppm1      7.642 ppm2      8.115 CV     1
 ASSI {  287}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      3.000     1.100     1.100 peak   287 spectrum    1 weight  0.10000E+01 volume  0.21263E-02 ppm1      7.654 ppm2      1.001 CV     1
 ASSI {  289}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      3.200     1.200     1.200 peak   289 spectrum    1 weight  0.10000E+01 volume  0.13385E-02 ppm1      7.655 ppm2      4.338 CV     1
 ASSI {  290}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      2.300     0.700     0.700 peak   290 spectrum    1 weight  0.10000E+01 volume  0.84038E-02 ppm1      7.655 ppm2      1.462 CV     1
 ASSI {  291}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.500     1.500     1.500 peak   291 spectrum    1 weight  0.10000E+01 volume  0.79971E-03 ppm1      7.655 ppm2      3.537 CV     1
 ASSI {  295}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
      4.100     2.100     1.900 peak   295 spectrum    1 weight  0.10000E+01 volume  0.43882E-03 ppm1      7.656 ppm2      0.577 CV     1
 ASSI {  296}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 48   and name HD22))
      1.900     0.500     0.500 peak   296 spectrum    1 weight  0.10000E+01 volume  0.12453E-01 ppm1      7.661 ppm2      6.854 CV     1
 ASSI {  297}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 48   and name HB3 ))
      3.000     1.100     1.100 peak   297 spectrum    1 weight  0.10000E+01 volume  0.10335E-02 ppm1      7.661 ppm2      2.841 CV     1
 ASSI {  299}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 6    and name HG13))
      3.800     3.800     2.200 peak   299 spectrum    1 weight  0.10000E+01 volume  0.15587E-02 ppm1      7.662 ppm2      1.553 CV     1
 OR {  299}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 6    and name HG12))
 ASSI {  302}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.800     1.000     1.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.20501E-02 ppm1      7.664 ppm2      4.285 CV     1
 ASSI {  303}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      3.800     1.800     1.800 peak   303 spectrum    1 weight  0.10000E+01 volume  0.51000E-03 ppm1      7.664 ppm2      3.766 CV     1
 ASSI {  304}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB3 ))
      3.400     1.500     1.500 peak   304 spectrum    1 weight  0.10000E+01 volume  0.13300E-02 ppm1      7.664 ppm2      0.596 CV     1
 ASSI {  305}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HB3 ))
      4.000     2.000     2.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      7.664 ppm2      2.640 CV     1
 OR {  305}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  307}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.500     2.500     1.500 peak   307 spectrum    1 weight  0.10000E+01 volume  0.21263E-03 ppm1      7.664 ppm2      0.379 CV     1
 ASSI {  309}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.500     1.500     1.500 peak   309 spectrum    1 weight  0.10000E+01 volume  0.82004E-03 ppm1      7.665 ppm2      4.156 CV     1
 ASSI {  311}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.400     1.400     1.400 peak   311 spectrum    1 weight  0.10000E+01 volume  0.83611E-03 ppm1      7.665 ppm2      4.002 CV     1
 ASSI {  312}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB3 ))
      3.000     1.100     1.100 peak   312 spectrum    1 weight  0.10000E+01 volume  0.35834E-02 ppm1      7.666 ppm2      2.975 CV     1
 ASSI {  313}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      2.500     0.800     0.800 peak   313 spectrum    1 weight  0.10000E+01 volume  0.36597E-02 ppm1      7.667 ppm2      6.831 CV     1
 ASSI {  315}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.800     1.000     1.000 peak   315 spectrum    1 weight  0.10000E+01 volume  0.64213E-02 ppm1      7.668 ppm2      0.842 CV     1
 ASSI {  316}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      2.500     0.800     0.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.41340E-02 ppm1      7.669 ppm2      8.519 CV     1
 ASSI {  317}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.600     0.900     0.900 peak   317 spectrum    1 weight  0.10000E+01 volume  0.22618E-02 ppm1      7.670 ppm2      3.243 CV     1
 ASSI {  318}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.800     1.800     1.800 peak   318 spectrum    1 weight  0.10000E+01 volume  0.96573E-03 ppm1      7.670 ppm2      2.882 CV     1
 ASSI {  319}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HB3 ))
      2.800     1.000     1.000 peak   319 spectrum    1 weight  0.10000E+01 volume  0.49388E-02 ppm1      7.670 ppm2      2.053 CV     1
 ASSI {  320}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.200     0.600     0.600 peak   320 spectrum    1 weight  0.10000E+01 volume  0.10505E-01 ppm1      7.670 ppm2      1.758 CV     1
 OR {  320}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB3 ))
 ASSI {  321}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      4.200     2.200     1.800 peak   321 spectrum    1 weight  0.10000E+01 volume  0.32276E-03 ppm1      7.670 ppm2      8.714 CV     1
 ASSI {  322}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HB3 ))
      3.700     1.700     1.700 peak   322 spectrum    1 weight  0.10000E+01 volume  0.53284E-03 ppm1      7.670 ppm2      2.562 CV     1
 ASSI {  324}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.900     1.000     1.000 peak   324 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      7.672 ppm2      3.920 CV     1
 ASSI {  325}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HG3 ))
      2.700     2.700     3.300 peak   325 spectrum    1 weight  0.10000E+01 volume  0.12368E-02 ppm1      7.672 ppm2      2.392 CV     1
 OR {  325}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI {  326}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HG2 ))
      3.800     1.800     1.800 peak   326 spectrum    1 weight  0.10000E+01 volume  0.82767E-03 ppm1      7.673 ppm2      2.239 CV     1
 OR {  326}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HG3 ))
 ASSI {  327}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.800     1.800     1.800 peak   327 spectrum    1 weight  0.10000E+01 volume  0.44983E-03 ppm1      7.673 ppm2      4.532 CV     1
 ASSI {  330}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.400     0.700     0.700 peak   330 spectrum    1 weight  0.10000E+01 volume  0.81493E-02 ppm1      7.688 ppm2      1.760 CV     1
 OR {  330}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI {  331}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      2.700     0.900     0.900 peak   331 spectrum    1 weight  0.10000E+01 volume  0.35410E-02 ppm1      7.688 ppm2      8.934 CV     1
 ASSI {  332}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      3.200     1.300     1.300 peak   332 spectrum    1 weight  0.10000E+01 volume  0.11775E-02 ppm1      7.689 ppm2      3.823 CV     1
 ASSI {  335}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.700     0.900     0.900 peak   335 spectrum    1 weight  0.10000E+01 volume  0.26346E-02 ppm1      7.689 ppm2      3.888 CV     1
 ASSI {  336}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.100     1.200     1.200 peak   336 spectrum    1 weight  0.10000E+01 volume  0.13978E-02 ppm1      7.689 ppm2      0.869 CV     1
 ASSI {  338}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      4.700     2.800     1.300 peak   338 spectrum    1 weight  0.10000E+01 volume  0.18129E-03 ppm1      7.689 ppm2      0.685 CV     1
 ASSI {  339}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.800     1.800     1.800 peak   339 spectrum    1 weight  0.10000E+01 volume  0.47016E-03 ppm1      7.691 ppm2      4.382 CV     1
 ASSI {  340}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      4.300     2.300     1.700 peak   340 spectrum    1 weight  0.10000E+01 volume  0.23551E-03 ppm1      7.691 ppm2      7.201 CV     1
 ASSI {  341}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      3.300     1.400     1.400 peak   341 spectrum    1 weight  0.10000E+01 volume  0.71583E-03 ppm1      7.693 ppm2      1.803 CV     1
 ASSI {  343}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HB3 ))
      3.600     1.600     1.600 peak   343 spectrum    1 weight  0.10000E+01 volume  0.56080E-03 ppm1      7.693 ppm2      2.630 CV     1
 ASSI {  344}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      3.300     1.400     1.400 peak   344 spectrum    1 weight  0.10000E+01 volume  0.99113E-03 ppm1      7.694 ppm2      4.535 CV     1
 ASSI {  345}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HD2 ))
      3.500     1.500     1.500 peak   345 spectrum    1 weight  0.10000E+01 volume  0.11606E-02 ppm1      7.694 ppm2      1.496 CV     1
 OR {  345}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HD3 ))
 ASSI {  347}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      3.800     1.800     1.800 peak   347 spectrum    1 weight  0.10000E+01 volume  0.48369E-03 ppm1      7.694 ppm2      0.349 CV     1
 ASSI {  348}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HB3 ))
      3.500     1.600     1.600 peak   348 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      7.695 ppm2      1.681 CV     1
 ASSI {  350}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 75   and name HB3 ))
      4.100     2.100     1.900 peak   350 spectrum    1 weight  0.10000E+01 volume  0.31090E-03 ppm1      7.695 ppm2      2.976 CV     1
 ASSI {  352}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      4.100     2.100     1.900 peak   352 spectrum    1 weight  0.10000E+01 volume  0.38375E-03 ppm1      7.698 ppm2      1.540 CV     1
 ASSI {  354}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.800     1.000     1.000 peak   354 spectrum    1 weight  0.10000E+01 volume  0.25583E-02 ppm1      7.700 ppm2      4.534 CV     1
 ASSI {  355}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      2.700     0.900     0.900 peak   355 spectrum    1 weight  0.10000E+01 volume  0.25329E-02 ppm1      7.700 ppm2      2.885 CV     1
 ASSI {  357}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      2.400     0.700     0.700 peak   357 spectrum    1 weight  0.10000E+01 volume  0.51166E-02 ppm1      7.700 ppm2      7.435 CV     1
 ASSI {  358}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      3.600     1.600     1.600 peak   358 spectrum    1 weight  0.10000E+01 volume  0.76583E-03 ppm1      7.700 ppm2      6.302 CV     1
 ASSI {  359}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      3.300     1.400     1.400 peak   359 spectrum    1 weight  0.10000E+01 volume  0.97421E-03 ppm1      7.701 ppm2      4.343 CV     1
 ASSI {  360}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
      3.200     1.300     1.300 peak   360 spectrum    1 weight  0.10000E+01 volume  0.17790E-02 ppm1      7.701 ppm2      0.979 CV     1
 ASSI {  361}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.600     0.900     0.900 peak   361 spectrum    1 weight  0.10000E+01 volume  0.34563E-02 ppm1      7.701 ppm2      4.017 CV     1
 ASSI {  362}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB3 ))
      3.400     1.500     1.500 peak   362 spectrum    1 weight  0.10000E+01 volume  0.17366E-02 ppm1      7.701 ppm2      2.556 CV     1
 ASSI {  364}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.800     1.800     1.800 peak   364 spectrum    1 weight  0.10000E+01 volume  0.47101E-03 ppm1      7.701 ppm2      3.534 CV     1
 ASSI {  365}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      5.000     3.100     1.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.28464E-03 ppm1      7.701 ppm2      2.150 CV     1
 ASSI {  366}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      2.600     0.800     0.800 peak   366 spectrum    1 weight  0.10000E+01 volume  0.38121E-02 ppm1      7.702 ppm2      0.842 CV     1
 ASSI {  367}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB  ))
      2.700     0.900     0.900 peak   367 spectrum    1 weight  0.10000E+01 volume  0.29480E-02 ppm1      7.702 ppm2      4.122 CV     1
 ASSI {  368}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.700     0.900     0.900 peak   368 spectrum    1 weight  0.10000E+01 volume  0.25160E-02 ppm1      7.702 ppm2      3.201 CV     1
 ASSI {  369}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB3 ))
      3.100     1.200     1.200 peak   369 spectrum    1 weight  0.10000E+01 volume  0.37359E-02 ppm1      7.702 ppm2      3.038 CV     1
 ASSI {  370}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 19   and name HD% )
      3.700     1.700     1.700 peak   370 spectrum    1 weight  0.10000E+01 volume  0.53455E-03 ppm1      7.702 ppm2      7.086 CV     1
 ASSI {  371}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 16   and name HB% )
      5.800     4.100     0.200 peak   371 spectrum    1 weight  0.10000E+01 volume  0.67516E-04 ppm1      7.702 ppm2      1.360 CV     1
 ASSI {  372}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      3.200     1.300     1.300 peak   372 spectrum    1 weight  0.10000E+01 volume  0.10928E-02 ppm1      7.703 ppm2      8.855 CV     1
 ASSI {  373}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      4.000     2.000     2.000 peak   373 spectrum    1 weight  0.10000E+01 volume  0.44729E-03 ppm1      7.703 ppm2      8.129 CV     1
 ASSI {  376}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      3.900     1.900     1.900 peak   376 spectrum    1 weight  0.10000E+01 volume  0.73360E-03 ppm1      7.703 ppm2      1.449 CV     1
 ASSI {  377}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HB  ))
      3.000     1.100     1.100 peak   377 spectrum    1 weight  0.10000E+01 volume  0.20670E-02 ppm1      7.704 ppm2      4.175 CV     1
 ASSI {  378}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      2.300     0.700     0.700 peak   378 spectrum    1 weight  0.10000E+01 volume  0.45745E-02 ppm1      7.704 ppm2      0.654 CV     1
 ASSI {  379}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      2.600     0.900     0.900 peak   379 spectrum    1 weight  0.10000E+01 volume  0.30666E-02 ppm1      7.704 ppm2      8.465 CV     1
 ASSI {  380}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      3.900     1.900     1.900 peak   380 spectrum    1 weight  0.10000E+01 volume  0.59132E-03 ppm1      7.704 ppm2      2.250 CV     1
 ASSI {  381}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      5.200     3.400     0.800 peak   381 spectrum    1 weight  0.10000E+01 volume  0.31175E-03 ppm1      7.704 ppm2      7.072 CV     1
 ASSI {  382}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.300     0.700     0.700 peak   382 spectrum    1 weight  0.10000E+01 volume  0.52436E-02 ppm1      7.705 ppm2      5.496 CV     1
 ASSI {  383}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      2.800     1.000     1.000 peak   383 spectrum    1 weight  0.10000E+01 volume  0.19061E-02 ppm1      7.705 ppm2      4.790 CV     1
 ASSI {  384}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      2.900     1.100     1.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.20162E-02 ppm1      7.705 ppm2      1.221 CV     1
 ASSI {  386}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      4.100     2.100     1.900 peak   386 spectrum    1 weight  0.10000E+01 volume  0.42187E-03 ppm1      7.705 ppm2      1.784 CV     1
 ASSI {  388}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.800     1.800     1.800 peak   388 spectrum    1 weight  0.10000E+01 volume  0.37359E-03 ppm1      7.706 ppm2      5.670 CV     1
 ASSI {  390}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      4.000     2.000     2.000 peak   390 spectrum    1 weight  0.10000E+01 volume  0.26770E-03 ppm1      7.706 ppm2      3.532 CV     1
 ASSI {  391}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.900     1.900     1.900 peak   391 spectrum    1 weight  0.10000E+01 volume  0.57606E-03 ppm1      7.706 ppm2      3.303 CV     1
 ASSI {  392}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 69   and name HG1%)
      5.000     3.200     1.000 peak   392 spectrum    1 weight  0.10000E+01 volume  0.34987E-03 ppm1      7.707 ppm2     -0.003 CV     1
 ASSI {  393}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG2 ))
      3.100     1.200     1.200 peak   393 spectrum    1 weight  0.10000E+01 volume  0.16180E-02 ppm1      7.708 ppm2      1.202 CV     1
 OR {  393}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG3 ))
 ASSI {  397}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HE2 ))
      4.200     2.200     1.800 peak   397 spectrum    1 weight  0.10000E+01 volume  0.42865E-03 ppm1      7.718 ppm2      2.990 CV     1
 OR {  397}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HE3 ))
 ASSI {  399}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      2.600     0.900     0.900 peak   399 spectrum    1 weight  0.10000E+01 volume  0.34648E-02 ppm1      7.720 ppm2      8.277 CV     1
 ASSI {  401}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB3 ))
      2.400     0.700     0.700 peak   401 spectrum    1 weight  0.10000E+01 volume  0.73023E-02 ppm1      7.721 ppm2      1.965 CV     1
 ASSI {  402}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      3.000     1.100     1.100 peak   402 spectrum    1 weight  0.10000E+01 volume  0.17959E-02 ppm1      7.721 ppm2      1.212 CV     1
 ASSI {  404}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      2.800     1.000     1.000 peak   404 spectrum    1 weight  0.10000E+01 volume  0.26685E-02 ppm1      7.722 ppm2      4.135 CV     1
 ASSI {  406}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.100     1.200     1.200 peak   406 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      7.755 ppm2      4.868 CV     1
 ASSI {  407}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HB3 ))
      3.200     1.300     1.300 peak   407 spectrum    1 weight  0.10000E+01 volume  0.86407E-03 ppm1      7.757 ppm2      2.775 CV     1
 ASSI {  408}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      4.000     2.000     2.000 peak   408 spectrum    1 weight  0.10000E+01 volume  0.45745E-03 ppm1      7.757 ppm2      8.068 CV     1
 ASSI {  410}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.200     0.600     0.600 peak   410 spectrum    1 weight  0.10000E+01 volume  0.70568E-02 ppm1      7.758 ppm2      5.683 CV     1
 ASSI {  411}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.000     1.100     1.100 peak   411 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      7.758 ppm2      5.157 CV     1
 ASSI {  412}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      3.200     1.300     1.300 peak   412 spectrum    1 weight  0.10000E+01 volume  0.99113E-03 ppm1      7.758 ppm2      2.962 CV     1
 ASSI {  413}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      2.300     0.700     0.700 peak   413 spectrum    1 weight  0.10000E+01 volume  0.33716E-02 ppm1      7.758 ppm2      2.253 CV     1
 ASSI {  414}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.100     1.200     1.200 peak   414 spectrum    1 weight  0.10000E+01 volume  0.27532E-02 ppm1      7.758 ppm2      0.875 CV     1
 ASSI {  415}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      3.500     1.500     1.500 peak   415 spectrum    1 weight  0.10000E+01 volume  0.26600E-02 ppm1      7.758 ppm2      0.696 CV     1
 ASSI {  416}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      3.300     1.300     1.300 peak   416 spectrum    1 weight  0.10000E+01 volume  0.94881E-03 ppm1      7.759 ppm2      1.778 CV     1
 ASSI {  417}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      5.000     3.100     1.000 peak   417 spectrum    1 weight  0.10000E+01 volume  0.33801E-03 ppm1      7.759 ppm2      4.501 CV     1
 ASSI {  418}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      3.900     1.900     1.900 peak   418 spectrum    1 weight  0.10000E+01 volume  0.74464E-03 ppm1      7.759 ppm2      1.222 CV     1
 ASSI {  419}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HB  ))
      4.300     2.300     1.700 peak   419 spectrum    1 weight  0.10000E+01 volume  0.64469E-03 ppm1      7.762 ppm2      3.991 CV     1
 ASSI {  420}
   (( segid "    " and resid 34   and name HD22))
   (  segid "    " and resid 96   and name HG2%)
      3.300     1.300     1.300 peak   420 spectrum    1 weight  0.10000E+01 volume  0.11098E-02 ppm1      7.793 ppm2      0.756 CV     1
 OR {  420}
   (( segid "    " and resid 34   and name HD22))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {  421}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 34   and name HD21))
      2.100     0.500     0.500 peak   421 spectrum    1 weight  0.10000E+01 volume  0.66076E-02 ppm1      7.794 ppm2      5.716 CV     1
 ASSI {  422}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 34   and name HB3 ))
      4.400     2.400     1.600 peak   422 spectrum    1 weight  0.10000E+01 volume  0.39646E-03 ppm1      7.794 ppm2      2.122 CV     1
 ASSI {  424}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 32   and name HB2 ))
      3.600     1.600     1.600 peak   424 spectrum    1 weight  0.10000E+01 volume  0.42272E-03 ppm1      7.796 ppm2      2.362 CV     1
 ASSI {  427}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      3.700     1.800     1.800 peak   427 spectrum    1 weight  0.10000E+01 volume  0.72853E-03 ppm1      7.803 ppm2      2.279 CV     1
 ASSI {  428}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.600     0.900     0.900 peak   428 spectrum    1 weight  0.10000E+01 volume  0.42780E-02 ppm1      7.804 ppm2      4.295 CV     1
 ASSI {  429}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      3.400     1.400     1.400 peak   429 spectrum    1 weight  0.10000E+01 volume  0.11775E-02 ppm1      7.805 ppm2      2.042 CV     1
 ASSI {  430}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.600     2.600     3.400 peak   430 spectrum    1 weight  0.10000E+01 volume  0.14401E-02 ppm1      7.805 ppm2      1.828 CV     1
 ASSI {  431}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 100  and name HB3 ))
      2.800     2.800     3.200 peak   431 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      7.805 ppm2      1.396 CV     1
 ASSI {  432}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      4.000     2.000     2.000 peak   432 spectrum    1 weight  0.10000E+01 volume  0.39646E-03 ppm1      7.805 ppm2      2.693 CV     1
 ASSI {  435}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HB3 ))
      3.800     1.800     1.800 peak   435 spectrum    1 weight  0.10000E+01 volume  0.88947E-03 ppm1      7.844 ppm2      2.719 CV     1
 ASSI {  437}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 71   and name HB2 ))
      4.100     2.100     1.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.59891E-03 ppm1      7.845 ppm2      2.918 CV     1
 ASSI {  438}
   (( segid "    " and resid 71   and name HD22))
   (  segid "    " and resid 46   and name HD1%)
      3.800     1.800     1.800 peak   438 spectrum    1 weight  0.10000E+01 volume  0.28633E-03 ppm1      7.846 ppm2      0.790 CV     1
 ASSI {  441}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA1 ))
      2.800     0.900     0.900 peak   441 spectrum    1 weight  0.10000E+01 volume  0.23127E-02 ppm1      7.854 ppm2      4.138 CV     1
 ASSI {  443}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      2.500     0.800     0.800 peak   443 spectrum    1 weight  0.10000E+01 volume  0.42780E-02 ppm1      7.855 ppm2      7.419 CV     1
 ASSI {  446}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB  ))
      3.400     1.500     1.500 peak   446 spectrum    1 weight  0.10000E+01 volume  0.81071E-03 ppm1      7.856 ppm2      1.498 CV     1
 ASSI {  447}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.300     1.400     1.400 peak   447 spectrum    1 weight  0.10000E+01 volume  0.18044E-02 ppm1      7.858 ppm2      8.797 CV     1
 ASSI {  448}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HB  ))
      4.100     2.100     1.900 peak   448 spectrum    1 weight  0.10000E+01 volume  0.69635E-03 ppm1      7.858 ppm2      1.935 CV     1
 ASSI {  449}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      2.200     0.600     0.600 peak   449 spectrum    1 weight  0.10000E+01 volume  0.98270E-02 ppm1      7.859 ppm2      3.847 CV     1
 ASSI {  450}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
      2.900     1.000     1.000 peak   450 spectrum    1 weight  0.10000E+01 volume  0.33801E-02 ppm1      7.859 ppm2      0.833 CV     1
 ASSI {  451}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      3.400     1.500     1.500 peak   451 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      7.859 ppm2     -0.163 CV     1
 ASSI {  452}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      2.900     1.000     1.000 peak   452 spectrum    1 weight  0.10000E+01 volume  0.24059E-02 ppm1      7.860 ppm2      0.345 CV     1
 ASSI {  454}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      3.100     1.200     1.200 peak   454 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      7.861 ppm2      4.684 CV     1
 ASSI {  455}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      2.300     2.300     3.700 peak   455 spectrum    1 weight  0.10000E+01 volume  0.42696E-02 ppm1      7.862 ppm2      2.383 CV     1
 ASSI {  456}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 79   and name HG2%)
      3.300     1.400     1.400 peak   456 spectrum    1 weight  0.10000E+01 volume  0.16604E-02 ppm1      7.863 ppm2      1.006 CV     1
 ASSI {  459}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB3 ))
      3.300     1.300     1.300 peak   459 spectrum    1 weight  0.10000E+01 volume  0.22110E-02 ppm1      7.868 ppm2      1.915 CV     1
 ASSI {  460}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HD2 ))
      2.500     0.800     0.800 peak   460 spectrum    1 weight  0.10000E+01 volume  0.30073E-02 ppm1      7.869 ppm2      3.443 CV     1
 ASSI {  461}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 87   and name HB% )
      2.600     0.900     0.900 peak   461 spectrum    1 weight  0.10000E+01 volume  0.31937E-02 ppm1      7.869 ppm2      1.458 CV     1
 ASSI {  462}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HD3 ))
      2.900     1.000     1.000 peak   462 spectrum    1 weight  0.10000E+01 volume  0.25414E-02 ppm1      7.870 ppm2      4.405 CV     1
 ASSI {  463}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      3.800     1.800     1.800 peak   463 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      7.870 ppm2      0.839 CV     1
 OR {  463}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  466}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      4.900     3.000     1.100 peak   466 spectrum    1 weight  0.10000E+01 volume  0.21348E-03 ppm1      7.873 ppm2      1.038 CV     1
 ASSI {  467}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 84   and name HB3 ))
      4.200     2.200     1.800 peak   467 spectrum    1 weight  0.10000E+01 volume  0.92336E-03 ppm1      7.874 ppm2      1.869 CV     1
 ASSI {  468}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      3.300     1.300     1.300 peak   468 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      7.881 ppm2      7.551 CV     1
 ASSI {  470}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      4.600     2.700     1.400 peak   470 spectrum    1 weight  0.10000E+01 volume  0.43543E-03 ppm1      7.881 ppm2      8.987 CV     1
 ASSI {  471}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      3.700     1.800     1.800 peak   471 spectrum    1 weight  0.10000E+01 volume  0.47186E-03 ppm1      7.882 ppm2      8.174 CV     1
 ASSI {  472}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      3.700     1.700     1.700 peak   472 spectrum    1 weight  0.10000E+01 volume  0.88104E-03 ppm1      7.882 ppm2      2.142 CV     1
 ASSI {  473}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HE22))
      4.000     2.000     2.000 peak   473 spectrum    1 weight  0.10000E+01 volume  0.78952E-03 ppm1      7.882 ppm2      9.361 CV     1
 ASSI {  474}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HA2 ))
      2.900     1.100     1.100 peak   474 spectrum    1 weight  0.10000E+01 volume  0.17366E-02 ppm1      7.883 ppm2      4.078 CV     1
 ASSI {  475}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.300     0.700     0.700 peak   475 spectrum    1 weight  0.10000E+01 volume  0.64298E-02 ppm1      7.883 ppm2      4.982 CV     1
 ASSI {  476}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.100     1.200     1.200 peak   476 spectrum    1 weight  0.10000E+01 volume  0.20585E-02 ppm1      7.883 ppm2      4.768 CV     1
 ASSI {  477}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HA1 ))
      2.900     1.100     1.100 peak   477 spectrum    1 weight  0.10000E+01 volume  0.28549E-02 ppm1      7.883 ppm2      4.552 CV     1
 ASSI {  478}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HA2 ))
      2.600     0.800     0.800 peak   478 spectrum    1 weight  0.10000E+01 volume  0.35410E-02 ppm1      7.883 ppm2      4.003 CV     1
 ASSI {  479}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB3 ))
      3.400     1.400     1.400 peak   479 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      7.883 ppm2      1.827 CV     1
 ASSI {  480}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.800     1.800     1.800 peak   480 spectrum    1 weight  0.10000E+01 volume  0.11860E-02 ppm1      7.883 ppm2      0.896 CV     1
 ASSI {  481}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HG3 ))
      3.500     1.500     1.500 peak   481 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      7.883 ppm2      2.355 CV     1
 ASSI {  482}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      4.400     2.400     1.600 peak   482 spectrum    1 weight  0.10000E+01 volume  0.42950E-03 ppm1      7.883 ppm2      4.411 CV     1
 ASSI {  484}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB  ))
      4.200     2.200     1.800 peak   484 spectrum    1 weight  0.10000E+01 volume  0.22195E-03 ppm1      7.884 ppm2      4.258 CV     1
 ASSI {  485}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.700     0.900     0.900 peak   485 spectrum    1 weight  0.10000E+01 volume  0.30243E-02 ppm1      7.885 ppm2      4.018 CV     1
 ASSI {  486}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.400     0.700     0.700 peak   486 spectrum    1 weight  0.10000E+01 volume  0.61246E-02 ppm1      7.885 ppm2      1.721 CV     1
 ASSI {  488}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.700     1.700     1.700 peak   488 spectrum    1 weight  0.10000E+01 volume  0.61587E-03 ppm1      7.885 ppm2      4.394 CV     1
 ASSI {  489}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      2.700     0.900     0.900 peak   489 spectrum    1 weight  0.10000E+01 volume  0.39561E-02 ppm1      7.885 ppm2      3.877 CV     1
 ASSI {  490}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD2 ))
      4.200     2.200     1.800 peak   490 spectrum    1 weight  0.10000E+01 volume  0.46677E-03 ppm1      7.886 ppm2      1.474 CV     1
 OR {  490}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HD3 ))
 ASSI {  491}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      4.600     2.600     1.400 peak   491 spectrum    1 weight  0.10000E+01 volume  0.30582E-03 ppm1      7.887 ppm2      1.336 CV     1
 ASSI {  492}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HB3 ))
      2.500     0.800     0.800 peak   492 spectrum    1 weight  0.10000E+01 volume  0.56502E-02 ppm1      7.889 ppm2      1.974 CV     1
 ASSI {  493}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 46   and name HG12))
      2.500     2.500     3.500 peak   493 spectrum    1 weight  0.10000E+01 volume  0.60910E-02 ppm1      7.892 ppm2      1.649 CV     1
 OR {  493}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 46   and name HG13))
 ASSI {  494}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
      4.300     2.300     1.700 peak   494 spectrum    1 weight  0.10000E+01 volume  0.18807E-03 ppm1      7.921 ppm2      3.883 CV     1
 ASSI {  496}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 102  and name HD1%)
      4.100     2.100     1.900 peak   496 spectrum    1 weight  0.10000E+01 volume  0.46254E-03 ppm1      7.922 ppm2      1.986 CV     1
 OR {  496}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  497}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HG3 ))
      5.100     3.200     0.900 peak   497 spectrum    1 weight  0.10000E+01 volume  0.22195E-03 ppm1      7.924 ppm2      2.463 CV     1
 ASSI {  498}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      2.700     0.900     0.900 peak   498 spectrum    1 weight  0.10000E+01 volume  0.27871E-02 ppm1      7.926 ppm2      7.723 CV     1
 ASSI {  499}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      2.600     0.900     0.900 peak   499 spectrum    1 weight  0.10000E+01 volume  0.31260E-02 ppm1      7.926 ppm2      7.422 CV     1
 ASSI {  500}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      2.800     1.000     1.000 peak   500 spectrum    1 weight  0.10000E+01 volume  0.26092E-02 ppm1      7.926 ppm2      4.015 CV     1
 ASSI {  503}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      5.300     3.500     0.700 peak   503 spectrum    1 weight  0.10000E+01 volume  0.13978E-03 ppm1      7.928 ppm2      3.250 CV     1
 ASSI {  504}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
      5.200     3.400     0.800 peak   504 spectrum    1 weight  0.10000E+01 volume  0.14232E-03 ppm1      7.929 ppm2      2.845 CV     1
 ASSI {  505}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      4.600     2.700     1.400 peak   505 spectrum    1 weight  0.10000E+01 volume  0.31090E-03 ppm1      7.929 ppm2      1.209 CV     1
 ASSI {  506}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      3.400     1.400     1.400 peak   506 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      7.931 ppm2      4.101 CV     1
 ASSI {  507}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.500     1.500     1.500 peak   507 spectrum    1 weight  0.10000E+01 volume  0.68616E-03 ppm1      7.931 ppm2      3.382 CV     1
 ASSI {  508}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.900     1.000     1.000 peak   508 spectrum    1 weight  0.10000E+01 volume  0.22195E-02 ppm1      7.932 ppm2      3.930 CV     1
 ASSI {  509}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HB% )
      2.200     0.600     0.600 peak   509 spectrum    1 weight  0.10000E+01 volume  0.91492E-02 ppm1      7.932 ppm2      1.394 CV     1
 ASSI {  510}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      2.600     0.900     0.900 peak   510 spectrum    1 weight  0.10000E+01 volume  0.32530E-02 ppm1      7.932 ppm2      8.224 CV     1
 ASSI {  512}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      3.600     1.600     1.600 peak   512 spectrum    1 weight  0.10000E+01 volume  0.13724E-02 ppm1      7.933 ppm2      0.663 CV     1
 ASSI {  513}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      3.700     3.700     2.300 peak   513 spectrum    1 weight  0.10000E+01 volume  0.59469E-03 ppm1      7.933 ppm2      4.422 CV     1
 ASSI {  514}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      4.100     2.200     1.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.28888E-03 ppm1      7.933 ppm2      8.723 CV     1
 ASSI {  515}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      4.000     2.000     2.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.37951E-03 ppm1      7.933 ppm2      3.585 CV     1
 ASSI {  516}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      3.600     1.700     1.700 peak   516 spectrum    1 weight  0.10000E+01 volume  0.79630E-03 ppm1      7.934 ppm2      1.772 CV     1
 ASSI {  517}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.700     0.900     0.900 peak   517 spectrum    1 weight  0.10000E+01 volume  0.34309E-02 ppm1      7.948 ppm2      2.775 CV     1
 ASSI {  518}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.000     2.000     2.000 peak   518 spectrum    1 weight  0.10000E+01 volume  0.37697E-03 ppm1      7.948 ppm2      7.177 CV     1
 ASSI {  519}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      2.700     0.900     0.900 peak   519 spectrum    1 weight  0.10000E+01 volume  0.36851E-02 ppm1      7.950 ppm2      4.102 CV     1
 ASSI {  520}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.300     1.400     1.400 peak   520 spectrum    1 weight  0.10000E+01 volume  0.10335E-02 ppm1      7.950 ppm2      3.583 CV     1
 ASSI {  521}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      2.700     0.900     0.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.25583E-02 ppm1      7.950 ppm2      8.722 CV     1
 ASSI {  522}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB3 ))
      3.700     1.800     1.800 peak   522 spectrum    1 weight  0.10000E+01 volume  0.98270E-03 ppm1      7.951 ppm2      2.566 CV     1
 ASSI {  523}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      2.300     0.700     0.700 peak   523 spectrum    1 weight  0.10000E+01 volume  0.75393E-02 ppm1      7.951 ppm2      1.454 CV     1
 ASSI {  525}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      3.600     1.600     1.600 peak   525 spectrum    1 weight  0.10000E+01 volume  0.68616E-03 ppm1      7.952 ppm2      4.417 CV     1
 ASSI {  527}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      4.600     2.600     1.400 peak   527 spectrum    1 weight  0.10000E+01 volume  0.16689E-03 ppm1      7.953 ppm2      3.381 CV     1
 ASSI {  530}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      3.900     1.900     1.900 peak   530 spectrum    1 weight  0.10000E+01 volume  0.50744E-03 ppm1      7.968 ppm2      0.616 CV     1
 ASSI {  532}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.600     0.900     0.900 peak   532 spectrum    1 weight  0.10000E+01 volume  0.29311E-02 ppm1      7.969 ppm2      1.835 CV     1
 ASSI {  533}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HB% )
      2.300     0.700     0.700 peak   533 spectrum    1 weight  0.10000E+01 volume  0.88947E-02 ppm1      7.969 ppm2      1.440 CV     1
 ASSI {  535}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      2.500     0.800     0.800 peak   535 spectrum    1 weight  0.10000E+01 volume  0.37867E-02 ppm1      7.969 ppm2      8.221 CV     1
 ASSI {  536}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      3.700     1.700     1.700 peak   536 spectrum    1 weight  0.10000E+01 volume  0.61587E-03 ppm1      7.969 ppm2      4.423 CV     1
 ASSI {  537}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      2.700     0.900     0.900 peak   537 spectrum    1 weight  0.10000E+01 volume  0.25075E-02 ppm1      7.970 ppm2      7.328 CV     1
 ASSI {  538}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      4.600     2.700     1.400 peak   538 spectrum    1 weight  0.10000E+01 volume  0.19992E-03 ppm1      7.970 ppm2      7.147 CV     1
 ASSI {  540}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.900     1.000     1.000 peak   540 spectrum    1 weight  0.10000E+01 volume  0.22788E-02 ppm1      7.991 ppm2      4.010 CV     1
 ASSI {  541}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HB2 ))
      3.100     1.200     1.200 peak   541 spectrum    1 weight  0.10000E+01 volume  0.16350E-02 ppm1      7.992 ppm2      2.075 CV     1
 ASSI {  542}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HB3 ))
      3.900     1.900     1.900 peak   542 spectrum    1 weight  0.10000E+01 volume  0.30073E-03 ppm1      7.992 ppm2      1.144 CV     1
 ASSI {  543}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      2.500     0.800     0.800 peak   543 spectrum    1 weight  0.10000E+01 volume  0.38799E-02 ppm1      7.993 ppm2      8.354 CV     1
 ASSI {  545}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.200     0.600     0.600 peak   545 spectrum    1 weight  0.10000E+01 volume  0.81834E-02 ppm1      7.995 ppm2      2.883 CV     1
 ASSI {  546}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
      3.800     1.800     1.800 peak   546 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      7.995 ppm2      0.859 CV     1
 ASSI {  547}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 55   and name HG1%)
      3.400     1.500     1.500 peak   547 spectrum    1 weight  0.10000E+01 volume  0.98270E-03 ppm1      7.995 ppm2      0.729 CV     1
 ASSI {  548}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.900     1.900     1.900 peak   548 spectrum    1 weight  0.10000E+01 volume  0.46762E-03 ppm1      7.995 ppm2      4.204 CV     1
 ASSI {  549}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD2 ))
      3.600     1.700     1.700 peak   549 spectrum    1 weight  0.10000E+01 volume  0.14317E-02 ppm1      7.996 ppm2      1.629 CV     1
 OR {  549}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD3 ))
 ASSI {  551}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.800     0.900     0.900 peak   551 spectrum    1 weight  0.10000E+01 volume  0.28464E-02 ppm1      7.996 ppm2      4.402 CV     1
 ASSI {  552}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB  ))
      2.500     0.800     0.800 peak   552 spectrum    1 weight  0.10000E+01 volume  0.36003E-02 ppm1      7.996 ppm2      2.016 CV     1
 ASSI {  553}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      3.400     1.500     1.500 peak   553 spectrum    1 weight  0.10000E+01 volume  0.80222E-03 ppm1      7.996 ppm2      3.511 CV     1
 ASSI {  555}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB3 ))
      2.800     1.000     1.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.24482E-02 ppm1      7.997 ppm2      1.847 CV     1
 ASSI {  556}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HG12))
      3.400     1.500     1.500 peak   556 spectrum    1 weight  0.10000E+01 volume  0.20331E-02 ppm1      7.997 ppm2      1.643 CV     1
 ASSI {  557}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HG13))
      3.100     1.200     1.200 peak   557 spectrum    1 weight  0.10000E+01 volume  0.11775E-02 ppm1      7.997 ppm2      1.163 CV     1
 ASSI {  558}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      4.200     2.200     1.800 peak   558 spectrum    1 weight  0.10000E+01 volume  0.76497E-03 ppm1      7.997 ppm2      0.993 CV     1
 ASSI {  559}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.100     1.200     1.200 peak   559 spectrum    1 weight  0.10000E+01 volume  0.22618E-02 ppm1      7.997 ppm2      3.874 CV     1
 ASSI {  562}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.200     1.300     1.300 peak   562 spectrum    1 weight  0.10000E+01 volume  0.16096E-02 ppm1      7.998 ppm2      4.427 CV     1
 ASSI {  563}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.200     1.300     1.300 peak   563 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      7.998 ppm2      4.104 CV     1
 ASSI {  564}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HB3 ))
      2.800     1.000     1.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.39900E-02 ppm1      7.998 ppm2      2.593 CV     1
 ASSI {  567}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.200     2.200     1.800 peak   567 spectrum    1 weight  0.10000E+01 volume  0.57606E-03 ppm1      7.998 ppm2      7.325 CV     1
 ASSI {  569}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.900     3.900     2.100 peak   569 spectrum    1 weight  0.10000E+01 volume  0.40917E-03 ppm1      7.999 ppm2      7.632 CV     1
 ASSI {  571}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HG3 ))
      3.200     1.200     1.200 peak   571 spectrum    1 weight  0.10000E+01 volume  0.31598E-02 ppm1      8.000 ppm2      1.314 CV     1
 OR {  571}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HG2 ))
 ASSI {  572}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 20   and name HG2 ))
      4.900     3.100     1.100 peak   572 spectrum    1 weight  0.10000E+01 volume  0.14147E-03 ppm1      8.000 ppm2      2.769 CV     1
 ASSI {  573}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HG13))
      4.100     2.100     1.900 peak   573 spectrum    1 weight  0.10000E+01 volume  0.39646E-03 ppm1      8.000 ppm2      1.284 CV     1
 ASSI {  574}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.400     1.500     1.500 peak   574 spectrum    1 weight  0.10000E+01 volume  0.62350E-03 ppm1      8.001 ppm2      8.133 CV     1
 ASSI {  575}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      2.900     1.100     1.100 peak   575 spectrum    1 weight  0.10000E+01 volume  0.15587E-02 ppm1      8.002 ppm2      4.647 CV     1
 ASSI {  576}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.900     1.900     1.900 peak   576 spectrum    1 weight  0.10000E+01 volume  0.52270E-03 ppm1      8.005 ppm2      3.907 CV     1
 ASSI {  577}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HG12))
      4.600     2.700     1.400 peak   577 spectrum    1 weight  0.10000E+01 volume  0.36681E-03 ppm1      8.018 ppm2      1.676 CV     1
 ASSI {  580}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.700     0.900     0.900 peak   580 spectrum    1 weight  0.10000E+01 volume  0.29819E-02 ppm1      8.025 ppm2      4.296 CV     1
 ASSI {  581}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.400     1.400     1.400 peak   581 spectrum    1 weight  0.10000E+01 volume  0.76583E-03 ppm1      8.025 ppm2      4.105 CV     1
 ASSI {  582}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      3.600     1.600     1.600 peak   582 spectrum    1 weight  0.10000E+01 volume  0.84203E-03 ppm1      8.025 ppm2      2.670 CV     1
 ASSI {  583}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB3 ))
      2.800     1.000     1.000 peak   583 spectrum    1 weight  0.10000E+01 volume  0.46084E-02 ppm1      8.025 ppm2      2.006 CV     1
 ASSI {  584}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      3.500     1.600     1.600 peak   584 spectrum    1 weight  0.10000E+01 volume  0.67094E-03 ppm1      8.025 ppm2      7.799 CV     1
 ASSI {  585}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      4.600     2.600     1.400 peak   585 spectrum    1 weight  0.10000E+01 volume  0.41425E-03 ppm1      8.025 ppm2      7.131 CV     1
 ASSI {  586}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 101  and name HB% )
      4.100     2.100     1.900 peak   586 spectrum    1 weight  0.10000E+01 volume  0.44475E-03 ppm1      8.025 ppm2      1.432 CV     1
 ASSI {  587}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      2.900     1.100     1.100 peak   587 spectrum    1 weight  0.10000E+01 volume  0.23042E-02 ppm1      8.026 ppm2      4.641 CV     1
 ASSI {  588}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HB3 ))
      3.700     1.700     1.700 peak   588 spectrum    1 weight  0.10000E+01 volume  0.69635E-03 ppm1      8.026 ppm2      2.590 CV     1
 ASSI {  589}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      3.400     1.500     1.500 peak   589 spectrum    1 weight  0.10000E+01 volume  0.10081E-02 ppm1      8.026 ppm2      2.279 CV     1
 ASSI {  596}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB2 ))
      2.500     0.800     0.800 peak   596 spectrum    1 weight  0.10000E+01 volume  0.36427E-02 ppm1      8.036 ppm2      2.079 CV     1
 ASSI {  597}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB3 ))
      3.200     1.300     1.300 peak   597 spectrum    1 weight  0.10000E+01 volume  0.15926E-02 ppm1      8.036 ppm2      1.128 CV     1
 ASSI {  598}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
      4.200     2.200     1.800 peak   598 spectrum    1 weight  0.10000E+01 volume  0.38629E-03 ppm1      8.038 ppm2      0.811 CV     1
 OR {  598}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
 ASSI {  600}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      3.600     1.700     1.700 peak   600 spectrum    1 weight  0.10000E+01 volume  0.59132E-03 ppm1      8.075 ppm2      1.771 CV     1
 ASSI {  601}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.100     1.200     1.200 peak   601 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      8.076 ppm2      5.684 CV     1
 ASSI {  602}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      4.300     2.400     1.700 peak   602 spectrum    1 weight  0.10000E+01 volume  0.49810E-03 ppm1      8.076 ppm2      3.167 CV     1
 ASSI {  603}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB  ))
      3.700     1.700     1.700 peak   603 spectrum    1 weight  0.10000E+01 volume  0.84715E-03 ppm1      8.076 ppm2      2.252 CV     1
 ASSI {  604}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   604 spectrum    1 weight  0.10000E+01 volume  0.94881E-02 ppm1      8.077 ppm2      5.425 CV     1
 ASSI {  605}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      2.600     0.800     0.800 peak   605 spectrum    1 weight  0.10000E+01 volume  0.43458E-02 ppm1      8.077 ppm2      0.748 CV     1
 ASSI {  606}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.200     2.200     1.800 peak   606 spectrum    1 weight  0.10000E+01 volume  0.83867E-03 ppm1      8.077 ppm2      7.714 CV     1
 ASSI {  608}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.300     1.300     1.300 peak   608 spectrum    1 weight  0.10000E+01 volume  0.10844E-02 ppm1      8.078 ppm2      4.737 CV     1
 ASSI {  609}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      3.600     1.600     1.600 peak   609 spectrum    1 weight  0.10000E+01 volume  0.17536E-02 ppm1      8.079 ppm2      1.049 CV     1
 ASSI {  610}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      3.500     1.600     1.600 peak   610 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      8.079 ppm2      9.392 CV     1
 ASSI {  611}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      3.800     1.800     1.800 peak   611 spectrum    1 weight  0.10000E+01 volume  0.62265E-03 ppm1      8.079 ppm2      8.840 CV     1
 ASSI {  612}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.800     1.800     1.800 peak   612 spectrum    1 weight  0.10000E+01 volume  0.61331E-03 ppm1      8.082 ppm2      3.323 CV     1
 ASSI {  614}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      3.800     1.800     1.800 peak   614 spectrum    1 weight  0.10000E+01 volume  0.49559E-03 ppm1      8.105 ppm2      8.578 CV     1
 ASSI {  615}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.900     1.900     1.900 peak   615 spectrum    1 weight  0.10000E+01 volume  0.48033E-03 ppm1      8.111 ppm2      7.192 CV     1
 ASSI {  616}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 58   and name HA1 ))
      4.900     3.000     1.100 peak   616 spectrum    1 weight  0.10000E+01 volume  0.49896E-03 ppm1      8.112 ppm2      3.625 CV     1
 ASSI {  617}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.800     1.000     1.000 peak   617 spectrum    1 weight  0.10000E+01 volume  0.13470E-02 ppm1      8.113 ppm2      5.438 CV     1
 ASSI {  618}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.100     0.600     0.600 peak   618 spectrum    1 weight  0.10000E+01 volume  0.68872E-02 ppm1      8.113 ppm2      4.524 CV     1
 ASSI {  619}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HG12))
      2.800     1.000     1.000 peak   619 spectrum    1 weight  0.10000E+01 volume  0.28972E-02 ppm1      8.113 ppm2      1.562 CV     1
 OR {  619}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HG13))
 ASSI {  620}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      2.100     0.600     0.600 peak   620 spectrum    1 weight  0.10000E+01 volume  0.50659E-02 ppm1      8.113 ppm2      1.102 CV     1
 ASSI {  621}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      3.000     1.100     1.100 peak   621 spectrum    1 weight  0.10000E+01 volume  0.11521E-02 ppm1      8.114 ppm2      4.960 CV     1
 ASSI {  622}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
      2.400     0.700     0.700 peak   622 spectrum    1 weight  0.10000E+01 volume  0.41425E-02 ppm1      8.114 ppm2      0.840 CV     1
 ASSI {  624}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      4.800     2.900     1.200 peak   624 spectrum    1 weight  0.10000E+01 volume  0.32953E-03 ppm1      8.114 ppm2      3.161 CV     1
 ASSI {  626}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.800     2.800     1.200 peak   626 spectrum    1 weight  0.10000E+01 volume  0.24228E-03 ppm1      8.115 ppm2      9.346 CV     1
 ASSI {  628}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HB  ))
      3.900     1.900     1.900 peak   628 spectrum    1 weight  0.10000E+01 volume  0.54640E-03 ppm1      8.116 ppm2      2.182 CV     1
 ASSI {  629}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      4.800     2.900     1.200 peak   629 spectrum    1 weight  0.10000E+01 volume  0.28718E-03 ppm1      8.118 ppm2      0.202 CV     1
 ASSI {  631}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 89   and name HG13))
      5.000     3.100     1.000 peak   631 spectrum    1 weight  0.10000E+01 volume  0.25583E-03 ppm1      8.126 ppm2      0.535 CV     1
 ASSI {  633}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.500     0.800     0.800 peak   633 spectrum    1 weight  0.10000E+01 volume  0.50403E-02 ppm1      8.130 ppm2      4.135 CV     1
 ASSI {  634}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     0.800     0.800 peak   634 spectrum    1 weight  0.10000E+01 volume  0.39053E-02 ppm1      8.130 ppm2      8.423 CV     1
 ASSI {  636}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      2.300     0.700     0.700 peak   636 spectrum    1 weight  0.10000E+01 volume  0.86407E-02 ppm1      8.131 ppm2      1.439 CV     1
 ASSI {  638}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HG3 ))
      3.200     1.300     1.300 peak   638 spectrum    1 weight  0.10000E+01 volume  0.14147E-02 ppm1      8.131 ppm2      2.337 CV     1
 ASSI {  639}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      6.000     5.100     0.000 peak   639 spectrum    1 weight  0.10000E+01 volume  0.74208E-04 ppm1      8.132 ppm2      3.310 CV     1
 ASSI {  641}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      4.400     2.400     1.600 peak   641 spectrum    1 weight  0.10000E+01 volume  0.24906E-03 ppm1      8.139 ppm2      3.526 CV     1
 ASSI {  642}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.100     1.200     1.200 peak   642 spectrum    1 weight  0.10000E+01 volume  0.14994E-02 ppm1      8.140 ppm2      5.167 CV     1
 ASSI {  643}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      3.100     1.200     1.200 peak   643 spectrum    1 weight  0.10000E+01 volume  0.19145E-02 ppm1      8.140 ppm2      3.008 CV     1
 ASSI {  644}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB3 ))
      3.000     1.200     1.200 peak   644 spectrum    1 weight  0.10000E+01 volume  0.15503E-02 ppm1      8.140 ppm2      2.797 CV     1
 ASSI {  645}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      3.000     1.100     1.100 peak   645 spectrum    1 weight  0.10000E+01 volume  0.22280E-02 ppm1      8.140 ppm2      1.219 CV     1
 ASSI {  646}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
      3.800     1.800     1.800 peak   646 spectrum    1 weight  0.10000E+01 volume  0.53199E-03 ppm1      8.140 ppm2      0.984 CV     1
 ASSI {  648}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
      2.400     2.400     3.600 peak   648 spectrum    1 weight  0.10000E+01 volume  0.56673E-02 ppm1      8.144 ppm2      0.867 CV     1
 ASSI {  651}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB3 ))
      3.300     1.400     1.400 peak   651 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      8.148 ppm2      2.498 CV     1
 ASSI {  652}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.400     1.500     1.500 peak   652 spectrum    1 weight  0.10000E+01 volume  0.88104E-03 ppm1      8.149 ppm2      4.196 CV     1
 ASSI {  653}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.700     0.900     0.900 peak   653 spectrum    1 weight  0.10000E+01 volume  0.30582E-02 ppm1      8.149 ppm2      3.030 CV     1
 ASSI {  655}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.300     1.400     1.400 peak   655 spectrum    1 weight  0.10000E+01 volume  0.11267E-02 ppm1      8.150 ppm2      3.859 CV     1
 ASSI {  656}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      2.900     1.000     1.000 peak   656 spectrum    1 weight  0.10000E+01 volume  0.18468E-02 ppm1      8.150 ppm2      3.518 CV     1
 ASSI {  657}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB  ))
      2.400     0.700     0.700 peak   657 spectrum    1 weight  0.10000E+01 volume  0.55573E-02 ppm1      8.150 ppm2      2.016 CV     1
 ASSI {  658}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 55   and name HG1%)
      3.200     1.200     1.200 peak   658 spectrum    1 weight  0.10000E+01 volume  0.38545E-02 ppm1      8.150 ppm2      0.730 CV     1
 ASSI {  659}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      3.800     1.800     1.800 peak   659 spectrum    1 weight  0.10000E+01 volume  0.46677E-03 ppm1      8.150 ppm2      4.012 CV     1
 ASSI {  660}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HB3 ))
      3.200     3.200     2.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.18468E-02 ppm1      8.150 ppm2      1.702 CV     1
 ASSI {  661}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      3.900     1.900     1.900 peak   661 spectrum    1 weight  0.10000E+01 volume  0.44221E-03 ppm1      8.151 ppm2      9.370 CV     1
 ASSI {  665}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB3 ))
      3.800     1.800     1.800 peak   665 spectrum    1 weight  0.10000E+01 volume  0.13893E-02 ppm1      8.160 ppm2      1.928 CV     1
 ASSI {  666}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 35   and name HD1%)
      4.200     2.200     1.800 peak   666 spectrum    1 weight  0.10000E+01 volume  0.28888E-03 ppm1      8.161 ppm2      0.859 CV     1
 OR {  666}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 35   and name HD2%)
 ASSI {  668}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA1 ))
      2.800     1.000     1.000 peak   668 spectrum    1 weight  0.10000E+01 volume  0.28972E-02 ppm1      8.162 ppm2      4.135 CV     1
 ASSI {  669}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.100     2.100     1.900 peak   669 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      8.162 ppm2      7.422 CV     1
 ASSI {  670}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 3    and name HB3 ))
      4.300     2.300     1.700 peak   670 spectrum    1 weight  0.10000E+01 volume  0.54469E-03 ppm1      8.162 ppm2      1.347 CV     1
 ASSI {  673}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      2.400     0.700     0.700 peak   673 spectrum    1 weight  0.10000E+01 volume  0.46508E-02 ppm1      8.163 ppm2      7.853 CV     1
 ASSI {  674}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.600     1.600     1.600 peak   674 spectrum    1 weight  0.10000E+01 volume  0.84715E-03 ppm1      8.163 ppm2      2.375 CV     1
 ASSI {  675}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.700     2.700     3.300 peak   675 spectrum    1 weight  0.10000E+01 volume  0.42187E-02 ppm1      8.164 ppm2      2.110 CV     1
 ASSI {  676}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      3.400     1.400     1.400 peak   676 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      8.164 ppm2      1.211 CV     1
 ASSI {  677}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HD21))
      3.300     1.400     1.400 peak   677 spectrum    1 weight  0.10000E+01 volume  0.62350E-03 ppm1      8.164 ppm2      5.714 CV     1
 ASSI {  678}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   678 spectrum    1 weight  0.10000E+01 volume  0.24821E-02 ppm1      8.165 ppm2      5.204 CV     1
 ASSI {  679}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 3    and name HD3 ))
      3.000     1.100     1.100 peak   679 spectrum    1 weight  0.10000E+01 volume  0.17790E-02 ppm1      8.165 ppm2      2.878 CV     1
 ASSI {  680}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 3    and name HG3 ))
      3.000     1.100     1.100 peak   680 spectrum    1 weight  0.10000E+01 volume  0.16435E-02 ppm1      8.165 ppm2      1.658 CV     1
 OR {  680}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 3    and name HG2 ))
 ASSI {  681}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.800     1.800     1.800 peak   681 spectrum    1 weight  0.10000E+01 volume  0.82341E-03 ppm1      8.165 ppm2      8.763 CV     1
 ASSI {  682}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.400     0.700     0.700 peak   682 spectrum    1 weight  0.10000E+01 volume  0.62350E-02 ppm1      8.166 ppm2      2.818 CV     1
 ASSI {  683}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 3    and name HD2 ))
      3.100     1.200     1.200 peak   683 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      8.168 ppm2      3.252 CV     1
 ASSI {  684}
   (( segid "    " and resid 3    and name HE  ))
   (  segid "    " and resid 100  and name HD2%)
      3.600     1.600     1.600 peak   684 spectrum    1 weight  0.10000E+01 volume  0.60147E-03 ppm1      8.173 ppm2      0.611 CV     1
 OR {  684}
   (( segid "    " and resid 3    and name HE  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  686}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.100     1.200     1.200 peak   686 spectrum    1 weight  0.10000E+01 volume  0.14909E-02 ppm1      8.176 ppm2      4.396 CV     1
 ASSI {  688}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 13   and name HG2%)
      3.300     1.300     1.300 peak   688 spectrum    1 weight  0.10000E+01 volume  0.13554E-02 ppm1      8.176 ppm2      1.179 CV     1
 ASSI {  689}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      4.300     2.300     1.700 peak   689 spectrum    1 weight  0.10000E+01 volume  0.36003E-03 ppm1      8.176 ppm2      2.999 CV     1
 ASSI {  691}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      4.500     2.500     1.500 peak   691 spectrum    1 weight  0.10000E+01 volume  0.27278E-03 ppm1      8.177 ppm2      5.157 CV     1
 ASSI {  692}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.300     1.300     1.300 peak   692 spectrum    1 weight  0.10000E+01 volume  0.10505E-02 ppm1      8.177 ppm2     10.628 CV     1
 ASSI {  694}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 12   and name HB% )
      2.800     1.000     1.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.26854E-02 ppm1      8.181 ppm2      1.461 CV     1
 ASSI {  695}
   (( segid "    " and resid 2    and name HN  ))
   (  segid "    " and resid 35   and name HD1%)
      3.800     1.800     1.800 peak   695 spectrum    1 weight  0.10000E+01 volume  0.63365E-03 ppm1      8.205 ppm2      0.847 CV     1
 OR {  695}
   (( segid "    " and resid 2    and name HN  ))
   (  segid "    " and resid 35   and name HD2%)
 ASSI {  696}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HG2 ))
      4.400     2.400     1.600 peak   696 spectrum    1 weight  0.10000E+01 volume  0.36258E-03 ppm1      8.216 ppm2      2.539 CV     1
 OR {  696}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HG3 ))
 ASSI {  697}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HB2 ))
      2.600     2.600     3.400 peak   697 spectrum    1 weight  0.10000E+01 volume  0.37697E-02 ppm1      8.217 ppm2      1.820 CV     1
 ASSI {  698}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      4.000     2.000     2.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.69805E-03 ppm1      8.217 ppm2      5.204 CV     1
 ASSI {  699}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HA  ))
      2.600     0.900     0.900 peak   699 spectrum    1 weight  0.10000E+01 volume  0.38799E-02 ppm1      8.218 ppm2      4.476 CV     1
 ASSI {  700}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      3.100     1.200     1.200 peak   700 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      8.218 ppm2      4.322 CV     1
 ASSI {  701}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HG2 ))
      2.800     1.000     1.000 peak   701 spectrum    1 weight  0.10000E+01 volume  0.30158E-02 ppm1      8.218 ppm2      1.511 CV     1
 OR {  701}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HG3 ))
 ASSI {  702}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HB3 ))
      3.000     1.200     1.200 peak   702 spectrum    1 weight  0.10000E+01 volume  0.21517E-02 ppm1      8.219 ppm2      2.038 CV     1
 OR {  702}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 1    and name HB2 ))
 ASSI {  703}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      3.800     1.800     1.800 peak   703 spectrum    1 weight  0.10000E+01 volume  0.88104E-03 ppm1      8.219 ppm2      0.618 CV     1
 OR {  703}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  704}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HD2 ))
      4.200     2.200     1.800 peak   704 spectrum    1 weight  0.10000E+01 volume  0.55995E-03 ppm1      8.219 ppm2      3.256 CV     1
 ASSI {  705}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.300     0.700     0.700 peak   705 spectrum    1 weight  0.10000E+01 volume  0.60147E-02 ppm1      8.220 ppm2      1.659 CV     1
 ASSI {  706}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HB3 ))
      2.800     1.000     1.000 peak   706 spectrum    1 weight  0.10000E+01 volume  0.26600E-02 ppm1      8.220 ppm2      1.327 CV     1
 ASSI {  707}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HE2 ))
      4.900     3.000     1.100 peak   707 spectrum    1 weight  0.10000E+01 volume  0.17112E-03 ppm1      8.220 ppm2      2.953 CV     1
 OR {  707}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 2    and name HE3 ))
 ASSI {  708}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   708 spectrum    1 weight  0.10000E+01 volume  0.25160E-02 ppm1      8.221 ppm2      5.204 CV     1
 ASSI {  709}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      2.600     0.800     0.800 peak   709 spectrum    1 weight  0.10000E+01 volume  0.33462E-02 ppm1      8.221 ppm2      4.326 CV     1
 ASSI {  710}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      3.700     1.700     1.700 peak   710 spectrum    1 weight  0.10000E+01 volume  0.13470E-02 ppm1      8.221 ppm2      2.855 CV     1
 ASSI {  711}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 34   and name HD22))
      4.000     2.000     2.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.59725E-03 ppm1      8.221 ppm2      7.798 CV     1
 ASSI {  712}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.900     1.000     1.000 peak   712 spectrum    1 weight  0.10000E+01 volume  0.16096E-02 ppm1      8.222 ppm2      2.079 CV     1
 ASSI {  713}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.000     1.100     1.100 peak   713 spectrum    1 weight  0.10000E+01 volume  0.16350E-02 ppm1      8.222 ppm2      8.770 CV     1
 ASSI {  714}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
      2.900     2.900     3.100 peak   714 spectrum    1 weight  0.10000E+01 volume  0.41764E-02 ppm1      8.222 ppm2      8.868 CV     1
 ASSI {  715}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      3.200     1.300     1.300 peak   715 spectrum    1 weight  0.10000E+01 volume  0.12199E-02 ppm1      8.223 ppm2      4.416 CV     1
 ASSI {  717}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 35   and name HD1%)
      4.100     2.100     1.900 peak   717 spectrum    1 weight  0.10000E+01 volume  0.47270E-03 ppm1      8.224 ppm2      0.839 CV     1
 OR {  717}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 35   and name HD2%)
 ASSI {  718}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 34   and name HD21))
      4.100     2.100     1.900 peak   718 spectrum    1 weight  0.10000E+01 volume  0.63113E-03 ppm1      8.224 ppm2      5.708 CV     1
 ASSI {  719}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.100     2.100     3.900 peak   719 spectrum    1 weight  0.10000E+01 volume  0.10505E-01 ppm1      8.225 ppm2      1.802 CV     1
 ASSI {  721}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
      2.800     1.000     1.000 peak   721 spectrum    1 weight  0.10000E+01 volume  0.20670E-02 ppm1      8.225 ppm2      0.807 CV     1
 ASSI {  723}
   (( segid "    " and resid 3    and name HN  ))
   (  segid "    " and resid 5    and name HD1%)
      4.000     2.000     2.000 peak   723 spectrum    1 weight  0.10000E+01 volume  0.58877E-03 ppm1      8.226 ppm2      0.687 CV     1
 ASSI {  725}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.800     1.800     1.800 peak   725 spectrum    1 weight  0.10000E+01 volume  0.42950E-03 ppm1      8.227 ppm2      3.371 CV     1
 ASSI {  726}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
      3.000     1.100     1.100 peak   726 spectrum    1 weight  0.10000E+01 volume  0.13215E-02 ppm1      8.228 ppm2      4.654 CV     1
 ASSI {  727}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      2.600     0.900     0.900 peak   727 spectrum    1 weight  0.10000E+01 volume  0.40493E-02 ppm1      8.247 ppm2      2.030 CV     1
 ASSI {  729}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 16   and name HB% )
      4.800     2.900     1.200 peak   729 spectrum    1 weight  0.10000E+01 volume  0.33970E-03 ppm1      8.247 ppm2      1.377 CV     1
 ASSI {  731}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      3.300     1.400     1.400 peak   731 spectrum    1 weight  0.10000E+01 volume  0.94881E-03 ppm1      8.252 ppm2      0.923 CV     1
 ASSI {  733}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      3.400     1.400     1.400 peak   733 spectrum    1 weight  0.10000E+01 volume  0.11436E-02 ppm1      8.275 ppm2      1.429 CV     1
 ASSI {  735}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      2.700     0.900     0.900 peak   735 spectrum    1 weight  0.10000E+01 volume  0.27108E-02 ppm1      8.277 ppm2      3.242 CV     1
 ASSI {  736}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      2.300     0.700     0.700 peak   736 spectrum    1 weight  0.10000E+01 volume  0.76748E-02 ppm1      8.277 ppm2      1.213 CV     1
 ASSI {  738}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.100     2.100     1.900 peak   738 spectrum    1 weight  0.10000E+01 volume  0.40324E-03 ppm1      8.277 ppm2      7.414 CV     1
 ASSI {  742}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.700     1.700     1.700 peak   742 spectrum    1 weight  0.10000E+01 volume  0.72767E-03 ppm1      8.278 ppm2      7.932 CV     1
 ASSI {  744}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.800     1.800     1.800 peak   744 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      8.286 ppm2      0.191 CV     1
 ASSI {  745}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.400     2.400     1.600 peak   745 spectrum    1 weight  0.10000E+01 volume  0.34648E-03 ppm1      8.286 ppm2      0.332 CV     1
 ASSI {  746}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
      3.500     1.600     1.600 peak   746 spectrum    1 weight  0.10000E+01 volume  0.69720E-03 ppm1      8.287 ppm2      0.831 CV     1
 ASSI {  747}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      2.500     0.800     0.800 peak   747 spectrum    1 weight  0.10000E+01 volume  0.45660E-02 ppm1      8.287 ppm2      0.685 CV     1
 ASSI {  749}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.900     1.100     1.100 peak   749 spectrum    1 weight  0.10000E+01 volume  0.19653E-02 ppm1      8.288 ppm2      4.684 CV     1
 ASSI {  750}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
      3.400     1.400     1.400 peak   750 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      8.288 ppm2      2.079 CV     1
 ASSI {  751}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      2.300     0.700     0.700 peak   751 spectrum    1 weight  0.10000E+01 volume  0.72682E-02 ppm1      8.288 ppm2      4.404 CV     1
 ASSI {  752}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.500     0.800     0.800 peak   752 spectrum    1 weight  0.10000E+01 volume  0.39307E-02 ppm1      8.288 ppm2      1.737 CV     1
 ASSI {  753}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HG1%)
      2.800     1.000     1.000 peak   753 spectrum    1 weight  0.10000E+01 volume  0.59976E-02 ppm1      8.288 ppm2      0.968 CV     1
 ASSI {  754}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      4.400     2.400     1.600 peak   754 spectrum    1 weight  0.10000E+01 volume  0.40493E-03 ppm1      8.288 ppm2     -0.164 CV     1
 ASSI {  755}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.900     1.100     1.100 peak   755 spectrum    1 weight  0.10000E+01 volume  0.16519E-02 ppm1      8.289 ppm2      4.959 CV     1
 ASSI {  761}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.200     0.600     0.600 peak   761 spectrum    1 weight  0.10000E+01 volume  0.10759E-01 ppm1      8.323 ppm2      4.078 CV     1
 ASSI {  762}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB3 ))
      2.700     0.900     0.900 peak   762 spectrum    1 weight  0.10000E+01 volume  0.35156E-02 ppm1      8.323 ppm2      1.664 CV     1
 OR {  762}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  764}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      3.800     1.800     1.800 peak   764 spectrum    1 weight  0.10000E+01 volume  0.54303E-03 ppm1      8.323 ppm2      0.379 CV     1
 ASSI {  765}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 69   and name HG1%)
      2.600     0.800     0.800 peak   765 spectrum    1 weight  0.10000E+01 volume  0.46847E-02 ppm1      8.323 ppm2      0.002 CV     1
 ASSI {  766}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.800     1.000     1.000 peak   766 spectrum    1 weight  0.10000E+01 volume  0.22025E-02 ppm1      8.324 ppm2      3.303 CV     1
 ASSI {  768}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.000     2.000     2.000 peak   768 spectrum    1 weight  0.10000E+01 volume  0.41510E-03 ppm1      8.324 ppm2      1.984 CV     1
 ASSI {  770}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.900     1.000     1.000 peak   770 spectrum    1 weight  0.10000E+01 volume  0.24482E-02 ppm1      8.348 ppm2      4.132 CV     1
 ASSI {  771}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HD3 ))
      3.300     1.300     1.300 peak   771 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      8.348 ppm2      1.606 CV     1
 ASSI {  775}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.000     1.100     1.100 peak   775 spectrum    1 weight  0.10000E+01 volume  0.18298E-02 ppm1      8.351 ppm2      3.986 CV     1
 ASSI {  777}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      4.100     2.100     1.900 peak   777 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      8.354 ppm2      3.232 CV     1
 ASSI {  778}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.400     1.500     1.500 peak   778 spectrum    1 weight  0.10000E+01 volume  0.79545E-03 ppm1      8.370 ppm2      3.578 CV     1
 ASSI {  779}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.900     1.000     1.000 peak   779 spectrum    1 weight  0.10000E+01 volume  0.20162E-02 ppm1      8.373 ppm2      3.381 CV     1
 ASSI {  780}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      2.600     0.800     0.800 peak   780 spectrum    1 weight  0.10000E+01 volume  0.30751E-02 ppm1      8.374 ppm2      7.144 CV     1
 ASSI {  782}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.600     0.800     0.800 peak   782 spectrum    1 weight  0.10000E+01 volume  0.38290E-02 ppm1      8.374 ppm2      2.107 CV     1
 ASSI {  783}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HG12))
      2.300     0.700     0.700 peak   783 spectrum    1 weight  0.10000E+01 volume  0.81071E-02 ppm1      8.374 ppm2      1.700 CV     1
 OR {  783}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
 ASSI {  784}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      4.400     2.400     1.600 peak   784 spectrum    1 weight  0.10000E+01 volume  0.32445E-03 ppm1      8.374 ppm2      0.845 CV     1
 ASSI {  786}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      4.300     2.300     1.700 peak   786 spectrum    1 weight  0.10000E+01 volume  0.31852E-03 ppm1      8.374 ppm2      7.666 CV     1
 ASSI {  787}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.800     1.800     1.800 peak   787 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      8.375 ppm2      0.718 CV     1
 OR {  787}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI {  788}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.200     2.200     1.800 peak   788 spectrum    1 weight  0.10000E+01 volume  0.33292E-03 ppm1      8.375 ppm2      7.941 CV     1
 ASSI {  789}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      3.300     1.400     1.400 peak   789 spectrum    1 weight  0.10000E+01 volume  0.25499E-02 ppm1      8.377 ppm2      2.776 CV     1
 ASSI {  790}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HG13))
      2.800     1.000     1.000 peak   790 spectrum    1 weight  0.10000E+01 volume  0.14825E-02 ppm1      8.380 ppm2      0.569 CV     1
 ASSI {  793}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      3.600     1.600     1.600 peak   793 spectrum    1 weight  0.10000E+01 volume  0.15079E-02 ppm1      8.387 ppm2      1.734 CV     1
 ASSI {  794}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB3 ))
      2.900     1.000     1.000 peak   794 spectrum    1 weight  0.10000E+01 volume  0.24313E-02 ppm1      8.388 ppm2      1.612 CV     1
 ASSI {  796}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
      2.900     1.000     1.000 peak   796 spectrum    1 weight  0.10000E+01 volume  0.20585E-02 ppm1      8.389 ppm2      0.747 CV     1
 ASSI {  798}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.900     1.000     1.000 peak   798 spectrum    1 weight  0.10000E+01 volume  0.19145E-02 ppm1      8.390 ppm2      5.659 CV     1
 ASSI {  799}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.200     0.600     0.600 peak   799 spectrum    1 weight  0.10000E+01 volume  0.89796E-02 ppm1      8.390 ppm2      4.621 CV     1
 ASSI {  800}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      3.300     1.400     1.400 peak   800 spectrum    1 weight  0.10000E+01 volume  0.73701E-03 ppm1      8.393 ppm2      2.932 CV     1
 ASSI {  801}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HG3 ))
      4.700     2.700     1.300 peak   801 spectrum    1 weight  0.10000E+01 volume  0.24482E-03 ppm1      8.393 ppm2      2.384 CV     1
 OR {  801}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI {  802}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.400     2.400     3.600 peak   802 spectrum    1 weight  0.10000E+01 volume  0.64635E-02 ppm1      8.394 ppm2      4.656 CV     1
 ASSI {  803}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.800     1.000     1.000 peak   803 spectrum    1 weight  0.10000E+01 volume  0.17875E-02 ppm1      8.394 ppm2      4.003 CV     1
 ASSI {  804}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB3 ))
      2.500     0.800     0.800 peak   804 spectrum    1 weight  0.10000E+01 volume  0.39307E-02 ppm1      8.394 ppm2      1.880 CV     1
 ASSI {  805}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.100     1.200     1.200 peak   805 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      8.394 ppm2      9.171 CV     1
 ASSI {  806}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB3 ))
      3.800     1.800     1.800 peak   806 spectrum    1 weight  0.10000E+01 volume  0.91492E-03 ppm1      8.394 ppm2      2.715 CV     1
 ASSI {  807}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 69   and name HG1%)
      3.300     1.300     1.300 peak   807 spectrum    1 weight  0.10000E+01 volume  0.10928E-02 ppm1      8.394 ppm2      0.017 CV     1
 ASSI {  808}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.800     1.800     1.800 peak   808 spectrum    1 weight  0.10000E+01 volume  0.75312E-03 ppm1      8.394 ppm2      7.198 CV     1
 ASSI {  810}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      2.800     1.000     1.000 peak   810 spectrum    1 weight  0.10000E+01 volume  0.21094E-02 ppm1      8.395 ppm2      9.958 CV     1
 ASSI {  812}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.600     1.600     1.600 peak   812 spectrum    1 weight  0.10000E+01 volume  0.59047E-03 ppm1      8.396 ppm2      1.972 CV     1
 ASSI {  813}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      3.300     1.400     1.400 peak   813 spectrum    1 weight  0.10000E+01 volume  0.79801E-03 ppm1      8.396 ppm2      0.379 CV     1
 ASSI {  816}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HG2 ))
      5.800     4.200     0.200 peak   816 spectrum    1 weight  0.10000E+01 volume  0.53625E-04 ppm1      8.403 ppm2      1.757 CV     1
 OR {  816}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HG3 ))
 ASSI {  818}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      4.100     2.100     1.900 peak   818 spectrum    1 weight  0.10000E+01 volume  0.39477E-03 ppm1      8.406 ppm2      7.714 CV     1
 ASSI {  819}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
      2.800     0.900     0.900 peak   819 spectrum    1 weight  0.10000E+01 volume  0.42187E-02 ppm1      8.407 ppm2      3.879 CV     1
 ASSI {  820}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      2.300     0.700     0.700 peak   820 spectrum    1 weight  0.10000E+01 volume  0.61080E-02 ppm1      8.408 ppm2      3.243 CV     1
 ASSI {  821}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB3 ))
      2.500     0.800     0.800 peak   821 spectrum    1 weight  0.10000E+01 volume  0.42442E-02 ppm1      8.408 ppm2      1.855 CV     1
 ASSI {  822}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      4.100     2.200     1.900 peak   822 spectrum    1 weight  0.10000E+01 volume  0.72516E-03 ppm1      8.408 ppm2      1.212 CV     1
 ASSI {  825}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
      4.200     2.200     1.800 peak   825 spectrum    1 weight  0.10000E+01 volume  0.48369E-03 ppm1      8.423 ppm2      0.838 CV     1
 OR {  825}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 ASSI {  827}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   827 spectrum    1 weight  0.10000E+01 volume  0.30921E-02 ppm1      8.424 ppm2      7.654 CV     1
 ASSI {  830}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HG3 ))
      2.800     1.000     1.000 peak   830 spectrum    1 weight  0.10000E+01 volume  0.26261E-02 ppm1      8.424 ppm2      2.343 CV     1
 ASSI {  831}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      2.500     0.800     0.800 peak   831 spectrum    1 weight  0.10000E+01 volume  0.51166E-02 ppm1      8.424 ppm2      1.448 CV     1
 ASSI {  832}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      3.600     1.600     1.600 peak   832 spectrum    1 weight  0.10000E+01 volume  0.70142E-03 ppm1      8.424 ppm2      4.342 CV     1
 ASSI {  833}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      4.100     2.100     1.900 peak   833 spectrum    1 weight  0.10000E+01 volume  0.47355E-03 ppm1      8.424 ppm2      1.001 CV     1
 ASSI {  834}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
      2.500     0.800     0.800 peak   834 spectrum    1 weight  0.10000E+01 volume  0.83611E-02 ppm1      8.425 ppm2      2.094 CV     1
 ASSI {  835}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 16   and name HB% )
      3.100     1.200     1.200 peak   835 spectrum    1 weight  0.10000E+01 volume  0.13978E-02 ppm1      8.426 ppm2      1.349 CV     1
 ASSI {  836}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      3.700     1.700     1.700 peak   836 spectrum    1 weight  0.10000E+01 volume  0.54469E-03 ppm1      8.426 ppm2      4.229 CV     1
 ASSI {  838}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      4.500     2.600     1.500 peak   838 spectrum    1 weight  0.10000E+01 volume  0.22449E-03 ppm1      8.428 ppm2      0.927 CV     1
 OR {  838}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 15   and name HG1%)
 ASSI {  839}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      4.100     2.100     1.900 peak   839 spectrum    1 weight  0.10000E+01 volume  0.25922E-03 ppm1      8.429 ppm2      2.037 CV     1
 ASSI {  840}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      3.300     1.400     1.400 peak   840 spectrum    1 weight  0.10000E+01 volume  0.77175E-03 ppm1      8.432 ppm2      8.253 CV     1
 ASSI {  841}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      5.200     3.400     0.800 peak   841 spectrum    1 weight  0.10000E+01 volume  0.18807E-03 ppm1      8.449 ppm2      1.512 CV     1
 ASSI {  842}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 19   and name HD% )
      5.400     3.600     0.600 peak   842 spectrum    1 weight  0.10000E+01 volume  0.10166E-03 ppm1      8.461 ppm2      7.075 CV     1
 ASSI {  846}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.900     1.000     1.000 peak   846 spectrum    1 weight  0.10000E+01 volume  0.23127E-02 ppm1      8.463 ppm2      4.161 CV     1
 ASSI {  847}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HG2 ))
      3.600     1.600     1.600 peak   847 spectrum    1 weight  0.10000E+01 volume  0.22788E-02 ppm1      8.463 ppm2      2.763 CV     1
 ASSI {  848}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB3 ))
      3.100     1.200     1.200 peak   848 spectrum    1 weight  0.10000E+01 volume  0.23381E-02 ppm1      8.464 ppm2      3.035 CV     1
 ASSI {  849}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HG3 ))
      4.000     2.000     2.000 peak   849 spectrum    1 weight  0.10000E+01 volume  0.96573E-03 ppm1      8.464 ppm2      2.634 CV     1
 ASSI {  850}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.900     1.100     1.100 peak   850 spectrum    1 weight  0.10000E+01 volume  0.19145E-02 ppm1      8.465 ppm2      3.201 CV     1
 ASSI {  851}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB3 ))
      3.300     1.300     1.300 peak   851 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      8.466 ppm2      1.824 CV     1
 ASSI {  853}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      3.100     1.200     1.200 peak   853 spectrum    1 weight  0.10000E+01 volume  0.17197E-02 ppm1      8.467 ppm2      1.214 CV     1
 ASSI {  854}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      4.300     2.300     1.700 peak   854 spectrum    1 weight  0.10000E+01 volume  0.41256E-03 ppm1      8.467 ppm2      7.880 CV     1
 ASSI {  855}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      3.500     1.500     1.500 peak   855 spectrum    1 weight  0.10000E+01 volume  0.79123E-03 ppm1      8.467 ppm2      0.647 CV     1
 ASSI {  856}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      2.300     0.700     0.700 peak   856 spectrum    1 weight  0.10000E+01 volume  0.71497E-02 ppm1      8.468 ppm2      5.172 CV     1
 ASSI {  857}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.800     1.000     1.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.22873E-02 ppm1      8.468 ppm2      4.995 CV     1
 ASSI {  859}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.000     2.000     2.000 peak   859 spectrum    1 weight  0.10000E+01 volume  0.29904E-03 ppm1      8.469 ppm2      8.854 CV     1
 ASSI {  862}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HG2 ))
      3.700     1.700     1.700 peak   862 spectrum    1 weight  0.10000E+01 volume  0.84715E-03 ppm1      8.472 ppm2      2.422 CV     1
 ASSI {  863}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA1 ))
      2.500     0.800     0.800 peak   863 spectrum    1 weight  0.10000E+01 volume  0.61080E-02 ppm1      8.476 ppm2      4.416 CV     1
 ASSI {  864}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA2 ))
      2.600     0.800     0.800 peak   864 spectrum    1 weight  0.10000E+01 volume  0.53540E-02 ppm1      8.477 ppm2      3.816 CV     1
 ASSI {  866}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.600     0.900     0.900 peak   866 spectrum    1 weight  0.10000E+01 volume  0.31175E-02 ppm1      8.478 ppm2      4.761 CV     1
 ASSI {  868}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
      3.600     3.600     2.400 peak   868 spectrum    1 weight  0.10000E+01 volume  0.73023E-03 ppm1      8.486 ppm2      8.095 CV     1
 ASSI {  869}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HG3 ))
      4.500     2.600     1.500 peak   869 spectrum    1 weight  0.10000E+01 volume  0.30327E-03 ppm1      8.486 ppm2      2.627 CV     1
 ASSI {  870}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 17   and name HB3 ))
      4.200     2.200     1.800 peak   870 spectrum    1 weight  0.10000E+01 volume  0.27447E-03 ppm1      8.487 ppm2      2.986 CV     1
 ASSI {  871}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      3.600     1.600     1.600 peak   871 spectrum    1 weight  0.10000E+01 volume  0.18976E-02 ppm1      8.488 ppm2      2.152 CV     1
 ASSI {  872}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 89   and name HG13))
      4.000     2.000     2.000 peak   872 spectrum    1 weight  0.10000E+01 volume  0.76834E-03 ppm1      8.488 ppm2      0.527 CV     1
 ASSI {  873}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      2.600     0.800     0.800 peak   873 spectrum    1 weight  0.10000E+01 volume  0.37020E-02 ppm1      8.489 ppm2      1.515 CV     1
 ASSI {  874}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      4.000     2.000     2.000 peak   874 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      8.489 ppm2      8.981 CV     1
 ASSI {  875}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   875 spectrum    1 weight  0.10000E+01 volume  0.31090E-02 ppm1      8.490 ppm2      7.657 CV     1
 ASSI {  876}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      3.400     1.500     1.500 peak   876 spectrum    1 weight  0.10000E+01 volume  0.98270E-03 ppm1      8.490 ppm2      4.161 CV     1
 ASSI {  877}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      4.600     2.700     1.400 peak   877 spectrum    1 weight  0.10000E+01 volume  0.27786E-03 ppm1      8.491 ppm2      9.222 CV     1
 ASSI {  878}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.800     1.800     1.800 peak   878 spectrum    1 weight  0.10000E+01 volume  0.44051E-03 ppm1      8.493 ppm2      3.531 CV     1
 ASSI {  879}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HG2 ))
      4.400     2.500     1.600 peak   879 spectrum    1 weight  0.10000E+01 volume  0.28549E-03 ppm1      8.493 ppm2      2.765 CV     1
 ASSI {  880}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      2.700     0.900     0.900 peak   880 spectrum    1 weight  0.10000E+01 volume  0.31514E-02 ppm1      8.497 ppm2      8.996 CV     1
 ASSI {  881}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      4.000     2.000     2.000 peak   881 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      8.500 ppm2      2.627 CV     1
 ASSI {  882}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      3.100     1.200     1.200 peak   882 spectrum    1 weight  0.10000E+01 volume  0.19230E-02 ppm1      8.500 ppm2      0.998 CV     1
 ASSI {  883}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.300     0.700     0.700 peak   883 spectrum    1 weight  0.10000E+01 volume  0.58706E-02 ppm1      8.501 ppm2      5.013 CV     1
 ASSI {  884}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB  ))
      3.300     1.400     1.400 peak   884 spectrum    1 weight  0.10000E+01 volume  0.90644E-03 ppm1      8.501 ppm2      3.869 CV     1
 ASSI {  885}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG3 ))
      3.000     1.100     1.100 peak   885 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.501 ppm2      1.958 CV     1
 ASSI {  886}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
      2.700     0.900     0.900 peak   886 spectrum    1 weight  0.10000E+01 volume  0.23212E-02 ppm1      8.502 ppm2      2.346 CV     1
 ASSI {  887}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.400     1.500     1.500 peak   887 spectrum    1 weight  0.10000E+01 volume  0.99113E-03 ppm1      8.502 ppm2      0.862 CV     1
 ASSI {  889}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 48   and name HB3 ))
      3.400     1.400     1.400 peak   889 spectrum    1 weight  0.10000E+01 volume  0.84630E-03 ppm1      8.502 ppm2      2.844 CV     1
 ASSI {  890}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.400     1.500     1.500 peak   890 spectrum    1 weight  0.10000E+01 volume  0.65739E-03 ppm1      8.503 ppm2      5.172 CV     1
 ASSI {  891}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      3.500     1.600     1.600 peak   891 spectrum    1 weight  0.10000E+01 volume  0.69971E-03 ppm1      8.503 ppm2      3.401 CV     1
 ASSI {  892}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      4.200     2.200     1.800 peak   892 spectrum    1 weight  0.10000E+01 volume  0.44305E-03 ppm1      8.519 ppm2      0.725 CV     1
 ASSI {  895}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HG2 ))
      2.600     0.900     0.900 peak   895 spectrum    1 weight  0.10000E+01 volume  0.41086E-02 ppm1      8.520 ppm2      2.247 CV     1
 OR {  895}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HG3 ))
 ASSI {  896}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HB3 ))
      2.600     0.900     0.900 peak   896 spectrum    1 weight  0.10000E+01 volume  0.86407E-02 ppm1      8.520 ppm2      2.047 CV     1
 ASSI {  897}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      2.800     1.000     1.000 peak   897 spectrum    1 weight  0.10000E+01 volume  0.23635E-02 ppm1      8.520 ppm2      8.853 CV     1
 ASSI {  898}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.100     2.100     1.900 peak   898 spectrum    1 weight  0.10000E+01 volume  0.45660E-03 ppm1      8.520 ppm2      7.150 CV     1
 ASSI {  899}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.500     1.500     1.500 peak   899 spectrum    1 weight  0.10000E+01 volume  0.76412E-03 ppm1      8.521 ppm2      4.529 CV     1
 ASSI {  900}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.700     0.900     0.900 peak   900 spectrum    1 weight  0.10000E+01 volume  0.31175E-02 ppm1      8.521 ppm2      1.427 CV     1
 ASSI {  901}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.900     1.900     1.900 peak   901 spectrum    1 weight  0.10000E+01 volume  0.70649E-03 ppm1      8.522 ppm2      2.868 CV     1
 ASSI {  902}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.600     1.700     1.700 peak   902 spectrum    1 weight  0.10000E+01 volume  0.15587E-02 ppm1      8.523 ppm2      1.756 CV     1
 OR {  902}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HB3 ))
 ASSI {  903}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      4.300     2.300     1.700 peak   903 spectrum    1 weight  0.10000E+01 volume  0.21263E-03 ppm1      8.523 ppm2      3.242 CV     1
 ASSI {  904}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      4.400     2.400     1.600 peak   904 spectrum    1 weight  0.10000E+01 volume  0.29650E-03 ppm1      8.523 ppm2      0.860 CV     1
 OR {  904}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  905}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      2.800     1.000     1.000 peak   905 spectrum    1 weight  0.10000E+01 volume  0.22534E-02 ppm1      8.571 ppm2      0.197 CV     1
 ASSI {  906}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      4.100     2.100     1.900 peak   906 spectrum    1 weight  0.10000E+01 volume  0.47441E-03 ppm1      8.571 ppm2      9.328 CV     1
 ASSI {  907}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG13))
      3.000     1.100     1.100 peak   907 spectrum    1 weight  0.10000E+01 volume  0.17112E-02 ppm1      8.572 ppm2      0.808 CV     1
 OR {  907}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HG12))
 ASSI {  909}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      3.700     1.700     1.700 peak   909 spectrum    1 weight  0.10000E+01 volume  0.81919E-03 ppm1      8.572 ppm2      1.727 CV     1
 ASSI {  912}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      3.500     1.600     1.600 peak   912 spectrum    1 weight  0.10000E+01 volume  0.17536E-02 ppm1      8.573 ppm2      1.110 CV     1
 ASSI {  913}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      2.600     0.800     0.800 peak   913 spectrum    1 weight  0.10000E+01 volume  0.36003E-02 ppm1      8.574 ppm2      5.763 CV     1
 ASSI {  914}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.400     0.700     0.700 peak   914 spectrum    1 weight  0.10000E+01 volume  0.51507E-02 ppm1      8.574 ppm2      4.958 CV     1
 ASSI {  915}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      3.200     1.300     1.300 peak   915 spectrum    1 weight  0.10000E+01 volume  0.14571E-02 ppm1      8.574 ppm2      1.289 CV     1
 ASSI {  916}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.500     1.500     1.500 peak   916 spectrum    1 weight  0.10000E+01 volume  0.13639E-02 ppm1      8.574 ppm2      8.276 CV     1
 ASSI {  917}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.200     1.300     1.300 peak   917 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      8.575 ppm2      4.818 CV     1
 ASSI {  918}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      2.700     0.900     0.900 peak   918 spectrum    1 weight  0.10000E+01 volume  0.26600E-02 ppm1      8.725 ppm2      8.378 CV     1
 ASSI {  921}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 93   and name HB3 ))
      3.300     3.300     2.700 peak   921 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      8.725 ppm2      1.999 CV     1
 ASSI {  923}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.800     1.000     1.000 peak   923 spectrum    1 weight  0.10000E+01 volume  0.25753E-02 ppm1      8.726 ppm2      4.416 CV     1
 ASSI {  924}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.300     0.700     0.700 peak   924 spectrum    1 weight  0.10000E+01 volume  0.50237E-02 ppm1      8.726 ppm2      2.775 CV     1
 ASSI {  925}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB3 ))
      3.500     1.500     1.500 peak   925 spectrum    1 weight  0.10000E+01 volume  0.26431E-02 ppm1      8.726 ppm2      2.568 CV     1
 ASSI {  926}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      2.700     0.900     0.900 peak   926 spectrum    1 weight  0.10000E+01 volume  0.27532E-02 ppm1      8.726 ppm2      1.668 CV     1
 ASSI {  927}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
      3.700     1.700     1.700 peak   927 spectrum    1 weight  0.10000E+01 volume  0.13978E-02 ppm1      8.726 ppm2      1.434 CV     1
 ASSI {  928}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      4.000     2.000     2.000 peak   928 spectrum    1 weight  0.10000E+01 volume  0.44729E-03 ppm1      8.726 ppm2      3.578 CV     1
 ASSI {  929}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.500     1.500     1.500 peak   929 spectrum    1 weight  0.10000E+01 volume  0.75564E-03 ppm1      8.726 ppm2      3.382 CV     1
 ASSI {  930}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.900     1.100     1.100 peak   930 spectrum    1 weight  0.10000E+01 volume  0.21009E-02 ppm1      8.728 ppm2      3.912 CV     1
 ASSI {  931}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      3.100     1.200     1.200 peak   931 spectrum    1 weight  0.10000E+01 volume  0.17451E-02 ppm1      8.728 ppm2      0.733 CV     1
 ASSI {  933}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.400     3.400     2.600 peak   933 spectrum    1 weight  0.10000E+01 volume  0.17705E-02 ppm1      8.741 ppm2      4.754 CV     1
 ASSI {  934}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      5.100     3.200     0.900 peak   934 spectrum    1 weight  0.10000E+01 volume  0.27362E-03 ppm1      8.744 ppm2      1.740 CV     1
 ASSI {  935}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.800     1.000     1.000 peak   935 spectrum    1 weight  0.10000E+01 volume  0.21517E-02 ppm1      8.750 ppm2      5.449 CV     1
 ASSI {  936}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      2.200     0.600     0.600 peak   936 spectrum    1 weight  0.10000E+01 volume  0.94033E-02 ppm1      8.751 ppm2      4.492 CV     1
 ASSI {  937}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.200     1.300     1.300 peak   937 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      8.751 ppm2      1.296 CV     1
 ASSI {  938}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HD2%)
      2.900     1.100     1.100 peak   938 spectrum    1 weight  0.10000E+01 volume  0.45576E-02 ppm1      8.751 ppm2      0.865 CV     1
 ASSI {  939}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.900     1.900     1.900 peak   939 spectrum    1 weight  0.10000E+01 volume  0.83952E-03 ppm1      8.752 ppm2      2.242 CV     1
 ASSI {  940}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.600     0.900     0.900 peak   940 spectrum    1 weight  0.10000E+01 volume  0.27278E-02 ppm1      8.752 ppm2      2.027 CV     1
 ASSI {  942}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      3.600     1.600     1.600 peak   942 spectrum    1 weight  0.10000E+01 volume  0.21094E-03 ppm1      8.753 ppm2     -0.171 CV     1
 ASSI {  943}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB3 ))
      3.100     1.200     1.200 peak   943 spectrum    1 weight  0.10000E+01 volume  0.26261E-02 ppm1      8.754 ppm2      1.922 CV     1
 ASSI {  945}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      4.300     2.300     1.700 peak   945 spectrum    1 weight  0.10000E+01 volume  0.34224E-03 ppm1      8.755 ppm2      7.211 CV     1
 ASSI {  946}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      3.800     1.800     1.800 peak   946 spectrum    1 weight  0.10000E+01 volume  0.11944E-02 ppm1      8.758 ppm2      1.746 CV     1
 ASSI {  947}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB3 ))
      3.600     1.600     1.600 peak   947 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      8.758 ppm2      1.651 CV     1
 ASSI {  948}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      4.400     2.400     1.600 peak   948 spectrum    1 weight  0.10000E+01 volume  0.39477E-03 ppm1      8.758 ppm2      9.224 CV     1
 ASSI {  949}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HD2 ))
      3.800     1.800     1.800 peak   949 spectrum    1 weight  0.10000E+01 volume  0.11606E-02 ppm1      8.759 ppm2      1.462 CV     1
 OR {  949}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HD3 ))
 ASSI {  950}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG2 ))
      3.900     1.900     1.900 peak   950 spectrum    1 weight  0.10000E+01 volume  0.88947E-03 ppm1      8.760 ppm2      1.140 CV     1
 OR {  950}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG3 ))
 ASSI {  951}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HB3 ))
      3.300     1.400     1.400 peak   951 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      8.760 ppm2      1.905 CV     1
 ASSI {  953}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.100     0.600     0.600 peak   953 spectrum    1 weight  0.10000E+01 volume  0.99962E-02 ppm1      8.761 ppm2      4.598 CV     1
 ASSI {  954}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      4.500     2.500     1.500 peak   954 spectrum    1 weight  0.10000E+01 volume  0.30836E-03 ppm1      8.761 ppm2      7.199 CV     1
 ASSI {  955}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 5    and name HD1%)
      3.400     1.400     1.400 peak   955 spectrum    1 weight  0.10000E+01 volume  0.22873E-02 ppm1      8.762 ppm2      0.695 CV     1
 ASSI {  956}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
      3.500     1.600     1.600 peak   956 spectrum    1 weight  0.10000E+01 volume  0.65568E-03 ppm1      8.762 ppm2      4.764 CV     1
 ASSI {  957}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB  ))
      2.700     0.900     0.900 peak   957 spectrum    1 weight  0.10000E+01 volume  0.33547E-02 ppm1      8.762 ppm2      1.964 CV     1
 ASSI {  958}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
      2.500     0.800     0.800 peak   958 spectrum    1 weight  0.10000E+01 volume  0.50659E-02 ppm1      8.762 ppm2      0.822 CV     1
 OR {  958}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
 ASSI {  959}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 36   and name HG12))
      4.000     2.000     2.000 peak   959 spectrum    1 weight  0.10000E+01 volume  0.97421E-03 ppm1      8.762 ppm2      1.227 CV     1
 ASSI {  960}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.900     1.100     1.100 peak   960 spectrum    1 weight  0.10000E+01 volume  0.16350E-02 ppm1      8.762 ppm2      4.525 CV     1
 ASSI {  961}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.900     3.000     1.100 peak   961 spectrum    1 weight  0.10000E+01 volume  0.13724E-03 ppm1      8.762 ppm2      9.337 CV     1
 ASSI {  962}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB  ))
      2.500     0.800     0.800 peak   962 spectrum    1 weight  0.10000E+01 volume  0.46932E-02 ppm1      8.763 ppm2      1.588 CV     1
 ASSI {  963}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HG13))
      2.900     1.100     1.100 peak   963 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      8.763 ppm2      1.417 CV     1
 ASSI {  964}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.000     1.100     1.100 peak   964 spectrum    1 weight  0.10000E+01 volume  0.16011E-02 ppm1      8.763 ppm2      4.618 CV     1
 ASSI {  966}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      3.000     1.100     1.100 peak   966 spectrum    1 weight  0.10000E+01 volume  0.14655E-02 ppm1      8.764 ppm2      5.656 CV     1
 ASSI {  967}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HG12))
      2.900     1.100     1.100 peak   967 spectrum    1 weight  0.10000E+01 volume  0.52014E-02 ppm1      8.764 ppm2      0.880 CV     1
 OR {  967}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
 ASSI {  968}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      3.100     1.200     1.200 peak   968 spectrum    1 weight  0.10000E+01 volume  0.12029E-02 ppm1      8.764 ppm2      4.904 CV     1
 ASSI {  969}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.700     2.700     1.300 peak   969 spectrum    1 weight  0.10000E+01 volume  0.25668E-03 ppm1      8.764 ppm2      8.394 CV     1
 ASSI {  970}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 48   and name HD21))
      4.000     2.000     2.000 peak   970 spectrum    1 weight  0.10000E+01 volume  0.34055E-03 ppm1      8.764 ppm2      7.656 CV     1
 ASSI {  972}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 26   and name HE3 ))
      3.300     1.400     1.400 peak   972 spectrum    1 weight  0.10000E+01 volume  0.34733E-03 ppm1      8.765 ppm2      2.971 CV     1
 OR {  972}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 26   and name HE2 ))
 ASSI {  973}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HG  ))
      3.300     1.400     1.400 peak   973 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      8.766 ppm2      1.508 CV     1
 ASSI {  974}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HD21))
      3.100     3.100     2.900 peak   974 spectrum    1 weight  0.10000E+01 volume  0.50403E-03 ppm1      8.766 ppm2      5.715 CV     1
 ASSI {  975}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.400     0.700     0.700 peak   975 spectrum    1 weight  0.10000E+01 volume  0.51336E-02 ppm1      8.767 ppm2      5.203 CV     1
 ASSI {  976}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.600     0.900     0.900 peak   976 spectrum    1 weight  0.10000E+01 volume  0.45406E-02 ppm1      8.767 ppm2      2.826 CV     1
 ASSI {  977}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 35   and name HD1%)
      3.600     1.600     1.600 peak   977 spectrum    1 weight  0.10000E+01 volume  0.90644E-03 ppm1      8.767 ppm2      0.865 CV     1
 OR {  977}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 35   and name HD2%)
 ASSI {  978}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.900     1.000     1.000 peak   978 spectrum    1 weight  0.10000E+01 volume  0.14825E-02 ppm1      8.768 ppm2      1.707 CV     1
 ASSI {  979}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      4.600     2.700     1.400 peak   979 spectrum    1 weight  0.10000E+01 volume  0.19061E-03 ppm1      8.769 ppm2      8.116 CV     1
 ASSI {  982}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.900     1.100     1.100 peak   982 spectrum    1 weight  0.10000E+01 volume  0.18044E-02 ppm1      8.770 ppm2      2.111 CV     1
 ASSI {  983}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 2    and name HA  ))
      4.200     2.200     1.800 peak   983 spectrum    1 weight  0.10000E+01 volume  0.57777E-03 ppm1      8.772 ppm2      4.327 CV     1
 ASSI {  984}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB  ))
      3.600     1.700     1.700 peak   984 spectrum    1 weight  0.10000E+01 volume  0.70734E-03 ppm1      8.787 ppm2      1.508 CV     1
 ASSI {  985}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.000     1.200     1.200 peak   985 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      8.788 ppm2      4.818 CV     1
 ASSI {  986}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      3.000     1.200     1.200 peak   986 spectrum    1 weight  0.10000E+01 volume  0.22788E-02 ppm1      8.788 ppm2     -0.163 CV     1
 ASSI {  988}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB3 ))
      2.900     1.000     1.000 peak   988 spectrum    1 weight  0.10000E+01 volume  0.20416E-02 ppm1      8.789 ppm2      1.131 CV     1
 ASSI {  989}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      3.200     1.300     1.300 peak   989 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      8.790 ppm2      5.759 CV     1
 ASSI {  990}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.400     0.700     0.700 peak   990 spectrum    1 weight  0.10000E+01 volume  0.56502E-02 ppm1      8.790 ppm2      4.683 CV     1
 ASSI {  991}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.800     1.800     1.800 peak   991 spectrum    1 weight  0.10000E+01 volume  0.64549E-03 ppm1      8.790 ppm2      9.213 CV     1
 ASSI {  992}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.300     0.700     0.700 peak   992 spectrum    1 weight  0.10000E+01 volume  0.63194E-02 ppm1      8.791 ppm2      5.438 CV     1
 ASSI {  993}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.800     0.900     0.900 peak   993 spectrum    1 weight  0.10000E+01 volume  0.25075E-02 ppm1      8.791 ppm2      4.910 CV     1
 ASSI {  994}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB  ))
      2.700     0.900     0.900 peak   994 spectrum    1 weight  0.10000E+01 volume  0.34309E-02 ppm1      8.791 ppm2      2.184 CV     1
 ASSI {  995}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      2.600     0.900     0.900 peak   995 spectrum    1 weight  0.10000E+01 volume  0.36003E-02 ppm1      8.791 ppm2      1.282 CV     1
 ASSI {  997}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 6    and name HG2%)
      3.600     1.600     1.600 peak   997 spectrum    1 weight  0.10000E+01 volume  0.14825E-02 ppm1      8.791 ppm2      0.950 CV     1
 ASSI {  998}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
      4.600     2.600     1.400 peak   998 spectrum    1 weight  0.10000E+01 volume  0.21348E-03 ppm1      8.791 ppm2      0.584 CV     1
 ASSI {  999}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.700     1.700     1.700 peak   999 spectrum    1 weight  0.10000E+01 volume  0.72346E-03 ppm1      8.791 ppm2      8.294 CV     1
 ASSI { 1001}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 60   and name HG1%)
      4.000     2.000     2.000 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.43967E-03 ppm1      8.792 ppm2      0.975 CV     1
 ASSI { 1003}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      3.700     1.700     1.700 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.80478E-03 ppm1      8.792 ppm2      0.345 CV     1
 ASSI { 1004}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.300     1.300     1.300 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.37782E-03 ppm1      8.792 ppm2      0.189 CV     1
 ASSI { 1005}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      2.900     1.100     1.100 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.16943E-02 ppm1      8.793 ppm2      4.486 CV     1
 ASSI { 1006}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.800     1.800     1.800 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.69128E-03 ppm1      8.793 ppm2      7.202 CV     1
 ASSI { 1007}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      3.700     1.700     1.700 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.69971E-03 ppm1      8.794 ppm2      0.684 CV     1
 ASSI { 1008}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      3.900     1.900     1.900 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.55744E-03 ppm1      8.794 ppm2      4.593 CV     1
 ASSI { 1009}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HN  ))
      4.600     2.700     1.400 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.20585E-03 ppm1      8.794 ppm2      8.102 CV     1
 ASSI { 1012}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      4.200     2.200     1.800 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.34563E-03 ppm1      8.796 ppm2      0.201 CV     1
 ASSI { 1013}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      3.500     1.600     1.600 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.66753E-03 ppm1      8.796 ppm2      9.319 CV     1
 ASSI { 1014}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.300     1.400     1.400 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.21517E-02 ppm1      8.798 ppm2      1.303 CV     1
 ASSI { 1015}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      4.000     2.000     2.000 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.42357E-03 ppm1      8.800 ppm2      1.729 CV     1
 ASSI { 1016}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      3.900     1.900     1.900 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.40493E-03 ppm1      8.839 ppm2      1.270 CV     1
 ASSI { 1017}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.100     0.600     0.600 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.10505E-01 ppm1      8.841 ppm2      5.483 CV     1
 ASSI { 1018}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      2.500     0.800     0.800 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.45322E-02 ppm1      8.841 ppm2      1.045 CV     1
 ASSI { 1020}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 8    and name HB  ))
      3.400     1.500     1.500 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      8.841 ppm2      1.591 CV     1
 ASSI { 1022}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      4.900     3.000     1.100 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.31344E-03 ppm1      8.842 ppm2      3.133 CV     1
 ASSI { 1023}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
      4.000     2.000     2.000 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.49981E-03 ppm1      8.842 ppm2      2.982 CV     1
 ASSI { 1024}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      3.800     1.800     1.800 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.66668E-03 ppm1      8.843 ppm2      9.340 CV     1
 ASSI { 1025}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 63   and name HD% )
      4.300     2.300     1.700 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.42865E-03 ppm1      8.843 ppm2      6.915 CV     1
 ASSI { 1026}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.400     2.400     1.600 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.54895E-03 ppm1      8.844 ppm2      7.710 CV     1
 ASSI { 1027}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 9    and name HB  ))
      4.400     2.400     1.600 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.32615E-03 ppm1      8.844 ppm2      4.166 CV     1
 ASSI { 1029}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 39   and name HB3 ))
      4.800     2.900     1.200 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.12368E-03 ppm1      8.852 ppm2      2.092 CV     1
 ASSI { 1030}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      3.500     1.600     1.600 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.94033E-03 ppm1      8.853 ppm2      0.859 CV     1
 OR { 1030}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 1031}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      2.700     0.900     0.900 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.30158E-02 ppm1      8.854 ppm2      1.000 CV     1
 ASSI { 1032}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HB  ))
      4.600     2.600     1.400 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.27616E-03 ppm1      8.854 ppm2      1.591 CV     1
 ASSI { 1033}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HB  ))
      3.700     1.700     1.700 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.68701E-03 ppm1      8.854 ppm2      4.176 CV     1
 ASSI { 1035}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB3 ))
      4.200     2.200     1.800 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.52099E-03 ppm1      8.854 ppm2      2.554 CV     1
 ASSI { 1036}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.900     1.100     1.100 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.17197E-02 ppm1      8.855 ppm2      5.497 CV     1
 ASSI { 1037}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      2.100     0.600     0.600 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.10420E-01 ppm1      8.855 ppm2      5.178 CV     1
 ASSI { 1040}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 22   and name HB% )
      4.900     3.000     1.100 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.14486E-03 ppm1      8.856 ppm2      1.440 CV     1
 ASSI { 1041}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HG2 ))
      4.900     3.000     1.100 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.20755E-03 ppm1      8.856 ppm2      2.245 CV     1
 OR { 1041}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HG3 ))
 ASSI { 1042}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     1.600     1.600 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.81412E-03 ppm1      8.856 ppm2      3.994 CV     1
 ASSI { 1044}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.300     0.700     0.700 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.73701E-02 ppm1      8.857 ppm2      4.531 CV     1
 ASSI { 1045}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.400     0.700     0.700 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.56758E-02 ppm1      8.857 ppm2      1.427 CV     1
 ASSI { 1046}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
      4.500     2.500     1.500 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.20501E-03 ppm1      8.857 ppm2      2.369 CV     1
 ASSI { 1047}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      4.100     2.100     1.900 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.49047E-03 ppm1      8.857 ppm2      7.695 CV     1
 ASSI { 1048}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HB3 ))
      5.000     3.100     1.000 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.24059E-03 ppm1      8.857 ppm2      2.048 CV     1
 ASSI { 1050}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.100     1.200     1.200 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      8.858 ppm2      3.828 CV     1
 ASSI { 1052}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 10   and name HB% )
      3.600     1.600     1.600 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.68957E-03 ppm1      8.859 ppm2      1.240 CV     1
 ASSI { 1053}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.900     1.900     1.900 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.51507E-03 ppm1      8.859 ppm2      9.210 CV     1
 ASSI { 1054}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      3.700     1.700     1.700 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.84203E-03 ppm1      8.860 ppm2      2.889 CV     1
 ASSI { 1055}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      4.500     2.500     1.500 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.25668E-03 ppm1      8.860 ppm2      0.708 CV     1
 OR { 1055}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI { 1056}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      4.200     2.300     1.800 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.26600E-03 ppm1      8.863 ppm2      4.788 CV     1
 ASSI { 1057}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
      3.100     1.200     1.200 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.19992E-02 ppm1      8.864 ppm2      0.836 CV     1
 OR { 1057}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 ASSI { 1058}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HD2 ))
      4.100     2.100     1.900 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.31937E-03 ppm1      8.872 ppm2      3.242 CV     1
 ASSI { 1059}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HG2 ))
      2.000     0.500     0.500 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.12283E-01 ppm1      8.873 ppm2      1.457 CV     1
 ASSI { 1060}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HE  ))
      4.200     2.200     1.800 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.41849E-03 ppm1      8.873 ppm2      8.168 CV     1
 ASSI { 1063}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
      2.400     0.700     0.700 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.53540E-02 ppm1      8.875 ppm2      4.647 CV     1
 ASSI { 1064}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      2.300     2.300     3.700 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.52521E-02 ppm1      8.875 ppm2      1.932 CV     1
 ASSI { 1065}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HD3 ))
      4.000     2.000     2.000 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.52355E-03 ppm1      8.875 ppm2      2.875 CV     1
 ASSI { 1066}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      3.400     1.500     1.500 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.73616E-03 ppm1      8.876 ppm2      2.654 CV     1
 ASSI { 1067}
   (( segid "    " and resid 4    and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      5.500     3.800     0.500 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.85559E-04 ppm1      8.876 ppm2      0.640 CV     1
 OR { 1067}
   (( segid "    " and resid 4    and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 1069}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 59   and name HG3 ))
      3.200     3.200     2.800 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      8.879 ppm2      2.348 CV     1
 ASSI { 1071}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      4.100     2.100     1.900 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.55147E-03 ppm1      8.891 ppm2      7.685 CV     1
 ASSI { 1072}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      2.700     0.900     0.900 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.24059E-02 ppm1      8.892 ppm2      1.787 CV     1
 ASSI { 1073}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB3 ))
      2.400     0.700     0.700 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.41086E-02 ppm1      8.894 ppm2      1.689 CV     1
 ASSI { 1074}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 79   and name HG2%)
      2.600     0.800     0.800 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.56336E-02 ppm1      8.894 ppm2      1.011 CV     1
 ASSI { 1075}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
      2.900     1.000     1.000 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.22957E-02 ppm1      8.894 ppm2      0.837 CV     1
 ASSI { 1077}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.600     0.800     0.800 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.59810E-02 ppm1      8.895 ppm2      4.534 CV     1
 ASSI { 1078}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HB  ))
      2.400     0.700     0.700 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.50744E-02 ppm1      8.895 ppm2      1.937 CV     1
 ASSI { 1079}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 80   and name HG2%)
      4.200     2.200     1.800 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.26092E-03 ppm1      8.895 ppm2      0.349 CV     1
 ASSI { 1080}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      2.900     1.000     1.000 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.18383E-02 ppm1      8.896 ppm2      3.851 CV     1
 ASSI { 1081}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      4.100     2.100     1.900 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.53199E-03 ppm1      8.896 ppm2      7.865 CV     1
 ASSI { 1082}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.400     1.400     1.400 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.73786E-03 ppm1      8.896 ppm2      0.691 CV     1
 ASSI { 1083}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.400     1.500     1.500 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      8.898 ppm2      8.297 CV     1
 ASSI { 1084}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HE3 ))
      3.900     1.900     1.900 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      8.899 ppm2      2.742 CV     1
 ASSI { 1085}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.200     0.600     0.600 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.10420E-01 ppm1      8.902 ppm2      4.417 CV     1
 ASSI { 1086}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.900     1.100     1.100 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.17959E-02 ppm1      8.904 ppm2      7.888 CV     1
 ASSI { 1087}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.600     3.600     2.400 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      8.904 ppm2      4.744 CV     1
 ASSI { 1088}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      3.900     1.900     1.900 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      8.905 ppm2      1.317 CV     1
 ASSI { 1089}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      2.800     1.000     1.000 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.24482E-02 ppm1      8.906 ppm2      3.859 CV     1
 ASSI { 1090}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      3.300     1.400     1.400 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.15842E-02 ppm1      8.906 ppm2      7.444 CV     1
 ASSI { 1092}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      4.100     2.100     1.900 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.63872E-03 ppm1      8.910 ppm2      9.374 CV     1
 ASSI { 1093}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.800     1.000     1.000 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.27447E-02 ppm1      8.918 ppm2      4.377 CV     1
 ASSI { 1095}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HA1 ))
      3.300     1.300     1.300 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.11436E-02 ppm1      8.920 ppm2      4.103 CV     1
 ASSI { 1096}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      3.500     1.500     1.500 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      8.921 ppm2      2.625 CV     1
 OR { 1096}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB3 ))
 ASSI { 1098}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      3.400     1.400     1.400 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.99113E-03 ppm1      8.922 ppm2      3.823 CV     1
 ASSI { 1099}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 78   and name HN  ))
      3.900     1.900     1.900 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.35749E-03 ppm1      8.924 ppm2      7.688 CV     1
 ASSI { 1100}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HG3 ))
      3.600     1.700     1.700 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      8.929 ppm2      2.139 CV     1
 OR { 1100}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HG2 ))
 ASSI { 1104}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.300     0.700     0.700 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.94881E-02 ppm1      8.933 ppm2      4.226 CV     1
 ASSI { 1105}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      3.400     1.400     1.400 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.77175E-03 ppm1      8.933 ppm2      3.400 CV     1
 ASSI { 1106}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB3 ))
      3.400     1.400     1.400 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.11013E-02 ppm1      8.934 ppm2      2.845 CV     1
 ASSI { 1107}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 63   and name HD% )
      3.600     1.600     1.600 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.76327E-03 ppm1      8.939 ppm2      6.913 CV     1
 ASSI { 1108}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.800     0.800 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.38714E-02 ppm1      8.940 ppm2      5.478 CV     1
 ASSI { 1110}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 75   and name HE% )
      4.200     4.200     1.800 peak  1110 spectrum    1 weight  0.10000E+01 volume  0.59047E-03 ppm1      8.941 ppm2      7.047 CV     1
 ASSI { 1111}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      2.600     0.900     0.900 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.39900E-02 ppm1      8.942 ppm2      1.286 CV     1
 ASSI { 1112}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 63   and name HZ  ))
      3.900     1.900     1.900 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.51592E-03 ppm1      8.942 ppm2      6.788 CV     1
 ASSI { 1113}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      2.300     0.600     0.600 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.77260E-02 ppm1      8.943 ppm2      5.763 CV     1
 ASSI { 1114}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      3.000     1.100     1.100 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.15757E-02 ppm1      8.943 ppm2      5.182 CV     1
 ASSI { 1115}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HB  ))
      2.600     0.800     0.800 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.34479E-02 ppm1      8.943 ppm2      1.592 CV     1
 ASSI { 1117}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      3.900     1.900     1.900 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      8.943 ppm2      8.569 CV     1
 ASSI { 1118}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.600     1.600     1.600 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      8.944 ppm2      0.194 CV     1
 ASSI { 1119}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
      4.300     2.300     1.700 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.48455E-03 ppm1      8.948 ppm2      2.990 CV     1
 ASSI { 1120}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HG3 ))
      3.700     1.700     1.700 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.58706E-03 ppm1      9.000 ppm2      2.122 CV     1
 ASSI { 1121}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 40   and name HB  ))
      3.800     1.800     1.800 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.43882E-03 ppm1      9.000 ppm2      3.871 CV     1
 ASSI { 1123}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      4.600     2.600     1.400 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.18383E-03 ppm1      9.000 ppm2      7.677 CV     1
 ASSI { 1124}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      2.600     0.800     0.800 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.39646E-02 ppm1      9.002 ppm2      0.880 CV     1
 ASSI { 1125}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB3 ))
      2.800     1.000     1.000 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.25244E-02 ppm1      9.003 ppm2      1.995 CV     1
 OR { 1125}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1126}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      3.600     1.600     1.600 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      9.003 ppm2      1.698 CV     1
 ASSI { 1127}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
      3.400     1.400     1.400 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.94881E-03 ppm1      9.003 ppm2      2.350 CV     1
 ASSI { 1129}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      3.400     1.400     1.400 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.18383E-02 ppm1      9.004 ppm2      4.987 CV     1
 ASSI { 1130}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.000     1.100     1.100 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.19823E-02 ppm1      9.172 ppm2      4.159 CV     1
 ASSI { 1131}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.200     1.300     1.300 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.14232E-02 ppm1      9.172 ppm2      1.695 CV     1
 OR { 1131}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HG2 ))
 ASSI { 1133}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.300     0.700     0.700 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.67260E-02 ppm1      9.175 ppm2      4.665 CV     1
 ASSI { 1134}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB3 ))
      4.100     2.100     1.900 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.69805E-03 ppm1      9.176 ppm2      2.717 CV     1
 ASSI { 1135}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HG2 ))
      4.500     2.600     1.500 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.34987E-03 ppm1      9.206 ppm2      2.347 CV     1
 ASSI { 1137}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.400     0.700     0.700 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.46338E-02 ppm1      9.214 ppm2      4.905 CV     1
 ASSI { 1138}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      3.500     1.600     1.600 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.49218E-03 ppm1      9.215 ppm2      5.173 CV     1
 ASSI { 1139}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.400     1.400     1.400 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.82090E-03 ppm1      9.215 ppm2      2.627 CV     1
 ASSI { 1140}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB3 ))
      2.500     0.800     0.800 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.34055E-02 ppm1      9.215 ppm2      2.094 CV     1
 ASSI { 1141}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
      3.000     1.100     1.100 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.28464E-02 ppm1      9.215 ppm2      0.826 CV     1
 OR { 1141}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 ASSI { 1143}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      4.400     2.400     1.600 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.44898E-03 ppm1      9.223 ppm2      4.625 CV     1
 ASSI { 1144}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      2.500     0.800     0.800 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.62772E-02 ppm1      9.224 ppm2      1.105 CV     1
 ASSI { 1146}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 61   and name HG1%)
      3.700     1.700     1.700 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.59298E-03 ppm1      9.324 ppm2      0.187 CV     1
 ASSI { 1148}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.300     0.700     0.700 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.59047E-02 ppm1      9.326 ppm2      4.816 CV     1
 ASSI { 1149}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
      3.800     1.800     1.800 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.12199E-02 ppm1      9.326 ppm2      2.982 CV     1
 ASSI { 1152}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      2.700     0.900     0.900 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.21856E-02 ppm1      9.327 ppm2      3.140 CV     1
 ASSI { 1155}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      3.600     1.700     1.700 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.79971E-03 ppm1      9.328 ppm2      1.081 CV     1
 ASSI { 1156}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 80   and name HG1%)
      3.700     1.700     1.700 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.71668E-03 ppm1      9.328 ppm2     -0.162 CV     1
 ASSI { 1157}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      2.600     0.800     0.800 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.44221E-02 ppm1      9.329 ppm2      0.680 CV     1
 ASSI { 1158}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB  ))
      3.200     1.300     1.300 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.23381E-02 ppm1      9.329 ppm2      1.545 CV     1
 ASSI { 1159}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 63   and name HD% )
      3.900     1.900     1.900 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.52606E-03 ppm1      9.331 ppm2      6.912 CV     1
 ASSI { 1162}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      2.900     1.100     1.100 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.46169E-02 ppm1      9.340 ppm2      0.641 CV     1
 ASSI { 1163}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      2.400     0.700     0.700 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.51843E-02 ppm1      9.346 ppm2      2.653 CV     1
 ASSI { 1164}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.800     1.000     1.000 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.15672E-02 ppm1      9.346 ppm2      2.207 CV     1
 ASSI { 1165}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA1 ))
      2.400     0.700     0.700 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.40069E-02 ppm1      9.348 ppm2      3.629 CV     1
 ASSI { 1166}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG3 ))
      3.700     1.700     1.700 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.11521E-02 ppm1      9.348 ppm2      2.344 CV     1
 ASSI { 1168}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 5    and name HG13))
      4.200     2.200     1.800 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.29311E-03 ppm1      9.348 ppm2      1.425 CV     1
 ASSI { 1170}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      3.100     1.200     1.200 peak  1170 spectrum    1 weight  0.10000E+01 volume  0.15418E-02 ppm1      9.349 ppm2      4.237 CV     1
 ASSI { 1171}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
      3.000     1.100     1.100 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.22957E-02 ppm1      9.349 ppm2      3.167 CV     1
 ASSI { 1173}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      3.300     1.400     1.400 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.74038E-03 ppm1      9.350 ppm2      4.521 CV     1
 ASSI { 1174}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
      3.700     1.700     1.700 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.62943E-03 ppm1      9.351 ppm2      8.875 CV     1
 ASSI { 1176}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 3    and name HG3 ))
      2.400     2.400     3.600 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.60824E-02 ppm1      9.356 ppm2      1.672 CV     1
 OR { 1176}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 3    and name HG2 ))
 ASSI { 1177}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      2.800     0.900     0.900 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.51166E-02 ppm1      9.357 ppm2      1.093 CV     1
 ASSI { 1178}
   (( segid "    " and resid 41   and name HE22))
   (( segid "    " and resid 70   and name HB3 ))
      4.800     2.800     1.200 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.19484E-03 ppm1      9.375 ppm2      1.459 CV     1
 ASSI { 1180}
   (( segid "    " and resid 41   and name HE22))
   (  segid "    " and resid 46   and name HD1%)
      3.900     1.900     1.900 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.46084E-03 ppm1      9.378 ppm2      0.786 CV     1
 ASSI { 1181}
   (( segid "    " and resid 41   and name HE22))
   (  segid "    " and resid 69   and name HG2%)
      3.900     1.900     1.900 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.36935E-03 ppm1      9.378 ppm2      0.381 CV     1
 ASSI { 1183}
   (( segid "    " and resid 41   and name HE22))
   (( segid "    " and resid 41   and name HG3 ))
      3.800     1.800     1.800 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.94033E-03 ppm1      9.379 ppm2      2.353 CV     1
 ASSI { 1184}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      2.500     0.800     0.800 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.36851E-02 ppm1      9.381 ppm2      3.026 CV     1
 ASSI { 1187}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.400     0.700     0.700 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.58962E-02 ppm1      9.383 ppm2      4.673 CV     1
 ASSI { 1188}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.100     1.200     1.200 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.13978E-02 ppm1      9.383 ppm2      4.414 CV     1
 ASSI { 1189}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 54   and name HB3 ))
      3.900     1.900     1.900 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.11606E-02 ppm1      9.383 ppm2      2.499 CV     1
 ASSI { 1190}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HG2%)
      2.500     0.800     0.800 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.45660E-02 ppm1      9.383 ppm2      1.306 CV     1
 ASSI { 1191}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      3.800     1.800     1.800 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.11013E-02 ppm1      9.383 ppm2      0.946 CV     1
 ASSI { 1192}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      4.400     2.400     1.600 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.44983E-03 ppm1      9.383 ppm2      4.195 CV     1
 ASSI { 1195}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      5.400     3.600     0.600 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.13554E-03 ppm1      9.384 ppm2      1.854 CV     1
 ASSI { 1196}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 55   and name HG1%)
      5.000     3.100     1.000 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.16943E-03 ppm1      9.385 ppm2      0.730 CV     1
 ASSI { 1198}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG  ))
      5.200     3.400     0.800 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.18468E-03 ppm1      9.388 ppm2      2.233 CV     1
 ASSI { 1199}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.200     0.600     0.600 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.90644E-02 ppm1      9.395 ppm2      5.451 CV     1
 ASSI { 1201}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.900     1.900     1.900 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      9.395 ppm2      2.040 CV     1
 ASSI { 1202}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HD2 ))
      4.500     2.600     1.500 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.41849E-03 ppm1      9.395 ppm2      3.847 CV     1
 ASSI { 1203}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.000     1.100     1.100 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.13300E-02 ppm1      9.396 ppm2      4.950 CV     1
 ASSI { 1204}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      2.600     0.800     0.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.39646E-02 ppm1      9.396 ppm2      0.768 CV     1
 ASSI { 1205}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 64   and name HB% )
      4.300     2.300     1.700 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.42611E-03 ppm1      9.397 ppm2      1.047 CV     1
 ASSI { 1207}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      4.400     2.400     1.600 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.44898E-03 ppm1      9.399 ppm2      8.771 CV     1
 ASSI { 1208}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
      3.800     1.800     1.800 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.56929E-03 ppm1      9.399 ppm2      2.977 CV     1
 ASSI { 1209}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
      3.100     1.200     1.200 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.19399E-02 ppm1      9.399 ppm2      1.317 CV     1
 ASSI { 1210}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      4.000     2.000     2.000 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.64635E-03 ppm1      9.400 ppm2      3.138 CV     1
 ASSI { 1211}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      3.800     1.800     1.800 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.88104E-03 ppm1      9.557 ppm2      7.697 CV     1
 ASSI { 1212}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HG  ))
      3.100     1.200     1.200 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      9.558 ppm2      2.238 CV     1
 ASSI { 1214}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.300     1.400     1.400 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.86407E-03 ppm1      9.559 ppm2      4.674 CV     1
 ASSI { 1215}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      2.400     0.700     0.700 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.51677E-02 ppm1      9.560 ppm2      3.884 CV     1
 ASSI { 1216}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.300     1.400     1.400 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      9.560 ppm2      2.629 CV     1
 ASSI { 1217}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      2.800     1.000     1.000 peak  1217 spectrum    1 weight  0.10000E+01 volume  0.16943E-02 ppm1      9.561 ppm2      1.867 CV     1
 ASSI { 1218}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      3.800     1.800     1.800 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.10420E-02 ppm1      9.561 ppm2      1.113 CV     1
 ASSI { 1220}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB3 ))
      3.800     1.800     1.800 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.11944E-02 ppm1      9.562 ppm2      1.257 CV     1
 ASSI { 1221}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      4.300     2.300     1.700 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.41256E-03 ppm1      9.562 ppm2      5.011 CV     1
 ASSI { 1223}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.000     1.100     1.100 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.16943E-02 ppm1      9.575 ppm2      0.763 CV     1
 ASSI { 1224}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      3.000     1.100     1.100 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.22703E-02 ppm1      9.576 ppm2      0.379 CV     1
 ASSI { 1225}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HD2 ))
      3.900     1.900     1.900 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.60147E-03 ppm1      9.576 ppm2      3.064 CV     1
 OR { 1225}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HD3 ))
 ASSI { 1226}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.200     0.600     0.600 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.69971E-02 ppm1      9.577 ppm2      3.313 CV     1
 ASSI { 1227}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      3.200     1.300     1.300 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.98270E-03 ppm1      9.577 ppm2      1.701 CV     1
 OR { 1227}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HG2 ))
 ASSI { 1228}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB3 ))
      3.200     1.300     1.300 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.11436E-02 ppm1      9.577 ppm2      1.475 CV     1
 ASSI { 1229}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 69   and name HG1%)
      4.000     2.000     2.000 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.53284E-03 ppm1      9.577 ppm2     -0.001 CV     1
 ASSI { 1230}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.100     2.100     1.900 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.45660E-03 ppm1      9.577 ppm2      8.333 CV     1
 ASSI { 1231}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 41   and name HE21))
      3.800     1.800     1.800 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.18976E-02 ppm1      9.578 ppm2      6.695 CV     1
 ASSI { 1232}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.000     1.100     1.100 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.16265E-02 ppm1      9.578 ppm2      4.156 CV     1
 ASSI { 1233}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 8    and name HG2%)
      4.600     2.600     1.400 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.19484E-03 ppm1      9.579 ppm2      0.643 CV     1
 ASSI { 1234}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 41   and name HG3 ))
      2.800     2.800     3.200 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.92336E-03 ppm1      9.579 ppm2      2.323 CV     1
 ASSI { 1235}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.700     1.700     1.700 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.34733E-03 ppm1      9.581 ppm2      9.180 CV     1
 ASSI { 1237}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HD2 ))
      3.000     3.000     3.000 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.60232E-03 ppm1      9.958 ppm2      1.373 CV     1
 OR { 1237}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HD3 ))
 ASSI { 1238}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      3.500     3.500     2.500 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.26770E-03 ppm1      9.958 ppm2      9.555 CV     1
 ASSI { 1240}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.900     1.100     1.100 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.20840E-02 ppm1      9.960 ppm2      4.159 CV     1
 ASSI { 1241}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HG3 ))
      3.100     1.200     1.200 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.13808E-02 ppm1      9.960 ppm2      2.370 CV     1
 OR { 1241}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI { 1242}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.800     1.000     1.000 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.30582E-02 ppm1      9.961 ppm2      2.013 CV     1
 OR { 1242}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB3 ))
 ASSI { 1243}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      4.700     2.700     1.300 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.14909E-03 ppm1      9.965 ppm2      7.654 CV     1
 ASSI { 1244}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.400     2.400     3.600 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.49303E-02 ppm1      9.968 ppm2      4.011 CV     1
 ASSI { 1245}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 12   and name HB% )
      3.600     1.600     1.600 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.69379E-03 ppm1     10.630 ppm2      1.461 CV     1
 ASSI { 1246}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      4.900     3.000     1.100 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.10166E-03 ppm1     10.631 ppm2      4.225 CV     1
 ASSI { 1247}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.300     1.400     1.400 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.92336E-03 ppm1     10.632 ppm2      5.160 CV     1
 ASSI { 1248}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      5.900     4.300     0.100 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.39223E-04 ppm1     10.637 ppm2      0.881 CV     1
 ASSI {    3}
   (  segid "    " and resid 80   and name HG2%)
   (  segid "    " and resid 80   and name HG1%)
      4.400     4.400     1.600 peak     3 spectrum    1 weight  0.10000E+01 volume  0.17441E-03 ppm1     -0.130 ppm2      0.368 CV     1
 ASSI {    4}
   (  segid "    " and resid 63   and name HD% )
   (  segid "    " and resid 80   and name HG1%)
      4.000     2.000     2.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.25309E-03 ppm1     -0.130 ppm2      6.944 CV     1
 ASSI {    7}
   (( segid "    " and resid 72   and name HG3 ))
   (  segid "    " and resid 69   and name HG1%)
      3.700     1.700     1.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.71919E-03 ppm1      0.019 ppm2      1.762 CV     1
 OR {    7}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 69   and name HG1%)
 ASSI {    9}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 69   and name HG1%)
      2.400     0.700     0.700 peak     9 spectrum    1 weight  0.10000E+01 volume  0.52374E-02 ppm1      0.023 ppm2      1.395 CV     1
 ASSI {   10}
   (  segid "    " and resid 63   and name HD% )
   (  segid "    " and resid 69   and name HG1%)
      3.500     1.600     1.600 peak    10 spectrum    1 weight  0.10000E+01 volume  0.74924E-03 ppm1      0.023 ppm2      6.942 CV     1
 ASSI {   12}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 69   and name HG1%)
      2.600     0.800     0.800 peak    12 spectrum    1 weight  0.10000E+01 volume  0.42600E-02 ppm1      0.024 ppm2      3.331 CV     1
 ASSI {   14}
   (  segid "    " and resid 69   and name HG2%)
   (  segid "    " and resid 69   and name HG1%)
      2.300     2.300     3.700 peak    14 spectrum    1 weight  0.10000E+01 volume  0.90962E-02 ppm1      0.024 ppm2      0.404 CV     1
 ASSI {   15}
   (  segid "    " and resid 63   and name HD% )
   (  segid "    " and resid 61   and name HG1%)
      2.900     1.000     1.000 peak    15 spectrum    1 weight  0.10000E+01 volume  0.17341E-02 ppm1      0.210 ppm2      6.941 CV     1
 ASSI {   16}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 61   and name HG1%)
      2.300     2.300     3.700 peak    16 spectrum    1 weight  0.10000E+01 volume  0.74924E-02 ppm1      0.212 ppm2      0.706 CV     1
 ASSI {   17}
   (  segid "    " and resid 63   and name HE% )
   (  segid "    " and resid 61   and name HG1%)
      2.800     1.000     1.000 peak    17 spectrum    1 weight  0.10000E+01 volume  0.19797E-02 ppm1      0.213 ppm2      6.495 CV     1
 ASSI {   18}
   (( segid "    " and resid 6    and name HG12))
   (  segid "    " and resid 61   and name HG1%)
      2.600     0.800     0.800 peak    18 spectrum    1 weight  0.10000E+01 volume  0.31574E-02 ppm1      0.213 ppm2      1.578 CV     1
 OR {   18}
   (( segid "    " and resid 6    and name HG13))
   (  segid "    " and resid 61   and name HG1%)
 ASSI {   21}
   (  segid "    " and resid 80   and name HG1%)
   (  segid "    " and resid 61   and name HG1%)
      2.800     2.800     3.200 peak    21 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      0.213 ppm2     -0.125 CV     1
 ASSI {   22}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 61   and name HG1%)
      3.300     1.400     1.400 peak    22 spectrum    1 weight  0.10000E+01 volume  0.77180E-03 ppm1      0.215 ppm2      5.796 CV     1
 ASSI {   23}
   (  segid "    " and resid 75   and name HD% )
   (  segid "    " and resid 61   and name HG1%)
      3.500     1.500     1.500 peak    23 spectrum    1 weight  0.10000E+01 volume  0.52872E-03 ppm1      0.215 ppm2      7.334 CV     1
 ASSI {   24}
   (  segid "    " and resid 63   and name HE% )
   (  segid "    " and resid 80   and name HG2%)
      3.500     1.600     1.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.58388E-03 ppm1      0.359 ppm2      6.489 CV     1
 ASSI {   27}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 80   and name HG2%)
      3.900     1.900     1.900 peak    27 spectrum    1 weight  0.10000E+01 volume  0.40344E-03 ppm1      0.367 ppm2      3.250 CV     1
 ASSI {   29}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 80   and name HG2%)
      2.500     0.800     0.800 peak    29 spectrum    1 weight  0.10000E+01 volume  0.54379E-02 ppm1      0.368 ppm2      1.764 CV     1
 ASSI {   30}
   (  segid "    " and resid 63   and name HE% )
   (  segid "    " and resid 69   and name HG2%)
      2.900     1.000     1.000 peak    30 spectrum    1 weight  0.10000E+01 volume  0.17617E-02 ppm1      0.401 ppm2      6.487 CV     1
 ASSI {   31}
   (( segid "    " and resid 72   and name HG3 ))
   (  segid "    " and resid 69   and name HG2%)
      2.900     1.000     1.000 peak    31 spectrum    1 weight  0.10000E+01 volume  0.85952E-03 ppm1      0.402 ppm2      1.776 CV     1
 OR {   31}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 69   and name HG2%)
 ASSI {   32}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
      2.400     0.700     0.700 peak    32 spectrum    1 weight  0.10000E+01 volume  0.53877E-02 ppm1      0.404 ppm2      1.395 CV     1
 ASSI {   36}
   (  segid "    " and resid 75   and name HE% )
   (  segid "    " and resid 69   and name HG2%)
      3.000     1.100     1.100 peak    36 spectrum    1 weight  0.10000E+01 volume  0.66407E-03 ppm1      0.404 ppm2      7.104 CV     1
 ASSI {   38}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
      3.700     1.700     1.700 peak    38 spectrum    1 weight  0.10000E+01 volume  0.16438E-02 ppm1      0.549 ppm2      5.682 CV     1
 ASSI {   39}
   (( segid "    " and resid 5    and name HB  ))
   (  segid "    " and resid 36   and name HD1%)
      2.600     0.800     0.800 peak    39 spectrum    1 weight  0.10000E+01 volume  0.46609E-02 ppm1      0.550 ppm2      1.609 CV     1
 ASSI {   40}
   (( segid "    " and resid 36   and name HG12))
   (  segid "    " and resid 36   and name HD1%)
      1.900     1.900     4.100 peak    40 spectrum    1 weight  0.10000E+01 volume  0.21901E-01 ppm1      0.552 ppm2      1.248 CV     1
 ASSI {   41}
   (( segid "    " and resid 25   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
      3.200     1.300     1.300 peak    41 spectrum    1 weight  0.10000E+01 volume  0.16739E-02 ppm1      0.553 ppm2      2.104 CV     1
 ASSI {   43}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HG13))
      1.800     0.400     0.400 peak    43 spectrum    1 weight  0.10000E+01 volume  0.13407E-01 ppm1      0.583 ppm2      1.761 CV     1
 ASSI {   44}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 96   and name HG13))
      2.100     0.600     0.600 peak    44 spectrum    1 weight  0.10000E+01 volume  0.11702E-01 ppm1      0.583 ppm2      0.748 CV     1
 OR {   44}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HG13))
 ASSI {   45}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HG13))
      3.000     1.100     1.100 peak    45 spectrum    1 weight  0.10000E+01 volume  0.19696E-02 ppm1      0.587 ppm2      3.403 CV     1
 ASSI {   46}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HB3 ))
      3.900     1.900     1.900 peak    46 spectrum    1 weight  0.10000E+01 volume  0.34581E-03 ppm1      0.600 ppm2      1.503 CV     1
 ASSI {   48}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HB3 ))
      1.900     1.900     4.100 peak    48 spectrum    1 weight  0.10000E+01 volume  0.10099E-01 ppm1      0.609 ppm2      0.929 CV     1
 ASSI {   51}
   (( segid "    " and resid 25   and name HG  ))
   (  segid "    " and resid 25   and name HD1%)
      3.300     1.400     1.400 peak    51 spectrum    1 weight  0.10000E+01 volume  0.79687E-03 ppm1      0.613 ppm2      1.727 CV     1
 ASSI {   53}
   (  segid "    " and resid 7    and name HB% )
   (  segid "    " and resid 25   and name HD1%)
      2.600     2.600     3.400 peak    53 spectrum    1 weight  0.10000E+01 volume  0.39342E-02 ppm1      0.613 ppm2      1.306 CV     1
 ASSI {   57}
   (  segid "    " and resid 99   and name HB% )
   (  segid "    " and resid 60   and name HG2%)
      2.800     2.800     3.200 peak    57 spectrum    1 weight  0.10000E+01 volume  0.23054E-02 ppm1      0.653 ppm2      1.407 CV     1
 ASSI {   59}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 60   and name HG2%)
      4.400     2.400     1.600 peak    59 spectrum    1 weight  0.10000E+01 volume  0.22753E-03 ppm1      0.655 ppm2      4.424 CV     1
 ASSI {   61}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 8    and name HG2%)
      2.800     1.000     1.000 peak    61 spectrum    1 weight  0.10000E+01 volume  0.19596E-02 ppm1      0.665 ppm2      5.198 CV     1
 ASSI {   62}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 65   and name HG1%)
      2.600     0.800     0.800 peak    62 spectrum    1 weight  0.10000E+01 volume  0.40094E-02 ppm1      0.678 ppm2      5.518 CV     1
 ASSI {   64}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 65   and name HG1%)
      3.700     1.700     1.700 peak    64 spectrum    1 weight  0.10000E+01 volume  0.12404E-02 ppm1      0.679 ppm2      3.169 CV     1
 ASSI {   65}
   (( segid "    " and resid 65   and name HB  ))
   (  segid "    " and resid 65   and name HG1%)
      2.300     0.700     0.700 peak    65 spectrum    1 weight  0.10000E+01 volume  0.46359E-02 ppm1      0.679 ppm2      2.280 CV     1
 ASSI {   67}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 65   and name HG1%)
      2.500     0.800     0.800 peak    67 spectrum    1 weight  0.10000E+01 volume  0.40344E-02 ppm1      0.680 ppm2      5.703 CV     1
 ASSI {   68}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 5    and name HD1%)
      2.700     0.900     0.900 peak    68 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      0.681 ppm2      3.402 CV     1
 ASSI {   69}
   (( segid "    " and resid 5    and name HB  ))
   (  segid "    " and resid 5    and name HD1%)
      2.200     0.600     0.600 peak    69 spectrum    1 weight  0.10000E+01 volume  0.95474E-02 ppm1      0.683 ppm2      1.566 CV     1
 ASSI {   70}
   (( segid "    " and resid 5    and name HG13))
   (  segid "    " and resid 5    and name HD1%)
      2.200     2.200     3.800 peak    70 spectrum    1 weight  0.10000E+01 volume  0.95222E-02 ppm1      0.689 ppm2      1.400 CV     1
 ASSI {   71}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 62   and name HG2%)
      3.200     1.300     1.300 peak    71 spectrum    1 weight  0.10000E+01 volume  0.13256E-02 ppm1      0.693 ppm2      5.485 CV     1
 ASSI {   74}
   (( segid "    " and resid 25   and name HG  ))
   (  segid "    " and resid 25   and name HD2%)
      2.500     0.800     0.800 peak    74 spectrum    1 weight  0.10000E+01 volume  0.40094E-02 ppm1      0.714 ppm2      1.749 CV     1
 ASSI {   75}
   (  segid "    " and resid 75   and name HD% )
   (  segid "    " and resid 61   and name HG2%)
      2.700     0.900     0.900 peak    75 spectrum    1 weight  0.10000E+01 volume  0.18218E-02 ppm1      0.714 ppm2      7.330 CV     1
 ASSI {   77}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 61   and name HG2%)
      2.500     0.800     0.800 peak    77 spectrum    1 weight  0.10000E+01 volume  0.32326E-02 ppm1      0.714 ppm2      1.753 CV     1
 ASSI {   78}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
      3.500     1.500     1.500 peak    78 spectrum    1 weight  0.10000E+01 volume  0.73170E-03 ppm1      0.714 ppm2      4.418 CV     1
 ASSI {   81}
   (( segid "    " and resid 78   and name HE3 ))
   (  segid "    " and resid 61   and name HG2%)
      3.100     1.200     1.200 peak    81 spectrum    1 weight  0.10000E+01 volume  0.97729E-03 ppm1      0.716 ppm2      2.754 CV     1
 ASSI {   82}
   (( segid "    " and resid 74   and name HG3 ))
   (  segid "    " and resid 55   and name HG1%)
      2.600     2.600     3.400 peak    82 spectrum    1 weight  0.10000E+01 volume  0.22954E-02 ppm1      0.718 ppm2      1.447 CV     1
 ASSI {   83}
   (( segid "    " and resid 6    and name HG12))
   (  segid "    " and resid 61   and name HG2%)
      3.200     1.300     1.300 peak    83 spectrum    1 weight  0.10000E+01 volume  0.91464E-03 ppm1      0.721 ppm2      1.595 CV     1
 OR {   83}
   (( segid "    " and resid 6    and name HG13))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {   84}
   (( segid "    " and resid 34   and name HB3 ))
   (  segid "    " and resid 5    and name HD1%)
      3.300     1.300     1.300 peak    84 spectrum    1 weight  0.10000E+01 volume  0.98232E-03 ppm1      0.721 ppm2      2.134 CV     1
 ASSI {   86}
   (( segid "    " and resid 34   and name HB2 ))
   (  segid "    " and resid 5    and name HD1%)
      2.900     1.100     1.100 peak    86 spectrum    1 weight  0.10000E+01 volume  0.18744E-02 ppm1      0.722 ppm2      2.844 CV     1
 ASSI {   88}
   (  segid "    " and resid 63   and name HD% )
   (  segid "    " and resid 8    and name HG1%)
      3.100     1.200     1.200 peak    88 spectrum    1 weight  0.10000E+01 volume  0.19195E-02 ppm1      0.747 ppm2      6.948 CV     1
 ASSI {   89}
   (  segid "    " and resid 75   and name HE% )
   (  segid "    " and resid 8    and name HG1%)
      2.400     0.700     0.700 peak    89 spectrum    1 weight  0.10000E+01 volume  0.24934E-02 ppm1      0.747 ppm2      7.077 CV     1
 ASSI {   90}
   (  segid "    " and resid 63   and name HE% )
   (  segid "    " and resid 8    and name HG1%)
      3.100     1.200     1.200 peak    90 spectrum    1 weight  0.10000E+01 volume  0.15536E-02 ppm1      0.747 ppm2      6.496 CV     1
 ASSI {   93}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
      4.100     2.100     1.900 peak    93 spectrum    1 weight  0.10000E+01 volume  0.81189E-03 ppm1      0.754 ppm2      3.400 CV     1
 ASSI {   97}
   (( segid "    " and resid 28   and name HA2 ))
   (  segid "    " and resid 96   and name HD1%)
      3.000     1.100     1.100 peak    97 spectrum    1 weight  0.10000E+01 volume  0.11853E-02 ppm1      0.756 ppm2      3.266 CV     1
 ASSI {   98}
   (( segid "    " and resid 74   and name HD3 ))
   (  segid "    " and resid 55   and name HG1%)
      3.400     1.400     1.400 peak    98 spectrum    1 weight  0.10000E+01 volume  0.61393E-03 ppm1      0.756 ppm2      2.540 CV     1
 ASSI {  100}
   (( segid "    " and resid 55   and name HB  ))
   (  segid "    " and resid 55   and name HG1%)
      2.500     0.800     0.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.32827E-02 ppm1      0.757 ppm2      2.042 CV     1
 ASSI {  101}
   (  segid "    " and resid 75   and name HE% )
   (  segid "    " and resid 55   and name HG1%)
      2.600     0.800     0.800 peak   101 spectrum    1 weight  0.10000E+01 volume  0.25309E-02 ppm1      0.757 ppm2      7.101 CV     1
 ASSI {  102}
   (  segid "    " and resid 29   and name HB% )
   (  segid "    " and resid 96   and name HD1%)
      2.700     2.700     3.300 peak   102 spectrum    1 weight  0.10000E+01 volume  0.33078E-02 ppm1      0.758 ppm2      1.234 CV     1
 ASSI {  103}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
      3.400     1.400     1.400 peak   103 spectrum    1 weight  0.10000E+01 volume  0.12805E-02 ppm1      0.758 ppm2      5.682 CV     1
 ASSI {  105}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      2.900     1.000     1.000 peak   105 spectrum    1 weight  0.10000E+01 volume  0.20573E-02 ppm1      0.761 ppm2      3.397 CV     1
 ASSI {  106}
   (( segid "    " and resid 96   and name HG12))
   (  segid "    " and resid 96   and name HG2%)
      2.400     0.700     0.700 peak   106 spectrum    1 weight  0.10000E+01 volume  0.52625E-02 ppm1      0.762 ppm2      1.714 CV     1
 ASSI {  107}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
      5.200     3.400     0.800 peak   107 spectrum    1 weight  0.10000E+01 volume  0.19020E-03 ppm1      0.762 ppm2      3.156 CV     1
 ASSI {  108}
   (( segid "    " and resid 26   and name HB2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.000     1.100     1.100 peak   108 spectrum    1 weight  0.10000E+01 volume  0.18117E-02 ppm1      0.763 ppm2      1.882 CV     1
 ASSI {  111}
   (  segid "    " and resid 69   and name HG1%)
   (  segid "    " and resid 65   and name HG2%)
      2.700     2.700     3.300 peak   111 spectrum    1 weight  0.10000E+01 volume  0.31574E-02 ppm1      0.764 ppm2      0.021 CV     1
 ASSI {  113}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 36   and name HG2%)
      2.500     0.800     0.800 peak   113 spectrum    1 weight  0.10000E+01 volume  0.48114E-02 ppm1      0.765 ppm2      3.857 CV     1
 ASSI {  115}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 65   and name HG2%)
      3.600     1.600     1.600 peak   115 spectrum    1 weight  0.10000E+01 volume  0.89962E-03 ppm1      0.765 ppm2      5.704 CV     1
 ASSI {  116}
   (( segid "    " and resid 70   and name HD2 ))
   (  segid "    " and resid 46   and name HD1%)
      3.100     1.200     1.200 peak   116 spectrum    1 weight  0.10000E+01 volume  0.54379E-03 ppm1      0.808 ppm2      3.085 CV     1
 ASSI {  119}
   (( segid "    " and resid 57   and name HG13))
   (  segid "    " and resid 57   and name HD1%)
      2.400     2.400     3.600 peak   119 spectrum    1 weight  0.10000E+01 volume  0.59891E-02 ppm1      0.826 ppm2      1.298 CV     1
 ASSI {  120}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HG  ))
      2.200     0.600     0.600 peak   120 spectrum    1 weight  0.10000E+01 volume  0.82692E-02 ppm1      0.827 ppm2      1.811 CV     1
 ASSI {  121}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 57   and name HD1%)
      3.700     1.700     1.700 peak   121 spectrum    1 weight  0.10000E+01 volume  0.56881E-03 ppm1      0.827 ppm2      1.900 CV     1
 ASSI {  122}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 103  and name HD1%)
      3.400     1.500     1.500 peak   122 spectrum    1 weight  0.10000E+01 volume  0.84696E-03 ppm1      0.828 ppm2      3.909 CV     1
 ASSI {  123}
   (( segid "    " and resid 103  and name HB  ))
   (  segid "    " and resid 103  and name HD1%)
      2.400     0.700     0.700 peak   123 spectrum    1 weight  0.10000E+01 volume  0.62649E-02 ppm1      0.829 ppm2      2.084 CV     1
 ASSI {  125}
   (( segid "    " and resid 102  and name HB3 ))
   (( segid "    " and resid 102  and name HG  ))
      2.400     2.400     3.600 peak   125 spectrum    1 weight  0.10000E+01 volume  0.66658E-02 ppm1      0.839 ppm2      1.478 CV     1
 ASSI {  126}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 102  and name HD2%)
      2.500     0.800     0.800 peak   126 spectrum    1 weight  0.10000E+01 volume  0.46609E-02 ppm1      0.841 ppm2      4.132 CV     1
 ASSI {  127}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 102  and name HG  ))
      3.000     1.100     1.100 peak   127 spectrum    1 weight  0.10000E+01 volume  0.15962E-02 ppm1      0.842 ppm2      3.938 CV     1
 ASSI {  128}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 102  and name HG  ))
      2.000     0.500     0.500 peak   128 spectrum    1 weight  0.10000E+01 volume  0.13707E-01 ppm1      0.846 ppm2      2.005 CV     1
 OR {  128}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HG  ))
 ASSI {  132}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG1%)
      3.300     1.400     1.400 peak   132 spectrum    1 weight  0.10000E+01 volume  0.15637E-02 ppm1      0.861 ppm2      3.342 CV     1
 ASSI {  134}
   (( segid "    " and resid 11   and name HB3 ))
   (  segid "    " and resid 85   and name HG1%)
      3.500     1.600     1.600 peak   134 spectrum    1 weight  0.10000E+01 volume  0.11653E-02 ppm1      0.863 ppm2      2.823 CV     1
 ASSI {  135}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HG2%)
      2.500     0.800     0.800 peak   135 spectrum    1 weight  0.10000E+01 volume  0.49616E-02 ppm1      0.867 ppm2      3.330 CV     1
 ASSI {  136}
   (( segid "    " and resid 89   and name HB  ))
   (  segid "    " and resid 89   and name HG2%)
      2.300     0.700     0.700 peak   136 spectrum    1 weight  0.10000E+01 volume  0.65905E-02 ppm1      0.868 ppm2      1.877 CV     1
 ASSI {  137}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
      3.500     1.500     1.500 peak   137 spectrum    1 weight  0.10000E+01 volume  0.10425E-02 ppm1      0.870 ppm2      3.216 CV     1
 ASSI {  138}
   (( segid "    " and resid 11   and name HB3 ))
   (  segid "    " and resid 85   and name HG2%)
      3.200     1.300     1.300 peak   138 spectrum    1 weight  0.10000E+01 volume  0.26312E-02 ppm1      0.870 ppm2      2.815 CV     1
 ASSI {  139}
   (  segid "    " and resid 21   and name HB% )
   (  segid "    " and resid 85   and name HG2%)
      2.800     2.800     3.200 peak   139 spectrum    1 weight  0.10000E+01 volume  0.22678E-02 ppm1      0.870 ppm2      1.540 CV     1
 ASSI {  141}
   (( segid "    " and resid 85   and name HB  ))
   (  segid "    " and resid 85   and name HG2%)
      2.500     0.800     0.800 peak   141 spectrum    1 weight  0.10000E+01 volume  0.41848E-02 ppm1      0.871 ppm2      1.799 CV     1
 ASSI {  142}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      3.100     1.200     1.200 peak   142 spectrum    1 weight  0.10000E+01 volume  0.12229E-02 ppm1      0.872 ppm2      3.333 CV     1
 ASSI {  143}
   (  segid "    " and resid 75   and name HD% )
   (  segid "    " and resid 55   and name HG2%)
      4.300     2.300     1.700 peak   143 spectrum    1 weight  0.10000E+01 volume  0.33328E-03 ppm1      0.880 ppm2      7.317 CV     1
 ASSI {  144}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 55   and name HG2%)
      3.700     1.700     1.700 peak   144 spectrum    1 weight  0.10000E+01 volume  0.86203E-03 ppm1      0.881 ppm2      4.309 CV     1
 ASSI {  146}
   (( segid "    " and resid 71   and name HB3 ))
   (  segid "    " and resid 55   and name HG2%)
      3.700     1.700     1.700 peak   146 spectrum    1 weight  0.10000E+01 volume  0.92966E-03 ppm1      0.882 ppm2      2.759 CV     1
 ASSI {  147}
   (( segid "    " and resid 4    and name HE2 ))
   (  segid "    " and resid 35   and name HD1%)
      3.000     1.100     1.100 peak   147 spectrum    1 weight  0.10000E+01 volume  0.14108E-02 ppm1      0.885 ppm2      2.987 CV     1
 OR {  147}
   (( segid "    " and resid 4    and name HE3 ))
   (  segid "    " and resid 35   and name HD1%)
 ASSI {  148}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 89   and name HD1%)
      3.100     1.200     1.200 peak   148 spectrum    1 weight  0.10000E+01 volume  0.11001E-02 ppm1      0.898 ppm2      2.980 CV     1
 ASSI {  150}
   (( segid "    " and resid 39   and name HG2 ))
   (  segid "    " and resid 46   and name HG2%)
      2.600     0.900     0.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.30070E-02 ppm1      0.900 ppm2      2.372 CV     1
 ASSI {  151}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      2.600     0.800     0.800 peak   151 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      0.900 ppm2      3.609 CV     1
 ASSI {  152}
   (( segid "    " and resid 89   and name HB  ))
   (  segid "    " and resid 89   and name HD1%)
      2.500     0.800     0.800 peak   152 spectrum    1 weight  0.10000E+01 volume  0.46609E-02 ppm1      0.901 ppm2      1.873 CV     1
 ASSI {  153}
   (( segid "    " and resid 89   and name HG12))
   (  segid "    " and resid 89   and name HD1%)
      2.300     0.700     0.700 peak   153 spectrum    1 weight  0.10000E+01 volume  0.54128E-02 ppm1      0.901 ppm2      1.724 CV     1
 ASSI {  154}
   (( segid "    " and resid 89   and name HG13))
   (  segid "    " and resid 89   and name HD1%)
      2.300     2.300     3.700 peak   154 spectrum    1 weight  0.10000E+01 volume  0.61895E-02 ppm1      0.901 ppm2      0.550 CV     1
 ASSI {  156}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 89   and name HD1%)
      3.800     1.800     1.800 peak   156 spectrum    1 weight  0.10000E+01 volume  0.11677E-02 ppm1      0.902 ppm2      2.181 CV     1
 ASSI {  157}
   (( segid "    " and resid 20   and name HB3 ))
   (  segid "    " and resid 89   and name HD1%)
      3.000     1.100     1.100 peak   157 spectrum    1 weight  0.10000E+01 volume  0.12253E-02 ppm1      0.902 ppm2      2.091 CV     1
 ASSI {  158}
   (  segid "    " and resid 21   and name HB% )
   (  segid "    " and resid 89   and name HD1%)
      3.000     3.000     3.000 peak   158 spectrum    1 weight  0.10000E+01 volume  0.15536E-02 ppm1      0.902 ppm2      1.540 CV     1
 ASSI {  159}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
      4.200     2.200     1.800 peak   159 spectrum    1 weight  0.10000E+01 volume  0.64654E-03 ppm1      0.902 ppm2      3.333 CV     1
 ASSI {  164}
   (( segid "    " and resid 74   and name HD3 ))
   (( segid "    " and resid 74   and name HB2 ))
      3.300     1.300     1.300 peak   164 spectrum    1 weight  0.10000E+01 volume  0.15386E-02 ppm1      0.918 ppm2      2.558 CV     1
 ASSI {  168}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HB2 ))
      3.400     3.400     2.600 peak   168 spectrum    1 weight  0.10000E+01 volume  0.73673E-03 ppm1      0.937 ppm2      1.609 CV     1
 ASSI {  173}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HG1%)
      3.200     1.300     1.300 peak   173 spectrum    1 weight  0.10000E+01 volume  0.11552E-02 ppm1      0.964 ppm2      4.129 CV     1
 ASSI {  174}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 6    and name HG2%)
      3.100     1.200     1.200 peak   174 spectrum    1 weight  0.10000E+01 volume  0.12354E-02 ppm1      0.966 ppm2      2.529 CV     1
 ASSI {  176}
   (( segid "    " and resid 54   and name HB3 ))
   (  segid "    " and resid 50   and name HD2%)
      3.300     1.300     1.300 peak   176 spectrum    1 weight  0.10000E+01 volume  0.10425E-02 ppm1      0.969 ppm2      2.527 CV     1
 ASSI {  177}
   (( segid "    " and resid 37   and name HB2 ))
   (  segid "    " and resid 50   and name HD2%)
      2.500     0.800     0.800 peak   177 spectrum    1 weight  0.10000E+01 volume  0.11928E-01 ppm1      0.969 ppm2      1.778 CV     1
 ASSI {  178}
   (( segid "    " and resid 50   and name HG  ))
   (  segid "    " and resid 50   and name HD2%)
      2.300     0.600     0.600 peak   178 spectrum    1 weight  0.10000E+01 volume  0.67658E-02 ppm1      0.970 ppm2      2.232 CV     1
 ASSI {  179}
   (( segid "    " and resid 37   and name HE3 ))
   (  segid "    " and resid 50   and name HD2%)
      3.800     1.800     1.800 peak   179 spectrum    1 weight  0.10000E+01 volume  0.59137E-03 ppm1      0.971 ppm2      2.783 CV     1
 OR {  179}
   (( segid "    " and resid 37   and name HE2 ))
   (  segid "    " and resid 50   and name HD2%)
 ASSI {  180}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 50   and name HD2%)
      3.300     1.400     1.400 peak   180 spectrum    1 weight  0.10000E+01 volume  0.94222E-03 ppm1      0.971 ppm2      3.054 CV     1
 ASSI {  181}
   (( segid "    " and resid 37   and name HD3 ))
   (  segid "    " and resid 50   and name HD2%)
      2.600     2.600     3.400 peak   181 spectrum    1 weight  0.10000E+01 volume  0.51369E-02 ppm1      0.977 ppm2      1.505 CV     1
 OR {  181}
   (( segid "    " and resid 37   and name HD2 ))
   (  segid "    " and resid 50   and name HD2%)
 ASSI {  182}
   (( segid "    " and resid 60   and name HB  ))
   (  segid "    " and resid 60   and name HG1%)
      2.200     0.600     0.600 peak   182 spectrum    1 weight  0.10000E+01 volume  0.10124E-01 ppm1      0.980 ppm2      2.078 CV     1
 ASSI {  184}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 60   and name HG1%)
      3.300     1.400     1.400 peak   184 spectrum    1 weight  0.10000E+01 volume  0.11276E-02 ppm1      0.989 ppm2      3.941 CV     1
 ASSI {  187}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 9    and name HG2%)
      2.300     0.700     0.700 peak   187 spectrum    1 weight  0.10000E+01 volume  0.70417E-02 ppm1      1.004 ppm2      3.887 CV     1
 ASSI {  189}
   (( segid "    " and resid 103  and name HB  ))
   (  segid "    " and resid 103  and name HG2%)
      2.300     0.600     0.600 peak   189 spectrum    1 weight  0.10000E+01 volume  0.80938E-02 ppm1      1.011 ppm2      2.076 CV     1
 ASSI {  194}
   (  segid "    " and resid 21   and name HB% )
   (  segid "    " and resid 9    and name HG2%)
      2.400     2.400     3.600 peak   194 spectrum    1 weight  0.10000E+01 volume  0.69914E-02 ppm1      1.028 ppm2      1.528 CV     1
 ASSI {  195}
   (( segid "    " and resid 79   and name HB  ))
   (  segid "    " and resid 79   and name HG2%)
      2.300     0.700     0.700 peak   195 spectrum    1 weight  0.10000E+01 volume  0.67658E-02 ppm1      1.034 ppm2      1.957 CV     1
 ASSI {  196}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 64   and name HB% )
      2.400     0.700     0.700 peak   196 spectrum    1 weight  0.10000E+01 volume  0.42851E-02 ppm1      1.074 ppm2      3.330 CV     1
 ASSI {  198}
   (( segid "    " and resid 6    and name HB  ))
   (  segid "    " and resid 6    and name HD1%)
      3.100     1.200     1.200 peak   198 spectrum    1 weight  0.10000E+01 volume  0.25309E-02 ppm1      1.101 ppm2      2.206 CV     1
 ASSI {  201}
   (( segid "    " and resid 6    and name HG12))
   (  segid "    " and resid 6    and name HD1%)
      2.300     2.300     3.700 peak   201 spectrum    1 weight  0.10000E+01 volume  0.49867E-02 ppm1      1.102 ppm2      1.582 CV     1
 OR {  201}
   (( segid "    " and resid 6    and name HG13))
   (  segid "    " and resid 6    and name HD1%)
 ASSI {  202}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 6    and name HD1%)
      2.100     2.100     3.900 peak   202 spectrum    1 weight  0.10000E+01 volume  0.83194E-02 ppm1      1.102 ppm2      0.731 CV     1
 ASSI {  203}
   (  segid "    " and resid 75   and name HE% )
   (  segid "    " and resid 6    and name HD1%)
      3.800     1.800     1.800 peak   203 spectrum    1 weight  0.10000E+01 volume  0.13231E-02 ppm1      1.103 ppm2      7.095 CV     1
 ASSI {  204}
   (  segid "    " and resid 61   and name HG1%)
   (  segid "    " and resid 6    and name HD1%)
      3.700     1.700     1.700 peak   204 spectrum    1 weight  0.10000E+01 volume  0.12204E-02 ppm1      1.105 ppm2      0.209 CV     1
 ASSI {  206}
   (  segid "    " and resid 25   and name HD2%)
   (( segid "    " and resid 25   and name HB3 ))
      2.300     2.300     3.700 peak   206 spectrum    1 weight  0.10000E+01 volume  0.63398E-02 ppm1      1.152 ppm2      0.724 CV     1
 ASSI {  207}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HB3 ))
      1.900     0.500     0.500 peak   207 spectrum    1 weight  0.10000E+01 volume  0.11427E-01 ppm1      1.153 ppm2      2.106 CV     1
 ASSI {  208}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HB3 ))
      3.500     3.500     2.500 peak   208 spectrum    1 weight  0.10000E+01 volume  0.10650E-02 ppm1      1.153 ppm2      0.582 CV     1
 ASSI {  210}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 25   and name HB3 ))
      5.700     5.700     0.300 peak   210 spectrum    1 weight  0.10000E+01 volume  0.31825E-04 ppm1      1.157 ppm2      0.831 CV     1
 OR {  210}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 25   and name HB3 ))
 ASSI {  211}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HB3 ))
      1.900     1.900     4.100 peak   211 spectrum    1 weight  0.10000E+01 volume  0.10324E-01 ppm1      1.160 ppm2      1.760 CV     1
 ASSI {  212}
   (( segid "    " and resid 25   and name HG  ))
   (( segid "    " and resid 25   and name HB3 ))
      2.900     2.900     3.100 peak   212 spectrum    1 weight  0.10000E+01 volume  0.19245E-02 ppm1      1.163 ppm2      1.734 CV     1
 ASSI {  215}
   (( segid "    " and resid 37   and name HE3 ))
   (( segid "    " and resid 37   and name HG3 ))
      2.800     1.000     1.000 peak   215 spectrum    1 weight  0.10000E+01 volume  0.27314E-02 ppm1      1.175 ppm2      2.803 CV     1
 OR {  215}
   (( segid "    " and resid 37   and name HE2 ))
   (( segid "    " and resid 37   and name HG3 ))
 OR {  215}
   (( segid "    " and resid 37   and name HE2 ))
   (( segid "    " and resid 37   and name HG2 ))
 OR {  215}
   (( segid "    " and resid 37   and name HE3 ))
   (( segid "    " and resid 37   and name HG2 ))
 ASSI {  220}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HB  ))
      2.600     2.600     3.400 peak   220 spectrum    1 weight  0.10000E+01 volume  0.38590E-02 ppm1      1.192 ppm2      0.550 CV     1
 ASSI {  221}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB  ))
      2.500     0.800     0.800 peak   221 spectrum    1 weight  0.10000E+01 volume  0.36335E-02 ppm1      1.193 ppm2      5.683 CV     1
 ASSI {  222}
   (  segid "    " and resid 103  and name HD1%)
   (( segid "    " and resid 103  and name HG13))
      2.900     2.900     3.100 peak   222 spectrum    1 weight  0.10000E+01 volume  0.17290E-02 ppm1      1.193 ppm2      0.835 CV     1
 ASSI {  223}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 36   and name HB  ))
      2.800     2.800     3.200 peak   223 spectrum    1 weight  0.10000E+01 volume  0.19897E-02 ppm1      1.193 ppm2      1.607 CV     1
 ASSI {  224}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 36   and name HB  ))
      2.400     2.400     3.600 peak   224 spectrum    1 weight  0.10000E+01 volume  0.53123E-02 ppm1      1.195 ppm2      0.771 CV     1
 OR {  224}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 36   and name HB  ))
 ASSI {  226}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 29   and name HB% )
      2.300     0.600     0.600 peak   226 spectrum    1 weight  0.10000E+01 volume  0.81440E-02 ppm1      1.238 ppm2      3.840 CV     1
 ASSI {  227}
   (  segid "    " and resid 69   and name HG1%)
   (  segid "    " and resid 10   and name HB% )
      3.200     1.300     1.300 peak   227 spectrum    1 weight  0.10000E+01 volume  0.45858E-03 ppm1      1.242 ppm2      0.026 CV     1
 ASSI {  228}
   (( segid "    " and resid 41   and name HB3 ))
   (  segid "    " and resid 10   and name HB% )
      2.800     2.800     3.200 peak   228 spectrum    1 weight  0.10000E+01 volume  0.17742E-02 ppm1      1.245 ppm2      1.843 CV     1
 ASSI {  229}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 10   and name HB% )
      3.700     1.700     1.700 peak   229 spectrum    1 weight  0.10000E+01 volume  0.88706E-03 ppm1      1.245 ppm2      5.705 CV     1
 ASSI {  234}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HB3 ))
      3.300     3.300     2.700 peak   234 spectrum    1 weight  0.10000E+01 volume  0.69412E-03 ppm1      1.279 ppm2      0.969 CV     1
 ASSI {  236}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HG3 ))
      3.500     1.500     1.500 peak   236 spectrum    1 weight  0.10000E+01 volume  0.65654E-03 ppm1      1.289 ppm2      3.946 CV     1
 ASSI {  239}
   (( segid "    " and resid 7    and name HA  ))
   (  segid "    " and resid 7    and name HB% )
      2.400     0.700     0.700 peak   239 spectrum    1 weight  0.10000E+01 volume  0.50621E-02 ppm1      1.309 ppm2      5.793 CV     1
 ASSI {  242}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 26   and name HG2 ))
      2.000     2.000     4.000 peak   242 spectrum    1 weight  0.10000E+01 volume  0.73170E-02 ppm1      1.324 ppm2      0.832 CV     1
 OR {  242}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 26   and name HG2 ))
 OR {  242}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 26   and name HG3 ))
 OR {  242}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 26   and name HG3 ))
 ASSI {  245}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HG2 ))
      2.400     2.400     3.600 peak   245 spectrum    1 weight  0.10000E+01 volume  0.64151E-02 ppm1      1.336 ppm2      1.882 CV     1
 OR {  245}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HG3 ))
 ASSI {  249}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      2.600     0.800     0.800 peak   249 spectrum    1 weight  0.10000E+01 volume  0.30070E-02 ppm1      1.394 ppm2      3.330 CV     1
 ASSI {  252}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 99   and name HB% )
      2.900     1.100     1.100 peak   252 spectrum    1 weight  0.10000E+01 volume  0.18819E-02 ppm1      1.404 ppm2      3.405 CV     1
 ASSI {  253}
   (( segid "    " and resid 28   and name HA2 ))
   (  segid "    " and resid 92   and name HB% )
      2.700     0.900     0.900 peak   253 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      1.448 ppm2      3.268 CV     1
 ASSI {  257}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 100  and name HB3 ))
      2.700     2.700     3.300 peak   257 spectrum    1 weight  0.10000E+01 volume  0.36586E-02 ppm1      1.455 ppm2      0.826 CV     1
 ASSI {  258}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 100  and name HB3 ))
      1.900     1.900     4.100 peak   258 spectrum    1 weight  0.10000E+01 volume  0.12204E-01 ppm1      1.456 ppm2      1.855 CV     1
 ASSI {  259}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HB3 ))
      2.800     1.000     1.000 peak   259 spectrum    1 weight  0.10000E+01 volume  0.20849E-02 ppm1      1.459 ppm2      0.638 CV     1
 OR {  259}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HB3 ))
 ASSI {  262}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HB% )
      2.400     0.700     0.700 peak   262 spectrum    1 weight  0.10000E+01 volume  0.53374E-02 ppm1      1.472 ppm2      3.913 CV     1
 ASSI {  263}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 98   and name HB% )
      2.700     0.900     0.900 peak   263 spectrum    1 weight  0.10000E+01 volume  0.27314E-02 ppm1      1.477 ppm2      3.608 CV     1
 ASSI {  264}
   (( segid "    " and resid 84   and name HD2 ))
   (  segid "    " and resid 87   and name HB% )
      3.000     1.100     1.100 peak   264 spectrum    1 weight  0.10000E+01 volume  0.11252E-02 ppm1      1.480 ppm2      3.862 CV     1
 ASSI {  265}
   (( segid "    " and resid 87   and name HA  ))
   (  segid "    " and resid 87   and name HB% )
      2.400     0.700     0.700 peak   265 spectrum    1 weight  0.10000E+01 volume  0.54630E-02 ppm1      1.481 ppm2      4.290 CV     1
 ASSI {  266}
   (( segid "    " and resid 84   and name HD3 ))
   (  segid "    " and resid 87   and name HB% )
      3.400     1.400     1.400 peak   266 spectrum    1 weight  0.10000E+01 volume  0.28567E-02 ppm1      1.481 ppm2      3.615 CV     1
 ASSI {  267}
   (( segid "    " and resid 88   and name HD2 ))
   (  segid "    " and resid 87   and name HB% )
      3.100     1.200     1.200 peak   267 spectrum    1 weight  0.10000E+01 volume  0.42099E-02 ppm1      1.481 ppm2      3.463 CV     1
 ASSI {  268}
   (( segid "    " and resid 83   and name HB  ))
   (  segid "    " and resid 87   and name HB% )
      2.600     0.800     0.800 peak   268 spectrum    1 weight  0.10000E+01 volume  0.41096E-02 ppm1      1.482 ppm2      2.318 CV     1
 ASSI {  273}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HG3 ))
      2.100     0.600     0.600 peak   273 spectrum    1 weight  0.10000E+01 volume  0.13031E-01 ppm1      1.491 ppm2      3.326 CV     1
 ASSI {  274}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 70   and name HB3 ))
      3.400     3.400     2.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.75175E-03 ppm1      1.492 ppm2      0.807 CV     1
 ASSI {  275}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 102  and name HB3 ))
      2.300     2.300     3.700 peak   275 spectrum    1 weight  0.10000E+01 volume  0.97729E-02 ppm1      1.492 ppm2      0.853 CV     1
 OR {  275}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 102  and name HB3 ))
 ASSI {  276}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB3 ))
      3.000     1.200     1.200 peak   276 spectrum    1 weight  0.10000E+01 volume  0.14308E-02 ppm1      1.493 ppm2      4.168 CV     1
 ASSI {  277}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HB3 ))
      1.800     1.800     4.200 peak   277 spectrum    1 weight  0.10000E+01 volume  0.16263E-01 ppm1      1.494 ppm2      2.039 CV     1
 ASSI {  278}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB3 ))
      2.700     0.900     0.900 peak   278 spectrum    1 weight  0.10000E+01 volume  0.27815E-02 ppm1      1.496 ppm2      4.127 CV     1
 ASSI {  279}
   (( segid "    " and resid 70   and name HD2 ))
   (( segid "    " and resid 70   and name HB3 ))
      3.300     1.300     1.300 peak   279 spectrum    1 weight  0.10000E+01 volume  0.10474E-02 ppm1      1.496 ppm2      3.080 CV     1
 OR {  279}
   (( segid "    " and resid 70   and name HD3 ))
   (( segid "    " and resid 70   and name HB3 ))
 ASSI {  280}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 80   and name HB  ))
      2.400     0.700     0.700 peak   280 spectrum    1 weight  0.10000E+01 volume  0.61142E-02 ppm1      1.518 ppm2     -0.130 CV     1
 ASSI {  281}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 80   and name HB  ))
      2.500     0.800     0.800 peak   281 spectrum    1 weight  0.10000E+01 volume  0.48616E-02 ppm1      1.519 ppm2      0.370 CV     1
 ASSI {  283}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
      2.300     0.600     0.600 peak   283 spectrum    1 weight  0.10000E+01 volume  0.76180E-02 ppm1      1.543 ppm2      3.887 CV     1
 ASSI {  285}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 62   and name HB  ))
      2.400     2.400     3.600 peak   285 spectrum    1 weight  0.10000E+01 volume  0.49114E-02 ppm1      1.560 ppm2      1.306 CV     1
 ASSI {  286}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 62   and name HB  ))
      2.400     0.700     0.700 peak   286 spectrum    1 weight  0.10000E+01 volume  0.45607E-02 ppm1      1.565 ppm2      0.679 CV     1
 ASSI {  287}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 62   and name HB  ))
      3.000     1.200     1.200 peak   287 spectrum    1 weight  0.10000E+01 volume  0.19445E-02 ppm1      1.565 ppm2      5.802 CV     1
 ASSI {  290}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 5    and name HB  ))
      2.700     0.900     0.900 peak   290 spectrum    1 weight  0.10000E+01 volume  0.26312E-02 ppm1      1.602 ppm2      5.679 CV     1
 ASSI {  291}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HG2 ))
      2.100     0.600     0.600 peak   291 spectrum    1 weight  0.10000E+01 volume  0.82194E-02 ppm1      1.605 ppm2      3.281 CV     1
 ASSI {  293}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 5    and name HB  ))
      2.800     2.800     3.200 peak   293 spectrum    1 weight  0.10000E+01 volume  0.84199E-02 ppm1      1.606 ppm2      1.263 CV     1
 ASSI {  294}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 5    and name HB  ))
      2.100     2.100     3.900 peak   294 spectrum    1 weight  0.10000E+01 volume  0.12078E-01 ppm1      1.609 ppm2      0.870 CV     1
 OR {  294}
   (( segid "    " and resid 5    and name HG12))
   (( segid "    " and resid 5    and name HB  ))
 ASSI {  295}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 8    and name HB  ))
      3.200     1.300     1.300 peak   295 spectrum    1 weight  0.10000E+01 volume  0.11803E-02 ppm1      1.617 ppm2      0.409 CV     1
 ASSI {  297}
   (( segid "    " and resid 78   and name HE3 ))
   (( segid "    " and resid 74   and name HG2 ))
      2.600     2.600     3.400 peak   297 spectrum    1 weight  0.10000E+01 volume  0.47361E-02 ppm1      1.622 ppm2      2.767 CV     1
 ASSI {  299}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 8    and name HB  ))
      2.000     0.500     0.500 peak   299 spectrum    1 weight  0.10000E+01 volume  0.14785E-01 ppm1      1.627 ppm2      0.704 CV     1
 ASSI {  300}
   (  segid "    " and resid 63   and name HD% )
   (( segid "    " and resid 8    and name HB  ))
      2.600     0.800     0.800 peak   300 spectrum    1 weight  0.10000E+01 volume  0.35333E-02 ppm1      1.628 ppm2      6.939 CV     1
 ASSI {  302}
   (  segid "    " and resid 69   and name HG1%)
   (( segid "    " and resid 8    and name HB  ))
      4.000     2.000     2.000 peak   302 spectrum    1 weight  0.10000E+01 volume  0.42349E-03 ppm1      1.642 ppm2      0.022 CV     1
 ASSI {  303}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 103  and name HG12))
      2.700     0.900     0.900 peak   303 spectrum    1 weight  0.10000E+01 volume  0.19145E-02 ppm1      1.661 ppm2      3.914 CV     1
 ASSI {  304}
   (( segid "    " and resid 103  and name HG13))
   (( segid "    " and resid 103  and name HG12))
      1.700     1.700     4.300 peak   304 spectrum    1 weight  0.10000E+01 volume  0.19797E-01 ppm1      1.662 ppm2      1.190 CV     1
 ASSI {  305}
   (  segid "    " and resid 103  and name HD1%)
   (( segid "    " and resid 103  and name HG12))
      2.200     0.600     0.600 peak   305 spectrum    1 weight  0.10000E+01 volume  0.80189E-02 ppm1      1.663 ppm2      0.837 CV     1
 ASSI {  306}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 103  and name HG12))
      2.400     2.400     3.600 peak   306 spectrum    1 weight  0.10000E+01 volume  0.52123E-02 ppm1      1.664 ppm2      1.010 CV     1
 ASSI {  307}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 103  and name HG12))
      2.800     2.800     3.200 peak   307 spectrum    1 weight  0.10000E+01 volume  0.35834E-02 ppm1      1.665 ppm2      2.079 CV     1
 ASSI {  308}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 3    and name HG2 ))
      2.500     0.800     0.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.43101E-02 ppm1      1.674 ppm2      0.644 CV     1
 OR {  308}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 3    and name HG3 ))
 OR {  308}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 3    and name HG2 ))
 OR {  308}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 3    and name HG3 ))
 ASSI {  310}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 37   and name HB3 ))
      2.400     2.400     3.600 peak   310 spectrum    1 weight  0.10000E+01 volume  0.43101E-02 ppm1      1.683 ppm2      0.965 CV     1
 ASSI {  311}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HB3 ))
      3.200     3.200     2.800 peak   311 spectrum    1 weight  0.10000E+01 volume  0.98981E-03 ppm1      1.684 ppm2      1.171 CV     1
 OR {  311}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HB3 ))
 ASSI {  313}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 96   and name HB  ))
      3.000     1.200     1.200 peak   313 spectrum    1 weight  0.10000E+01 volume  0.15336E-02 ppm1      1.690 ppm2      3.415 CV     1
 ASSI {  315}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HB  ))
      2.200     0.600     0.600 peak   315 spectrum    1 weight  0.10000E+01 volume  0.81189E-02 ppm1      1.693 ppm2      0.759 CV     1
 OR {  315}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 96   and name HB  ))
 ASSI {  316}
   (( segid "    " and resid 70   and name HD2 ))
   (( segid "    " and resid 70   and name HB2 ))
      2.900     1.000     1.000 peak   316 spectrum    1 weight  0.10000E+01 volume  0.22779E-02 ppm1      1.718 ppm2      3.076 CV     1
 OR {  316}
   (( segid "    " and resid 70   and name HD3 ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI {  317}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.800     1.000     1.000 peak   317 spectrum    1 weight  0.10000E+01 volume  0.23280E-02 ppm1      1.722 ppm2      4.173 CV     1
 ASSI {  318}
   (( segid "    " and resid 70   and name HD3 ))
   (( segid "    " and resid 70   and name HG2 ))
      2.700     0.900     0.900 peak   318 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      1.725 ppm2      3.081 CV     1
 OR {  318}
   (( segid "    " and resid 70   and name HD2 ))
   (( segid "    " and resid 70   and name HG2 ))
 ASSI {  319}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      2.100     0.600     0.600 peak   319 spectrum    1 weight  0.10000E+01 volume  0.11727E-01 ppm1      1.730 ppm2      0.900 CV     1
 ASSI {  320}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HG2 ))
      2.900     1.000     1.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.24908E-02 ppm1      1.737 ppm2      4.168 CV     1
 ASSI {  321}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
      3.600     1.600     1.600 peak   321 spectrum    1 weight  0.10000E+01 volume  0.57384E-03 ppm1      1.748 ppm2      4.820 CV     1
 ASSI {  326}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 61   and name HB  ))
      2.400     0.700     0.700 peak   326 spectrum    1 weight  0.10000E+01 volume  0.44605E-02 ppm1      1.762 ppm2      0.216 CV     1
 ASSI {  328}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 61   and name HB  ))
      3.200     1.200     1.200 peak   328 spectrum    1 weight  0.10000E+01 volume  0.11577E-02 ppm1      1.763 ppm2     -0.124 CV     1
 ASSI {  330}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 96   and name HG12))
      2.100     0.600     0.600 peak   330 spectrum    1 weight  0.10000E+01 volume  0.11201E-01 ppm1      1.763 ppm2      0.748 CV     1
 OR {  330}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HG12))
 ASSI {  333}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HG3 ))
      3.700     1.700     1.700 peak   333 spectrum    1 weight  0.10000E+01 volume  0.37087E-03 ppm1      1.775 ppm2      4.024 CV     1
 OR {  333}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HG2 ))
 ASSI {  334}
   (( segid "    " and resid 72   and name HE3 ))
   (( segid "    " and resid 72   and name HG3 ))
      3.100     1.200     1.200 peak   334 spectrum    1 weight  0.10000E+01 volume  0.13507E-02 ppm1      1.776 ppm2      3.017 CV     1
 OR {  334}
   (( segid "    " and resid 72   and name HE3 ))
   (( segid "    " and resid 72   and name HG2 ))
 OR {  334}
   (( segid "    " and resid 72   and name HE2 ))
   (( segid "    " and resid 72   and name HG2 ))
 OR {  334}
   (( segid "    " and resid 72   and name HE2 ))
   (( segid "    " and resid 72   and name HG3 ))
 ASSI {  336}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HB2 ))
      2.900     2.900     3.100 peak   336 spectrum    1 weight  0.10000E+01 volume  0.16489E-02 ppm1      1.781 ppm2      1.176 CV     1
 OR {  336}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI {  338}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 85   and name HB  ))
      2.300     0.600     0.600 peak   338 spectrum    1 weight  0.10000E+01 volume  0.73924E-02 ppm1      1.800 ppm2      0.868 CV     1
 OR {  338}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
 ASSI {  340}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 85   and name HB  ))
      2.600     0.800     0.800 peak   340 spectrum    1 weight  0.10000E+01 volume  0.30070E-02 ppm1      1.803 ppm2      5.704 CV     1
 ASSI {  342}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HB2 ))
      3.100     1.200     1.200 peak   342 spectrum    1 weight  0.10000E+01 volume  0.16163E-02 ppm1      1.859 ppm2      0.642 CV     1
 OR {  342}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HB2 ))
 ASSI {  344}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      3.100     1.200     1.200 peak   344 spectrum    1 weight  0.10000E+01 volume  0.16514E-02 ppm1      1.863 ppm2      3.916 CV     1
 ASSI {  345}
   (( segid "    " and resid 89   and name HG13))
   (( segid "    " and resid 89   and name HB  ))
      2.700     0.900     0.900 peak   345 spectrum    1 weight  0.10000E+01 volume  0.20749E-02 ppm1      1.868 ppm2      0.553 CV     1
 ASSI {  347}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      2.900     1.000     1.000 peak   347 spectrum    1 weight  0.10000E+01 volume  0.19922E-02 ppm1      1.873 ppm2      3.327 CV     1
 ASSI {  349}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HB  ))
      2.100     0.600     0.600 peak   349 spectrum    1 weight  0.10000E+01 volume  0.11026E-01 ppm1      1.877 ppm2      0.879 CV     1
 OR {  349}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HB  ))
 ASSI {  350}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HB2 ))
      3.000     1.200     1.200 peak   350 spectrum    1 weight  0.10000E+01 volume  0.32326E-02 ppm1      1.885 ppm2      0.978 CV     1
 ASSI {  352}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HB3 ))
      3.800     1.900     1.900 peak   352 spectrum    1 weight  0.10000E+01 volume  0.45607E-03 ppm1      1.888 ppm2      0.409 CV     1
 ASSI {  353}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HB2 ))
      1.900     1.900     4.100 peak   353 spectrum    1 weight  0.10000E+01 volume  0.11252E-01 ppm1      1.893 ppm2      1.275 CV     1
 ASSI {  354}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HB3 ))
      1.900     1.900     4.100 peak   354 spectrum    1 weight  0.10000E+01 volume  0.10324E-01 ppm1      1.893 ppm2      2.528 CV     1
 ASSI {  356}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HB  ))
      2.700     0.900     0.900 peak   356 spectrum    1 weight  0.10000E+01 volume  0.29820E-02 ppm1      1.895 ppm2      3.969 CV     1
 ASSI {  357}
   (( segid "    " and resid 57   and name HG12))
   (( segid "    " and resid 57   and name HB  ))
      2.600     2.600     3.400 peak   357 spectrum    1 weight  0.10000E+01 volume  0.44104E-02 ppm1      1.895 ppm2      1.582 CV     1
 ASSI {  359}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HB  ))
      2.300     0.600     0.600 peak   359 spectrum    1 weight  0.10000E+01 volume  0.74677E-02 ppm1      1.897 ppm2      0.901 CV     1
 ASSI {  360}
   (( segid "    " and resid 57   and name HG13))
   (( segid "    " and resid 57   and name HB  ))
      2.700     2.700     3.300 peak   360 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      1.899 ppm2      1.308 CV     1
 ASSI {  361}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 32   and name HB3 ))
      2.800     1.000     1.000 peak   361 spectrum    1 weight  0.10000E+01 volume  0.88459E-03 ppm1      1.924 ppm2      0.771 CV     1
 OR {  361}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 32   and name HB3 ))
 ASSI {  362}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB3 ))
      3.100     1.200     1.200 peak   362 spectrum    1 weight  0.10000E+01 volume  0.10650E-02 ppm1      1.932 ppm2      4.255 CV     1
 ASSI {  363}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB3 ))
      2.600     0.800     0.800 peak   363 spectrum    1 weight  0.10000E+01 volume  0.35583E-02 ppm1      1.933 ppm2      5.486 CV     1
 ASSI {  364}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 32   and name HB3 ))
      2.900     1.100     1.100 peak   364 spectrum    1 weight  0.10000E+01 volume  0.23956E-02 ppm1      1.940 ppm2      2.870 CV     1
 ASSI {  366}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 39   and name HG3 ))
      3.300     1.300     1.300 peak   366 spectrum    1 weight  0.10000E+01 volume  0.69412E-03 ppm1      1.953 ppm2      3.909 CV     1
 ASSI {  367}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 39   and name HG3 ))
      4.000     2.000     2.000 peak   367 spectrum    1 weight  0.10000E+01 volume  0.66407E-03 ppm1      1.956 ppm2      0.664 CV     1
 ASSI {  368}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HG3 ))
      1.900     1.900     4.100 peak   368 spectrum    1 weight  0.10000E+01 volume  0.11301E-01 ppm1      1.957 ppm2      2.372 CV     1
 ASSI {  370}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB  ))
      2.600     0.900     0.900 peak   370 spectrum    1 weight  0.10000E+01 volume  0.34080E-02 ppm1      1.958 ppm2      3.869 CV     1
 ASSI {  371}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 79   and name HB  ))
      2.700     0.900     0.900 peak   371 spectrum    1 weight  0.10000E+01 volume  0.31574E-02 ppm1      1.958 ppm2      0.855 CV     1
 ASSI {  373}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 38   and name HB  ))
      3.100     1.200     1.200 peak   373 spectrum    1 weight  0.10000E+01 volume  0.16463E-02 ppm1      1.959 ppm2      3.865 CV     1
 ASSI {  374}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HG3 ))
      2.700     2.700     3.300 peak   374 spectrum    1 weight  0.10000E+01 volume  0.17842E-02 ppm1      1.962 ppm2      2.643 CV     1
 ASSI {  375}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 38   and name HB  ))
      2.300     0.700     0.700 peak   375 spectrum    1 weight  0.10000E+01 volume  0.72919E-02 ppm1      1.983 ppm2      0.844 CV     1
 OR {  375}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 38   and name HB  ))
 ASSI {  376}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 38   and name HB  ))
      3.000     3.000     3.000 peak   376 spectrum    1 weight  0.10000E+01 volume  0.19396E-02 ppm1      1.984 ppm2      1.461 CV     1
 ASSI {  377}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB3 ))
      2.400     0.700     0.700 peak   377 spectrum    1 weight  0.10000E+01 volume  0.51621E-02 ppm1      1.985 ppm2      3.882 CV     1
 ASSI {  378}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.900     1.000     1.000 peak   378 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      1.988 ppm2      4.141 CV     1
 ASSI {  379}
   (( segid "    " and resid 102  and name HB3 ))
   (  segid "    " and resid 102  and name HD1%)
      2.700     2.700     3.300 peak   379 spectrum    1 weight  0.10000E+01 volume  0.28567E-02 ppm1      1.993 ppm2      1.485 CV     1
 ASSI {  381}
   (( segid "    " and resid 102  and name HG  ))
   (  segid "    " and resid 102  and name HD1%)
      1.900     0.400     0.400 peak   381 spectrum    1 weight  0.10000E+01 volume  0.25059E-01 ppm1      2.001 ppm2      0.846 CV     1
 OR {  381}
   (  segid "    " and resid 102  and name HD2%)
   (  segid "    " and resid 102  and name HD1%)
 ASSI {  382}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HG2 ))
      3.200     1.300     1.300 peak   382 spectrum    1 weight  0.10000E+01 volume  0.22127E-02 ppm1      2.002 ppm2      4.023 CV     1
 ASSI {  383}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 102  and name HD1%)
      6.000     4.700     0.000 peak   383 spectrum    1 weight  0.10000E+01 volume  0.28567E-04 ppm1      2.004 ppm2      4.116 CV     1
 ASSI {  384}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HB2 ))
      3.100     1.200     1.200 peak   384 spectrum    1 weight  0.10000E+01 volume  0.12880E-02 ppm1      2.004 ppm2      0.400 CV     1
 ASSI {  385}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 102  and name HD1%)
      3.900     1.900     1.900 peak   385 spectrum    1 weight  0.10000E+01 volume  0.42349E-03 ppm1      2.008 ppm2      3.963 CV     1
 ASSI {  388}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.900     1.100     1.100 peak   388 spectrum    1 weight  0.10000E+01 volume  0.17717E-02 ppm1      2.031 ppm2      5.490 CV     1
 ASSI {  391}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HG3 ))
      2.900     1.100     1.100 peak   391 spectrum    1 weight  0.10000E+01 volume  0.14910E-02 ppm1      2.040 ppm2      3.611 CV     1
 OR {  391}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HG2 ))
 ASSI {  392}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HG2 ))
      2.600     0.900     0.900 peak   392 spectrum    1 weight  0.10000E+01 volume  0.29820E-02 ppm1      2.040 ppm2      3.865 CV     1
 OR {  392}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 84   and name HG3 ))
 ASSI {  393}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HB  ))
      2.400     0.700     0.700 peak   393 spectrum    1 weight  0.10000E+01 volume  0.41848E-02 ppm1      2.041 ppm2      0.877 CV     1
 ASSI {  394}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HB  ))
      2.500     0.800     0.800 peak   394 spectrum    1 weight  0.10000E+01 volume  0.41848E-02 ppm1      2.043 ppm2      3.882 CV     1
 ASSI {  396}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 102  and name HB2 ))
      2.300     0.600     0.600 peak   396 spectrum    1 weight  0.10000E+01 volume  0.78436E-02 ppm1      2.047 ppm2      0.850 CV     1
 OR {  396}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  398}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HB  ))
      2.100     0.600     0.600 peak   398 spectrum    1 weight  0.10000E+01 volume  0.12830E-01 ppm1      2.059 ppm2      0.949 CV     1
 OR {  398}
   (  segid "    " and resid 15   and name HG1%)
   (( segid "    " and resid 15   and name HB  ))
 ASSI {  399}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.100     0.600     0.600 peak   399 spectrum    1 weight  0.10000E+01 volume  0.13983E-01 ppm1      2.070 ppm2      4.315 CV     1
 ASSI {  403}
   (( segid "    " and resid 103  and name HG13))
   (( segid "    " and resid 103  and name HB  ))
      2.800     1.000     1.000 peak   403 spectrum    1 weight  0.10000E+01 volume  0.19546E-02 ppm1      2.075 ppm2      1.180 CV     1
 ASSI {  404}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HG3 ))
      3.000     1.100     1.100 peak   404 spectrum    1 weight  0.10000E+01 volume  0.21776E-02 ppm1      2.078 ppm2      0.905 CV     1
 OR {  404}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HG2 ))
 ASSI {  406}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HG2 ))
      2.000     2.000     4.000 peak   406 spectrum    1 weight  0.10000E+01 volume  0.18243E-01 ppm1      2.089 ppm2      1.783 CV     1
 OR {  406}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HG3 ))
 OR {  406}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HG2 ))
 OR {  406}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HG3 ))
 ASSI {  412}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB3 ))
      4.300     2.300     1.700 peak   412 spectrum    1 weight  0.10000E+01 volume  0.23831E-03 ppm1      2.105 ppm2      5.039 CV     1
 ASSI {  413}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HB  ))
      2.400     0.700     0.700 peak   413 spectrum    1 weight  0.10000E+01 volume  0.48114E-02 ppm1      2.106 ppm2      0.656 CV     1
 ASSI {  414}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HB2 ))
      2.600     0.800     0.800 peak   414 spectrum    1 weight  0.10000E+01 volume  0.34080E-02 ppm1      2.106 ppm2      0.597 CV     1
 ASSI {  415}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 25   and name HB2 ))
      3.100     1.200     1.200 peak   415 spectrum    1 weight  0.10000E+01 volume  0.12981E-02 ppm1      2.107 ppm2      0.842 CV     1
 OR {  415}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 25   and name HB2 ))
 ASSI {  416}
   (( segid "    " and resid 25   and name HG  ))
   (( segid "    " and resid 25   and name HB2 ))
      2.700     2.700     3.300 peak   416 spectrum    1 weight  0.10000E+01 volume  0.28316E-02 ppm1      2.109 ppm2      1.743 CV     1
 ASSI {  418}
   (  segid "    " and resid 25   and name HD2%)
   (( segid "    " and resid 25   and name HB2 ))
      2.900     1.000     1.000 peak   418 spectrum    1 weight  0.10000E+01 volume  0.28066E-02 ppm1      2.109 ppm2      0.721 CV     1
 ASSI {  421}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HB3 ))
      1.900     1.900     4.100 peak   421 spectrum    1 weight  0.10000E+01 volume  0.12955E-01 ppm1      2.118 ppm2      2.652 CV     1
 ASSI {  422}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 39   and name HB3 ))
      2.500     0.800     0.800 peak   422 spectrum    1 weight  0.10000E+01 volume  0.37087E-02 ppm1      2.118 ppm2      0.735 CV     1
 ASSI {  423}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      2.900     1.100     1.100 peak   423 spectrum    1 weight  0.10000E+01 volume  0.22853E-02 ppm1      2.124 ppm2      4.010 CV     1
 ASSI {  424}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HB  ))
      2.100     0.600     0.600 peak   424 spectrum    1 weight  0.10000E+01 volume  0.10249E-01 ppm1      2.127 ppm2      0.871 CV     1
 OR {  424}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 95   and name HB  ))
 ASSI {  425}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 39   and name HB3 ))
      3.300     1.300     1.300 peak   425 spectrum    1 weight  0.10000E+01 volume  0.18193E-02 ppm1      2.128 ppm2      1.138 CV     1
 ASSI {  426}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      2.600     0.900     0.900 peak   426 spectrum    1 weight  0.10000E+01 volume  0.33078E-02 ppm1      2.129 ppm2      3.842 CV     1
 ASSI {  428}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      3.000     1.100     1.100 peak   428 spectrum    1 weight  0.10000E+01 volume  0.16288E-02 ppm1      2.133 ppm2      3.611 CV     1
 ASSI {  429}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HG3 ))
      3.400     1.400     1.400 peak   429 spectrum    1 weight  0.10000E+01 volume  0.80938E-03 ppm1      2.197 ppm2      3.885 CV     1
 ASSI {  430}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 6    and name HB  ))
      2.300     0.600     0.600 peak   430 spectrum    1 weight  0.10000E+01 volume  0.70914E-02 ppm1      2.204 ppm2      1.127 CV     1
 ASSI {  432}
   (( segid "    " and resid 6    and name HG13))
   (( segid "    " and resid 6    and name HB  ))
      2.400     2.400     3.600 peak   432 spectrum    1 weight  0.10000E+01 volume  0.36085E-02 ppm1      2.208 ppm2      1.576 CV     1
 OR {  432}
   (( segid "    " and resid 6    and name HG12))
   (( segid "    " and resid 6    and name HB  ))
 ASSI {  433}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 6    and name HB  ))
      2.200     0.600     0.600 peak   433 spectrum    1 weight  0.10000E+01 volume  0.69412E-02 ppm1      2.211 ppm2      0.958 CV     1
 ASSI {  434}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.200     1.300     1.300 peak   434 spectrum    1 weight  0.10000E+01 volume  0.17216E-02 ppm1      2.231 ppm2      4.253 CV     1
 ASSI {  435}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HG3 ))
      2.900     1.000     1.000 peak   435 spectrum    1 weight  0.10000E+01 volume  0.23931E-02 ppm1      2.263 ppm2      3.886 CV     1
 OR {  435}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HG2 ))
 ASSI {  438}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 65   and name HB  ))
      5.300     3.500     0.700 peak   438 spectrum    1 weight  0.10000E+01 volume  0.94971E-04 ppm1      2.270 ppm2      0.905 CV     1
 ASSI {  439}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 65   and name HB  ))
      2.000     0.500     0.500 peak   439 spectrum    1 weight  0.10000E+01 volume  0.13306E-01 ppm1      2.278 ppm2      0.724 CV     1
 ASSI {  440}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB  ))
      2.400     0.700     0.700 peak   440 spectrum    1 weight  0.10000E+01 volume  0.39342E-02 ppm1      2.280 ppm2      5.704 CV     1
 ASSI {  441}
   (  segid "    " and resid 10   and name HB% )
   (( segid "    " and resid 65   and name HB  ))
      2.700     0.900     0.900 peak   441 spectrum    1 weight  0.10000E+01 volume  0.22353E-02 ppm1      2.281 ppm2      1.243 CV     1
 ASSI {  442}
   (  segid "    " and resid 69   and name HG1%)
   (( segid "    " and resid 65   and name HB  ))
      3.200     1.300     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.40344E-03 ppm1      2.285 ppm2      0.038 CV     1
 ASSI {  443}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HG2 ))
      3.800     1.800     1.800 peak   443 spectrum    1 weight  0.10000E+01 volume  0.42099E-03 ppm1      2.308 ppm2      3.880 CV     1
 ASSI {  444}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 83   and name HB  ))
      2.300     0.700     0.700 peak   444 spectrum    1 weight  0.10000E+01 volume  0.71417E-02 ppm1      2.319 ppm2      0.912 CV     1
 ASSI {  445}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 83   and name HB  ))
      2.300     0.700     0.700 peak   445 spectrum    1 weight  0.10000E+01 volume  0.68412E-02 ppm1      2.319 ppm2      0.802 CV     1
 ASSI {  446}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 83   and name HB  ))
      3.000     1.100     1.100 peak   446 spectrum    1 weight  0.10000E+01 volume  0.36335E-02 ppm1      2.319 ppm2      3.613 CV     1
 ASSI {  447}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG2 ))
      4.200     2.200     1.800 peak   447 spectrum    1 weight  0.10000E+01 volume  0.24934E-03 ppm1      2.320 ppm2      4.303 CV     1
 ASSI {  449}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 83   and name HB  ))
      2.600     0.900     0.900 peak   449 spectrum    1 weight  0.10000E+01 volume  0.22503E-02 ppm1      2.322 ppm2      3.880 CV     1
 ASSI {  451}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 59   and name HG3 ))
      3.500     3.500     2.500 peak   451 spectrum    1 weight  0.10000E+01 volume  0.61393E-03 ppm1      2.353 ppm2      1.977 CV     1
 ASSI {  452}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HG3 ))
      3.400     1.400     1.400 peak   452 spectrum    1 weight  0.10000E+01 volume  0.17892E-02 ppm1      2.360 ppm2      4.250 CV     1
 ASSI {  453}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HG3 ))
      2.000     2.000     4.000 peak   453 spectrum    1 weight  0.10000E+01 volume  0.84696E-02 ppm1      2.362 ppm2      2.680 CV     1
 ASSI {  456}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 39   and name HG2 ))
      3.500     3.500     2.500 peak   456 spectrum    1 weight  0.10000E+01 volume  0.38590E-03 ppm1      2.373 ppm2      2.108 CV     1
 ASSI {  459}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 39   and name HG2 ))
      3.600     1.600     1.600 peak   459 spectrum    1 weight  0.10000E+01 volume  0.95474E-03 ppm1      2.383 ppm2      0.670 CV     1
 ASSI {  460}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HG2 ))
      3.000     3.000     3.000 peak   460 spectrum    1 weight  0.10000E+01 volume  0.27063E-02 ppm1      2.388 ppm2      2.652 CV     1
 ASSI {  462}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 32   and name HG3 ))
      1.800     1.800     4.200 peak   462 spectrum    1 weight  0.10000E+01 volume  0.15085E-01 ppm1      2.496 ppm2      2.871 CV     1
 ASSI {  463}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HB3 ))
      2.600     0.900     0.900 peak   463 spectrum    1 weight  0.10000E+01 volume  0.31073E-02 ppm1      2.524 ppm2      4.221 CV     1
 ASSI {  464}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 54   and name HB3 ))
      3.600     1.600     1.600 peak   464 spectrum    1 weight  0.10000E+01 volume  0.78436E-03 ppm1      2.524 ppm2      1.489 CV     1
 OR {  464}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 54   and name HB3 ))
 ASSI {  467}
   (( segid "    " and resid 74   and name HG3 ))
   (( segid "    " and resid 74   and name HD3 ))
      3.100     1.200     1.200 peak   467 spectrum    1 weight  0.10000E+01 volume  0.66658E-03 ppm1      2.548 ppm2      1.501 CV     1
 ASSI {  468}
   (( segid "    " and resid 74   and name HD2 ))
   (( segid "    " and resid 74   and name HD3 ))
      1.900     1.900     4.100 peak   468 spectrum    1 weight  0.10000E+01 volume  0.85701E-02 ppm1      2.549 ppm2      3.320 CV     1
 ASSI {  469}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 74   and name HD3 ))
      3.100     1.200     1.200 peak   469 spectrum    1 weight  0.10000E+01 volume  0.11702E-02 ppm1      2.551 ppm2      1.606 CV     1
 ASSI {  470}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HD3 ))
      3.100     1.200     1.200 peak   470 spectrum    1 weight  0.10000E+01 volume  0.10425E-02 ppm1      2.555 ppm2      0.629 CV     1
 ASSI {  471}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 97   and name HB3 ))
      4.200     2.200     1.800 peak   471 spectrum    1 weight  0.10000E+01 volume  0.95976E-03 ppm1      2.581 ppm2      3.947 CV     1
 ASSI {  472}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB3 ))
      2.900     1.100     1.100 peak   472 spectrum    1 weight  0.10000E+01 volume  0.17115E-02 ppm1      2.586 ppm2      4.438 CV     1
 ASSI {  473}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 104  and name HB3 ))
      3.400     1.500     1.500 peak   473 spectrum    1 weight  0.10000E+01 volume  0.11126E-02 ppm1      2.625 ppm2      4.111 CV     1
 ASSI {  476}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 39   and name HB2 ))
      3.500     1.500     1.500 peak   476 spectrum    1 weight  0.10000E+01 volume  0.57384E-03 ppm1      2.650 ppm2      0.931 CV     1
 ASSI {  477}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.800     1.800     1.800 peak   477 spectrum    1 weight  0.10000E+01 volume  0.67407E-03 ppm1      2.652 ppm2      3.888 CV     1
 ASSI {  478}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 39   and name HB2 ))
      4.000     2.000     2.000 peak   478 spectrum    1 weight  0.10000E+01 volume  0.12128E-02 ppm1      2.653 ppm2      0.736 CV     1
 ASSI {  479}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HG3 ))
      3.200     1.200     1.200 peak   479 spectrum    1 weight  0.10000E+01 volume  0.10224E-02 ppm1      2.655 ppm2      4.175 CV     1
 ASSI {  481}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 39   and name HB2 ))
      3.100     1.200     1.200 peak   481 spectrum    1 weight  0.10000E+01 volume  0.11026E-02 ppm1      2.663 ppm2      1.140 CV     1
 ASSI {  483}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 59   and name HG2 ))
      2.800     2.800     3.200 peak   483 spectrum    1 weight  0.10000E+01 volume  0.32827E-02 ppm1      2.682 ppm2      1.969 CV     1
 ASSI {  485}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
      3.200     3.200     2.800 peak   485 spectrum    1 weight  0.10000E+01 volume  0.10725E-02 ppm1      2.697 ppm2      4.118 CV     1
 ASSI {  486}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
      3.700     1.800     1.800 peak   486 spectrum    1 weight  0.10000E+01 volume  0.74677E-03 ppm1      2.786 ppm2      4.176 CV     1
 ASSI {  487}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
      3.900     1.900     1.900 peak   487 spectrum    1 weight  0.10000E+01 volume  0.44855E-03 ppm1      2.791 ppm2      4.435 CV     1
 ASSI {  489}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      3.600     1.700     1.700 peak   489 spectrum    1 weight  0.10000E+01 volume  0.16062E-02 ppm1      2.798 ppm2      4.038 CV     1
 ASSI {  490}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB3 ))
      2.800     1.000     1.000 peak   490 spectrum    1 weight  0.10000E+01 volume  0.21150E-02 ppm1      2.802 ppm2      4.422 CV     1
 ASSI {  491}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 11   and name HB3 ))
      3.100     1.200     1.200 peak   491 spectrum    1 weight  0.10000E+01 volume  0.25560E-02 ppm1      2.823 ppm2      0.866 CV     1
 OR {  491}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 11   and name HB3 ))
 ASSI {  495}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HB3 ))
      1.800     1.800     4.200 peak   495 spectrum    1 weight  0.10000E+01 volume  0.17391E-01 ppm1      2.866 ppm2      3.412 CV     1
 ASSI {  496}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HG2 ))
      3.200     1.300     1.300 peak   496 spectrum    1 weight  0.10000E+01 volume  0.99734E-03 ppm1      2.869 ppm2      4.252 CV     1
 ASSI {  499}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 32   and name HG2 ))
      2.400     0.700     0.700 peak   499 spectrum    1 weight  0.10000E+01 volume  0.50621E-02 ppm1      2.874 ppm2      1.973 CV     1
 ASSI {  500}
   (( segid "    " and resid 3    and name HD2 ))
   (( segid "    " and resid 3    and name HD3 ))
      1.900     1.900     4.100 peak   500 spectrum    1 weight  0.10000E+01 volume  0.11978E-01 ppm1      2.893 ppm2      3.264 CV     1
 ASSI {  501}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.100     1.200     1.200 peak   501 spectrum    1 weight  0.10000E+01 volume  0.19997E-02 ppm1      2.896 ppm2      4.424 CV     1
 ASSI {  502}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HD3 ))
      2.300     0.700     0.700 peak   502 spectrum    1 weight  0.10000E+01 volume  0.53123E-02 ppm1      2.897 ppm2      1.687 CV     1
 ASSI {  503}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      2.600     0.800     0.800 peak   503 spectrum    1 weight  0.10000E+01 volume  0.31574E-02 ppm1      2.898 ppm2      4.034 CV     1
 ASSI {  507}
   (  segid "    " and resid 75   and name HD% )
   (( segid "    " and resid 75   and name HB3 ))
      3.100     1.200     1.200 peak   507 spectrum    1 weight  0.10000E+01 volume  0.12003E-02 ppm1      2.999 ppm2      7.333 CV     1
 ASSI {  509}
   (  segid "    " and resid 63   and name HD% )
   (( segid "    " and resid 63   and name HB3 ))
      3.300     1.300     1.300 peak   509 spectrum    1 weight  0.10000E+01 volume  0.88459E-03 ppm1      3.005 ppm2      6.936 CV     1
 ASSI {  510}
   (( segid "    " and resid 63   and name HZ  ))
   (( segid "    " and resid 75   and name HB3 ))
      4.000     2.000     2.000 peak   510 spectrum    1 weight  0.10000E+01 volume  0.85952E-03 ppm1      3.013 ppm2      6.778 CV     1
 ASSI {  511}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 11   and name HB2 ))
      3.000     1.200     1.200 peak   511 spectrum    1 weight  0.10000E+01 volume  0.11953E-02 ppm1      3.013 ppm2      0.870 CV     1
 OR {  511}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 11   and name HB2 ))
 ASSI {  512}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 11   and name HB2 ))
      1.900     1.900     4.100 peak   512 spectrum    1 weight  0.10000E+01 volume  0.13031E-01 ppm1      3.015 ppm2      2.826 CV     1
 ASSI {  516}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB3 ))
      3.000     1.100     1.100 peak   516 spectrum    1 weight  0.10000E+01 volume  0.15862E-02 ppm1      3.069 ppm2      7.109 CV     1
 ASSI {  517}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HD3 ))
      2.400     0.700     0.700 peak   517 spectrum    1 weight  0.10000E+01 volume  0.61895E-02 ppm1      3.081 ppm2      1.730 CV     1
 OR {  517}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HD2 ))
 OR {  517}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HD2 ))
 ASSI {  518}
   (( segid "    " and resid 70   and name HG3 ))
   (( segid "    " and resid 70   and name HD3 ))
      2.100     0.600     0.600 peak   518 spectrum    1 weight  0.10000E+01 volume  0.12905E-01 ppm1      3.082 ppm2      1.564 CV     1
 OR {  518}
   (( segid "    " and resid 70   and name HG3 ))
   (( segid "    " and resid 70   and name HD2 ))
 ASSI {  522}
   (  segid "    " and resid 63   and name HD% )
   (( segid "    " and resid 63   and name HB2 ))
      3.400     1.400     1.400 peak   522 spectrum    1 weight  0.10000E+01 volume  0.67156E-03 ppm1      3.173 ppm2      6.923 CV     1
 ASSI {  523}
   (( segid "    " and resid 6    and name HG13))
   (( segid "    " and resid 58   and name HA2 ))
      5.100     3.300     0.900 peak   523 spectrum    1 weight  0.10000E+01 volume  0.17441E-03 ppm1      3.182 ppm2      1.588 CV     1
 OR {  523}
   (( segid "    " and resid 6    and name HG12))
   (( segid "    " and resid 58   and name HA2 ))
 ASSI {  524}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 58   and name HA2 ))
      2.600     0.900     0.900 peak   524 spectrum    1 weight  0.10000E+01 volume  0.17892E-02 ppm1      3.186 ppm2      1.114 CV     1
 ASSI {  525}
   (( segid "    " and resid 58   and name HA1 ))
   (( segid "    " and resid 58   and name HA2 ))
      1.800     1.800     4.200 peak   525 spectrum    1 weight  0.10000E+01 volume  0.15862E-01 ppm1      3.186 ppm2      3.653 CV     1
 ASSI {  526}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 58   and name HA2 ))
      2.800     1.000     1.000 peak   526 spectrum    1 weight  0.10000E+01 volume  0.18193E-02 ppm1      3.188 ppm2      0.957 CV     1
 ASSI {  527}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 58   and name HA2 ))
      4.100     2.100     1.900 peak   527 spectrum    1 weight  0.10000E+01 volume  0.14359E-02 ppm1      3.193 ppm2      1.938 CV     1
 ASSI {  529}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 17   and name HB2 ))
      2.800     1.000     1.000 peak   529 spectrum    1 weight  0.10000E+01 volume  0.31825E-02 ppm1      3.214 ppm2      0.869 CV     1
 OR {  529}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 17   and name HB2 ))
 ASSI {  530}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HB2 ))
      1.800     1.800     4.200 peak   530 spectrum    1 weight  0.10000E+01 volume  0.19345E-01 ppm1      3.216 ppm2      2.977 CV     1
 ASSI {  532}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HB2 ))
      3.200     1.200     1.200 peak   532 spectrum    1 weight  0.10000E+01 volume  0.10675E-02 ppm1      3.220 ppm2      7.105 CV     1
 ASSI {  533}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
      3.700     1.700     1.700 peak   533 spectrum    1 weight  0.10000E+01 volume  0.67156E-03 ppm1      3.259 ppm2      4.297 CV     1
 ASSI {  534}
   (  segid "    " and resid 75   and name HD% )
   (( segid "    " and resid 75   and name HB2 ))
      2.900     1.100     1.100 peak   534 spectrum    1 weight  0.10000E+01 volume  0.11326E-02 ppm1      3.260 ppm2      7.325 CV     1
 ASSI {  537}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 78   and name HE2 ))
      2.300     2.300     3.700 peak   537 spectrum    1 weight  0.10000E+01 volume  0.64654E-02 ppm1      3.264 ppm2      1.623 CV     1
 ASSI {  539}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 3    and name HD2 ))
      2.500     0.800     0.800 peak   539 spectrum    1 weight  0.10000E+01 volume  0.42099E-02 ppm1      3.265 ppm2      1.682 CV     1
 OR {  539}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HD2 ))
 ASSI {  542}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 78   and name HE2 ))
      3.200     1.300     1.300 peak   542 spectrum    1 weight  0.10000E+01 volume  0.88459E-03 ppm1      3.266 ppm2      0.720 CV     1
 ASSI {  543}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HE2 ))
      3.400     1.400     1.400 peak   543 spectrum    1 weight  0.10000E+01 volume  0.88459E-03 ppm1      3.267 ppm2      1.215 CV     1
 OR {  543}
   (( segid "    " and resid 78   and name HG3 ))
   (( segid "    " and resid 78   and name HE2 ))
 ASSI {  544}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HD2 ))
      3.300     1.300     1.300 peak   544 spectrum    1 weight  0.10000E+01 volume  0.10425E-02 ppm1      3.304 ppm2      0.611 CV     1
 ASSI {  545}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HD2 ))
      4.000     2.000     2.000 peak   545 spectrum    1 weight  0.10000E+01 volume  0.62895E-03 ppm1      3.320 ppm2      0.934 CV     1
 ASSI {  551}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 69   and name HA  ))
      2.600     0.800     0.800 peak   551 spectrum    1 weight  0.10000E+01 volume  0.39092E-02 ppm1      3.330 ppm2      0.404 CV     1
 ASSI {  553}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 89   and name HA  ))
      2.400     0.700     0.700 peak   553 spectrum    1 weight  0.10000E+01 volume  0.52374E-02 ppm1      3.332 ppm2      1.466 CV     1
 ASSI {  554}
   (( segid "    " and resid 89   and name HG13))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.000     1.000 peak   554 spectrum    1 weight  0.10000E+01 volume  0.23806E-02 ppm1      3.333 ppm2      0.551 CV     1
 ASSI {  555}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 85   and name HA  ))
      2.300     0.700     0.700 peak   555 spectrum    1 weight  0.10000E+01 volume  0.64654E-02 ppm1      3.335 ppm2      1.794 CV     1
 ASSI {  558}
   (( segid "    " and resid 96   and name HG12))
   (( segid "    " and resid 96   and name HA  ))
      2.700     0.900     0.900 peak   558 spectrum    1 weight  0.10000E+01 volume  0.25059E-02 ppm1      3.403 ppm2      1.731 CV     1
 ASSI {  560}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 96   and name HA  ))
      2.300     0.600     0.600 peak   560 spectrum    1 weight  0.10000E+01 volume  0.96478E-02 ppm1      3.406 ppm2      0.732 CV     1
 OR {  560}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 96   and name HA  ))
 ASSI {  566}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 88   and name HD2 ))
      5.200     3.400     0.800 peak   566 spectrum    1 weight  0.10000E+01 volume  0.84947E-04 ppm1      3.461 ppm2      1.071 CV     1
 ASSI {  567}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 88   and name HD2 ))
      5.100     3.200     0.900 peak   567 spectrum    1 weight  0.10000E+01 volume  0.70417E-04 ppm1      3.462 ppm2      0.843 CV     1
 OR {  567}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 88   and name HD2 ))
 ASSI {  569}
   (( segid "    " and resid 88   and name HG2 ))
   (( segid "    " and resid 88   and name HD2 ))
      3.000     1.100     1.100 peak   569 spectrum    1 weight  0.10000E+01 volume  0.10149E-02 ppm1      3.463 ppm2      2.022 CV     1
 ASSI {  570}
   (( segid "    " and resid 88   and name HG3 ))
   (( segid "    " and resid 88   and name HD2 ))
      6.000     5.800     0.000 peak   570 spectrum    1 weight  0.10000E+01 volume  0.17942E-04 ppm1      3.468 ppm2      1.657 CV     1
 ASSI {  571}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HA  ))
      2.500     0.800     0.800 peak   571 spectrum    1 weight  0.10000E+01 volume  0.38089E-02 ppm1      3.536 ppm2      0.880 CV     1
 ASSI {  572}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 55   and name HA  ))
      3.100     1.200     1.200 peak   572 spectrum    1 weight  0.10000E+01 volume  0.12705E-02 ppm1      3.538 ppm2      2.040 CV     1
 ASSI {  573}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 55   and name HA  ))
      2.500     0.800     0.800 peak   573 spectrum    1 weight  0.10000E+01 volume  0.60644E-02 ppm1      3.540 ppm2      1.105 CV     1
 ASSI {  574}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HA  ))
      2.400     0.700     0.700 peak   574 spectrum    1 weight  0.10000E+01 volume  0.44605E-02 ppm1      3.541 ppm2      0.750 CV     1
 ASSI {  575}
   (( segid "    " and resid 18   and name HB  ))
   (( segid "    " and resid 18   and name HA  ))
      2.900     2.900     3.100 peak   575 spectrum    1 weight  0.10000E+01 volume  0.21450E-02 ppm1      3.559 ppm2      4.155 CV     1
 ASSI {  576}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 18   and name HA  ))
      3.000     1.100     1.100 peak   576 spectrum    1 weight  0.10000E+01 volume  0.16138E-02 ppm1      3.560 ppm2      1.542 CV     1
 ASSI {  577}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 18   and name HA  ))
      2.500     0.800     0.800 peak   577 spectrum    1 weight  0.10000E+01 volume  0.56132E-02 ppm1      3.562 ppm2      1.006 CV     1
 ASSI {  578}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 95   and name HA  ))
      2.100     0.600     0.600 peak   578 spectrum    1 weight  0.10000E+01 volume  0.12755E-01 ppm1      3.604 ppm2      0.874 CV     1
 OR {  578}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HA  ))
 ASSI {  587}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 84   and name HD3 ))
      3.700     1.700     1.700 peak   587 spectrum    1 weight  0.10000E+01 volume  0.97227E-03 ppm1      3.616 ppm2      0.910 CV     1
 ASSI {  592}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 58   and name HA1 ))
      3.900     1.900     1.900 peak   592 spectrum    1 weight  0.10000E+01 volume  0.15361E-02 ppm1      3.655 ppm2      1.118 CV     1
 ASSI {  594}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 58   and name HA1 ))
      3.400     1.500     1.500 peak   594 spectrum    1 weight  0.10000E+01 volume  0.17466E-02 ppm1      3.656 ppm2      0.952 CV     1
 ASSI {  595}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 58   and name HA1 ))
      2.400     0.700     0.700 peak   595 spectrum    1 weight  0.10000E+01 volume  0.32326E-02 ppm1      3.657 ppm2      1.941 CV     1
 ASSI {  596}
   (( segid "    " and resid 74   and name HB3 ))
   (( segid "    " and resid 74   and name HA  ))
      3.000     1.200     1.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.15787E-02 ppm1      3.785 ppm2      0.608 CV     1
 ASSI {  597}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 74   and name HA  ))
      2.800     1.000     1.000 peak   597 spectrum    1 weight  0.10000E+01 volume  0.18293E-02 ppm1      3.789 ppm2      0.924 CV     1
 ASSI {  598}
   (( segid "    " and resid 46   and name HG13))
   (( segid "    " and resid 45   and name HA2 ))
      3.800     1.800     1.800 peak   598 spectrum    1 weight  0.10000E+01 volume  0.46609E-03 ppm1      3.824 ppm2      1.664 CV     1
 ASSI {  600}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 29   and name HA  ))
      2.400     0.700     0.700 peak   600 spectrum    1 weight  0.10000E+01 volume  0.64151E-02 ppm1      3.836 ppm2      0.750 CV     1
 OR {  600}
   (  segid "    " and resid 96   and name HG2%)
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  602}
   (( segid "    " and resid 45   and name HA1 ))
   (( segid "    " and resid 45   and name HA2 ))
      1.900     1.900     4.100 peak   602 spectrum    1 weight  0.10000E+01 volume  0.15862E-01 ppm1      3.838 ppm2      4.425 CV     1
 ASSI {  607}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 45   and name HA2 ))
      3.300     3.300     2.700 peak   607 spectrum    1 weight  0.10000E+01 volume  0.35834E-03 ppm1      3.847 ppm2      0.900 CV     1
 ASSI {  608}
   (( segid "    " and resid 33   and name HA1 ))
   (( segid "    " and resid 33   and name HA2 ))
      1.700     1.700     4.300 peak   608 spectrum    1 weight  0.10000E+01 volume  0.27314E-01 ppm1      3.849 ppm2      4.148 CV     1
 ASSI {  613}
   (( segid "    " and resid 26   and name HG2 ))
   (( segid "    " and resid 26   and name HA  ))
      2.600     0.900     0.900 peak   613 spectrum    1 weight  0.10000E+01 volume  0.36586E-02 ppm1      3.861 ppm2      1.348 CV     1
 OR {  613}
   (( segid "    " and resid 26   and name HG3 ))
   (( segid "    " and resid 26   and name HA  ))
 ASSI {  614}
   (  segid "    " and resid 29   and name HB% )
   (( segid "    " and resid 26   and name HA  ))
      2.500     0.800     0.800 peak   614 spectrum    1 weight  0.10000E+01 volume  0.47361E-02 ppm1      3.861 ppm2      1.234 CV     1
 ASSI {  615}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HA  ))
      2.200     0.600     0.600 peak   615 spectrum    1 weight  0.10000E+01 volume  0.89208E-02 ppm1      3.862 ppm2      1.877 CV     1
 ASSI {  617}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 84   and name HD2 ))
      4.200     2.200     1.800 peak   617 spectrum    1 weight  0.10000E+01 volume  0.41096E-03 ppm1      3.863 ppm2      0.907 CV     1
 ASSI {  618}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 25   and name HA  ))
      2.600     0.800     0.800 peak   618 spectrum    1 weight  0.10000E+01 volume  0.38340E-02 ppm1      3.864 ppm2      1.456 CV     1
 ASSI {  619}
   (  segid "    " and resid 25   and name HD2%)
   (( segid "    " and resid 25   and name HA  ))
      2.700     0.900     0.900 peak   619 spectrum    1 weight  0.10000E+01 volume  0.37839E-02 ppm1      3.865 ppm2      0.724 CV     1
 ASSI {  624}
   (( segid "    " and resid 25   and name HB3 ))
   (( segid "    " and resid 25   and name HA  ))
      3.200     1.300     1.300 peak   624 spectrum    1 weight  0.10000E+01 volume  0.10700E-02 ppm1      3.867 ppm2      1.155 CV     1
 ASSI {  625}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 84   and name HD2 ))
      4.100     4.100     1.900 peak   625 spectrum    1 weight  0.10000E+01 volume  0.10299E-03 ppm1      3.867 ppm2      3.610 CV     1
 ASSI {  627}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 79   and name HA  ))
      2.400     0.700     0.700 peak   627 spectrum    1 weight  0.10000E+01 volume  0.59137E-02 ppm1      3.867 ppm2      1.038 CV     1
 ASSI {  628}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 79   and name HA  ))
      2.800     1.000     1.000 peak   628 spectrum    1 weight  0.10000E+01 volume  0.27565E-02 ppm1      3.867 ppm2      0.862 CV     1
 ASSI {  630}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
      2.600     0.800     0.800 peak   630 spectrum    1 weight  0.10000E+01 volume  0.33078E-02 ppm1      3.870 ppm2      2.096 CV     1
 ASSI {  632}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 93   and name HA  ))
      2.200     0.600     0.600 peak   632 spectrum    1 weight  0.10000E+01 volume  0.92218E-02 ppm1      3.873 ppm2      1.688 CV     1
 ASSI {  633}
   (( segid "    " and resid 25   and name HG  ))
   (( segid "    " and resid 25   and name HA  ))
      4.200     2.200     1.800 peak   633 spectrum    1 weight  0.10000E+01 volume  0.21701E-03 ppm1      3.873 ppm2      1.743 CV     1
 ASSI {  634}
   (  segid "    " and resid 19   and name HE% )
   (( segid "    " and resid 40   and name HB  ))
      6.000     6.000     0.000 peak   634 spectrum    1 weight  0.10000E+01 volume  0.48114E-05 ppm1      3.874 ppm2      6.789 CV     1
 ASSI {  636}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 40   and name HB  ))
      2.300     0.600     0.600 peak   636 spectrum    1 weight  0.10000E+01 volume  0.81943E-02 ppm1      3.877 ppm2      1.004 CV     1
 ASSI {  641}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HA  ))
      2.400     0.700     0.700 peak   641 spectrum    1 weight  0.10000E+01 volume  0.57635E-02 ppm1      3.909 ppm2      0.884 CV     1
 ASSI {  642}
   (( segid "    " and resid 49   and name HG3 ))
   (( segid "    " and resid 49   and name HA  ))
      2.400     0.700     0.700 peak   642 spectrum    1 weight  0.10000E+01 volume  0.71668E-02 ppm1      3.912 ppm2      2.091 CV     1
 OR {  642}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  643}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 49   and name HA  ))
      3.100     1.200     1.200 peak   643 spectrum    1 weight  0.10000E+01 volume  0.35333E-02 ppm1      3.913 ppm2      2.374 CV     1
 ASSI {  644}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
      2.100     0.600     0.600 peak   644 spectrum    1 weight  0.10000E+01 volume  0.11602E-01 ppm1      3.913 ppm2      1.789 CV     1
 OR {  644}
   (( segid "    " and resid 49   and name HB3 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  646}
   (( segid "    " and resid 103  and name HG13))
   (( segid "    " and resid 100  and name HA  ))
      2.900     1.100     1.100 peak   646 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      3.913 ppm2      1.188 CV     1
 ASSI {  648}
   (( segid "    " and resid 100  and name HB3 ))
   (( segid "    " and resid 100  and name HA  ))
      2.600     0.800     0.800 peak   648 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      3.914 ppm2      1.453 CV     1
 ASSI {  649}
   (( segid "    " and resid 28   and name HA2 ))
   (( segid "    " and resid 28   and name HA1 ))
      1.700     1.700     4.300 peak   649 spectrum    1 weight  0.10000E+01 volume  0.22052E-01 ppm1      3.915 ppm2      3.262 CV     1
 ASSI {  650}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 28   and name HA1 ))
      4.000     2.000     2.000 peak   650 spectrum    1 weight  0.10000E+01 volume  0.88208E-03 ppm1      3.915 ppm2      0.749 CV     1
 ASSI {  651}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 22   and name HA  ))
      2.400     0.700     0.700 peak   651 spectrum    1 weight  0.10000E+01 volume  0.74677E-02 ppm1      3.915 ppm2      0.609 CV     1
 ASSI {  652}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HA  ))
      2.300     0.700     0.700 peak   652 spectrum    1 weight  0.10000E+01 volume  0.66407E-02 ppm1      3.916 ppm2      0.643 CV     1
 ASSI {  653}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 28   and name HA1 ))
      2.700     0.900     0.900 peak   653 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      3.916 ppm2      2.004 CV     1
 ASSI {  654}
   (( segid "    " and resid 93   and name HG3 ))
   (( segid "    " and resid 28   and name HA1 ))
      3.300     1.300     1.300 peak   654 spectrum    1 weight  0.10000E+01 volume  0.98981E-03 ppm1      3.920 ppm2      2.278 CV     1
 OR {  654}
   (( segid "    " and resid 93   and name HG2 ))
   (( segid "    " and resid 28   and name HA1 ))
 ASSI {  655}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 22   and name HA  ))
      2.400     0.700     0.700 peak   655 spectrum    1 weight  0.10000E+01 volume  0.56132E-02 ppm1      3.921 ppm2      0.855 CV     1
 OR {  655}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  658}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
      2.800     1.000     1.000 peak   658 spectrum    1 weight  0.10000E+01 volume  0.21926E-02 ppm1      3.945 ppm2      1.755 CV     1
 ASSI {  659}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 94   and name HA  ))
      2.700     0.900     0.900 peak   659 spectrum    1 weight  0.10000E+01 volume  0.20523E-02 ppm1      3.946 ppm2      2.796 CV     1
 ASSI {  660}
   (( segid "    " and resid 94   and name HG2 ))
   (( segid "    " and resid 94   and name HA  ))
      2.500     0.800     0.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.54379E-02 ppm1      3.946 ppm2      1.444 CV     1
 ASSI {  661}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 99   and name HA  ))
      2.700     0.900     0.900 peak   661 spectrum    1 weight  0.10000E+01 volume  0.31073E-02 ppm1      3.954 ppm2      2.014 CV     1
 OR {  661}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  662}
   (  segid "    " and resid 99   and name HB% )
   (( segid "    " and resid 99   and name HA  ))
      2.100     0.600     0.600 peak   662 spectrum    1 weight  0.10000E+01 volume  0.11778E-01 ppm1      3.954 ppm2      1.409 CV     1
 ASSI {  664}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 99   and name HA  ))
      2.800     0.900     0.900 peak   664 spectrum    1 weight  0.10000E+01 volume  0.35834E-02 ppm1      3.954 ppm2      1.167 CV     1
 ASSI {  665}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HA  ))
      2.400     0.700     0.700 peak   665 spectrum    1 weight  0.10000E+01 volume  0.51369E-02 ppm1      3.955 ppm2      1.774 CV     1
 ASSI {  666}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 23   and name HA  ))
      2.900     1.100     1.100 peak   666 spectrum    1 weight  0.10000E+01 volume  0.21751E-02 ppm1      3.958 ppm2      1.868 CV     1
 ASSI {  667}
   (( segid "    " and resid 23   and name HG3 ))
   (( segid "    " and resid 23   and name HA  ))
      2.800     0.900     0.900 peak   667 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      3.961 ppm2      2.356 CV     1
 OR {  667}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI {  668}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HA  ))
      2.700     0.900     0.900 peak   668 spectrum    1 weight  0.10000E+01 volume  0.33829E-02 ppm1      3.962 ppm2      2.102 CV     1
 ASSI {  669}
   (( segid "    " and resid 57   and name HG13))
   (( segid "    " and resid 57   and name HA  ))
      3.100     1.200     1.200 peak   669 spectrum    1 weight  0.10000E+01 volume  0.20949E-02 ppm1      3.967 ppm2      1.299 CV     1
 ASSI {  670}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
      2.500     0.800     0.800 peak   670 spectrum    1 weight  0.10000E+01 volume  0.42600E-02 ppm1      3.969 ppm2      0.915 CV     1
 ASSI {  672}
   (( segid "    " and resid 26   and name HD2 ))
   (( segid "    " and resid 23   and name HA  ))
      3.400     1.500     1.500 peak   672 spectrum    1 weight  0.10000E+01 volume  0.80938E-03 ppm1      3.971 ppm2      1.658 CV     1
 OR {  672}
   (( segid "    " and resid 26   and name HD3 ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI {  673}
   (( segid "    " and resid 57   and name HG12))
   (( segid "    " and resid 57   and name HA  ))
      2.900     1.100     1.100 peak   673 spectrum    1 weight  0.10000E+01 volume  0.16414E-02 ppm1      3.971 ppm2      1.586 CV     1
 ASSI {  674}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 67   and name HB  ))
      2.200     0.600     0.600 peak   674 spectrum    1 weight  0.10000E+01 volume  0.85450E-02 ppm1      4.006 ppm2      0.924 CV     1
 ASSI {  675}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB  ))
      2.800     2.800     3.200 peak   675 spectrum    1 weight  0.10000E+01 volume  0.22804E-02 ppm1      4.006 ppm2      4.522 CV     1
 ASSI {  676}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 67   and name HB  ))
      2.600     0.800     0.800 peak   676 spectrum    1 weight  0.10000E+01 volume  0.38841E-02 ppm1      4.007 ppm2      1.479 CV     1
 ASSI {  678}
   (  segid "    " and resid 75   and name HD% )
   (( segid "    " and resid 72   and name HA  ))
      2.300     0.600     0.600 peak   678 spectrum    1 weight  0.10000E+01 volume  0.43351E-02 ppm1      4.019 ppm2      7.326 CV     1
 ASSI {  679}
   (  segid "    " and resid 75   and name HE% )
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.600     1.600 peak   679 spectrum    1 weight  0.10000E+01 volume  0.15135E-02 ppm1      4.019 ppm2      7.111 CV     1
 ASSI {  680}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 72   and name HA  ))
      2.800     1.000     1.000 peak   680 spectrum    1 weight  0.10000E+01 volume  0.37338E-02 ppm1      4.019 ppm2      0.402 CV     1
 ASSI {  683}
   (( segid "    " and resid 63   and name HZ  ))
   (( segid "    " and resid 72   and name HA  ))
      3.100     1.200     1.200 peak   683 spectrum    1 weight  0.10000E+01 volume  0.85701E-03 ppm1      4.021 ppm2      6.778 CV     1
 ASSI {  684}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
      3.000     1.200     1.200 peak   684 spectrum    1 weight  0.10000E+01 volume  0.24332E-02 ppm1      4.022 ppm2      0.897 CV     1
 ASSI {  686}
   (( segid "    " and resid 88   and name HG3 ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     1.600     1.600 peak   686 spectrum    1 weight  0.10000E+01 volume  0.84450E-03 ppm1      4.023 ppm2      1.678 CV     1
 ASSI {  687}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      2.600     0.800     0.800 peak   687 spectrum    1 weight  0.10000E+01 volume  0.56384E-02 ppm1      4.023 ppm2      1.878 CV     1
 ASSI {  693}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 86   and name HA  ))
      2.300     0.700     0.700 peak   693 spectrum    1 weight  0.10000E+01 volume  0.60393E-02 ppm1      4.039 ppm2      0.893 CV     1
 ASSI {  694}
   (( segid "    " and resid 68   and name HB3 ))
   (( segid "    " and resid 68   and name HA  ))
      2.300     0.700     0.700 peak   694 spectrum    1 weight  0.10000E+01 volume  0.66905E-02 ppm1      4.094 ppm2      1.679 CV     1
 OR {  694}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI {  695}
   (  segid "    " and resid 69   and name HG1%)
   (( segid "    " and resid 68   and name HA  ))
      3.900     1.900     1.900 peak   695 spectrum    1 weight  0.10000E+01 volume  0.37087E-03 ppm1      4.096 ppm2      0.023 CV     1
 ASSI {  696}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HA  ))
      2.600     2.600     3.400 peak   696 spectrum    1 weight  0.10000E+01 volume  0.61644E-02 ppm1      4.103 ppm2      1.391 CV     1
 ASSI {  697}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 101  and name HA  ))
      3.600     1.600     1.600 peak   697 spectrum    1 weight  0.10000E+01 volume  0.71668E-03 ppm1      4.114 ppm2      2.281 CV     1
 ASSI {  698}
   (( segid "    " and resid 77   and name HA2 ))
   (( segid "    " and resid 77   and name HA1 ))
      1.800     1.800     4.200 peak   698 spectrum    1 weight  0.10000E+01 volume  0.18218E-01 ppm1      4.115 ppm2      3.834 CV     1
 ASSI {  701}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 18   and name HB  ))
      2.300     0.700     0.700 peak   701 spectrum    1 weight  0.10000E+01 volume  0.69161E-02 ppm1      4.129 ppm2      1.000 CV     1
 ASSI {  702}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 102  and name HA  ))
      2.300     0.700     0.700 peak   702 spectrum    1 weight  0.10000E+01 volume  0.83947E-02 ppm1      4.131 ppm2      0.842 CV     1
 OR {  702}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 102  and name HA  ))
 ASSI {  703}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HA  ))
      2.700     0.900     0.900 peak   703 spectrum    1 weight  0.10000E+01 volume  0.46359E-02 ppm1      4.132 ppm2      2.034 CV     1
 ASSI {  704}
   (  segid "    " and resid 15   and name HG1%)
   (( segid "    " and resid 15   and name HA  ))
      2.400     0.700     0.700 peak   704 spectrum    1 weight  0.10000E+01 volume  0.64900E-02 ppm1      4.132 ppm2      0.956 CV     1
 OR {  704}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  705}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 15   and name HA  ))
      2.500     0.800     0.800 peak   705 spectrum    1 weight  0.10000E+01 volume  0.44104E-02 ppm1      4.132 ppm2      2.060 CV     1
 ASSI {  710}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 24   and name HA  ))
      2.400     0.700     0.700 peak   710 spectrum    1 weight  0.10000E+01 volume  0.55379E-02 ppm1      4.155 ppm2      1.874 CV     1
 ASSI {  711}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 30   and name HA  ))
      2.700     0.900     0.900 peak   711 spectrum    1 weight  0.10000E+01 volume  0.36085E-02 ppm1      4.162 ppm2      1.505 CV     1
 OR {  711}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 30   and name HA  ))
 ASSI {  715}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HA  ))
      2.800     1.000     1.000 peak   715 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      4.176 ppm2      1.713 CV     1
 OR {  715}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI {  717}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 9    and name HB  ))
      3.000     3.000     3.000 peak   717 spectrum    1 weight  0.10000E+01 volume  0.15361E-02 ppm1      4.186 ppm2      3.557 CV     1
 ASSI {  718}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB  ))
      2.400     0.700     0.700 peak   718 spectrum    1 weight  0.10000E+01 volume  0.53625E-02 ppm1      4.188 ppm2      5.525 CV     1
 ASSI {  719}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 9    and name HB  ))
      2.800     1.000     1.000 peak   719 spectrum    1 weight  0.10000E+01 volume  0.22453E-02 ppm1      4.188 ppm2      1.541 CV     1
 ASSI {  720}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 9    and name HB  ))
      2.200     0.600     0.600 peak   720 spectrum    1 weight  0.10000E+01 volume  0.92218E-02 ppm1      4.188 ppm2      1.028 CV     1
 ASSI {  721}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 9    and name HB  ))
      2.900     1.000     1.000 peak   721 spectrum    1 weight  0.10000E+01 volume  0.18569E-02 ppm1      4.189 ppm2      0.864 CV     1
 ASSI {  722}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 9    and name HB  ))
      4.100     2.100     1.900 peak   722 spectrum    1 weight  0.10000E+01 volume  0.82445E-03 ppm1      4.190 ppm2      0.671 CV     1
 ASSI {  723}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      3.000     1.100     1.100 peak   723 spectrum    1 weight  0.10000E+01 volume  0.20523E-02 ppm1      4.190 ppm2      2.376 CV     1
 OR {  723}
   (( segid "    " and resid 73   and name HG3 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  724}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 54   and name HA  ))
      3.300     3.300     2.700 peak   724 spectrum    1 weight  0.10000E+01 volume  0.16489E-02 ppm1      4.212 ppm2      0.848 CV     1
 ASSI {  726}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 54   and name HA  ))
      2.700     0.900     0.900 peak   726 spectrum    1 weight  0.10000E+01 volume  0.31073E-02 ppm1      4.222 ppm2      1.889 CV     1
 ASSI {  727}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      3.100     1.200     1.200 peak   727 spectrum    1 weight  0.10000E+01 volume  0.16463E-02 ppm1      4.226 ppm2      3.056 CV     1
 ASSI {  728}
   (( segid "    " and resid 57   and name HG13))
   (( segid "    " and resid 54   and name HA  ))
      3.400     1.400     1.400 peak   728 spectrum    1 weight  0.10000E+01 volume  0.67407E-03 ppm1      4.226 ppm2      1.288 CV     1
 ASSI {  729}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 12   and name HA  ))
      2.200     0.600     0.600 peak   729 spectrum    1 weight  0.10000E+01 volume  0.10149E-01 ppm1      4.241 ppm2      1.476 CV     1
 ASSI {  730}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 48   and name HA  ))
      2.600     0.800     0.800 peak   730 spectrum    1 weight  0.10000E+01 volume  0.43602E-02 ppm1      4.242 ppm2      2.863 CV     1
 ASSI {  732}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      2.500     0.800     0.800 peak   732 spectrum    1 weight  0.10000E+01 volume  0.44855E-02 ppm1      4.243 ppm2      3.413 CV     1
 ASSI {  735}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 16   and name HA  ))
      3.300     1.300     1.300 peak   735 spectrum    1 weight  0.10000E+01 volume  0.94222E-03 ppm1      4.251 ppm2      7.108 CV     1
 ASSI {  736}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 59   and name HA  ))
      2.800     1.000     1.000 peak   736 spectrum    1 weight  0.10000E+01 volume  0.21475E-02 ppm1      4.251 ppm2      2.671 CV     1
 ASSI {  737}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 16   and name HA  ))
      3.900     1.900     1.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.82943E-03 ppm1      4.252 ppm2      3.060 CV     1
 ASSI {  738}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 59   and name HA  ))
      2.400     0.700     0.700 peak   738 spectrum    1 weight  0.10000E+01 volume  0.46108E-02 ppm1      4.252 ppm2      1.979 CV     1
 ASSI {  739}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 16   and name HA  ))
      3.300     1.400     1.400 peak   739 spectrum    1 weight  0.10000E+01 volume  0.86952E-03 ppm1      4.253 ppm2      3.215 CV     1
 ASSI {  740}
   (  segid "    " and resid 15   and name HG1%)
   (( segid "    " and resid 16   and name HA  ))
      3.800     1.800     1.800 peak   740 spectrum    1 weight  0.10000E+01 volume  0.53625E-03 ppm1      4.254 ppm2      0.946 CV     1
 OR {  740}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 16   and name HA  ))
 ASSI {  741}
   (  segid "    " and resid 16   and name HB% )
   (( segid "    " and resid 16   and name HA  ))
      2.400     0.700     0.700 peak   741 spectrum    1 weight  0.10000E+01 volume  0.68412E-02 ppm1      4.257 ppm2      1.362 CV     1
 ASSI {  742}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HB  ))
      2.300     0.700     0.700 peak   742 spectrum    1 weight  0.10000E+01 volume  0.71919E-02 ppm1      4.289 ppm2      1.194 CV     1
 ASSI {  744}
   (  segid "    " and resid 75   and name HD% )
   (( segid "    " and resid 75   and name HA  ))
      2.900     1.000     1.000 peak   744 spectrum    1 weight  0.10000E+01 volume  0.13557E-02 ppm1      4.304 ppm2      7.331 CV     1
 ASSI {  746}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 75   and name HA  ))
      2.500     0.800     0.800 peak   746 spectrum    1 weight  0.10000E+01 volume  0.32326E-02 ppm1      4.306 ppm2      2.994 CV     1
 ASSI {  749}
   (( segid "    " and resid 105  and name HG3 ))
   (( segid "    " and resid 105  and name HA  ))
      2.700     0.900     0.900 peak   749 spectrum    1 weight  0.10000E+01 volume  0.33829E-02 ppm1      4.316 ppm2      2.267 CV     1
 OR {  749}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  750}
   (( segid "    " and resid 2    and name HB2 ))
   (( segid "    " and resid 2    and name HA  ))
      2.100     0.500     0.500 peak   750 spectrum    1 weight  0.10000E+01 volume  0.14635E-01 ppm1      4.325 ppm2      1.821 CV     1
 ASSI {  752}
   (  segid "    " and resid 19   and name HD% )
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   752 spectrum    1 weight  0.10000E+01 volume  0.33579E-02 ppm1      4.358 ppm2      7.106 CV     1
 ASSI {  753}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 19   and name HA  ))
      2.500     0.800     0.800 peak   753 spectrum    1 weight  0.10000E+01 volume  0.51118E-02 ppm1      4.358 ppm2      1.471 CV     1
 ASSI {  754}
   (( segid "    " and resid 19   and name HB3 ))
   (( segid "    " and resid 19   and name HA  ))
      2.600     0.800     0.800 peak   754 spectrum    1 weight  0.10000E+01 volume  0.34331E-02 ppm1      4.359 ppm2      3.060 CV     1
 ASSI {  755}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   755 spectrum    1 weight  0.10000E+01 volume  0.43101E-02 ppm1      4.361 ppm2      3.218 CV     1
 ASSI {  757}
   (( segid "    " and resid 76   and name HB3 ))
   (( segid "    " and resid 76   and name HA  ))
      2.300     0.700     0.700 peak   757 spectrum    1 weight  0.10000E+01 volume  0.83194E-02 ppm1      4.399 ppm2      2.633 CV     1
 OR {  757}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI {  758}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 44   and name HA  ))
      2.800     1.000     1.000 peak   758 spectrum    1 weight  0.10000E+01 volume  0.32075E-02 ppm1      4.402 ppm2      1.163 CV     1
 ASSI {  759}
   (( segid "    " and resid 17   and name HD2 ))
   (( segid "    " and resid 17   and name HA  ))
      3.200     1.300     1.300 peak   759 spectrum    1 weight  0.10000E+01 volume  0.10700E-02 ppm1      4.405 ppm2      6.967 CV     1
 ASSI {  760}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 17   and name HA  ))
      2.400     0.700     0.700 peak   760 spectrum    1 weight  0.10000E+01 volume  0.47611E-02 ppm1      4.406 ppm2      2.980 CV     1
 ASSI {  761}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
      2.900     1.000     1.000 peak   761 spectrum    1 weight  0.10000E+01 volume  0.30572E-02 ppm1      4.407 ppm2      3.215 CV     1
 ASSI {  762}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 44   and name HA  ))
      3.100     3.100     2.900 peak   762 spectrum    1 weight  0.10000E+01 volume  0.57886E-03 ppm1      4.409 ppm2      2.960 CV     1
 OR {  762}
   (( segid "    " and resid 68   and name HE3 ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI {  763}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
      3.100     1.200     1.200 peak   763 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      4.412 ppm2      2.174 CV     1
 ASSI {  766}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 17   and name HA  ))
      3.700     1.700     1.700 peak   766 spectrum    1 weight  0.10000E+01 volume  0.10826E-02 ppm1      4.418 ppm2      2.782 CV     1
 ASSI {  767}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HA  ))
      2.100     0.600     0.600 peak   767 spectrum    1 weight  0.10000E+01 volume  0.15110E-01 ppm1      4.419 ppm2      1.182 CV     1
 ASSI {  768}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 60   and name HA  ))
      3.400     1.400     1.400 peak   768 spectrum    1 weight  0.10000E+01 volume  0.80687E-03 ppm1      4.422 ppm2      0.850 CV     1
 ASSI {  769}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 88   and name HD3 ))
      3.200     1.300     1.300 peak   769 spectrum    1 weight  0.10000E+01 volume  0.12880E-02 ppm1      4.423 ppm2      1.073 CV     1
 ASSI {  770}
   (( segid "    " and resid 88   and name HG2 ))
   (( segid "    " and resid 88   and name HD3 ))
      3.200     1.300     1.300 peak   770 spectrum    1 weight  0.10000E+01 volume  0.15912E-02 ppm1      4.424 ppm2      2.015 CV     1
 ASSI {  774}
   (( segid "    " and resid 88   and name HG3 ))
   (( segid "    " and resid 88   and name HD3 ))
      2.600     0.900     0.900 peak   774 spectrum    1 weight  0.10000E+01 volume  0.18919E-02 ppm1      4.426 ppm2      1.660 CV     1
 ASSI {  776}
   (( segid "    " and resid 88   and name HD2 ))
   (( segid "    " and resid 88   and name HD3 ))
      1.900     0.400     0.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.10073E-01 ppm1      4.427 ppm2      3.461 CV     1
 ASSI {  777}
   (  segid "    " and resid 87   and name HB% )
   (( segid "    " and resid 88   and name HD3 ))
      2.400     0.700     0.700 peak   777 spectrum    1 weight  0.10000E+01 volume  0.35333E-02 ppm1      4.427 ppm2      1.488 CV     1
 ASSI {  778}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HA  ))
      2.300     0.700     0.700 peak   778 spectrum    1 weight  0.10000E+01 volume  0.59137E-02 ppm1      4.427 ppm2      2.099 CV     1
 ASSI {  779}
   (  segid "    " and resid 60   and name HG1%)
   (( segid "    " and resid 60   and name HA  ))
      2.700     0.900     0.900 peak   779 spectrum    1 weight  0.10000E+01 volume  0.30572E-02 ppm1      4.427 ppm2      0.993 CV     1
 ASSI {  784}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HA  ))
      2.500     0.800     0.800 peak   784 spectrum    1 weight  0.10000E+01 volume  0.48365E-02 ppm1      4.438 ppm2      1.329 CV     1
 ASSI {  785}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
      2.400     0.700     0.700 peak   785 spectrum    1 weight  0.10000E+01 volume  0.47862E-02 ppm1      4.441 ppm2      1.852 CV     1
 ASSI {  786}
   (( segid "    " and resid 103  and name HG12))
   (( segid "    " and resid 103  and name HA  ))
      3.700     1.700     1.700 peak   786 spectrum    1 weight  0.10000E+01 volume  0.68663E-03 ppm1      4.450 ppm2      1.672 CV     1
 ASSI {  787}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 103  and name HA  ))
      2.300     0.700     0.700 peak   787 spectrum    1 weight  0.10000E+01 volume  0.75677E-02 ppm1      4.451 ppm2      1.015 CV     1
 ASSI {  788}
   (( segid "    " and resid 103  and name HB  ))
   (( segid "    " and resid 103  and name HA  ))
      2.400     0.700     0.700 peak   788 spectrum    1 weight  0.10000E+01 volume  0.56132E-02 ppm1      4.452 ppm2      2.072 CV     1
 ASSI {  790}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 44   and name HB  ))
      2.200     0.600     0.600 peak   790 spectrum    1 weight  0.10000E+01 volume  0.10024E-01 ppm1      4.476 ppm2      1.167 CV     1
 ASSI {  791}
   (( segid "    " and resid 1    and name HG2 ))
   (( segid "    " and resid 1    and name HA  ))
      2.900     1.100     1.100 peak   791 spectrum    1 weight  0.10000E+01 volume  0.21926E-02 ppm1      4.504 ppm2      2.572 CV     1
 OR {  791}
   (( segid "    " and resid 1    and name HG3 ))
   (( segid "    " and resid 1    and name HA  ))
 ASSI {  792}
   (( segid "    " and resid 1    and name HB2 ))
   (( segid "    " and resid 1    and name HA  ))
      2.400     0.700     0.700 peak   792 spectrum    1 weight  0.10000E+01 volume  0.59891E-02 ppm1      4.504 ppm2      2.057 CV     1
 OR {  792}
   (( segid "    " and resid 1    and name HB3 ))
   (( segid "    " and resid 1    and name HA  ))
 ASSI {  793}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 81   and name HA  ))
      2.700     0.900     0.900 peak   793 spectrum    1 weight  0.10000E+01 volume  0.23706E-02 ppm1      4.511 ppm2      1.760 CV     1
 ASSI {  794}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 81   and name HA  ))
      2.700     0.900     0.900 peak   794 spectrum    1 weight  0.10000E+01 volume  0.33829E-02 ppm1      4.513 ppm2      1.156 CV     1
 ASSI {  795}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 81   and name HA  ))
      2.200     0.600     0.600 peak   795 spectrum    1 weight  0.10000E+01 volume  0.97227E-02 ppm1      4.513 ppm2      0.873 CV     1
 ASSI {  796}
   (  segid "    " and resid 81   and name HD1%)
   (( segid "    " and resid 81   and name HA  ))
      2.800     1.000     1.000 peak   796 spectrum    1 weight  0.10000E+01 volume  0.25059E-02 ppm1      4.514 ppm2      1.319 CV     1
 ASSI {  797}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
      2.900     1.100     1.100 peak   797 spectrum    1 weight  0.10000E+01 volume  0.26562E-02 ppm1      4.529 ppm2      0.920 CV     1
 ASSI {  799}
   (( segid "    " and resid 5    and name HG13))
   (( segid "    " and resid 5    and name HA  ))
      2.800     1.000     1.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.27063E-02 ppm1      4.546 ppm2      1.444 CV     1
 ASSI {  800}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 5    and name HA  ))
      2.200     0.600     0.600 peak   800 spectrum    1 weight  0.10000E+01 volume  0.88957E-02 ppm1      4.547 ppm2      0.883 CV     1
 OR {  800}
   (( segid "    " and resid 5    and name HG12))
   (( segid "    " and resid 5    and name HA  ))
 ASSI {  801}
   (  segid "    " and resid 5    and name HD1%)
   (( segid "    " and resid 5    and name HA  ))
      2.900     1.100     1.100 peak   801 spectrum    1 weight  0.10000E+01 volume  0.49867E-02 ppm1      4.547 ppm2      0.678 CV     1
 ASSI {  802}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 91   and name HA  ))
      2.400     0.700     0.700 peak   802 spectrum    1 weight  0.10000E+01 volume  0.55128E-02 ppm1      4.550 ppm2      2.576 CV     1
 ASSI {  803}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 5    and name HA  ))
      2.800     1.000     1.000 peak   803 spectrum    1 weight  0.10000E+01 volume  0.23305E-02 ppm1      4.550 ppm2      1.615 CV     1
 ASSI {  804}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      2.800     1.000     1.000 peak   804 spectrum    1 weight  0.10000E+01 volume  0.37338E-02 ppm1      4.551 ppm2      2.904 CV     1
 ASSI {  805}
   (( segid "    " and resid 78   and name HG3 ))
   (( segid "    " and resid 78   and name HA  ))
      3.400     1.400     1.400 peak   805 spectrum    1 weight  0.10000E+01 volume  0.84947E-03 ppm1      4.552 ppm2      1.222 CV     1
 OR {  805}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  807}
   (( segid "    " and resid 78   and name HB2 ))
   (( segid "    " and resid 78   and name HA  ))
      2.800     1.000     1.000 peak   807 spectrum    1 weight  0.10000E+01 volume  0.38089E-02 ppm1      4.558 ppm2      1.820 CV     1
 ASSI {  808}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 78   and name HA  ))
      2.500     2.500     3.500 peak   808 spectrum    1 weight  0.10000E+01 volume  0.97981E-02 ppm1      4.564 ppm2      4.322 CV     1
 ASSI {  809}
   (( segid "    " and resid 42   and name HA2 ))
   (( segid "    " and resid 42   and name HA1 ))
      1.900     1.900     4.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.14810E-01 ppm1      4.582 ppm2      4.015 CV     1
 ASSI {  810}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 42   and name HA1 ))
      2.900     1.100     1.100 peak   810 spectrum    1 weight  0.10000E+01 volume  0.18518E-02 ppm1      4.582 ppm2      0.975 CV     1
 ASSI {  811}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HA  ))
      2.500     0.800     0.800 peak   811 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      4.605 ppm2      1.670 CV     1
 ASSI {  813}
   (( segid "    " and resid 37   and name HD2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.500     0.800     0.800 peak   813 spectrum    1 weight  0.10000E+01 volume  0.39092E-02 ppm1      4.606 ppm2      1.489 CV     1
 OR {  813}
   (( segid "    " and resid 37   and name HD3 ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  814}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.500     0.800     0.800 peak   814 spectrum    1 weight  0.10000E+01 volume  0.47361E-02 ppm1      4.606 ppm2      1.773 CV     1
 ASSI {  815}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.100     1.100 peak   815 spectrum    1 weight  0.10000E+01 volume  0.19445E-02 ppm1      4.607 ppm2      1.181 CV     1
 OR {  815}
   (( segid "    " and resid 37   and name HG3 ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  816}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 37   and name HA  ))
      3.200     1.300     1.300 peak   816 spectrum    1 weight  0.10000E+01 volume  0.20824E-02 ppm1      4.612 ppm2      0.985 CV     1
 ASSI {  817}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 35   and name HA  ))
      2.700     0.900     0.900 peak   817 spectrum    1 weight  0.10000E+01 volume  0.33328E-02 ppm1      4.634 ppm2      0.870 CV     1
 OR {  817}
   (  segid "    " and resid 35   and name HD2%)
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  818}
   (( segid "    " and resid 35   and name HB3 ))
   (( segid "    " and resid 35   and name HA  ))
      2.100     0.600     0.600 peak   818 spectrum    1 weight  0.10000E+01 volume  0.10149E-01 ppm1      4.638 ppm2      1.636 CV     1
 ASSI {  819}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
      2.300     0.700     0.700 peak   819 spectrum    1 weight  0.10000E+01 volume  0.87455E-02 ppm1      4.662 ppm2      2.684 CV     1
 ASSI {  820}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 3    and name HA  ))
      3.300     3.300     2.700 peak   820 spectrum    1 weight  0.10000E+01 volume  0.34832E-03 ppm1      4.672 ppm2      0.652 CV     1
 OR {  820}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 3    and name HA  ))
 ASSI {  821}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 47   and name HA  ))
      2.200     0.600     0.600 peak   821 spectrum    1 weight  0.10000E+01 volume  0.10299E-01 ppm1      4.677 ppm2      2.031 CV     1
 OR {  821}
   (( segid "    " and resid 47   and name HB3 ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  822}
   (( segid "    " and resid 3    and name HD3 ))
   (( segid "    " and resid 3    and name HA  ))
      2.500     0.800     0.800 peak   822 spectrum    1 weight  0.10000E+01 volume  0.44605E-02 ppm1      4.677 ppm2      2.894 CV     1
 ASSI {  823}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HA  ))
      2.400     0.700     0.700 peak   823 spectrum    1 weight  0.10000E+01 volume  0.59640E-02 ppm1      4.678 ppm2      1.678 CV     1
 OR {  823}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 3    and name HA  ))
 OR {  823}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI {  825}
   (( segid "    " and resid 47   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
      2.300     0.700     0.700 peak   825 spectrum    1 weight  0.10000E+01 volume  0.79687E-02 ppm1      4.679 ppm2      2.187 CV     1
 ASSI {  826}
   (( segid "    " and resid 3    and name HB3 ))
   (( segid "    " and resid 3    and name HA  ))
      3.000     1.200     1.200 peak   826 spectrum    1 weight  0.10000E+01 volume  0.16990E-02 ppm1      4.679 ppm2      1.352 CV     1
 ASSI {  827}
   (( segid "    " and resid 3    and name HD2 ))
   (( segid "    " and resid 3    and name HA  ))
      2.700     0.900     0.900 peak   827 spectrum    1 weight  0.10000E+01 volume  0.24607E-02 ppm1      4.680 ppm2      3.266 CV     1
 ASSI {  828}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB  ))
      2.000     2.000     4.000 peak   828 spectrum    1 weight  0.10000E+01 volume  0.14434E-01 ppm1      4.681 ppm2      4.440 CV     1
 ASSI {  829}
   (  segid "    " and resid 51   and name HG2%)
   (( segid "    " and resid 51   and name HB  ))
      2.200     0.600     0.600 peak   829 spectrum    1 weight  0.10000E+01 volume  0.96478E-02 ppm1      4.681 ppm2      1.326 CV     1
 ASSI {  830}
   (( segid "    " and resid 71   and name HB3 ))
   (( segid "    " and resid 71   and name HA  ))
      2.400     0.700     0.700 peak   830 spectrum    1 weight  0.10000E+01 volume  0.42851E-02 ppm1      4.690 ppm2      2.734 CV     1
 ASSI {  831}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      2.700     0.900     0.900 peak   831 spectrum    1 weight  0.10000E+01 volume  0.48365E-02 ppm1      4.690 ppm2      2.935 CV     1
 ASSI {  832}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 50   and name HA  ))
      2.500     0.800     0.800 peak   832 spectrum    1 weight  0.10000E+01 volume  0.41347E-02 ppm1      4.698 ppm2      0.969 CV     1
 ASSI {  833}
   (( segid "    " and resid 50   and name HB3 ))
   (( segid "    " and resid 50   and name HA  ))
      2.800     1.000     1.000 peak   833 spectrum    1 weight  0.10000E+01 volume  0.17165E-02 ppm1      4.708 ppm2      1.268 CV     1
 ASSI {  834}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 80   and name HA  ))
      2.500     0.800     0.800 peak   834 spectrum    1 weight  0.10000E+01 volume  0.42349E-02 ppm1      4.709 ppm2     -0.131 CV     1
 ASSI {  835}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 80   and name HA  ))
      3.400     1.400     1.400 peak   835 spectrum    1 weight  0.10000E+01 volume  0.14709E-02 ppm1      4.709 ppm2      0.214 CV     1
 ASSI {  836}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 80   and name HA  ))
      2.300     0.700     0.700 peak   836 spectrum    1 weight  0.10000E+01 volume  0.58640E-02 ppm1      4.709 ppm2      1.757 CV     1
 ASSI {  838}
   (( segid "    " and resid 80   and name HB  ))
   (( segid "    " and resid 80   and name HA  ))
      2.700     0.900     0.900 peak   838 spectrum    1 weight  0.10000E+01 volume  0.24934E-02 ppm1      4.710 ppm2      1.519 CV     1
 ASSI {  839}
   (  segid "    " and resid 80   and name HG2%)
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.900     0.900 peak   839 spectrum    1 weight  0.10000E+01 volume  0.39092E-02 ppm1      4.711 ppm2      0.369 CV     1
 ASSI {  840}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 80   and name HA  ))
      3.400     1.400     1.400 peak   840 spectrum    1 weight  0.10000E+01 volume  0.19445E-02 ppm1      4.711 ppm2      0.704 CV     1
 ASSI {  841}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 80   and name HA  ))
      3.200     1.300     1.300 peak   841 spectrum    1 weight  0.10000E+01 volume  0.10600E-02 ppm1      4.711 ppm2      0.854 CV     1
 ASSI {  842}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      2.800     1.000     1.000 peak   842 spectrum    1 weight  0.10000E+01 volume  0.36586E-02 ppm1      4.760 ppm2      2.527 CV     1
 ASSI {  843}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 84   and name HA  ))
      3.300     1.300     1.300 peak   843 spectrum    1 weight  0.10000E+01 volume  0.12830E-02 ppm1      4.762 ppm2      2.049 CV     1
 OR {  843}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 84   and name HA  ))
 ASSI {  844}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 84   and name HA  ))
      2.400     0.700     0.700 peak   844 spectrum    1 weight  0.10000E+01 volume  0.46359E-02 ppm1      4.767 ppm2      1.899 CV     1
 ASSI {  846}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.700     0.900     0.900 peak   846 spectrum    1 weight  0.10000E+01 volume  0.36586E-02 ppm1      4.792 ppm2      1.937 CV     1
 ASSI {  847}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.300     0.700     0.700 peak   847 spectrum    1 weight  0.10000E+01 volume  0.51118E-02 ppm1      4.792 ppm2      1.709 CV     1
 ASSI {  850}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HA  ))
      2.500     0.800     0.800 peak   850 spectrum    1 weight  0.10000E+01 volume  0.48616E-02 ppm1      4.804 ppm2      1.699 CV     1
 ASSI {  852}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      2.300     0.600     0.600 peak   852 spectrum    1 weight  0.10000E+01 volume  0.76180E-02 ppm1      4.805 ppm2      0.903 CV     1
 ASSI {  853}
   (  segid "    " and resid 10   and name HB% )
   (( segid "    " and resid 10   and name HA  ))
      2.200     0.600     0.600 peak   853 spectrum    1 weight  0.10000E+01 volume  0.82194E-02 ppm1      4.821 ppm2      1.245 CV     1
 ASSI {  854}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 10   and name HA  ))
      2.500     0.800     0.800 peak   854 spectrum    1 weight  0.10000E+01 volume  0.49616E-02 ppm1      4.822 ppm2      0.997 CV     1
 ASSI {  856}
   (( segid "    " and resid 62   and name HG12))
   (( segid "    " and resid 62   and name HA  ))
      2.400     0.700     0.700 peak   856 spectrum    1 weight  0.10000E+01 volume  0.58388E-02 ppm1      4.839 ppm2      0.825 CV     1
 OR {  856}
   (( segid "    " and resid 62   and name HG13))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  857}
   (  segid "    " and resid 80   and name HG1%)
   (( segid "    " and resid 62   and name HA  ))
      3.400     1.400     1.400 peak   857 spectrum    1 weight  0.10000E+01 volume  0.11477E-02 ppm1      4.839 ppm2     -0.129 CV     1
 ASSI {  858}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HA  ))
      2.400     0.700     0.700 peak   858 spectrum    1 weight  0.10000E+01 volume  0.51118E-02 ppm1      4.841 ppm2      1.560 CV     1
 ASSI {  859}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      2.300     0.700     0.700 peak   859 spectrum    1 weight  0.10000E+01 volume  0.73924E-02 ppm1      4.841 ppm2      0.690 CV     1
 ASSI {  860}
   (( segid "    " and resid 66   and name HB3 ))
   (( segid "    " and resid 66   and name HA  ))
      2.600     0.900     0.900 peak   860 spectrum    1 weight  0.10000E+01 volume  0.47862E-02 ppm1      4.884 ppm2      2.790 CV     1
 ASSI {  861}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      2.500     0.800     0.800 peak   861 spectrum    1 weight  0.10000E+01 volume  0.43853E-02 ppm1      4.886 ppm2      2.966 CV     1
 ASSI {  862}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
      3.800     1.800     1.800 peak   862 spectrum    1 weight  0.10000E+01 volume  0.41848E-03 ppm1      4.886 ppm2      0.758 CV     1
 ASSI {  863}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
      2.700     2.700     3.300 peak   863 spectrum    1 weight  0.10000E+01 volume  0.11452E-02 ppm1      4.887 ppm2      0.871 CV     1
 OR {  863}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  864}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 38   and name HA  ))
      2.200     0.600     0.600 peak   864 spectrum    1 weight  0.10000E+01 volume  0.11552E-01 ppm1      4.934 ppm2      0.850 CV     1
 OR {  864}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  865}
   (( segid "    " and resid 38   and name HB  ))
   (( segid "    " and resid 38   and name HA  ))
      2.700     0.900     0.900 peak   865 spectrum    1 weight  0.10000E+01 volume  0.24332E-02 ppm1      4.935 ppm2      1.987 CV     1
 ASSI {  866}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 38   and name HA  ))
      2.700     0.900     0.900 peak   866 spectrum    1 weight  0.10000E+01 volume  0.30321E-02 ppm1      4.935 ppm2      1.309 CV     1
 ASSI {  867}
   (( segid "    " and resid 83   and name HB  ))
   (( segid "    " and resid 83   and name HA  ))
      2.600     0.900     0.900 peak   867 spectrum    1 weight  0.10000E+01 volume  0.29319E-02 ppm1      4.965 ppm2      2.313 CV     1
 ASSI {  868}
   (  segid "    " and resid 87   and name HB% )
   (( segid "    " and resid 83   and name HA  ))
      3.800     1.800     1.800 peak   868 spectrum    1 weight  0.10000E+01 volume  0.17240E-03 ppm1      4.966 ppm2      1.472 CV     1
 ASSI {  869}
   (( segid "    " and resid 84   and name HD2 ))
   (( segid "    " and resid 83   and name HA  ))
      2.700     0.900     0.900 peak   869 spectrum    1 weight  0.10000E+01 volume  0.50867E-02 ppm1      4.967 ppm2      3.865 CV     1
 ASSI {  870}
   (( segid "    " and resid 84   and name HD3 ))
   (( segid "    " and resid 83   and name HA  ))
      2.500     0.800     0.800 peak   870 spectrum    1 weight  0.10000E+01 volume  0.30822E-02 ppm1      4.967 ppm2      3.609 CV     1
 ASSI {  871}
   (( segid "    " and resid 84   and name HG2 ))
   (( segid "    " and resid 83   and name HA  ))
      4.200     2.200     1.800 peak   871 spectrum    1 weight  0.10000E+01 volume  0.96976E-03 ppm1      4.967 ppm2      2.042 CV     1
 OR {  871}
   (( segid "    " and resid 84   and name HG3 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI {  872}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 83   and name HA  ))
      2.300     0.600     0.600 peak   872 spectrum    1 weight  0.10000E+01 volume  0.79184E-02 ppm1      4.969 ppm2      0.900 CV     1
 ASSI {  873}
   (( segid "    " and resid 6    and name HB  ))
   (( segid "    " and resid 61   and name HA  ))
      3.800     1.800     1.800 peak   873 spectrum    1 weight  0.10000E+01 volume  0.93720E-03 ppm1      4.978 ppm2      2.191 CV     1
 ASSI {  875}
   (( segid "    " and resid 6    and name HG12))
   (( segid "    " and resid 61   and name HA  ))
      2.800     0.900     0.900 peak   875 spectrum    1 weight  0.10000E+01 volume  0.23881E-02 ppm1      4.982 ppm2      1.573 CV     1
 OR {  875}
   (( segid "    " and resid 6    and name HG13))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  877}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
      2.400     0.700     0.700 peak   877 spectrum    1 weight  0.10000E+01 volume  0.49365E-02 ppm1      4.982 ppm2      0.713 CV     1
 ASSI {  878}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 61   and name HA  ))
      2.500     0.800     0.800 peak   878 spectrum    1 weight  0.10000E+01 volume  0.44104E-02 ppm1      4.983 ppm2      0.214 CV     1
 ASSI {  879}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HA  ))
      2.400     0.700     0.700 peak   879 spectrum    1 weight  0.10000E+01 volume  0.63147E-02 ppm1      4.985 ppm2      1.764 CV     1
 ASSI {  880}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 41   and name HA  ))
      3.800     1.800     1.800 peak   880 spectrum    1 weight  0.10000E+01 volume  0.53625E-03 ppm1      5.000 ppm2      0.906 CV     1
 ASSI {  881}
   (( segid "    " and resid 41   and name HB3 ))
   (( segid "    " and resid 41   and name HA  ))
      2.900     1.000     1.000 peak   881 spectrum    1 weight  0.10000E+01 volume  0.20899E-02 ppm1      5.001 ppm2      1.845 CV     1
 ASSI {  882}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
      3.800     1.800     1.800 peak   882 spectrum    1 weight  0.10000E+01 volume  0.28567E-03 ppm1      5.002 ppm2      2.179 CV     1
 ASSI {  883}
   (( segid "    " and resid 41   and name HG3 ))
   (( segid "    " and resid 41   and name HA  ))
      2.800     1.000     1.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.20072E-02 ppm1      5.004 ppm2      2.378 CV     1
 ASSI {  885}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 39   and name HA  ))
      3.000     1.100     1.100 peak   885 spectrum    1 weight  0.10000E+01 volume  0.21826E-02 ppm1      5.031 ppm2      2.383 CV     1
 ASSI {  887}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 39   and name HA  ))
      2.800     1.000     1.000 peak   887 spectrum    1 weight  0.10000E+01 volume  0.33579E-02 ppm1      5.040 ppm2      3.411 CV     1
 ASSI {  888}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HA  ))
      2.300     0.700     0.700 peak   888 spectrum    1 weight  0.10000E+01 volume  0.47111E-02 ppm1      5.040 ppm2      2.654 CV     1
 ASSI {  889}
   (( segid "    " and resid 48   and name HB3 ))
   (( segid "    " and resid 39   and name HA  ))
      2.500     0.800     0.800 peak   889 spectrum    1 weight  0.10000E+01 volume  0.30572E-02 ppm1      5.041 ppm2      2.862 CV     1
 ASSI {  891}
   (( segid "    " and resid 39   and name HG3 ))
   (( segid "    " and resid 39   and name HA  ))
      3.800     1.800     1.800 peak   891 spectrum    1 weight  0.10000E+01 volume  0.30070E-03 ppm1      5.047 ppm2      1.964 CV     1
 ASSI {  892}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      2.500     0.800     0.800 peak   892 spectrum    1 weight  0.10000E+01 volume  0.38590E-02 ppm1      5.185 ppm2      3.011 CV     1
 ASSI {  893}
   (( segid "    " and resid 11   and name HB3 ))
   (( segid "    " and resid 11   and name HA  ))
      2.600     0.900     0.900 peak   893 spectrum    1 weight  0.10000E+01 volume  0.48862E-02 ppm1      5.185 ppm2      2.822 CV     1
 ASSI {  894}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 11   and name HA  ))
      2.500     0.800     0.800 peak   894 spectrum    1 weight  0.10000E+01 volume  0.45858E-02 ppm1      5.185 ppm2      0.885 CV     1
 ASSI {  895}
   (( segid "    " and resid 40   and name HB  ))
   (( segid "    " and resid 40   and name HA  ))
      2.300     0.700     0.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.72673E-02 ppm1      5.188 ppm2      3.884 CV     1
 ASSI {  896}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      2.200     0.600     0.600 peak   896 spectrum    1 weight  0.10000E+01 volume  0.90710E-02 ppm1      5.188 ppm2      1.017 CV     1
 ASSI {  898}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 8    and name HA  ))
      2.900     1.000     1.000 peak   898 spectrum    1 weight  0.10000E+01 volume  0.19596E-02 ppm1      5.206 ppm2      1.628 CV     1
 ASSI {  899}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 8    and name HA  ))
      2.100     0.600     0.600 peak   899 spectrum    1 weight  0.10000E+01 volume  0.12479E-01 ppm1      5.206 ppm2      0.700 CV     1
 ASSI {  900}
   (( segid "    " and resid 39   and name HB3 ))
   (( segid "    " and resid 8    and name HA  ))
      2.400     0.700     0.700 peak   900 spectrum    1 weight  0.10000E+01 volume  0.44855E-02 ppm1      5.207 ppm2      2.111 CV     1
 ASSI {  901}
   (( segid "    " and resid 2    and name HA  ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   901 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      5.220 ppm2      4.324 CV     1
 ASSI {  902}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     0.900     0.900 peak   902 spectrum    1 weight  0.10000E+01 volume  0.41848E-02 ppm1      5.221 ppm2      2.845 CV     1
 ASSI {  904}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 34   and name HA  ))
      5.100     3.300     0.900 peak   904 spectrum    1 weight  0.10000E+01 volume  0.78436E-04 ppm1      5.221 ppm2      0.883 CV     1
 OR {  904}
   (  segid "    " and resid 35   and name HD2%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  905}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.900     0.900 peak   905 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      5.222 ppm2      2.133 CV     1
 ASSI {  906}
   (( segid "    " and resid 2    and name HB3 ))
   (( segid "    " and resid 34   and name HA  ))
      2.700     2.700     3.300 peak   906 spectrum    1 weight  0.10000E+01 volume  0.33328E-02 ppm1      5.223 ppm2      1.809 CV     1
 ASSI {  907}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 64   and name HA  ))
      3.300     1.400     1.400 peak   907 spectrum    1 weight  0.10000E+01 volume  0.12880E-02 ppm1      5.447 ppm2      3.336 CV     1
 ASSI {  908}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   908 spectrum    1 weight  0.10000E+01 volume  0.92218E-02 ppm1      5.452 ppm2      1.073 CV     1
 ASSI {  909}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
      2.200     0.600     0.600 peak   909 spectrum    1 weight  0.10000E+01 volume  0.10525E-01 ppm1      5.452 ppm2      0.800 CV     1
 ASSI {  910}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 6    and name HA  ))
      3.900     1.900     1.900 peak   910 spectrum    1 weight  0.10000E+01 volume  0.63649E-03 ppm1      5.460 ppm2      0.554 CV     1
 ASSI {  911}
   (( segid "    " and resid 6    and name HB  ))
   (( segid "    " and resid 6    and name HA  ))
      2.300     0.700     0.700 peak   911 spectrum    1 weight  0.10000E+01 volume  0.61895E-02 ppm1      5.461 ppm2      2.205 CV     1
 ASSI {  912}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 6    and name HA  ))
      2.300     0.700     0.700 peak   912 spectrum    1 weight  0.10000E+01 volume  0.63649E-02 ppm1      5.461 ppm2      0.954 CV     1
 ASSI {  915}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 6    and name HA  ))
      2.300     2.300     3.700 peak   915 spectrum    1 weight  0.10000E+01 volume  0.89711E-02 ppm1      5.465 ppm2      1.601 CV     1
 ASSI {  917}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.300     0.700     0.700 peak   917 spectrum    1 weight  0.10000E+01 volume  0.55630E-02 ppm1      5.490 ppm2      3.167 CV     1
 ASSI {  918}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 82   and name HA  ))
      2.800     1.000     1.000 peak   918 spectrum    1 weight  0.10000E+01 volume  0.26562E-02 ppm1      5.491 ppm2      3.004 CV     1
 ASSI {  919}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 82   and name HA  ))
      2.800     1.000     1.000 peak   919 spectrum    1 weight  0.10000E+01 volume  0.42600E-02 ppm1      5.491 ppm2      0.792 CV     1
 ASSI {  920}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.100     0.600     0.600 peak   920 spectrum    1 weight  0.10000E+01 volume  0.12654E-01 ppm1      5.492 ppm2      2.054 CV     1
 OR {  920}
   (( segid "    " and resid 82   and name HG3 ))
   (( segid "    " and resid 82   and name HA  ))
 ASSI {  921}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.100     0.500     0.500 peak   921 spectrum    1 weight  0.10000E+01 volume  0.14434E-01 ppm1      5.497 ppm2      2.259 CV     1
 ASSI {  922}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 63   and name HA  ))
      2.800     1.000     1.000 peak   922 spectrum    1 weight  0.10000E+01 volume  0.22853E-02 ppm1      5.512 ppm2      1.626 CV     1
 ASSI {  923}
   (  segid "    " and resid 63   and name HD% )
   (( segid "    " and resid 63   and name HA  ))
      2.400     0.700     0.700 peak   923 spectrum    1 weight  0.10000E+01 volume  0.60142E-02 ppm1      5.512 ppm2      6.938 CV     1
 ASSI {  924}
   (( segid "    " and resid 63   and name HB3 ))
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.800     0.800 peak   924 spectrum    1 weight  0.10000E+01 volume  0.35583E-02 ppm1      5.513 ppm2      3.000 CV     1
 ASSI {  926}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HA  ))
      2.900     1.000     1.000 peak   926 spectrum    1 weight  0.10000E+01 volume  0.23330E-02 ppm1      5.514 ppm2      3.166 CV     1
 ASSI {  928}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      2.400     0.700     0.700 peak   928 spectrum    1 weight  0.10000E+01 volume  0.66156E-02 ppm1      5.528 ppm2      1.036 CV     1
 ASSI {  931}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 36   and name HA  ))
      2.300     0.700     0.700 peak   931 spectrum    1 weight  0.10000E+01 volume  0.12479E-01 ppm1      5.683 ppm2      1.233 CV     1
 ASSI {  932}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 36   and name HA  ))
      1.900     0.500     0.500 peak   932 spectrum    1 weight  0.10000E+01 volume  0.15662E-01 ppm1      5.690 ppm2      0.792 CV     1
 ASSI {    8}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.200     1.200     1.200 peak     8 spectrum    1 weight  0.10000E+01 volume  0.13215E-02 ppm1      6.303 ppm2      4.013 CV     1
 OR {    8}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {    9}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 87   and name HB% )
      3.300     1.400     1.400 peak     9 spectrum    1 weight  0.10000E+01 volume  0.19992E-02 ppm1      6.303 ppm2      1.464 CV     1
 OR {    9}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
 OR {    9}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI {   11}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      4.000     2.000     2.000 peak    11 spectrum    1 weight  0.10000E+01 volume  0.68450E-03 ppm1      6.304 ppm2      3.857 CV     1
 OR {   11}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI {   13}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB  ))
      2.400     0.700     0.700 peak    13 spectrum    1 weight  0.10000E+01 volume  0.59047E-02 ppm1      6.304 ppm2      1.847 CV     1
 OR {   13}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {   18}
   (( segid "    " and resid 41   and name HE21))
   (  segid "    " and resid 8    and name HG2%)
      4.500     2.500     1.500 peak    18 spectrum    1 weight  0.10000E+01 volume  0.23466E-03 ppm1      6.685 ppm2      0.647 CV     1
 OR {   18}
   (( segid "    " and resid 41   and name HE21))
   (  segid "    " and resid 65   and name HG1%)
 ASSI {   20}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 70   and name HB2 ))
      4.900     3.000     1.100 peak    20 spectrum    1 weight  0.10000E+01 volume  0.21941E-03 ppm1      6.693 ppm2      1.693 CV     1
 OR {   20}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 70   and name HG2 ))
 OR {   20}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 46   and name HB  ))
 ASSI {   26}
   (( segid "    " and resid 41   and name HE21))
   (( segid "    " and resid 70   and name HB3 ))
      4.700     2.800     1.300 peak    26 spectrum    1 weight  0.10000E+01 volume  0.25244E-03 ppm1      6.697 ppm2      1.481 CV     1
 OR {   26}
   (( segid "    " and resid 41   and name HE21))
   (  segid "    " and resid 43   and name HB% )
 ASSI {   43}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 46   and name HB  ))
      3.800     1.800     1.800 peak    43 spectrum    1 weight  0.10000E+01 volume  0.16265E-03 ppm1      6.843 ppm2      1.688 CV     1
 OR {   43}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 70   and name HB2 ))
 OR {   43}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 70   and name HG2 ))
 ASSI {   44}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 70   and name HB3 ))
      4.300     2.400     1.700 peak    44 spectrum    1 weight  0.10000E+01 volume  0.10250E-03 ppm1      6.846 ppm2      1.456 CV     1
 OR {   44}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 74   and name HG3 ))
 ASSI {   46}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 69   and name HA  ))
      4.700     2.700     1.300 peak    46 spectrum    1 weight  0.10000E+01 volume  0.19061E-03 ppm1      6.848 ppm2      3.305 CV     1
 OR {   46}
   (( segid "    " and resid 71   and name HD21))
   (( segid "    " and resid 74   and name HD2 ))
 ASSI {   51}
   (( segid "    " and resid 48   and name HD22))
   (  segid "    " and resid 50   and name HD1%)
      4.900     3.000     1.100 peak    51 spectrum    1 weight  0.10000E+01 volume  0.13893E-03 ppm1      6.855 ppm2      1.150 CV     1
 OR {   51}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 37   and name HG3 ))
 OR {   51}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 37   and name HG2 ))
 ASSI {   52}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 38   and name HB  ))
      4.200     2.300     1.800 peak    52 spectrum    1 weight  0.10000E+01 volume  0.85559E-04 ppm1      6.855 ppm2      1.990 CV     1
 OR {   52}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 47   and name HB2 ))
 OR {   52}
   (( segid "    " and resid 48   and name HD22))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI {   60}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 97   and name HB2 ))
      3.100     1.200     1.200 peak    60 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      6.969 ppm2      2.774 CV     1
 OR {   60}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 56   and name HB3 ))
 ASSI {   61}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 55   and name HB  ))
      4.100     2.100     1.900 peak    61 spectrum    1 weight  0.10000E+01 volume  0.34479E-03 ppm1      6.971 ppm2      2.000 CV     1
 OR {   61}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 93   and name HB3 ))
 OR {   61}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 52   and name HB3 ))
 ASSI {   62}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 56   and name HA  ))
      4.000     2.000     2.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.43967E-03 ppm1      6.974 ppm2      4.400 CV     1
 OR {   62}
   (( segid "    " and resid 97   and name HD21))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {   66}
   (( segid "    " and resid 56   and name HD21))
   (  segid "    " and resid 55   and name HG2%)
      3.300     1.400     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.50659E-03 ppm1      6.982 ppm2      0.888 CV     1
 OR {   66}
   (( segid "    " and resid 56   and name HD21))
   (( segid "    " and resid 74   and name HB2 ))
 OR {   66}
   (( segid "    " and resid 56   and name HD21))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {   84}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      3.300     1.400     1.400 peak    84 spectrum    1 weight  0.10000E+01 volume  0.11860E-02 ppm1      7.137 ppm2      4.106 CV     1
 OR {   84}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI {   86}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      2.700     0.900     0.900 peak    86 spectrum    1 weight  0.10000E+01 volume  0.35241E-02 ppm1      7.137 ppm2      2.036 CV     1
 OR {   86}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB  ))
 ASSI {   89}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB3 ))
      3.300     1.300     1.300 peak    89 spectrum    1 weight  0.10000E+01 volume  0.15757E-02 ppm1      7.138 ppm2      1.460 CV     1
 OR {   89}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 101  and name HB% )
 ASSI {   95}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.900     3.000     1.100 peak    95 spectrum    1 weight  0.10000E+01 volume  0.13300E-03 ppm1      7.143 ppm2      7.936 CV     1
 OR {   95}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
 ASSI {  101}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HG2 ))
      3.600     1.600     1.600 peak   101 spectrum    1 weight  0.10000E+01 volume  0.94033E-03 ppm1      7.145 ppm2      1.437 CV     1
 OR {  101}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 98   and name HB% )
 OR {  101}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI {  104}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.300     1.300     1.300 peak   104 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      7.146 ppm2      3.825 CV     1
 OR {  104}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI {  108}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 6    and name HG2%)
      3.300     1.300     1.300 peak   108 spectrum    1 weight  0.10000E+01 volume  0.14486E-02 ppm1      7.194 ppm2      0.942 CV     1
 OR {  108}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
 ASSI {  116}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 7    and name HN  ))
      3.400     1.400     1.400 peak   116 spectrum    1 weight  0.10000E+01 volume  0.13300E-02 ppm1      7.202 ppm2      8.772 CV     1
 OR {  116}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 OR {  116}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {  136}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
      3.700     3.700     2.300 peak   136 spectrum    1 weight  0.10000E+01 volume  0.32784E-03 ppm1      7.210 ppm2      0.859 CV     1
 OR {  136}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
 ASSI {  137}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.100     3.100     2.900 peak   137 spectrum    1 weight  0.10000E+01 volume  0.57606E-03 ppm1      7.211 ppm2      2.019 CV     1
 OR {  137}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HB3 ))
 OR {  137}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  159}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 66   and name HB3 ))
      4.200     2.200     1.800 peak   159 spectrum    1 weight  0.10000E+01 volume  0.58199E-03 ppm1      7.241 ppm2      2.776 CV     1
 OR {  159}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 11   and name HB3 ))
 ASSI {  160}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HB3 ))
      4.400     2.400     1.600 peak   160 spectrum    1 weight  0.10000E+01 volume  0.50322E-03 ppm1      7.242 ppm2      3.832 CV     1
 OR {  160}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HD2 ))
 ASSI {  161}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.400     2.400     1.600 peak   161 spectrum    1 weight  0.10000E+01 volume  0.24313E-03 ppm1      7.245 ppm2      2.974 CV     1
 OR {  161}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 17   and name HB3 ))
 ASSI {  164}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.600     0.900     0.900 peak   164 spectrum    1 weight  0.10000E+01 volume  0.40324E-02 ppm1      7.329 ppm2      4.106 CV     1
 OR {  164}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI {  166}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 101  and name HB% )
      2.900     1.000     1.000 peak   166 spectrum    1 weight  0.10000E+01 volume  0.40917E-02 ppm1      7.329 ppm2      1.454 CV     1
 OR {  166}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB3 ))
 ASSI {  167}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      2.700     0.900     0.900 peak   167 spectrum    1 weight  0.10000E+01 volume  0.34733E-02 ppm1      7.329 ppm2      7.971 CV     1
 OR {  167}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI {  171}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.900     1.100     1.100 peak   171 spectrum    1 weight  0.10000E+01 volume  0.19738E-02 ppm1      7.333 ppm2      3.931 CV     1
 OR {  171}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  175}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      2.300     0.700     0.700 peak   175 spectrum    1 weight  0.10000E+01 volume  0.68450E-02 ppm1      7.422 ppm2      7.896 CV     1
 OR {  175}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI {  179}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB3 ))
      2.300     0.700     0.700 peak   179 spectrum    1 weight  0.10000E+01 volume  0.81493E-02 ppm1      7.423 ppm2      1.948 CV     1
 OR {  179}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB3 ))
 ASSI {  182}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.200     1.200     1.200 peak   182 spectrum    1 weight  0.10000E+01 volume  0.15248E-02 ppm1      7.424 ppm2      3.826 CV     1
 OR {  182}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HA2 ))
 ASSI {  185}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HB  ))
      6.000     6.000     0.000 peak   185 spectrum    1 weight  0.10000E+01 volume  0.13639E-04 ppm1      7.432 ppm2      1.994 CV     1
 OR {  185}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HB3 ))
 ASSI {  188}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      4.300     2.300     1.700 peak   188 spectrum    1 weight  0.10000E+01 volume  0.36427E-03 ppm1      7.437 ppm2      4.400 CV     1
 OR {  188}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HD3 ))
 ASSI {  195}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HG3 ))
      3.100     1.200     1.200 peak   195 spectrum    1 weight  0.10000E+01 volume  0.19653E-02 ppm1      7.439 ppm2      1.452 CV     1
 OR {  195}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HG2 ))
 OR {  195}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
 ASSI {  197}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      4.400     2.400     1.600 peak   197 spectrum    1 weight  0.10000E+01 volume  0.42526E-03 ppm1      7.439 ppm2      8.896 CV     1
 OR {  197}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  199}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.700     0.900     0.900 peak   199 spectrum    1 weight  0.10000E+01 volume  0.37189E-02 ppm1      7.440 ppm2      4.041 CV     1
 OR {  199}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  201}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.400     1.400     1.400 peak   201 spectrum    1 weight  0.10000E+01 volume  0.12538E-02 ppm1      7.440 ppm2      0.859 CV     1
 OR {  201}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  209}
   (( segid "    " and resid 56   and name HD22))
   (  segid "    " and resid 55   and name HG2%)
      3.500     1.500     1.500 peak   209 spectrum    1 weight  0.10000E+01 volume  0.25414E-03 ppm1      7.516 ppm2      0.888 CV     1
 OR {  209}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI {  212}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 52   and name HB2 ))
      4.500     2.500     1.500 peak   212 spectrum    1 weight  0.10000E+01 volume  0.25075E-03 ppm1      7.522 ppm2      2.035 CV     1
 OR {  212}
   (( segid "    " and resid 56   and name HD22))
   (( segid "    " and resid 55   and name HB  ))
 ASSI {  222}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA1 ))
      2.800     1.000     1.000 peak   222 spectrum    1 weight  0.10000E+01 volume  0.32276E-02 ppm1      7.562 ppm2      4.408 CV     1
 OR {  222}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI {  228}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      4.600     2.600     1.400 peak   228 spectrum    1 weight  0.10000E+01 volume  0.21094E-03 ppm1      7.594 ppm2      8.477 CV     1
 OR {  228}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  231}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      3.400     1.500     1.500 peak   231 spectrum    1 weight  0.10000E+01 volume  0.78360E-03 ppm1      7.598 ppm2      3.176 CV     1
 OR {  231}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HA2 ))
 ASSI {  232}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.900     1.900     1.900 peak   232 spectrum    1 weight  0.10000E+01 volume  0.43967E-03 ppm1      7.601 ppm2      4.390 CV     1
 OR {  232}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  242}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB3 ))
      4.800     2.900     1.200 peak   242 spectrum    1 weight  0.10000E+01 volume  0.15587E-03 ppm1      7.604 ppm2      2.781 CV     1
 OR {  242}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 11   and name HB3 ))
 ASSI {  254}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.600     1.600     1.600 peak   254 spectrum    1 weight  0.10000E+01 volume  0.45745E-03 ppm1      7.630 ppm2      4.203 CV     1
 OR {  254}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
 ASSI {  258}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HB3 ))
      3.200     3.200     2.800 peak   258 spectrum    1 weight  0.10000E+01 volume  0.61924E-03 ppm1      7.632 ppm2      2.747 CV     1
 OR {  258}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 78   and name HE3 ))
 ASSI {  259}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HG12))
      3.700     1.700     1.700 peak   259 spectrum    1 weight  0.10000E+01 volume  0.11182E-02 ppm1      7.633 ppm2      1.563 CV     1
 OR {  259}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 6    and name HG13))
 ASSI {  260}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 6    and name HG2%)
      2.900     1.100     1.100 peak   260 spectrum    1 weight  0.10000E+01 volume  0.29057E-02 ppm1      7.633 ppm2      0.914 CV     1
 OR {  260}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  278}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
      3.900     1.900     1.900 peak   278 spectrum    1 weight  0.10000E+01 volume  0.81412E-03 ppm1      7.641 ppm2      2.661 CV     1
 OR {  278}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 39   and name HB2 ))
 ASSI {  281}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      3.200     1.300     1.300 peak   281 spectrum    1 weight  0.10000E+01 volume  0.13046E-02 ppm1      7.642 ppm2      1.101 CV     1
 OR {  281}
   (( segid "    " and resid 48   and name HD21))
   (  segid "    " and resid 50   and name HD1%)
 ASSI {  282}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
      2.900     1.100     1.100 peak   282 spectrum    1 weight  0.10000E+01 volume  0.24821E-02 ppm1      7.643 ppm2      0.833 CV     1
 OR {  282}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 103  and name HD1%)
 OR {  282}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
 ASSI {  284}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      4.700     2.800     1.300 peak   284 spectrum    1 weight  0.10000E+01 volume  0.17027E-03 ppm1      7.648 ppm2      4.230 CV     1
 OR {  284}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  285}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 20   and name HB3 ))
      3.700     1.700     1.700 peak   285 spectrum    1 weight  0.10000E+01 volume  0.12199E-02 ppm1      7.653 ppm2      2.075 CV     1
 OR {  285}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
 ASSI {  286}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
      4.200     2.200     1.800 peak   286 spectrum    1 weight  0.10000E+01 volume  0.60488E-03 ppm1      7.653 ppm2      0.825 CV     1
 OR {  286}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 OR {  286}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  288}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      2.600     0.800     0.800 peak   288 spectrum    1 weight  0.10000E+01 volume  0.36766E-02 ppm1      7.654 ppm2      8.453 CV     1
 OR {  288}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  292}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      3.500     1.500     1.500 peak   292 spectrum    1 weight  0.10000E+01 volume  0.91492E-03 ppm1      7.655 ppm2      4.169 CV     1
 OR {  292}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 9    and name HB  ))
 ASSI {  293}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 39   and name HA  ))
      2.600     2.600     3.400 peak   293 spectrum    1 weight  0.10000E+01 volume  0.38206E-02 ppm1      7.655 ppm2      4.986 CV     1
 OR {  293}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI {  294}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.500     0.800     0.800 peak   294 spectrum    1 weight  0.10000E+01 volume  0.48118E-02 ppm1      7.656 ppm2      3.899 CV     1
 OR {  294}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  298}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 48   and name HB2 ))
      3.400     1.500     1.500 peak   298 spectrum    1 weight  0.10000E+01 volume  0.11098E-02 ppm1      7.662 ppm2      3.400 CV     1
 OR {  298}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  300}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
      5.700     4.000     0.300 peak   300 spectrum    1 weight  0.10000E+01 volume  0.10335E-03 ppm1      7.663 ppm2      1.104 CV     1
 OR {  300}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
 ASSI {  301}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.500     3.500     2.500 peak   301 spectrum    1 weight  0.10000E+01 volume  0.26177E-03 ppm1      7.664 ppm2      4.748 CV     1
 OR {  301}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  306}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.600     1.700     1.700 peak   306 spectrum    1 weight  0.10000E+01 volume  0.58028E-03 ppm1      7.664 ppm2      2.009 CV     1
 OR {  306}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
 OR {  306}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 55   and name HB  ))
 ASSI {  308}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      2.500     0.800     0.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.53540E-02 ppm1      7.665 ppm2      7.210 CV     1
 OR {  308}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HE  ))
 ASSI {  310}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      4.000     2.000     2.000 peak   310 spectrum    1 weight  0.10000E+01 volume  0.73701E-03 ppm1      7.665 ppm2      0.895 CV     1
 OR {  310}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI {  314}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HG3 ))
      3.700     1.700     1.700 peak   314 spectrum    1 weight  0.10000E+01 volume  0.69971E-03 ppm1      7.667 ppm2      1.757 CV     1
 OR {  314}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HG2 ))
 OR {  314}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
 ASSI {  329}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG3 ))
      3.400     1.500     1.500 peak   329 spectrum    1 weight  0.10000E+01 volume  0.18044E-02 ppm1      7.687 ppm2      2.064 CV     1
 OR {  329}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG2 ))
 OR {  329}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 39   and name HB3 ))
 ASSI {  333}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.900     1.900     1.900 peak   333 spectrum    1 weight  0.10000E+01 volume  0.47441E-03 ppm1      7.689 ppm2      4.664 CV     1
 OR {  333}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  334}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.700     0.900     0.900 peak   334 spectrum    1 weight  0.10000E+01 volume  0.39646E-02 ppm1      7.689 ppm2      4.225 CV     1
 OR {  334}
   (( segid "    " and resid 48   and name HD21))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  342}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.000     1.100     1.100 peak   342 spectrum    1 weight  0.10000E+01 volume  0.22025E-02 ppm1      7.693 ppm2      8.911 CV     1
 OR {  342}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
 ASSI {  346}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 79   and name HG1%)
      4.000     2.000     2.000 peak   346 spectrum    1 weight  0.10000E+01 volume  0.47777E-03 ppm1      7.694 ppm2      0.859 CV     1
 OR {  346}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 35   and name HD1%)
 OR {  346}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 35   and name HD2%)
 ASSI {  349}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HE2 ))
      3.500     1.500     1.500 peak   349 spectrum    1 weight  0.10000E+01 volume  0.11690E-02 ppm1      7.695 ppm2      3.242 CV     1
 OR {  349}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
 ASSI {  351}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      3.200     1.300     1.300 peak   351 spectrum    1 weight  0.10000E+01 volume  0.11436E-02 ppm1      7.696 ppm2      0.861 CV     1
 OR {  351}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
 OR {  351}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  353}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      3.400     1.400     1.400 peak   353 spectrum    1 weight  0.10000E+01 volume  0.94881E-03 ppm1      7.699 ppm2      4.100 CV     1
 OR {  353}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA1 ))
 ASSI {  356}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB3 ))
      3.000     1.100     1.100 peak   356 spectrum    1 weight  0.10000E+01 volume  0.31344E-02 ppm1      7.700 ppm2      1.800 CV     1
 OR {  356}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HB3 ))
 ASSI {  363}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      3.400     1.400     1.400 peak   363 spectrum    1 weight  0.10000E+01 volume  0.16096E-02 ppm1      7.701 ppm2      1.438 CV     1
 OR {  363}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HG3 ))
 OR {  363}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HG2 ))
 ASSI {  374}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 17   and name HD2 ))
      4.000     2.000     2.000 peak   374 spectrum    1 weight  0.10000E+01 volume  0.26516E-03 ppm1      7.703 ppm2      6.943 CV     1
 OR {  374}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 23   and name HE21))
 ASSI {  375}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 11   and name HB3 ))
      4.600     2.700     1.400 peak   375 spectrum    1 weight  0.10000E+01 volume  0.34648E-03 ppm1      7.703 ppm2      2.777 CV     1
 OR {  375}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI {  385}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      3.000     1.100     1.100 peak   385 spectrum    1 weight  0.10000E+01 volume  0.37105E-02 ppm1      7.705 ppm2      1.000 CV     1
 OR {  385}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  387}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.400     1.400     1.400 peak   387 spectrum    1 weight  0.10000E+01 volume  0.82848E-03 ppm1      7.705 ppm2      5.170 CV     1
 OR {  387}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
 ASSI {  389}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.200     2.200     1.800 peak   389 spectrum    1 weight  0.10000E+01 volume  0.48967E-03 ppm1      7.706 ppm2      8.846 CV     1
 OR {  389}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  394}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      3.800     1.800     1.800 peak   394 spectrum    1 weight  0.10000E+01 volume  0.46932E-03 ppm1      7.708 ppm2      3.022 CV     1
 OR {  394}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
 ASSI {  396}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA2 ))
      2.800     1.000     1.000 peak   396 spectrum    1 weight  0.10000E+01 volume  0.28888E-02 ppm1      7.717 ppm2      3.820 CV     1
 OR {  396}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  398}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      4.900     3.100     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.15672E-03 ppm1      7.718 ppm2      3.259 CV     1
 OR {  398}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HE2 ))
 ASSI {  400}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.400     1.400     1.400 peak   400 spectrum    1 weight  0.10000E+01 volume  0.99962E-03 ppm1      7.721 ppm2      3.984 CV     1
 OR {  400}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  403}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
      3.900     1.900     1.900 peak   403 spectrum    1 weight  0.10000E+01 volume  0.78275E-03 ppm1      7.721 ppm2      0.715 CV     1
 OR {  403}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
 OR {  403}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {  405}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG3 ))
      4.000     2.000     2.000 peak   405 spectrum    1 weight  0.10000E+01 volume  0.53114E-03 ppm1      7.724 ppm2      1.509 CV     1
 OR {  405}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG2 ))
 OR {  405}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HD2 ))
 OR {  405}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HD3 ))
 ASSI {  423}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 34   and name HB2 ))
      4.400     2.400     1.600 peak   423 spectrum    1 weight  0.10000E+01 volume  0.45745E-03 ppm1      7.796 ppm2      2.824 CV     1
 OR {  423}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 32   and name HG2 ))
 ASSI {  425}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 3    and name HB2 ))
      3.700     1.700     1.700 peak   425 spectrum    1 weight  0.10000E+01 volume  0.66583E-03 ppm1      7.796 ppm2      1.675 CV     1
 OR {  425}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 96   and name HB  ))
 OR {  425}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 3    and name HG2 ))
 ASSI {  426}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 31   and name HB3 ))
      2.700     2.700     3.300 peak   426 spectrum    1 weight  0.10000E+01 volume  0.12029E-02 ppm1      7.798 ppm2      1.983 CV     1
 OR {  426}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {  433}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 33   and name HA1 ))
      3.400     1.500     1.500 peak   433 spectrum    1 weight  0.10000E+01 volume  0.28125E-03 ppm1      7.807 ppm2      4.146 CV     1
 OR {  433}
   (( segid "    " and resid 34   and name HD22))
   (( segid "    " and resid 30   and name HA  ))
 ASSI {  434}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 69   and name HA  ))
      5.000     3.100     1.000 peak   434 spectrum    1 weight  0.10000E+01 volume  0.92336E-04 ppm1      7.840 ppm2      3.311 CV     1
 OR {  434}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 74   and name HD2 ))
 ASSI {  439}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 70   and name HB2 ))
      3.800     1.800     1.800 peak   439 spectrum    1 weight  0.10000E+01 volume  0.16773E-03 ppm1      7.847 ppm2      1.696 CV     1
 OR {  439}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 70   and name HG2 ))
 OR {  439}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 46   and name HB  ))
 ASSI {  440}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 70   and name HB3 ))
      4.500     2.500     1.500 peak   440 spectrum    1 weight  0.10000E+01 volume  0.76748E-04 ppm1      7.850 ppm2      1.492 CV     1
 OR {  440}
   (( segid "    " and resid 71   and name HD22))
   (( segid "    " and resid 74   and name HG3 ))
 ASSI {  442}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
      4.400     2.400     1.600 peak   442 spectrum    1 weight  0.10000E+01 volume  0.48455E-03 ppm1      7.854 ppm2      2.840 CV     1
 OR {  442}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI {  444}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA2 ))
      2.500     0.800     0.800 peak   444 spectrum    1 weight  0.10000E+01 volume  0.64805E-02 ppm1      7.855 ppm2      3.836 CV     1
 OR {  444}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB3 ))
 OR {  444}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI {  453}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      3.900     1.900     1.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.52606E-03 ppm1      7.860 ppm2      1.739 CV     1
 OR {  453}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  457}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 84   and name HG3 ))
      3.600     1.600     1.600 peak   457 spectrum    1 weight  0.10000E+01 volume  0.19823E-02 ppm1      7.867 ppm2      2.011 CV     1
 OR {  457}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
 OR {  457}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 84   and name HG2 ))
 ASSI {  458}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      2.600     0.800     0.800 peak   458 spectrum    1 weight  0.10000E+01 volume  0.39900E-02 ppm1      7.868 ppm2      4.269 CV     1
 OR {  458}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  469}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      3.600     1.700     1.700 peak   469 spectrum    1 weight  0.10000E+01 volume  0.77260E-03 ppm1      7.881 ppm2      8.476 CV     1
 OR {  469}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  495}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      5.300     3.600     0.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.92336E-04 ppm1      7.921 ppm2      0.720 CV     1
 OR {  495}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  501}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB3 ))
      2.200     0.600     0.600 peak   501 spectrum    1 weight  0.10000E+01 volume  0.11521E-01 ppm1      7.927 ppm2      1.969 CV     1
 OR {  501}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB3 ))
 ASSI {  502}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HG2 ))
      3.400     1.500     1.500 peak   502 spectrum    1 weight  0.10000E+01 volume  0.16858E-02 ppm1      7.928 ppm2      1.477 CV     1
 OR {  502}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HG3 ))
 OR {  502}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HG2 ))
 ASSI {  511}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 62   and name HG12))
      2.900     1.100     1.100 peak   511 spectrum    1 weight  0.10000E+01 volume  0.32276E-02 ppm1      7.933 ppm2      0.809 CV     1
 OR {  511}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
 OR {  511}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
 OR {  511}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 62   and name HG13))
 OR {  511}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  524}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.400     1.500     1.500 peak   524 spectrum    1 weight  0.10000E+01 volume  0.93184E-03 ppm1      7.951 ppm2      0.822 CV     1
 OR {  524}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
 OR {  524}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 62   and name HG12))
 OR {  524}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
 OR {  524}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  528}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.500     2.500     3.500 peak   528 spectrum    1 weight  0.10000E+01 volume  0.86407E-02 ppm1      7.960 ppm2      3.936 CV     1
 OR {  528}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  529}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.600     1.600     1.600 peak   529 spectrum    1 weight  0.10000E+01 volume  0.67858E-03 ppm1      7.968 ppm2      3.904 CV     1
 OR {  529}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  531}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.600     0.900     0.900 peak   531 spectrum    1 weight  0.10000E+01 volume  0.39477E-02 ppm1      7.969 ppm2      4.101 CV     1
 OR {  531}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  534}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
      3.900     1.900     1.900 peak   534 spectrum    1 weight  0.10000E+01 volume  0.73279E-03 ppm1      7.969 ppm2      0.815 CV     1
 OR {  534}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HG  ))
 OR {  534}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  539}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 97   and name HB3 ))
      3.900     1.900     1.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.27616E-03 ppm1      7.973 ppm2      2.585 CV     1
 OR {  539}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 104  and name HB3 ))
 ASSI {  544}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      3.200     1.300     1.300 peak   544 spectrum    1 weight  0.10000E+01 volume  0.12029E-02 ppm1      7.994 ppm2      3.852 CV     1
 OR {  544}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  554}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HG12))
      4.400     2.400     1.600 peak   554 spectrum    1 weight  0.10000E+01 volume  0.40324E-03 ppm1      7.996 ppm2      1.579 CV     1
 OR {  554}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 6    and name HG13))
 OR {  554}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
 ASSI {  560}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
      3.200     1.300     1.300 peak   560 spectrum    1 weight  0.10000E+01 volume  0.15079E-02 ppm1      7.998 ppm2      0.804 CV     1
 OR {  560}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
 OR {  560}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 OR {  560}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
 ASSI {  565}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HB  ))
      3.500     1.500     1.500 peak   565 spectrum    1 weight  0.10000E+01 volume  0.15333E-02 ppm1      7.998 ppm2      2.043 CV     1
 OR {  565}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  566}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HE3 ))
      5.100     3.300     0.900 peak   566 spectrum    1 weight  0.10000E+01 volume  0.18637E-03 ppm1      7.998 ppm2      2.940 CV     1
 OR {  566}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HE2 ))
 OR {  566}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HE3 ))
 ASSI {  568}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 103  and name HD1%)
      2.900     2.900     3.100 peak   568 spectrum    1 weight  0.10000E+01 volume  0.80222E-03 ppm1      7.998 ppm2      0.816 CV     1
 OR {  568}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HG  ))
 OR {  568}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  570}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 101  and name HB% )
      3.600     1.600     1.600 peak   570 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      7.999 ppm2      1.441 CV     1
 OR {  570}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 100  and name HB3 ))
 ASSI {  578}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 103  and name HD1%)
      3.300     1.400     1.400 peak   578 spectrum    1 weight  0.10000E+01 volume  0.35919E-03 ppm1      8.023 ppm2      0.819 CV     1
 OR {  578}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
 OR {  578}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  579}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 103  and name HG2%)
      3.800     1.800     1.800 peak   579 spectrum    1 weight  0.10000E+01 volume  0.15164E-03 ppm1      8.024 ppm2      0.994 CV     1
 OR {  579}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 60   and name HG1%)
 ASSI {  590}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
      4.500     2.600     1.500 peak   590 spectrum    1 weight  0.10000E+01 volume  0.34479E-03 ppm1      8.028 ppm2      0.577 CV     1
 OR {  590}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI {  591}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      2.500     0.800     0.800 peak   591 spectrum    1 weight  0.10000E+01 volume  0.55824E-02 ppm1      8.033 ppm2      3.857 CV     1
 OR {  591}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
 OR {  591}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  592}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HG  ))
      3.300     1.400     1.400 peak   592 spectrum    1 weight  0.10000E+01 volume  0.12368E-02 ppm1      8.034 ppm2      1.714 CV     1
 OR {  592}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HG  ))
 ASSI {  593}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.500     1.500     1.500 peak   593 spectrum    1 weight  0.10000E+01 volume  0.84715E-03 ppm1      8.035 ppm2      4.133 CV     1
 OR {  593}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  594}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      2.600     0.900     0.900 peak   594 spectrum    1 weight  0.10000E+01 volume  0.42865E-02 ppm1      8.035 ppm2      1.438 CV     1
 OR {  594}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI {  595}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 25   and name HD2%)
      3.100     1.200     1.200 peak   595 spectrum    1 weight  0.10000E+01 volume  0.29226E-02 ppm1      8.035 ppm2      0.686 CV     1
 OR {  595}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HD2%)
 ASSI {  599}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 82   and name HG3 ))
      3.800     1.800     1.800 peak   599 spectrum    1 weight  0.10000E+01 volume  0.72004E-03 ppm1      8.075 ppm2      2.052 CV     1
 OR {  599}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
 OR {  599}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 84   and name HG3 ))
 ASSI {  613}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 63   and name HB3 ))
      3.700     1.700     1.700 peak   613 spectrum    1 weight  0.10000E+01 volume  0.48796E-03 ppm1      8.082 ppm2      2.985 CV     1
 OR {  613}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  623}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.800     1.800     1.800 peak   623 spectrum    1 weight  0.10000E+01 volume  0.24059E-02 ppm1      8.114 ppm2      0.675 CV     1
 OR {  623}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 5    and name HD1%)
 ASSI {  625}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      3.900     1.900     1.900 peak   625 spectrum    1 weight  0.10000E+01 volume  0.87256E-03 ppm1      8.114 ppm2      7.640 CV     1
 OR {  625}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  627}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 7    and name HN  ))
      3.900     1.900     1.900 peak   627 spectrum    1 weight  0.10000E+01 volume  0.55744E-03 ppm1      8.115 ppm2      8.765 CV     1
 OR {  627}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {  630}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      3.100     1.200     1.200 peak   630 spectrum    1 weight  0.10000E+01 volume  0.15757E-02 ppm1      8.124 ppm2      3.886 CV     1
 OR {  630}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  632}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 89   and name HG12))
      3.300     1.400     1.400 peak   632 spectrum    1 weight  0.10000E+01 volume  0.14571E-02 ppm1      8.128 ppm2      1.697 CV     1
 OR {  632}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HG  ))
 ASSI {  635}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HB3 ))
      2.800     1.000     1.000 peak   635 spectrum    1 weight  0.10000E+01 volume  0.50829E-02 ppm1      8.131 ppm2      2.091 CV     1
 OR {  635}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HB2 ))
 ASSI {  637}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 41   and name HB3 ))
      4.400     2.400     1.600 peak   637 spectrum    1 weight  0.10000E+01 volume  0.38121E-03 ppm1      8.131 ppm2      1.825 CV     1
 OR {  637}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 26   and name HB3 ))
 OR {  637}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 27   and name HB3 ))
 ASSI {  640}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.300     1.400     1.400 peak   640 spectrum    1 weight  0.10000E+01 volume  0.14571E-02 ppm1      8.133 ppm2      7.678 CV     1
 OR {  640}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
 ASSI {  647}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
      4.300     2.300     1.700 peak   647 spectrum    1 weight  0.10000E+01 volume  0.37443E-03 ppm1      8.143 ppm2      0.860 CV     1
 OR {  647}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
 OR {  647}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
 OR {  647}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 38   and name HG1%)
 OR {  647}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
 ASSI {  649}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      5.800     4.200     0.200 peak   649 spectrum    1 weight  0.10000E+01 volume  0.10081E-03 ppm1      8.144 ppm2      0.681 CV     1
 OR {  649}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 25   and name HD2%)
 ASSI {  654}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 50   and name HB3 ))
      3.600     1.600     1.600 peak   654 spectrum    1 weight  0.10000E+01 volume  0.64549E-03 ppm1      8.149 ppm2      1.276 CV     1
 OR {  654}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HG13))
 ASSI {  662}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      3.900     1.900     1.900 peak   662 spectrum    1 weight  0.10000E+01 volume  0.80815E-03 ppm1      8.151 ppm2      1.090 CV     1
 OR {  662}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI {  664}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      4.300     2.300     1.700 peak   664 spectrum    1 weight  0.10000E+01 volume  0.44729E-03 ppm1      8.152 ppm2      4.405 CV     1
 OR {  664}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
 ASSI {  667}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      4.200     2.200     1.800 peak   667 spectrum    1 weight  0.10000E+01 volume  0.41256E-03 ppm1      8.161 ppm2      0.721 CV     1
 OR {  667}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
 OR {  667}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  671}
   (( segid "    " and resid 3    and name HE  ))
   (  segid "    " and resid 103  and name HD1%)
      4.000     2.000     2.000 peak   671 spectrum    1 weight  0.10000E+01 volume  0.43628E-03 ppm1      8.162 ppm2      0.806 CV     1
 OR {  671}
   (( segid "    " and resid 3    and name HE  ))
   (( segid "    " and resid 100  and name HG  ))
 ASSI {  672}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA2 ))
      3.000     1.200     1.200 peak   672 spectrum    1 weight  0.10000E+01 volume  0.26685E-02 ppm1      8.163 ppm2      3.829 CV     1
 OR {  672}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  685}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 67   and name HG2%)
      3.800     1.800     1.800 peak   685 spectrum    1 weight  0.10000E+01 volume  0.29311E-03 ppm1      8.175 ppm2      0.880 CV     1
 OR {  685}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
 OR {  685}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  687}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB  ))
      3.000     1.200     1.200 peak   687 spectrum    1 weight  0.10000E+01 volume  0.20924E-02 ppm1      8.176 ppm2      4.254 CV     1
 OR {  687}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI {  690}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 11   and name HB3 ))
      5.000     3.200     1.000 peak   690 spectrum    1 weight  0.10000E+01 volume  0.89796E-04 ppm1      8.176 ppm2      2.800 CV     1
 OR {  690}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 66   and name HB3 ))
 ASSI {  716}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.700     0.900     0.900 peak   716 spectrum    1 weight  0.10000E+01 volume  0.32784E-02 ppm1      8.224 ppm2      3.902 CV     1
 OR {  716}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  720}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HB% )
      2.500     0.800     0.800 peak   720 spectrum    1 weight  0.10000E+01 volume  0.65313E-02 ppm1      8.225 ppm2      1.400 CV     1
 OR {  720}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB3 ))
 ASSI {  722}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      2.400     0.700     0.700 peak   722 spectrum    1 weight  0.10000E+01 volume  0.52948E-02 ppm1      8.225 ppm2      7.948 CV     1
 OR {  722}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
 ASSI {  728}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 13   and name HB  ))
      2.400     2.400     3.600 peak   728 spectrum    1 weight  0.10000E+01 volume  0.29057E-02 ppm1      8.247 ppm2      4.304 CV     1
 OR {  728}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  730}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA2 ))
      3.200     1.300     1.300 peak   730 spectrum    1 weight  0.10000E+01 volume  0.20331E-02 ppm1      8.252 ppm2      4.084 CV     1
 OR {  730}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  732}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 30   and name HB3 ))
      3.600     1.700     1.700 peak   732 spectrum    1 weight  0.10000E+01 volume  0.12622E-02 ppm1      8.275 ppm2      1.960 CV     1
 OR {  732}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 31   and name HB3 ))
 ASSI {  734}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      2.500     0.800     0.800 peak   734 spectrum    1 weight  0.10000E+01 volume  0.54469E-02 ppm1      8.277 ppm2      3.828 CV     1
 OR {  734}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
 ASSI {  737}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      2.700     0.900     0.900 peak   737 spectrum    1 weight  0.10000E+01 volume  0.35834E-02 ppm1      8.277 ppm2      0.731 CV     1
 OR {  737}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  739}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 36   and name HD1%)
      3.900     1.900     1.900 peak   739 spectrum    1 weight  0.10000E+01 volume  0.63450E-03 ppm1      8.277 ppm2      0.541 CV     1
 OR {  739}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 96   and name HG13))
 ASSI {  740}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.500     1.500     1.500 peak   740 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      8.277 ppm2      1.694 CV     1
 OR {  740}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 25   and name HG  ))
 OR {  740}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 30   and name HD2 ))
 OR {  740}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 30   and name HD3 ))
 ASSI {  757}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 6    and name HG12))
      3.900     1.900     1.900 peak   757 spectrum    1 weight  0.10000E+01 volume  0.95725E-03 ppm1      8.290 ppm2      1.532 CV     1
 OR {  757}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 80   and name HB  ))
 OR {  757}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 6    and name HG13))
 ASSI {  759}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HE3 ))
      3.200     1.300     1.300 peak   759 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      8.321 ppm2      2.996 CV     1
 OR {  759}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 72   and name HE3 ))
 OR {  759}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 72   and name HE2 ))
 ASSI {  760}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      3.600     1.600     1.600 peak   760 spectrum    1 weight  0.10000E+01 volume  0.85559E-03 ppm1      8.322 ppm2      0.725 CV     1
 OR {  760}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 8    and name HG1%)
 ASSI {  763}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      2.400     0.700     0.700 peak   763 spectrum    1 weight  0.10000E+01 volume  0.77853E-02 ppm1      8.323 ppm2      1.373 CV     1
 OR {  763}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  769}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      3.900     1.900     1.900 peak   769 spectrum    1 weight  0.10000E+01 volume  0.47101E-03 ppm1      8.345 ppm2      3.868 CV     1
 OR {  769}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  772}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
      4.000     2.000     2.000 peak   772 spectrum    1 weight  0.10000E+01 volume  0.61080E-03 ppm1      8.348 ppm2      0.733 CV     1
 OR {  772}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
 OR {  772}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 25   and name HD2%)
 ASSI {  773}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HB3 ))
      2.400     0.700     0.700 peak   773 spectrum    1 weight  0.10000E+01 volume  0.80137E-02 ppm1      8.350 ppm2      1.854 CV     1
 OR {  773}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HB3 ))
 ASSI {  774}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HE2 ))
      4.500     2.600     1.500 peak   774 spectrum    1 weight  0.10000E+01 volume  0.27786E-03 ppm1      8.350 ppm2      2.970 CV     1
 OR {  774}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HE3 ))
 OR {  774}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 30   and name HE2 ))
 ASSI {  781}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      3.100     1.200     1.200 peak   781 spectrum    1 weight  0.10000E+01 volume  0.16265E-02 ppm1      8.374 ppm2      3.855 CV     1
 OR {  781}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI {  791}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 34   and name HB3 ))
      2.900     2.900     3.100 peak   791 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      8.383 ppm2      2.118 CV     1
 OR {  791}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 25   and name HB2 ))
 ASSI {  792}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      4.800     2.900     1.200 peak   792 spectrum    1 weight  0.10000E+01 volume  0.31768E-03 ppm1      8.384 ppm2      3.831 CV     1
 OR {  792}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  795}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB  ))
      2.800     1.000     1.000 peak   795 spectrum    1 weight  0.10000E+01 volume  0.33801E-02 ppm1      8.389 ppm2      1.186 CV     1
 OR {  795}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
 ASSI {  797}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.800     1.800     1.800 peak   797 spectrum    1 weight  0.10000E+01 volume  0.75990E-03 ppm1      8.389 ppm2      8.761 CV     1
 OR {  797}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {  809}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      5.000     3.100     1.000 peak   809 spectrum    1 weight  0.10000E+01 volume  0.17366E-03 ppm1      8.395 ppm2      1.374 CV     1
 OR {  809}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HD2 ))
 OR {  809}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HD3 ))
 ASSI {  814}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.200     1.300     1.300 peak   814 spectrum    1 weight  0.10000E+01 volume  0.14062E-02 ppm1      8.397 ppm2      4.156 CV     1
 OR {  814}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  815}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 74   and name HE  ))
      3.600     1.600     1.600 peak   815 spectrum    1 weight  0.10000E+01 volume  0.89796E-03 ppm1      8.398 ppm2      7.191 CV     1
 OR {  815}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI {  817}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      3.900     1.900     1.900 peak   817 spectrum    1 weight  0.10000E+01 volume  0.57777E-03 ppm1      8.406 ppm2      7.998 CV     1
 OR {  817}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  823}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      3.100     1.200     1.200 peak   823 spectrum    1 weight  0.10000E+01 volume  0.16519E-02 ppm1      8.409 ppm2      1.425 CV     1
 OR {  823}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HG2 ))
 OR {  823}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HG3 ))
 ASSI {  824}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 96   and name HD1%)
      3.900     1.900     1.900 peak   824 spectrum    1 weight  0.10000E+01 volume  0.71246E-03 ppm1      8.409 ppm2      0.727 CV     1
 OR {  824}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  828}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      3.200     1.200     1.200 peak   828 spectrum    1 weight  0.10000E+01 volume  0.14571E-02 ppm1      8.424 ppm2      4.155 CV     1
 OR {  828}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  829}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      2.600     0.900     0.900 peak   829 spectrum    1 weight  0.10000E+01 volume  0.38545E-02 ppm1      8.424 ppm2      3.934 CV     1
 OR {  829}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  837}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.800     1.800     1.800 peak   837 spectrum    1 weight  0.10000E+01 volume  0.55573E-03 ppm1      8.428 ppm2      4.096 CV     1
 OR {  837}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 14   and name HA2 ))
 ASSI {  843}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      2.200     0.600     0.600 peak   843 spectrum    1 weight  0.10000E+01 volume  0.86407E-02 ppm1      8.461 ppm2      2.153 CV     1
 OR {  843}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {  845}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.000     1.200     1.200 peak   845 spectrum    1 weight  0.10000E+01 volume  0.18553E-02 ppm1      8.463 ppm2      4.363 CV     1
 OR {  845}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  852}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      2.800     1.000     1.000 peak   852 spectrum    1 weight  0.10000E+01 volume  0.29311E-02 ppm1      8.467 ppm2      4.770 CV     1
 OR {  852}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  858}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      2.900     1.000     1.000 peak   858 spectrum    1 weight  0.10000E+01 volume  0.33292E-02 ppm1      8.468 ppm2      0.989 CV     1
 OR {  858}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  860}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB  ))
      3.400     1.400     1.400 peak   860 spectrum    1 weight  0.10000E+01 volume  0.17197E-02 ppm1      8.470 ppm2      3.858 CV     1
 OR {  860}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  861}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      4.200     2.200     1.800 peak   861 spectrum    1 weight  0.10000E+01 volume  0.41849E-03 ppm1      8.471 ppm2      0.860 CV     1
 OR {  861}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
 OR {  861}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 89   and name HG2%)
 ASSI {  865}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      2.500     0.800     0.800 peak   865 spectrum    1 weight  0.10000E+01 volume  0.52948E-02 ppm1      8.477 ppm2      1.687 CV     1
 OR {  865}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 89   and name HG12))
 ASSI {  867}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      3.000     1.100     1.100 peak   867 spectrum    1 weight  0.10000E+01 volume  0.30158E-02 ppm1      8.485 ppm2      0.874 CV     1
 OR {  867}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
 OR {  867}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  888}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      3.700     1.700     1.700 peak   888 spectrum    1 weight  0.10000E+01 volume  0.92336E-03 ppm1      8.502 ppm2      7.666 CV     1
 OR {  888}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 48   and name HD21))
 ASSI {  894}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      2.600     0.900     0.900 peak   894 spectrum    1 weight  0.10000E+01 volume  0.39900E-02 ppm1      8.520 ppm2      3.853 CV     1
 OR {  894}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
 ASSI {  910}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB  ))
      2.500     0.800     0.800 peak   910 spectrum    1 weight  0.10000E+01 volume  0.46169E-02 ppm1      8.573 ppm2      1.542 CV     1
 OR {  910}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 6    and name HG12))
 ASSI {  911}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      3.400     1.400     1.400 peak   911 spectrum    1 weight  0.10000E+01 volume  0.21771E-02 ppm1      8.573 ppm2      0.670 CV     1
 OR {  911}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {  920}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      3.900     1.900     1.900 peak   920 spectrum    1 weight  0.10000E+01 volume  0.75312E-03 ppm1      8.725 ppm2      7.183 CV     1
 OR {  920}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HD22))
 ASSI {  932}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      4.700     2.800     1.300 peak   932 spectrum    1 weight  0.10000E+01 volume  0.18976E-03 ppm1      8.728 ppm2      1.488 CV     1
 OR {  932}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HD3 ))
 ASSI {  944}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.000     2.000     2.000 peak   944 spectrum    1 weight  0.10000E+01 volume  0.14401E-03 ppm1      8.754 ppm2      8.359 CV     1
 OR {  944}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  952}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HE2 ))
      3.900     1.900     1.900 peak   952 spectrum    1 weight  0.10000E+01 volume  0.60232E-03 ppm1      8.760 ppm2      2.811 CV     1
 OR {  952}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 48   and name HB3 ))
 ASSI {  965}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 29   and name HB% )
      3.700     1.700     1.700 peak   965 spectrum    1 weight  0.10000E+01 volume  0.55066E-03 ppm1      8.763 ppm2      1.209 CV     1
 OR {  965}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 36   and name HB  ))
 ASSI {  981}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 5    and name HD1%)
      2.900     2.900     3.100 peak   981 spectrum    1 weight  0.10000E+01 volume  0.33377E-02 ppm1      8.769 ppm2      0.713 CV     1
 OR {  981}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  987}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      2.600     0.900     0.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.43458E-02 ppm1      8.789 ppm2      1.734 CV     1
 OR {  987}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
 ASSI {  996}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 50   and name HD1%)
      2.800     1.000     1.000 peak   996 spectrum    1 weight  0.10000E+01 volume  0.32276E-02 ppm1      8.791 ppm2      1.113 CV     1
 OR {  996}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 6    and name HD1%)
 ASSI { 1000}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 36   and name HG13))
      3.100     1.200     1.200 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.20416E-02 ppm1      8.792 ppm2      0.810 CV     1
 OR { 1000}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 5    and name HG2%)
 OR { 1000}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 38   and name HG2%)
 ASSI { 1002}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HG  ))
      3.000     1.200     1.200 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.30836E-02 ppm1      8.792 ppm2      0.831 CV     1
 OR { 1002}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 62   and name HG12))
 OR { 1002}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 62   and name HG13))
 ASSI { 1011}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HG12))
      4.000     2.000     2.000 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.58621E-03 ppm1      8.796 ppm2      1.558 CV     1
 OR { 1011}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HG13))
 OR { 1011}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 62   and name HB  ))
 ASSI { 1019}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
      2.700     0.900     0.900 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.31937E-02 ppm1      8.841 ppm2      0.655 CV     1
 OR { 1019}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
 ASSI { 1028}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 38   and name HB  ))
      5.500     3.800     0.500 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.10081E-03 ppm1      8.848 ppm2      1.944 CV     1
 OR { 1028}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 39   and name HG3 ))
 ASSI { 1034}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      4.000     2.000     2.000 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.60654E-03 ppm1      8.854 ppm2      3.875 CV     1
 OR { 1034}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 40   and name HB  ))
 ASSI { 1038}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 8    and name HG2%)
      3.300     1.300     1.300 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.29819E-02 ppm1      8.855 ppm2      0.640 CV     1
 OR { 1038}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 65   and name HG1%)
 ASSI { 1039}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      3.700     1.800     1.800 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.52099E-03 ppm1      8.855 ppm2      8.465 CV     1
 OR { 1039}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI { 1051}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.600     1.600     1.600 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.91492E-03 ppm1      8.858 ppm2      1.786 CV     1
 OR { 1051}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 88   and name HB3 ))
 ASSI { 1061}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HG3 ))
      2.500     0.800     0.800 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.76156E-02 ppm1      8.874 ppm2      1.660 CV     1
 OR { 1061}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HD3 ))
 OR { 1061}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
 OR { 1061}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HG2 ))
 ASSI { 1062}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      6.000     6.000     0.000 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.23042E-04 ppm1      8.874 ppm2      7.607 CV     1
 OR { 1062}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI { 1068}
   (( segid "    " and resid 4    and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
      3.800     1.800     1.800 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.10081E-02 ppm1      8.877 ppm2      0.871 CV     1
 OR { 1068}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 5    and name HG12))
 ASSI { 1076}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      3.500     1.500     1.500 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.63535E-03 ppm1      8.894 ppm2      3.243 CV     1
 OR { 1076}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HE2 ))
 ASSI { 1091}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      2.300     0.600     0.600 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.79886E-02 ppm1      8.910 ppm2      2.004 CV     1
 OR { 1091}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HB2 ))
 OR { 1091}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB3 ))
 ASSI { 1097}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB  ))
      2.100     0.500     0.500 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.15587E-01 ppm1      8.922 ppm2      4.671 CV     1
 OR { 1097}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI { 1101}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.800     1.800     1.800 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.49559E-03 ppm1      8.930 ppm2      0.889 CV     1
 OR { 1101}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 1102}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      3.900     1.900     1.900 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.73360E-03 ppm1      8.931 ppm2      1.748 CV     1
 OR { 1102}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
 OR { 1102}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB3 ))
 ASSI { 1109}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 9    and name HG2%)
      3.100     1.200     1.200 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.16773E-02 ppm1      8.941 ppm2      1.033 CV     1
 OR { 1109}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 64   and name HB% )
 ASSI { 1116}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 8    and name HG1%)
      3.200     1.300     1.300 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.28040E-02 ppm1      8.943 ppm2      0.705 CV     1
 OR { 1116}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
 ASSI { 1122}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      3.200     3.200     2.800 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.80308E-03 ppm1      9.000 ppm2      7.880 CV     1
 OR { 1122}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 71   and name HD22))
 ASSI { 1128}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      3.000     1.100     1.100 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.20924E-02 ppm1      9.004 ppm2      8.494 CV     1
 OR { 1128}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI { 1136}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 7    and name HN  ))
      3.700     1.700     1.700 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.91492E-03 ppm1      9.213 ppm2      8.790 CV     1
 OR { 1136}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 1142}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      3.400     1.400     1.400 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.53540E-03 ppm1      9.215 ppm2      1.288 CV     1
 OR { 1142}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 50   and name HB3 ))
 ASSI { 1145}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 7    and name HB% )
      3.900     1.900     1.900 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.60147E-03 ppm1      9.318 ppm2      1.301 CV     1
 OR { 1145}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 81   and name HD1%)
 ASSI { 1147}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.700     0.900     0.900 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.31937E-02 ppm1      9.325 ppm2      5.468 CV     1
 OR { 1147}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
 ASSI { 1150}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.800     2.800     1.200 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.23805E-03 ppm1      9.326 ppm2      2.257 CV     1
 OR { 1150}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 83   and name HB  ))
 ASSI { 1151}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 83   and name HG2%)
      2.700     0.900     0.900 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.53455E-02 ppm1      9.326 ppm2      0.757 CV     1
 OR { 1151}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG12))
 OR { 1151}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HG13))
 ASSI { 1153}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.300     1.300     1.300 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.12707E-02 ppm1      9.327 ppm2      8.806 CV     1
 OR { 1153}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 1160}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.400     3.400     2.600 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.17959E-02 ppm1      9.331 ppm2      2.020 CV     1
 OR { 1160}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 88   and name HG2 ))
 ASSI { 1161}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 81   and name HB2 ))
      2.800     2.800     3.200 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.58791E-02 ppm1      9.338 ppm2      1.729 CV     1
 OR { 1161}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
 ASSI { 1172}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB3 ))
      2.900     1.000     1.000 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.44644E-02 ppm1      9.349 ppm2      1.947 CV     1
 OR { 1172}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 1175}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 5    and name HG12))
      2.900     1.100     1.100 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.23296E-02 ppm1      9.351 ppm2      0.920 CV     1
 OR { 1175}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 6    and name HG2%)
 ASSI { 1179}
   (( segid "    " and resid 41   and name HE22))
   (  segid "    " and resid 8    and name HG2%)
      4.900     3.000     1.100 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.11606E-03 ppm1      9.375 ppm2      0.639 CV     1
 OR { 1179}
   (( segid "    " and resid 41   and name HE22))
   (  segid "    " and resid 65   and name HG1%)
 ASSI { 1193}
   (( segid "    " and resid 41   and name HE22))
   (( segid "    " and resid 70   and name HB2 ))
      4.100     2.100     1.900 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.47948E-03 ppm1      9.383 ppm2      1.692 CV     1
 OR { 1193}
   (( segid "    " and resid 41   and name HE22))
   (( segid "    " and resid 70   and name HG2 ))
 OR { 1193}
   (( segid "    " and resid 41   and name HE22))
   (( segid "    " and resid 46   and name HB  ))
 ASSI { 1197}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 37   and name HE2 ))
      4.000     2.000     2.000 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.25922E-03 ppm1      9.387 ppm2      2.754 CV     1
 OR { 1197}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 37   and name HE3 ))
 OR { 1197}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 71   and name HB3 ))
 ASSI { 1200}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.500     1.500     1.500 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.10759E-02 ppm1      9.395 ppm2      2.265 CV     1
 OR { 1200}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB  ))
 ASSI { 1213}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG3 ))
      3.600     1.600     1.600 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.12114E-02 ppm1      9.558 ppm2      2.069 CV     1
 OR { 1213}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG2 ))
 OR { 1213}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 39   and name HB3 ))
 ASSI { 1219}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 50   and name HD2%)
      3.500     1.500     1.500 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.14147E-02 ppm1      9.561 ppm2      0.920 CV     1
 OR { 1219}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
 ASSI { 1222}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 55   and name HG1%)
      3.400     1.400     1.400 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.16604E-02 ppm1      9.567 ppm2      0.732 CV     1
 OR { 1222}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 8    and name HG1%)
 ASSI {    6}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 80   and name HG1%)
      4.700     2.800     1.300 peak     6 spectrum    1 weight  0.10000E+01 volume  0.12304E-03 ppm1     -0.126 ppm2      5.468 CV     1
 OR {    6}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 80   and name HG1%)
 ASSI {    8}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 69   and name HG1%)
      3.200     1.300     1.300 peak     8 spectrum    1 weight  0.10000E+01 volume  0.87957E-03 ppm1      0.022 ppm2      3.007 CV     1
 OR {    8}
   (( segid "    " and resid 72   and name HE3 ))
   (  segid "    " and resid 69   and name HG1%)
 ASSI {   11}
   (( segid "    " and resid 8    and name HB  ))
   (  segid "    " and resid 69   and name HG1%)
      3.700     1.700     1.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.71417E-03 ppm1      0.023 ppm2      1.635 CV     1
 OR {   11}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 69   and name HG1%)
 ASSI {   13}
   (  segid "    " and resid 65   and name HG1%)
   (  segid "    " and resid 69   and name HG1%)
      2.200     2.200     3.800 peak    13 spectrum    1 weight  0.10000E+01 volume  0.10675E-01 ppm1      0.024 ppm2      0.683 CV     1
 OR {   13}
   (  segid "    " and resid 8    and name HG1%)
   (  segid "    " and resid 69   and name HG1%)
 ASSI {   26}
   (( segid "    " and resid 75   and name HB3 ))
   (  segid "    " and resid 80   and name HG2%)
      3.800     1.800     1.800 peak    26 spectrum    1 weight  0.10000E+01 volume  0.39843E-03 ppm1      0.367 ppm2      3.000 CV     1
 OR {   26}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 80   and name HG2%)
 ASSI {   42}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
      3.300     1.400     1.400 peak    42 spectrum    1 weight  0.10000E+01 volume  0.11276E-02 ppm1      0.554 ppm2      3.865 CV     1
 OR {   42}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
 ASSI {   49}
   (  segid "    " and resid 9    and name HG2%)
   (  segid "    " and resid 25   and name HD1%)
      2.500     2.500     3.500 peak    49 spectrum    1 weight  0.10000E+01 volume  0.52123E-02 ppm1      0.612 ppm2      1.044 CV     1
 OR {   49}
   (  segid "    " and resid 64   and name HB% )
   (  segid "    " and resid 25   and name HD1%)
 ASSI {   52}
   (( segid "    " and resid 62   and name HB  ))
   (  segid "    " and resid 25   and name HD1%)
      2.800     0.900     0.900 peak    52 spectrum    1 weight  0.10000E+01 volume  0.31073E-02 ppm1      0.613 ppm2      1.561 CV     1
 OR {   52}
   (  segid "    " and resid 21   and name HB% )
   (  segid "    " and resid 25   and name HD1%)
 ASSI {   60}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 60   and name HG2%)
      3.600     1.600     1.600 peak    60 spectrum    1 weight  0.10000E+01 volume  0.74677E-03 ppm1      0.657 ppm2      3.924 CV     1
 OR {   60}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 60   and name HG2%)
 ASSI {   63}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 65   and name HG1%)
      2.800     1.000     1.000 peak    63 spectrum    1 weight  0.10000E+01 volume  0.25309E-02 ppm1      0.679 ppm2      3.003 CV     1
 OR {   63}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 65   and name HG1%)
 ASSI {   66}
   (  segid "    " and resid 69   and name HG1%)
   (  segid "    " and resid 8    and name HG2%)
      2.400     2.400     3.600 peak    66 spectrum    1 weight  0.10000E+01 volume  0.66658E-02 ppm1      0.679 ppm2      0.022 CV     1
 OR {   66}
   (  segid "    " and resid 69   and name HG1%)
   (  segid "    " and resid 65   and name HG1%)
 ASSI {   73}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HD2%)
      2.600     0.900     0.900 peak    73 spectrum    1 weight  0.10000E+01 volume  0.42851E-02 ppm1      0.713 ppm2      3.862 CV     1
 OR {   73}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 55   and name HG1%)
 ASSI {   76}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
      3.600     1.700     1.700 peak    76 spectrum    1 weight  0.10000E+01 volume  0.14760E-02 ppm1      0.714 ppm2      3.260 CV     1
 OR {   76}
   (( segid "    " and resid 78   and name HE2 ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {   85}
   (( segid "    " and resid 5    and name HB  ))
   (  segid "    " and resid 5    and name HD1%)
      2.700     0.900     0.900 peak    85 spectrum    1 weight  0.10000E+01 volume  0.27063E-02 ppm1      0.721 ppm2      1.612 CV     1
 OR {   85}
   (( segid "    " and resid 3    and name HG3 ))
   (  segid "    " and resid 5    and name HD1%)
 ASSI {   94}
   (( segid "    " and resid 96   and name HG12))
   (  segid "    " and resid 96   and name HD1%)
      2.200     0.600     0.600 peak    94 spectrum    1 weight  0.10000E+01 volume  0.10349E-01 ppm1      0.755 ppm2      1.734 CV     1
 OR {   94}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {   95}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 96   and name HD1%)
      2.500     0.800     0.800 peak    95 spectrum    1 weight  0.10000E+01 volume  0.54379E-02 ppm1      0.755 ppm2      3.859 CV     1
 OR {   95}
   (( segid "    " and resid 28   and name HA1 ))
   (  segid "    " and resid 96   and name HD1%)
 ASSI {   96}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 96   and name HD1%)
      2.700     2.700     3.300 peak    96 spectrum    1 weight  0.10000E+01 volume  0.34080E-02 ppm1      0.755 ppm2      1.446 CV     1
 OR {   96}
   (( segid "    " and resid 70   and name HB3 ))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {  104}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
      2.900     2.900     3.100 peak   104 spectrum    1 weight  0.10000E+01 volume  0.24658E-02 ppm1      0.760 ppm2      2.024 CV     1
 OR {  104}
   (( segid "    " and resid 93   and name HB3 ))
   (  segid "    " and resid 96   and name HG2%)
 OR {  104}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 96   and name HG2%)
 ASSI {  110}
   (( segid "    " and resid 63   and name HB3 ))
   (  segid "    " and resid 65   and name HG2%)
      2.900     1.000     1.000 peak   110 spectrum    1 weight  0.10000E+01 volume  0.18368E-02 ppm1      0.764 ppm2      2.997 CV     1
 OR {  110}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
 ASSI {  112}
   (  segid "    " and resid 29   and name HB% )
   (  segid "    " and resid 36   and name HG2%)
      2.000     2.000     4.000 peak   112 spectrum    1 weight  0.10000E+01 volume  0.17516E-01 ppm1      0.765 ppm2      1.219 CV     1
 OR {  112}
   (( segid "    " and resid 36   and name HG12))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  114}
   (( segid "    " and resid 26   and name HD2 ))
   (  segid "    " and resid 36   and name HG2%)
      3.100     1.200     1.200 peak   114 spectrum    1 weight  0.10000E+01 volume  0.12805E-02 ppm1      0.765 ppm2      1.643 CV     1
 OR {  114}
   (( segid "    " and resid 26   and name HD3 ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  114}
   (( segid "    " and resid 35   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
 OR {  114}
   (( segid "    " and resid 37   and name HB3 ))
   (  segid "    " and resid 36   and name HG2%)
 ASSI {  117}
   (( segid "    " and resid 41   and name HG3 ))
   (  segid "    " and resid 46   and name HD1%)
      3.500     1.500     1.500 peak   117 spectrum    1 weight  0.10000E+01 volume  0.91213E-03 ppm1      0.809 ppm2      2.360 CV     1
 OR {  117}
   (( segid "    " and resid 39   and name HG2 ))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {  118}
   (( segid "    " and resid 57   and name HG12))
   (  segid "    " and resid 57   and name HD1%)
      2.000     0.500     0.500 peak   118 spectrum    1 weight  0.10000E+01 volume  0.15286E-01 ppm1      0.818 ppm2      1.601 CV     1
 OR {  118}
   (( segid "    " and resid 46   and name HG12))
   (  segid "    " and resid 46   and name HD1%)
 OR {  118}
   (( segid "    " and resid 46   and name HG13))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {  130}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 38   and name HG1%)
      2.400     0.700     0.700 peak   130 spectrum    1 weight  0.10000E+01 volume  0.63649E-02 ppm1      0.854 ppm2      3.909 CV     1
 OR {  130}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 38   and name HG2%)
 OR {  130}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  133}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 85   and name HG1%)
      3.000     1.100     1.100 peak   133 spectrum    1 weight  0.10000E+01 volume  0.15612E-02 ppm1      0.861 ppm2      2.995 CV     1
 OR {  133}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 85   and name HG1%)
 ASSI {  140}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
      2.600     0.800     0.800 peak   140 spectrum    1 weight  0.10000E+01 volume  0.31574E-02 ppm1      0.871 ppm2      2.984 CV     1
 OR {  140}
   (( segid "    " and resid 17   and name HB3 ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  155}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      3.000     1.100     1.100 peak   155 spectrum    1 weight  0.10000E+01 volume  0.20949E-02 ppm1      0.901 ppm2      3.854 CV     1
 OR {  155}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI {  161}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
      3.200     1.300     1.300 peak   161 spectrum    1 weight  0.10000E+01 volume  0.19897E-02 ppm1      0.903 ppm2      3.880 CV     1
 OR {  161}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 89   and name HD1%)
 ASSI {  163}
   (( segid "    " and resid 57   and name HB  ))
   (  segid "    " and resid 57   and name HG2%)
      2.500     0.800     0.800 peak   163 spectrum    1 weight  0.10000E+01 volume  0.41848E-02 ppm1      0.910 ppm2      1.906 CV     1
 OR {  163}
   (( segid "    " and resid 4    and name HB3 ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  165}
   (( segid "    " and resid 67   and name HB  ))
   (  segid "    " and resid 67   and name HG2%)
      2.300     0.700     0.700 peak   165 spectrum    1 weight  0.10000E+01 volume  0.76929E-02 ppm1      0.920 ppm2      3.988 CV     1
 OR {  165}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
 ASSI {  185}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 9    and name HG2%)
      3.200     1.300     1.300 peak   185 spectrum    1 weight  0.10000E+01 volume  0.12504E-02 ppm1      0.998 ppm2      5.186 CV     1
 OR {  185}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  188}
   (( segid "    " and resid 9    and name HB  ))
   (  segid "    " and resid 9    and name HG2%)
      2.200     0.600     0.600 peak   188 spectrum    1 weight  0.10000E+01 volume  0.88957E-02 ppm1      1.010 ppm2      4.146 CV     1
 OR {  188}
   (( segid "    " and resid 18   and name HB  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  192}
   (( segid "    " and resid 40   and name HB  ))
   (  segid "    " and resid 40   and name HG2%)
      2.200     0.600     0.600 peak   192 spectrum    1 weight  0.10000E+01 volume  0.93720E-02 ppm1      1.027 ppm2      3.874 CV     1
 OR {  192}
   (( segid "    " and resid 79   and name HA  ))
   (  segid "    " and resid 79   and name HG2%)
 ASSI {  209}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB3 ))
      2.600     0.900     0.900 peak   209 spectrum    1 weight  0.10000E+01 volume  0.35082E-02 ppm1      1.157 ppm2      3.873 CV     1
 OR {  209}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HB3 ))
 ASSI {  217}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 103  and name HG13))
      3.000     3.000     3.000 peak   217 spectrum    1 weight  0.10000E+01 volume  0.23405E-02 ppm1      1.187 ppm2      0.653 CV     1
 OR {  217}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 103  and name HG13))
 ASSI {  218}
   (( segid "    " and resid 103  and name HG12))
   (( segid "    " and resid 103  and name HG13))
      1.700     1.700     4.300 peak   218 spectrum    1 weight  0.10000E+01 volume  0.20623E-01 ppm1      1.189 ppm2      1.663 CV     1
 OR {  218}
   (( segid "    " and resid 37   and name HB3 ))
   (( segid "    " and resid 37   and name HG3 ))
 ASSI {  225}
   (  segid "    " and resid 103  and name HG2%)
   (( segid "    " and resid 103  and name HG13))
      3.500     3.500     2.500 peak   225 spectrum    1 weight  0.10000E+01 volume  0.14409E-02 ppm1      1.196 ppm2      0.984 CV     1
 OR {  225}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 37   and name HG3 ))
 OR {  225}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 37   and name HG2 ))
 ASSI {  232}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 50   and name HB3 ))
      4.100     4.100     1.900 peak   232 spectrum    1 weight  0.10000E+01 volume  0.56881E-03 ppm1      1.264 ppm2      0.752 CV     1
 OR {  232}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 50   and name HB3 ))
 ASSI {  240}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 7    and name HB% )
      2.100     2.100     3.900 peak   240 spectrum    1 weight  0.10000E+01 volume  0.17541E-01 ppm1      1.309 ppm2      0.615 CV     1
 OR {  240}
   (  segid "    " and resid 8    and name HG2%)
   (  segid "    " and resid 7    and name HB% )
 ASSI {  241}
   (  segid "    " and resid 5    and name HG2%)
   (  segid "    " and resid 7    and name HB% )
      2.400     2.400     3.600 peak   241 spectrum    1 weight  0.10000E+01 volume  0.60142E-02 ppm1      1.309 ppm2      0.845 CV     1
 OR {  241}
   (  segid "    " and resid 38   and name HG2%)
   (  segid "    " and resid 7    and name HB% )
 OR {  241}
   (  segid "    " and resid 38   and name HG1%)
   (  segid "    " and resid 7    and name HB% )
 ASSI {  254}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
      2.200     0.600     0.600 peak   254 spectrum    1 weight  0.10000E+01 volume  0.11026E-01 ppm1      1.449 ppm2      3.859 CV     1
 OR {  254}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI {  255}
   (  segid "    " and resid 96   and name HD1%)
   (  segid "    " and resid 92   and name HB% )
      2.500     2.500     3.500 peak   255 spectrum    1 weight  0.10000E+01 volume  0.62649E-02 ppm1      1.449 ppm2      0.726 CV     1
 OR {  255}
   (  segid "    " and resid 25   and name HD2%)
   (  segid "    " and resid 92   and name HB% )
 ASSI {  261}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 101  and name HB% )
      2.000     0.500     0.500 peak   261 spectrum    1 weight  0.10000E+01 volume  0.17817E-01 ppm1      1.466 ppm2      4.116 CV     1
 OR {  261}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HB% )
 ASSI {  270}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 78   and name HD3 ))
      2.300     2.300     3.700 peak   270 spectrum    1 weight  0.10000E+01 volume  0.35333E-02 ppm1      1.484 ppm2      2.812 CV     1
 OR {  270}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 78   and name HD2 ))
 OR {  270}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 74   and name HG3 ))
 ASSI {  271}
   (( segid "    " and resid 12   and name HA  ))
   (  segid "    " and resid 12   and name HB% )
      2.200     0.600     0.600 peak   271 spectrum    1 weight  0.10000E+01 volume  0.95725E-02 ppm1      1.490 ppm2      4.189 CV     1
 OR {  271}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 43   and name HB% )
 ASSI {  282}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
      3.300     1.400     1.400 peak   282 spectrum    1 weight  0.10000E+01 volume  0.12504E-02 ppm1      1.538 ppm2      3.337 CV     1
 OR {  282}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
 ASSI {  298}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 8    and name HB  ))
      3.000     1.100     1.100 peak   298 spectrum    1 weight  0.10000E+01 volume  0.15637E-02 ppm1      1.623 ppm2      5.509 CV     1
 OR {  298}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {  322}
   (  segid "    " and resid 35   and name HD2%)
   (( segid "    " and resid 35   and name HB2 ))
      2.100     0.600     0.600 peak   322 spectrum    1 weight  0.10000E+01 volume  0.13582E-01 ppm1      1.750 ppm2      0.859 CV     1
 OR {  322}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 35   and name HB2 ))
 OR {  322}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 81   and name HB2 ))
 ASSI {  337}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 37   and name HB2 ))
      2.500     0.800     0.800 peak   337 spectrum    1 weight  0.10000E+01 volume  0.58886E-02 ppm1      1.783 ppm2      0.964 CV     1
 OR {  337}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 37   and name HB2 ))
 ASSI {  346}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
      2.900     1.100     1.100 peak   346 spectrum    1 weight  0.10000E+01 volume  0.26061E-02 ppm1      1.870 ppm2      4.046 CV     1
 OR {  346}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
 ASSI {  348}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 89   and name HB  ))
      3.800     1.800     1.800 peak   348 spectrum    1 weight  0.10000E+01 volume  0.10625E-02 ppm1      1.873 ppm2      3.888 CV     1
 OR {  348}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 89   and name HB  ))
 ASSI {  351}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB3 ))
      2.100     0.600     0.600 peak   351 spectrum    1 weight  0.10000E+01 volume  0.11677E-01 ppm1      1.886 ppm2      3.996 CV     1
 OR {  351}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  355}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 50   and name HB2 ))
      3.500     1.600     1.600 peak   355 spectrum    1 weight  0.10000E+01 volume  0.11352E-02 ppm1      1.895 ppm2      0.754 CV     1
 OR {  355}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 50   and name HB2 ))
 ASSI {  365}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 32   and name HB3 ))
      4.000     2.000     2.000 peak   365 spectrum    1 weight  0.10000E+01 volume  0.67156E-03 ppm1      1.940 ppm2      3.834 CV     1
 OR {  365}
   (( segid "    " and resid 33   and name HA2 ))
   (( segid "    " and resid 32   and name HB3 ))
 ASSI {  380}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.200     0.600     0.600 peak   380 spectrum    1 weight  0.10000E+01 volume  0.64403E-02 ppm1      1.999 ppm2      4.023 CV     1
 OR {  380}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  397}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      2.300     0.700     0.700 peak   397 spectrum    1 weight  0.10000E+01 volume  0.63900E-02 ppm1      2.051 ppm2      3.886 CV     1
 OR {  397}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 93   and name HB3 ))
 ASSI {  408}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 60   and name HB  ))
      2.900     1.000     1.000 peak   408 spectrum    1 weight  0.10000E+01 volume  0.21776E-02 ppm1      2.092 ppm2      0.847 CV     1
 OR {  408}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 60   and name HB  ))
 ASSI {  409}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 82   and name HG3 ))
      3.600     1.700     1.700 peak   409 spectrum    1 weight  0.10000E+01 volume  0.32326E-03 ppm1      2.100 ppm2      0.774 CV     1
 OR {  409}
   (  segid "    " and resid 83   and name HG2%)
   (( segid "    " and resid 82   and name HG3 ))
 OR {  409}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 82   and name HG3 ))
 OR {  409}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 47   and name HG3 ))
 ASSI {  419}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
      2.900     1.100     1.100 peak   419 spectrum    1 weight  0.10000E+01 volume  0.16564E-02 ppm1      2.113 ppm2      3.874 CV     1
 OR {  419}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
 ASSI {  448}
   (  segid "    " and resid 87   and name HB% )
   (( segid "    " and resid 83   and name HB  ))
      2.600     0.800     0.800 peak   448 spectrum    1 weight  0.10000E+01 volume  0.45106E-02 ppm1      2.321 ppm2      1.481 CV     1
 OR {  448}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 23   and name HG3 ))
 ASSI {  450}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB  ))
      3.300     1.400     1.400 peak   450 spectrum    1 weight  0.10000E+01 volume  0.71166E-03 ppm1      2.322 ppm2      4.960 CV     1
 OR {  450}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HG3 ))
 ASSI {  461}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HG3 ))
      3.700     1.700     1.700 peak   461 spectrum    1 weight  0.10000E+01 volume  0.93971E-03 ppm1      2.494 ppm2      4.251 CV     1
 OR {  461}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  465}
   (  segid "    " and resid 6    and name HG2%)
   (( segid "    " and resid 54   and name HB3 ))
      2.600     0.900     0.900 peak   465 spectrum    1 weight  0.10000E+01 volume  0.33829E-02 ppm1      2.527 ppm2      0.966 CV     1
 OR {  465}
   (  segid "    " and resid 50   and name HD2%)
   (( segid "    " and resid 54   and name HB3 ))
 ASSI {  506}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 17   and name HB3 ))
      2.700     0.900     0.900 peak   506 spectrum    1 weight  0.10000E+01 volume  0.23956E-02 ppm1      2.978 ppm2      0.877 CV     1
 OR {  506}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 17   and name HB3 ))
 OR {  506}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 17   and name HB3 ))
 ASSI {  508}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB3 ))
      2.500     0.800     0.800 peak   508 spectrum    1 weight  0.10000E+01 volume  0.40094E-02 ppm1      3.005 ppm2      5.492 CV     1
 OR {  508}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 63   and name HB3 ))
 ASSI {  513}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 63   and name HB3 ))
      2.600     0.800     0.800 peak   513 spectrum    1 weight  0.10000E+01 volume  0.37338E-02 ppm1      3.016 ppm2      0.709 CV     1
 OR {  513}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 63   and name HB3 ))
 ASSI {  520}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
      3.700     1.700     1.700 peak   520 spectrum    1 weight  0.10000E+01 volume  0.67910E-03 ppm1      3.160 ppm2      0.708 CV     1
 OR {  520}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
 ASSI {  521}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 63   and name HB2 ))
      2.500     0.800     0.800 peak   521 spectrum    1 weight  0.10000E+01 volume  0.46860E-02 ppm1      3.165 ppm2      5.496 CV     1
 OR {  521}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB2 ))
 ASSI {  536}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 78   and name HE2 ))
      3.300     1.300     1.300 peak   536 spectrum    1 weight  0.10000E+01 volume  0.99483E-03 ppm1      3.263 ppm2      0.875 CV     1
 OR {  536}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 78   and name HE2 ))
 ASSI {  549}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 69   and name HA  ))
      3.700     1.700     1.700 peak   549 spectrum    1 weight  0.10000E+01 volume  0.66156E-03 ppm1      3.328 ppm2      0.667 CV     1
 OR {  549}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  556}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HA  ))
      2.200     0.600     0.600 peak   556 spectrum    1 weight  0.10000E+01 volume  0.11552E-01 ppm1      3.335 ppm2      0.865 CV     1
 OR {  556}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
 OR {  556}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 85   and name HA  ))
 ASSI {  564}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HD2 ))
      3.400     1.500     1.500 peak   564 spectrum    1 weight  0.10000E+01 volume  0.10224E-02 ppm1      3.458 ppm2      1.870 CV     1
 OR {  564}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 88   and name HD2 ))
 ASSI {  591}
   (( segid "    " and resid 5    and name HB  ))
   (( segid "    " and resid 58   and name HA1 ))
      3.500     1.600     1.600 peak   591 spectrum    1 weight  0.10000E+01 volume  0.80687E-03 ppm1      3.650 ppm2      1.610 CV     1
 OR {  591}
   (( segid "    " and resid 3    and name HG3 ))
   (( segid "    " and resid 58   and name HA1 ))
 OR {  591}
   (( segid "    " and resid 3    and name HG2 ))
   (( segid "    " and resid 58   and name HA1 ))
 ASSI {  599}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 29   and name HA  ))
      3.300     1.400     1.400 peak   599 spectrum    1 weight  0.10000E+01 volume  0.10474E-02 ppm1      3.834 ppm2      2.843 CV     1
 OR {  599}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  604}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 92   and name HA  ))
      2.300     0.700     0.700 peak   604 spectrum    1 weight  0.10000E+01 volume  0.65654E-02 ppm1      3.840 ppm2      1.445 CV     1
 OR {  604}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  605}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 92   and name HA  ))
      2.400     0.700     0.700 peak   605 spectrum    1 weight  0.10000E+01 volume  0.66407E-02 ppm1      3.842 ppm2      2.129 CV     1
 OR {  605}
   (( segid "    " and resid 34   and name HB3 ))
   (( segid "    " and resid 29   and name HA  ))
 OR {  605}
   (( segid "    " and resid 20   and name HB3 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  606}
   (( segid "    " and resid 78   and name HD2 ))
   (( segid "    " and resid 77   and name HA2 ))
      3.800     1.800     1.800 peak   606 spectrum    1 weight  0.10000E+01 volume  0.30822E-03 ppm1      3.843 ppm2      1.485 CV     1
 OR {  606}
   (( segid "    " and resid 78   and name HD3 ))
   (( segid "    " and resid 77   and name HA2 ))
 OR {  606}
   (( segid "    " and resid 30   and name HG3 ))
   (( segid "    " and resid 33   and name HA2 ))
 OR {  606}
   (( segid "    " and resid 30   and name HG2 ))
   (( segid "    " and resid 33   and name HA2 ))
 OR {  606}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 33   and name HA2 ))
 OR {  606}
   (( segid "    " and resid 2    and name HG3 ))
   (( segid "    " and resid 33   and name HA2 ))
 ASSI {  609}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
      4.100     2.100     1.900 peak   609 spectrum    1 weight  0.10000E+01 volume  0.29068E-03 ppm1      3.849 ppm2      1.879 CV     1
 OR {  609}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
 OR {  609}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  610}
   (( segid "    " and resid 32   and name HB3 ))
   (( segid "    " and resid 29   and name HA  ))
      2.500     0.800     0.800 peak   610 spectrum    1 weight  0.10000E+01 volume  0.10750E-01 ppm1      3.849 ppm2      1.917 CV     1
 OR {  610}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  611}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 92   and name HA  ))
      2.700     0.900     0.900 peak   611 spectrum    1 weight  0.10000E+01 volume  0.60891E-02 ppm1      3.851 ppm2      0.879 CV     1
 OR {  611}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 21   and name HA  ))
 OR {  611}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  623}
   (  segid "    " and resid 96   and name HD1%)
   (( segid "    " and resid 93   and name HA  ))
      2.200     0.600     0.600 peak   623 spectrum    1 weight  0.10000E+01 volume  0.99734E-02 ppm1      3.867 ppm2      0.762 CV     1
 OR {  623}
   (  segid "    " and resid 36   and name HG2%)
   (( segid "    " and resid 26   and name HA  ))
 ASSI {  631}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      3.200     3.200     2.800 peak   631 spectrum    1 weight  0.10000E+01 volume  0.19396E-02 ppm1      3.872 ppm2      1.019 CV     1
 OR {  631}
   (  segid "    " and resid 64   and name HB% )
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  638}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 52   and name HA  ))
      1.900     0.400     0.400 peak   638 spectrum    1 weight  0.10000E+01 volume  0.22378E-01 ppm1      3.883 ppm2      2.048 CV     1
 OR {  638}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
 OR {  638}
   (( segid "    " and resid 93   and name HB3 ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI {  639}
   (( segid "    " and resid 52   and name HG2 ))
   (( segid "    " and resid 52   and name HA  ))
      3.100     1.200     1.200 peak   639 spectrum    1 weight  0.10000E+01 volume  0.16288E-02 ppm1      3.887 ppm2      2.263 CV     1
 OR {  639}
   (( segid "    " and resid 93   and name HG3 ))
   (( segid "    " and resid 93   and name HA  ))
 OR {  639}
   (( segid "    " and resid 93   and name HG2 ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI {  640}
   (  segid "    " and resid 22   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      1.800     0.400     0.400 peak   640 spectrum    1 weight  0.10000E+01 volume  0.30572E-01 ppm1      3.904 ppm2      1.485 CV     1
 OR {  640}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  647}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 28   and name HA1 ))
      3.000     1.100     1.100 peak   647 spectrum    1 weight  0.10000E+01 volume  0.29570E-02 ppm1      3.913 ppm2      1.450 CV     1
 OR {  647}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 28   and name HA1 ))
 OR {  647}
   (( segid "    " and resid 31   and name HG3 ))
   (( segid "    " and resid 28   and name HA1 ))
 ASSI {  657}
   (( segid "    " and resid 97   and name HB3 ))
   (( segid "    " and resid 94   and name HA  ))
      3.900     1.900     1.900 peak   657 spectrum    1 weight  0.10000E+01 volume  0.13081E-02 ppm1      3.945 ppm2      2.577 CV     1
 OR {  657}
   (( segid "    " and resid 91   and name HB3 ))
   (( segid "    " and resid 94   and name HA  ))
 ASSI {  663}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 99   and name HA  ))
      2.200     0.600     0.600 peak   663 spectrum    1 weight  0.10000E+01 volume  0.10550E-01 ppm1      3.954 ppm2      0.840 CV     1
 OR {  663}
   (( segid "    " and resid 81   and name HG  ))
   (( segid "    " and resid 99   and name HA  ))
 OR {  663}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 99   and name HA  ))
 ASSI {  677}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HA  ))
      2.200     0.600     0.600 peak   677 spectrum    1 weight  0.10000E+01 volume  0.97729E-02 ppm1      4.011 ppm2      1.874 CV     1
 OR {  677}
   (( segid "    " and resid 89   and name HB  ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  682}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 42   and name HA2 ))
      3.200     1.300     1.300 peak   682 spectrum    1 weight  0.10000E+01 volume  0.17466E-02 ppm1      4.020 ppm2      0.986 CV     1
 OR {  682}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 42   and name HA2 ))
 ASSI {  685}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 88   and name HA  ))
      3.400     1.500     1.500 peak   685 spectrum    1 weight  0.10000E+01 volume  0.11377E-02 ppm1      4.023 ppm2      1.451 CV     1
 OR {  685}
   (  segid "    " and resid 87   and name HB% )
   (( segid "    " and resid 88   and name HA  ))
 ASSI {  689}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HA  ))
      2.000     0.500     0.500 peak   689 spectrum    1 weight  0.10000E+01 volume  0.14308E-01 ppm1      4.025 ppm2      1.987 CV     1
 OR {  689}
   (( segid "    " and resid 31   and name HB3 ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  690}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.100     0.500     0.500 peak   690 spectrum    1 weight  0.10000E+01 volume  0.13407E-01 ppm1      4.033 ppm2      1.740 CV     1
 OR {  690}
   (( segid "    " and resid 90   and name HB3 ))
   (( segid "    " and resid 90   and name HA  ))
 OR {  690}
   (( segid "    " and resid 72   and name HG3 ))
   (( segid "    " and resid 72   and name HA  ))
 OR {  690}
   (( segid "    " and resid 89   and name HG12))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  691}
   (( segid "    " and resid 31   and name HG3 ))
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak   691 spectrum    1 weight  0.10000E+01 volume  0.67407E-02 ppm1      4.035 ppm2      1.490 CV     1
 OR {  691}
   (( segid "    " and resid 31   and name HG2 ))
   (( segid "    " and resid 31   and name HA  ))
 OR {  691}
   (( segid "    " and resid 53   and name HD3 ))
   (( segid "    " and resid 53   and name HA  ))
 OR {  691}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  699}
   (( segid "    " and resid 104  and name HB3 ))
   (( segid "    " and resid 101  and name HA  ))
      2.900     1.000     1.000 peak   699 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      4.121 ppm2      2.600 CV     1
 OR {  699}
   (( segid "    " and resid 97   and name HB3 ))
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  700}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
      3.200     1.300     1.300 peak   700 spectrum    1 weight  0.10000E+01 volume  0.11653E-02 ppm1      4.126 ppm2      0.852 CV     1
 OR {  700}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 101  and name HA  ))
 OR {  700}
   (  segid "    " and resid 81   and name HD2%)
   (( segid "    " and resid 98   and name HA  ))
 OR {  700}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 101  and name HA  ))
 OR {  700}
   (  segid "    " and resid 102  and name HD2%)
   (( segid "    " and resid 98   and name HA  ))
 OR {  700}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 98   and name HA  ))
 ASSI {  707}
   (  segid "    " and resid 101  and name HB% )
   (( segid "    " and resid 101  and name HA  ))
      1.700     0.400     0.500 peak   707 spectrum    1 weight  0.10000E+01 volume  0.44855E-01 ppm1      4.133 ppm2      1.467 CV     1
 OR {  707}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 98   and name HA  ))
 OR {  707}
   (  segid "    " and resid 43   and name HB% )
   (( segid "    " and resid 43   and name HA  ))
 OR {  707}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  708}
   (( segid "    " and resid 102  and name HB3 ))
   (( segid "    " and resid 102  and name HA  ))
      2.500     0.800     0.800 peak   708 spectrum    1 weight  0.10000E+01 volume  0.38340E-02 ppm1      4.143 ppm2      1.491 CV     1
 OR {  708}
   (( segid "    " and resid 70   and name HB3 ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI {  709}
   (( segid "    " and resid 30   and name HD3 ))
   (( segid "    " and resid 30   and name HA  ))
      4.700     2.700     1.300 peak   709 spectrum    1 weight  0.10000E+01 volume  0.16539E-03 ppm1      4.152 ppm2      1.731 CV     1
 OR {  709}
   (( segid "    " and resid 30   and name HD2 ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  709}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  712}
   (( segid "    " and resid 30   and name HE2 ))
   (( segid "    " and resid 30   and name HA  ))
      3.000     1.100     1.100 peak   712 spectrum    1 weight  0.10000E+01 volume  0.94971E-03 ppm1      4.168 ppm2      2.993 CV     1
 OR {  712}
   (( segid "    " and resid 30   and name HE3 ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  712}
   (( segid "    " and resid 75   and name HB3 ))
   (( segid "    " and resid 73   and name HA  ))
 OR {  712}
   (( segid "    " and resid 72   and name HE3 ))
   (( segid "    " and resid 73   and name HA  ))
 OR {  712}
   (( segid "    " and resid 17   and name HB3 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  713}
   (( segid "    " and resid 73   and name HB3 ))
   (( segid "    " and resid 73   and name HA  ))
      2.000     0.500     0.500 peak   713 spectrum    1 weight  0.10000E+01 volume  0.20398E-01 ppm1      4.169 ppm2      2.031 CV     1
 OR {  713}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  713}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  714}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 20   and name HA  ))
      3.300     1.400     1.400 peak   714 spectrum    1 weight  0.10000E+01 volume  0.80189E-03 ppm1      4.176 ppm2      0.903 CV     1
 OR {  714}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  716}
   (( segid "    " and resid 20   and name HG3 ))
   (( segid "    " and resid 20   and name HA  ))
      2.600     0.800     0.800 peak   716 spectrum    1 weight  0.10000E+01 volume  0.34331E-02 ppm1      4.177 ppm2      2.640 CV     1
 OR {  716}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  731}
   (  segid "    " and resid 67   and name HG2%)
   (( segid "    " and resid 12   and name HA  ))
      3.200     1.300     1.300 peak   731 spectrum    1 weight  0.10000E+01 volume  0.12630E-02 ppm1      4.242 ppm2      0.921 CV     1
 OR {  731}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  743}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 75   and name HA  ))
      2.500     0.800     0.800 peak   743 spectrum    1 weight  0.10000E+01 volume  0.49616E-02 ppm1      4.303 ppm2      0.881 CV     1
 OR {  743}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
 OR {  743}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 2    and name HA  ))
 OR {  743}
   (  segid "    " and resid 35   and name HD2%)
   (( segid "    " and resid 2    and name HA  ))
 OR {  743}
   (  segid "    " and resid 89   and name HG2%)
   (( segid "    " and resid 87   and name HA  ))
 OR {  743}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  745}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      2.600     0.800     0.800 peak   745 spectrum    1 weight  0.10000E+01 volume  0.34832E-02 ppm1      4.304 ppm2      3.251 CV     1
 OR {  745}
   (( segid "    " and resid 78   and name HE2 ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  747}
   (  segid "    " and resid 87   and name HB% )
   (( segid "    " and resid 87   and name HA  ))
      1.900     0.500     0.500 peak   747 spectrum    1 weight  0.10000E+01 volume  0.20924E-01 ppm1      4.307 ppm2      1.490 CV     1
 OR {  747}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 2    and name HA  ))
 OR {  747}
   (( segid "    " and resid 2    and name HG3 ))
   (( segid "    " and resid 2    and name HA  ))
 ASSI {  756}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
      2.800     0.900     0.900 peak   756 spectrum    1 weight  0.10000E+01 volume  0.29570E-02 ppm1      4.361 ppm2      1.015 CV     1
 OR {  756}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  764}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 17   and name HA  ))
      2.800     1.000     1.000 peak   764 spectrum    1 weight  0.10000E+01 volume  0.26813E-02 ppm1      4.414 ppm2      0.892 CV     1
 OR {  764}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  765}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 13   and name HA  ))
      3.300     1.300     1.300 peak   765 spectrum    1 weight  0.10000E+01 volume  0.13632E-02 ppm1      4.416 ppm2      1.481 CV     1
 OR {  765}
   (( segid "    " and resid 102  and name HB3 ))
   (( segid "    " and resid 103  and name HA  ))
 OR {  765}
   (  segid "    " and resid 43   and name HB% )
   (( segid "    " and resid 44   and name HA  ))
 ASSI {  771}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 88   and name HD3 ))
      2.900     1.100     1.100 peak   771 spectrum    1 weight  0.10000E+01 volume  0.21074E-02 ppm1      4.424 ppm2      0.869 CV     1
 OR {  771}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 88   and name HD3 ))
 OR {  771}
   (  segid "    " and resid 83   and name HG1%)
   (( segid "    " and resid 88   and name HD3 ))
 OR {  771}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 88   and name HD3 ))
 ASSI {  772}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HD3 ))
      2.900     1.100     1.100 peak   772 spectrum    1 weight  0.10000E+01 volume  0.46609E-02 ppm1      4.425 ppm2      1.882 CV     1
 OR {  772}
   (( segid "    " and resid 84   and name HB3 ))
   (( segid "    " and resid 88   and name HD3 ))
 ASSI {  775}
   (( segid "    " and resid 56   and name HB3 ))
   (( segid "    " and resid 56   and name HA  ))
      2.000     0.500     0.500 peak   775 spectrum    1 weight  0.10000E+01 volume  0.20749E-01 ppm1      4.427 ppm2      2.802 CV     1
 OR {  775}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  780}
   (( segid "    " and resid 79   and name HB  ))
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak   780 spectrum    1 weight  0.10000E+01 volume  0.15060E-02 ppm1      4.427 ppm2      1.953 CV     1
 OR {  780}
   (( segid "    " and resid 59   and name HB3 ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  781}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
      2.700     0.900     0.900 peak   781 spectrum    1 weight  0.10000E+01 volume  0.39342E-02 ppm1      4.427 ppm2      0.671 CV     1
 OR {  781}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  782}
   (( segid "    " and resid 100  and name HB3 ))
   (( segid "    " and resid 97   and name HA  ))
      3.200     1.300     1.300 peak   782 spectrum    1 weight  0.10000E+01 volume  0.23254E-02 ppm1      4.437 ppm2      1.468 CV     1
 OR {  782}
   (( segid "    " and resid 78   and name HD2 ))
   (( segid "    " and resid 56   and name HA  ))
 OR {  782}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  783}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 56   and name HA  ))
      2.500     0.800     0.800 peak   783 spectrum    1 weight  0.10000E+01 volume  0.65403E-02 ppm1      4.437 ppm2      0.826 CV     1
 OR {  783}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  789}
   (  segid "    " and resid 103  and name HD1%)
   (( segid "    " and resid 103  and name HA  ))
      2.500     2.500     3.500 peak   789 spectrum    1 weight  0.10000E+01 volume  0.28066E-02 ppm1      4.454 ppm2      0.845 CV     1
 OR {  789}
   (  segid "    " and resid 79   and name HG1%)
   (( segid "    " and resid 103  and name HA  ))
 OR {  789}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI {  798}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 91   and name HA  ))
      4.100     2.100     1.900 peak   798 spectrum    1 weight  0.10000E+01 volume  0.51118E-03 ppm1      4.540 ppm2      1.461 CV     1
 OR {  798}
   (( segid "    " and resid 94   and name HG2 ))
   (( segid "    " and resid 91   and name HA  ))
 OR {  798}
   (( segid "    " and resid 90   and name HG3 ))
   (( segid "    " and resid 91   and name HA  ))
 ASSI {  806}
   (( segid "    " and resid 78   and name HE2 ))
   (( segid "    " and resid 78   and name HA  ))
      3.000     3.000     3.000 peak   806 spectrum    1 weight  0.10000E+01 volume  0.98483E-03 ppm1      4.555 ppm2      3.258 CV     1
 OR {  806}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 78   and name HA  ))
 ASSI {  812}
   (  segid "    " and resid 38   and name HG2%)
   (( segid "    " and resid 37   and name HA  ))
      3.600     1.600     1.600 peak   812 spectrum    1 weight  0.10000E+01 volume  0.13632E-02 ppm1      4.605 ppm2      0.821 CV     1
 OR {  812}
   (( segid "    " and resid 36   and name HG13))
   (( segid "    " and resid 37   and name HA  ))
 OR {  812}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  824}
   (  segid "    " and resid 35   and name HD2%)
   (( segid "    " and resid 3    and name HA  ))
      3.200     3.200     2.800 peak   824 spectrum    1 weight  0.10000E+01 volume  0.67156E-03 ppm1      4.678 ppm2      0.859 CV     1
 OR {  824}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 3    and name HA  ))
 OR {  824}
   (  segid "    " and resid 5    and name HG2%)
   (( segid "    " and resid 3    and name HA  ))
 ASSI {  837}
   (  segid "    " and resid 79   and name HG2%)
   (( segid "    " and resid 80   and name HA  ))
      3.300     1.300     1.300 peak   837 spectrum    1 weight  0.10000E+01 volume  0.12279E-02 ppm1      4.710 ppm2      0.997 CV     1
 OR {  837}
   (  segid "    " and resid 60   and name HG1%)
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  845}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 4    and name HA  ))
      3.700     1.700     1.700 peak   845 spectrum    1 weight  0.10000E+01 volume  0.10474E-02 ppm1      4.791 ppm2      0.884 CV     1
 OR {  845}
   (( segid "    " and resid 5    and name HG12))
   (( segid "    " and resid 4    and name HA  ))
 OR {  845}
   (  segid "    " and resid 35   and name HD1%)
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  848}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      2.400     0.700     0.700 peak   848 spectrum    1 weight  0.10000E+01 volume  0.60891E-02 ppm1      4.792 ppm2      1.453 CV     1
 OR {  848}
   (( segid "    " and resid 5    and name HG13))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  849}
   (( segid "    " and resid 41   and name HG3 ))
   (( segid "    " and resid 46   and name HA  ))
      3.000     1.100     1.100 peak   849 spectrum    1 weight  0.10000E+01 volume  0.23931E-02 ppm1      4.801 ppm2      2.357 CV     1
 OR {  849}
   (( segid "    " and resid 39   and name HG2 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  851}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.600     1.600     1.600 peak   851 spectrum    1 weight  0.10000E+01 volume  0.10499E-02 ppm1      4.805 ppm2      2.159 CV     1
 OR {  851}
   (( segid "    " and resid 47   and name HG3 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  855}
   (( segid "    " and resid 81   and name HB2 ))
   (( segid "    " and resid 62   and name HA  ))
      2.900     1.100     1.100 peak   855 spectrum    1 weight  0.10000E+01 volume  0.30822E-02 ppm1      4.838 ppm2      1.756 CV     1
 OR {  855}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  874}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      3.600     3.600     2.400 peak   874 spectrum    1 weight  0.10000E+01 volume  0.74924E-03 ppm1      4.979 ppm2      5.458 CV     1
 OR {  874}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  876}
   (( segid "    " and resid 81   and name HB3 ))
   (( segid "    " and resid 61   and name HA  ))
      2.600     2.600     3.400 peak   876 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      4.982 ppm2      1.126 CV     1
 OR {  876}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 61   and name HA  ))
 ASSI {  886}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      3.900     1.900     1.900 peak   886 spectrum    1 weight  0.10000E+01 volume  0.56881E-03 ppm1      5.039 ppm2      1.005 CV     1
 OR {  886}
   (  segid "    " and resid 9    and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
 ASSI {  890}
   (  segid "    " and resid 38   and name HG1%)
   (( segid "    " and resid 39   and name HA  ))
      6.000     5.500     0.000 peak   890 spectrum    1 weight  0.10000E+01 volume  0.22052E-04 ppm1      5.041 ppm2      0.864 CV     1
 OR {  890}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
 ASSI {  897}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      3.100     3.100     2.900 peak   897 spectrum    1 weight  0.10000E+01 volume  0.13958E-02 ppm1      5.194 ppm2      0.667 CV     1
 OR {  897}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 40   and name HA  ))
 ASSI {  903}
   (( segid "    " and resid 2    and name HG2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.900     1.100     1.100 peak   903 spectrum    1 weight  0.10000E+01 volume  0.23480E-02 ppm1      5.221 ppm2      1.528 CV     1
 OR {  903}
   (( segid "    " and resid 35   and name HG  ))
   (( segid "    " and resid 34   and name HA  ))
 OR {  903}
   (( segid "    " and resid 2    and name HG3 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  913}
   (( segid "    " and resid 36   and name HG12))
   (( segid "    " and resid 6    and name HA  ))
      4.400     2.400     1.600 peak   913 spectrum    1 weight  0.10000E+01 volume  0.28567E-03 ppm1      5.462 ppm2      1.280 CV     1
 OR {  913}
   (  segid "    " and resid 7    and name HB% )
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  914}
   (  segid "    " and resid 6    and name HD1%)
   (( segid "    " and resid 6    and name HA  ))
      2.700     0.900     0.900 peak   914 spectrum    1 weight  0.10000E+01 volume  0.64151E-02 ppm1      5.462 ppm2      1.115 CV     1
 OR {  914}
   (  segid "    " and resid 50   and name HD1%)
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  925}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.900     0.900 peak   925 spectrum    1 weight  0.10000E+01 volume  0.40595E-02 ppm1      5.513 ppm2      0.689 CV     1
 OR {  925}
   (  segid "    " and resid 65   and name HG1%)
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  936}
   (  segid "    " and resid 8    and name HG1%)
   (( segid "    " and resid 7    and name HA  ))
      3.000     1.200     1.200 peak   936 spectrum    1 weight  0.10000E+01 volume  0.32326E-02 ppm1      5.795 ppm2      0.727 CV     1
 OR {  936}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 7    and name HA  ))
 OR {  936}
   (  segid "    " and resid 25   and name HD2%)
   (( segid "    " and resid 7    and name HA  ))
 ASSI {  940}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 7    and name HA  ))
      5.300     3.500     0.700 peak   940 spectrum    1 weight  0.10000E+01 volume  0.68663E-04 ppm1      5.797 ppm2      1.573 CV     1
 OR {  940}
   (( segid "    " and resid 6    and name HG12))
   (( segid "    " and resid 7    and name HA  ))
 OR {  940}
   (( segid "    " and resid 8    and name HB  ))
   (( segid "    " and resid 7    and name HA  ))
assign (resid   4 and name C   ) (resid   5 and name N   )
       (resid   5 and name CA  ) (resid   5 and name C   ) 1.0  -120.4   43.2 2
assign (resid   5 and name C   ) (resid   6 and name N   )
       (resid   6 and name CA  ) (resid   6 and name C   ) 1.0  -124.2   30.6 2
assign (resid   6 and name C   ) (resid   7 and name N   )
       (resid   7 and name CA  ) (resid   7 and name C   ) 1.0  -144.1   33.1 2
assign (resid   7 and name C   ) (resid   8 and name N   )
       (resid   8 and name CA  ) (resid   8 and name C   ) 1.0  -131.2   36.5 2
assign (resid   8 and name C   ) (resid   9 and name N   )
       (resid   9 and name CA  ) (resid   9 and name C   ) 1.0  -132.0   40.3 2
assign (resid   9 and name C   ) (resid  10 and name N   )
       (resid  10 and name CA  ) (resid  10 and name C   ) 1.0  -139.0   53.5 2
assign (resid  14 and name C   ) (resid  15 and name N   )
       (resid  15 and name CA  ) (resid  15 and name C   ) 1.0  -66.3   39.4 2
assign (resid  15 and name C   ) (resid  16 and name N   )
       (resid  16 and name CA  ) (resid  16 and name C   ) 1.0  -62.0   15.2 2
assign (resid  16 and name C   ) (resid  17 and name N   )
       (resid  17 and name CA  ) (resid  17 and name C   ) 1.0  -65.2   19.0 2
assign (resid  17 and name C   ) (resid  18 and name N   )
       (resid  18 and name CA  ) (resid  18 and name C   ) 1.0  -64.2   16.4 2
assign (resid  18 and name C   ) (resid  19 and name N   )
       (resid  19 and name CA  ) (resid  19 and name C   ) 1.0  -67.7   22.6 2
assign (resid  19 and name C   ) (resid  20 and name N   )
       (resid  20 and name CA  ) (resid  20 and name C   ) 1.0  -64.1   16.4 2
assign (resid  20 and name C   ) (resid  21 and name N   )
       (resid  21 and name CA  ) (resid  21 and name C   ) 1.0  -64.2   18.7 2
assign (resid  21 and name C   ) (resid  22 and name N   )
       (resid  22 and name CA  ) (resid  22 and name C   ) 1.0  -61.8   11.6 2
assign (resid  22 and name C   ) (resid  23 and name N   )
       (resid  23 and name CA  ) (resid  23 and name C   ) 1.0  -66.2   13.4 2
assign (resid  23 and name C   ) (resid  24 and name N   )
       (resid  24 and name CA  ) (resid  24 and name C   ) 1.0  -60.8   17.2 2
assign (resid  24 and name C   ) (resid  25 and name N   )
       (resid  25 and name CA  ) (resid  25 and name C   ) 1.0  -66.8   11.4 2
assign (resid  25 and name C   ) (resid  26 and name N   )
       (resid  26 and name CA  ) (resid  26 and name C   ) 1.0  -60.1   15.4 2
assign (resid  26 and name C   ) (resid  27 and name N   )
       (resid  27 and name CA  ) (resid  27 and name C   ) 1.0  -62.0   14.5 2
assign (resid  28 and name C   ) (resid  29 and name N   )
       (resid  29 and name CA  ) (resid  29 and name C   ) 1.0  -60.3   14.0 2
assign (resid  29 and name C   ) (resid  30 and name N   )
       (resid  30 and name CA  ) (resid  30 and name C   ) 1.0  -62.2    6.8 2
assign (resid  30 and name C   ) (resid  31 and name N   )
       (resid  31 and name CA  ) (resid  31 and name C   ) 1.0  -65.8   19.6 2
assign (resid  34 and name C   ) (resid  35 and name N   )
       (resid  35 and name CA  ) (resid  35 and name C   ) 1.0  -122.0   65.5 2
assign (resid  35 and name C   ) (resid  36 and name N   )
       (resid  36 and name CA  ) (resid  36 and name C   ) 1.0  -131.8   56.6 2
assign (resid  36 and name C   ) (resid  37 and name N   )
       (resid  37 and name CA  ) (resid  37 and name C   ) 1.0  -147.2   30.4 2
assign (resid  37 and name C   ) (resid  38 and name N   )
       (resid  38 and name CA  ) (resid  38 and name C   ) 1.0  -131.0   36.9 2
assign (resid  38 and name C   ) (resid  39 and name N   )
       (resid  39 and name CA  ) (resid  39 and name C   ) 1.0  -121.9   26.0 2
assign (resid  39 and name C   ) (resid  40 and name N   )
       (resid  40 and name CA  ) (resid  40 and name C   ) 1.0  -117.6   36.0 2
assign (resid  51 and name C   ) (resid  52 and name N   )
       (resid  52 and name CA  ) (resid  52 and name C   ) 1.0  -60.7   11.9 2
assign (resid  52 and name C   ) (resid  53 and name N   )
       (resid  53 and name CA  ) (resid  53 and name C   ) 1.0  -65.6   18.6 2
assign (resid  53 and name C   ) (resid  54 and name N   )
       (resid  54 and name CA  ) (resid  54 and name C   ) 1.0  -62.7   19.3 2
assign (resid  54 and name C   ) (resid  55 and name N   )
       (resid  55 and name CA  ) (resid  55 and name C   ) 1.0  -64.0   19.2 2
assign (resid  55 and name C   ) (resid  56 and name N   )
       (resid  56 and name CA  ) (resid  56 and name C   ) 1.0  -59.6   32.7 2
assign (resid  59 and name C   ) (resid  60 and name N   )
       (resid  60 and name CA  ) (resid  60 and name C   ) 1.0  -143.4   47.9 2
assign (resid  60 and name C   ) (resid  61 and name N   )
       (resid  61 and name CA  ) (resid  61 and name C   ) 1.0  -122.4   11.7 2
assign (resid  61 and name C   ) (resid  62 and name N   )
       (resid  62 and name CA  ) (resid  62 and name C   ) 1.0  -127.6   35.5 2
assign (resid  62 and name C   ) (resid  63 and name N   )
       (resid  63 and name CA  ) (resid  63 and name C   ) 1.0  -116.5   37.5 2
assign (resid  63 and name C   ) (resid  64 and name N   )
       (resid  64 and name CA  ) (resid  64 and name C   ) 1.0  -104.1   39.3 2
assign (resid  64 and name C   ) (resid  65 and name N   )
       (resid  65 and name CA  ) (resid  65 and name C   ) 1.0  -133.1   40.5 2
assign (resid  69 and name C   ) (resid  70 and name N   )
       (resid  70 and name CA  ) (resid  70 and name C   ) 1.0  -66.0   26.3 2
assign (resid  70 and name C   ) (resid  71 and name N   )
       (resid  71 and name CA  ) (resid  71 and name C   ) 1.0  -63.1   18.7 2
assign (resid  71 and name C   ) (resid  72 and name N   )
       (resid  72 and name CA  ) (resid  72 and name C   ) 1.0  -63.1   15.9 2
assign (resid  72 and name C   ) (resid  73 and name N   )
       (resid  73 and name CA  ) (resid  73 and name C   ) 1.0  -58.9   17.4 2
assign (resid  79 and name C   ) (resid  80 and name N   )
       (resid  80 and name CA  ) (resid  80 and name C   ) 1.0  -133.6   53.2 2
assign (resid  80 and name C   ) (resid  81 and name N   )
       (resid  81 and name CA  ) (resid  81 and name C   ) 1.0  -139.8   39.3 2
assign (resid  81 and name C   ) (resid  82 and name N   )
       (resid  82 and name CA  ) (resid  82 and name C   ) 1.0  -111.0   59.0 2
assign (resid  84 and name C   ) (resid  85 and name N   )
       (resid  85 and name CA  ) (resid  85 and name C   ) 1.0  -48.6   32.9 2
assign (resid  85 and name C   ) (resid  86 and name N   )
       (resid  86 and name CA  ) (resid  86 and name C   ) 1.0  -62.0   11.0 2
assign (resid  86 and name C   ) (resid  87 and name N   )
       (resid  87 and name CA  ) (resid  87 and name C   ) 1.0  -54.2   21.6 2
assign (resid  87 and name C   ) (resid  88 and name N   )
       (resid  88 and name CA  ) (resid  88 and name C   ) 1.0  -60.2   13.0 2
assign (resid  88 and name C   ) (resid  89 and name N   )
       (resid  89 and name CA  ) (resid  89 and name C   ) 1.0  -64.2   27.7 2
assign (resid  89 and name C   ) (resid  90 and name N   )
       (resid  90 and name CA  ) (resid  90 and name C   ) 1.0  -68.4   27.2 2
assign (resid  90 and name C   ) (resid  91 and name N   )
       (resid  91 and name CA  ) (resid  91 and name C   ) 1.0  -79.6   61.9 2
assign (resid  91 and name C   ) (resid  92 and name N   )
       (resid  92 and name CA  ) (resid  92 and name C   ) 1.0  -62.0    8.1 2
assign (resid  92 and name C   ) (resid  93 and name N   )
       (resid  93 and name CA  ) (resid  93 and name C   ) 1.0  -64.3   18.4 2
assign (resid  93 and name C   ) (resid  94 and name N   )
       (resid  94 and name CA  ) (resid  94 and name C   ) 1.0  -60.7   12.0 2
assign (resid  94 and name C   ) (resid  95 and name N   )
       (resid  95 and name CA  ) (resid  95 and name C   ) 1.0  -66.9   18.6 2
assign (resid  95 and name C   ) (resid  96 and name N   )
       (resid  96 and name CA  ) (resid  96 and name C   ) 1.0  -62.1   13.9 2
assign (resid  96 and name C   ) (resid  97 and name N   )
       (resid  97 and name CA  ) (resid  97 and name C   ) 1.0  -65.0   25.5 2
assign (resid  97 and name C   ) (resid  98 and name N   )
       (resid  98 and name CA  ) (resid  98 and name C   ) 1.0  -62.9   18.7 2
assign (resid  98 and name C   ) (resid  99 and name N   )
       (resid  99 and name CA  ) (resid  99 and name C   ) 1.0  -65.5   19.1 2
assign (resid  99 and name C   ) (resid 100 and name N   )
       (resid 100 and name CA  ) (resid 100 and name C   ) 1.0  -58.7   14.4 2
assign (resid 100 and name C   ) (resid 101 and name N   )
       (resid 101 and name CA  ) (resid 101 and name C   ) 1.0  -62.8    9.8 2
assign (resid   5 and name N   ) (resid   5 and name CA  )
       (resid   5 and name C   ) (resid   6 and name N   ) 1.0  138.2   34.4 2
assign (resid   6 and name N   ) (resid   6 and name CA  )
       (resid   6 and name C   ) (resid   7 and name N   ) 1.0  128.5   30.6 2
assign (resid   7 and name N   ) (resid   7 and name CA  )
       (resid   7 and name C   ) (resid   8 and name N   ) 1.0  138.3   37.6 2
assign (resid   8 and name N   ) (resid   8 and name CA  )
       (resid   8 and name C   ) (resid   9 and name N   ) 1.0  131.9   34.0 2
assign (resid   9 and name N   ) (resid   9 and name CA  )
       (resid   9 and name C   ) (resid  10 and name N   ) 1.0  143.8   51.5 2
assign (resid  10 and name N   ) (resid  10 and name CA  )
       (resid  10 and name C   ) (resid  11 and name N   ) 1.0  140.8   44.1 2
assign (resid  15 and name N   ) (resid  15 and name CA  )
       (resid  15 and name C   ) (resid  16 and name N   ) 1.0  -36.5   55.8 2
assign (resid  16 and name N   ) (resid  16 and name CA  )
       (resid  16 and name C   ) (resid  17 and name N   ) 1.0  -37.7   31.9 2
assign (resid  17 and name N   ) (resid  17 and name CA  )
       (resid  17 and name C   ) (resid  18 and name N   ) 1.0  -43.4   13.2 2
assign (resid  18 and name N   ) (resid  18 and name CA  )
       (resid  18 and name C   ) (resid  19 and name N   ) 1.0  -45.5   20.0 2
assign (resid  19 and name N   ) (resid  19 and name CA  )
       (resid  19 and name C   ) (resid  20 and name N   ) 1.0  -35.5   31.7 2
assign (resid  20 and name N   ) (resid  20 and name CA  )
       (resid  20 and name C   ) (resid  21 and name N   ) 1.0  -41.5   18.4 2
assign (resid  21 and name N   ) (resid  21 and name CA  )
       (resid  21 and name C   ) (resid  22 and name N   ) 1.0  -41.8   23.8 2
assign (resid  22 and name N   ) (resid  22 and name CA  )
       (resid  22 and name C   ) (resid  23 and name N   ) 1.0  -42.8   14.4 2
assign (resid  23 and name N   ) (resid  23 and name CA  )
       (resid  23 and name C   ) (resid  24 and name N   ) 1.0  -43.2   26.8 2
assign (resid  24 and name N   ) (resid  24 and name CA  )
       (resid  24 and name C   ) (resid  25 and name N   ) 1.0  -42.5   15.3 2
assign (resid  25 and name N   ) (resid  25 and name CA  )
       (resid  25 and name C   ) (resid  26 and name N   ) 1.0  -42.6   17.8 2
assign (resid  26 and name N   ) (resid  26 and name CA  )
       (resid  26 and name C   ) (resid  27 and name N   ) 1.0  -44.0   15.4 2
assign (resid  27 and name N   ) (resid  27 and name CA  )
       (resid  27 and name C   ) (resid  28 and name N   ) 1.0  -39.1   16.8 2
assign (resid  29 and name N   ) (resid  29 and name CA  )
       (resid  29 and name C   ) (resid  30 and name N   ) 1.0  -43.4   14.7 2
assign (resid  30 and name N   ) (resid  30 and name CA  )
       (resid  30 and name C   ) (resid  31 and name N   ) 1.0  -40.1   13.8 2
assign (resid  31 and name N   ) (resid  31 and name CA  )
       (resid  31 and name C   ) (resid  32 and name N   ) 1.0  -36.7   34.0 2
assign (resid  35 and name N   ) (resid  35 and name CA  )
       (resid  35 and name C   ) (resid  36 and name N   ) 1.0  128.0   39.5 2
assign (resid  36 and name N   ) (resid  36 and name CA  )
       (resid  36 and name C   ) (resid  37 and name N   ) 1.0  149.1   30.2 2
assign (resid  37 and name N   ) (resid  37 and name CA  )
       (resid  37 and name C   ) (resid  38 and name N   ) 1.0  138.9   37.8 2
assign (resid  38 and name N   ) (resid  38 and name CA  )
       (resid  38 and name C   ) (resid  39 and name N   ) 1.0  131.8   42.2 2
assign (resid  39 and name N   ) (resid  39 and name CA  )
       (resid  39 and name C   ) (resid  40 and name N   ) 1.0  135.4   45.0 2
assign (resid  40 and name N   ) (resid  40 and name CA  )
       (resid  40 and name C   ) (resid  41 and name N   ) 1.0  135.2   41.9 2
assign (resid  52 and name N   ) (resid  52 and name CA  )
       (resid  52 and name C   ) (resid  53 and name N   ) 1.0  -38.0   20.8 2
assign (resid  53 and name N   ) (resid  53 and name CA  )
       (resid  53 and name C   ) (resid  54 and name N   ) 1.0  -39.0   24.0 2
assign (resid  54 and name N   ) (resid  54 and name CA  )
       (resid  54 and name C   ) (resid  55 and name N   ) 1.0  -42.2   16.5 2
assign (resid  55 and name N   ) (resid  55 and name CA  )
       (resid  55 and name C   ) (resid  56 and name N   ) 1.0  -43.7   12.1 2
assign (resid  56 and name N   ) (resid  56 and name CA  )
       (resid  56 and name C   ) (resid  57 and name N   ) 1.0  -41.9   52.1 2
assign (resid  60 and name N   ) (resid  60 and name CA  )
       (resid  60 and name C   ) (resid  61 and name N   ) 1.0  140.4   50.5 2
assign (resid  61 and name N   ) (resid  61 and name CA  )
       (resid  61 and name C   ) (resid  62 and name N   ) 1.0  131.4   29.9 2
assign (resid  62 and name N   ) (resid  62 and name CA  )
       (resid  62 and name C   ) (resid  63 and name N   ) 1.0  130.9   36.0 2
assign (resid  63 and name N   ) (resid  63 and name CA  )
       (resid  63 and name C   ) (resid  64 and name N   ) 1.0  122.0   44.5 2
assign (resid  64 and name N   ) (resid  64 and name CA  )
       (resid  64 and name C   ) (resid  65 and name N   ) 1.0  127.2   34.9 2
assign (resid  65 and name N   ) (resid  65 and name CA  )
       (resid  65 and name C   ) (resid  66 and name N   ) 1.0  162.4   31.2 2
assign (resid  70 and name N   ) (resid  70 and name CA  )
       (resid  70 and name C   ) (resid  71 and name N   ) 1.0  -36.2   26.1 2
assign (resid  71 and name N   ) (resid  71 and name CA  )
       (resid  71 and name C   ) (resid  72 and name N   ) 1.0  -35.6   26.6 2
assign (resid  72 and name N   ) (resid  72 and name CA  )
       (resid  72 and name C   ) (resid  73 and name N   ) 1.0  -39.2   14.0 2
assign (resid  73 and name N   ) (resid  73 and name CA  )
       (resid  73 and name C   ) (resid  74 and name N   ) 1.0  -44.2   26.2 2
assign (resid  80 and name N   ) (resid  80 and name CA  )
       (resid  80 and name C   ) (resid  81 and name N   ) 1.0  146.8   45.9 2
assign (resid  81 and name N   ) (resid  81 and name CA  )
       (resid  81 and name C   ) (resid  82 and name N   ) 1.0  129.8   31.6 2
assign (resid  82 and name N   ) (resid  82 and name CA  )
       (resid  82 and name C   ) (resid  83 and name N   ) 1.0  127.5   46.5 2
assign (resid  85 and name N   ) (resid  85 and name CA  )
       (resid  85 and name C   ) (resid  86 and name N   ) 1.0  -43.4   39.8 2
assign (resid  86 and name N   ) (resid  86 and name CA  )
       (resid  86 and name C   ) (resid  87 and name N   ) 1.0  -39.2   18.8 2
assign (resid  87 and name N   ) (resid  87 and name CA  )
       (resid  87 and name C   ) (resid  88 and name N   ) 1.0  -44.9   26.2 2
assign (resid  88 and name N   ) (resid  88 and name CA  )
       (resid  88 and name C   ) (resid  89 and name N   ) 1.0  -28.6   41.5 2
assign (resid  89 and name N   ) (resid  89 and name CA  )
       (resid  89 and name C   ) (resid  90 and name N   ) 1.0  -36.1   21.9 2
assign (resid  90 and name N   ) (resid  90 and name CA  )
       (resid  90 and name C   ) (resid  91 and name N   ) 1.0  -34.9   42.2 2
assign (resid  91 and name N   ) (resid  91 and name CA  )
       (resid  91 and name C   ) (resid  92 and name N   ) 1.0  -31.5   71.6 2
assign (resid  92 and name N   ) (resid  92 and name CA  )
       (resid  92 and name C   ) (resid  93 and name N   ) 1.0  -42.8    8.9 2
assign (resid  93 and name N   ) (resid  93 and name CA  )
       (resid  93 and name C   ) (resid  94 and name N   ) 1.0  -40.1   23.4 2
assign (resid  94 and name N   ) (resid  94 and name CA  )
       (resid  94 and name C   ) (resid  95 and name N   ) 1.0  -41.4   17.8 2
assign (resid  95 and name N   ) (resid  95 and name CA  )
       (resid  95 and name C   ) (resid  96 and name N   ) 1.0  -43.2   15.6 2
assign (resid  96 and name N   ) (resid  96 and name CA  )
       (resid  96 and name C   ) (resid  97 and name N   ) 1.0  -45.9   12.5 2
assign (resid  97 and name N   ) (resid  97 and name CA  )
       (resid  97 and name C   ) (resid  98 and name N   ) 1.0  -37.7   31.0 2
assign (resid  98 and name N   ) (resid  98 and name CA  )
       (resid  98 and name C   ) (resid  99 and name N   ) 1.0  -41.5   14.1 2
assign (resid  99 and name N   ) (resid  99 and name CA  )
       (resid  99 and name C   ) (resid 100 and name N   ) 1.0  -42.1   25.2 2
assign (resid 100 and name N   ) (resid 100 and name CA  )
       (resid 100 and name C   ) (resid 101 and name N   ) 1.0  -43.1   13.5 2
assign (resid 101 and name N   ) (resid 101 and name CA  )
       (resid 101 and name C   ) (resid 102 and name N   ) 1.0  -38.8   21.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1 -18.056   2.558  -7.696
    2    H2   MET   1           H2       MET   1 -16.501   3.056  -8.142
    3    H3   MET   1           H3       MET   1 -16.859   2.761  -6.514
    4    HA   MET   1           HA       MET   1 -17.199   0.437  -6.953
    5    HB2  MET   1           HB2      MET   1 -17.974   0.700  -9.291
    6    HB3  MET   1           HB3      MET   1 -16.335   1.122  -9.771
    7    HG2  MET   1           HG2      MET   1 -15.566  -1.096  -9.061
    8    HG3  MET   1           HG3      MET   1 -17.218  -1.517  -8.618
    9    HE1  MET   1           HE1      MET   1 -14.704  -0.804 -11.527
   10    HE2  MET   1           HE2      MET   1 -15.759  -0.785 -12.940
   11    HE3  MET   1           HE3      MET   1 -15.862   0.507 -11.745
   12    H    LYS   2           H        LYS   2 -14.693   2.320  -8.641
   13    HA   LYS   2           HA       LYS   2 -12.651   0.570  -7.522
   14    HB2  LYS   2           HB2      LYS   2 -12.408   2.891  -9.446
   15    HB3  LYS   2           HB3      LYS   2 -11.086   1.847  -8.947
   16    HG2  LYS   2           HG2      LYS   2 -12.348  -0.080  -9.926
   17    HG3  LYS   2           HG3      LYS   2 -13.497   1.090 -10.579
   18    HD2  LYS   2           HD2      LYS   2 -10.533   1.067 -11.141
   19    HD3  LYS   2           HD3      LYS   2 -11.774   0.423 -12.217
   20    HE2  LYS   2           HE2      LYS   2 -11.679   3.284 -11.280
   21    HE3  LYS   2           HE3      LYS   2 -10.961   2.724 -12.788
   22    HZ1  LYS   2           HZ1      LYS   2 -13.138   2.011 -13.531
   23    HZ2  LYS   2           HZ2      LYS   2 -13.161   3.659 -13.131
   24    HZ3  LYS   2           HZ3      LYS   2 -13.841   2.524 -12.074
   25    H    ARG   3           H        ARG   3 -12.327   1.052  -5.406
   26    HA   ARG   3           HA       ARG   3 -12.263   3.754  -4.442
   27    HB2  ARG   3           HB2      ARG   3 -12.778   1.539  -3.144
   28    HB3  ARG   3           HB3      ARG   3 -11.031   1.436  -2.975
   29    HG2  ARG   3           HG2      ARG   3 -11.808   2.471  -1.015
   30    HG3  ARG   3           HG3      ARG   3 -11.124   3.767  -1.998
   31    HD2  ARG   3           HD2      ARG   3 -13.462   4.203  -2.840
   32    HD3  ARG   3           HD3      ARG   3 -14.031   3.092  -1.595
   33    HE   ARG   3           HE       ARG   3 -12.435   5.470  -0.891
   34   HH11  ARG   3          2HH1      ARG   3 -15.383   3.583  -0.576
   35   HH12  ARG   3          1HH1      ARG   3 -16.017   4.562   0.714
   36   HH21  ARG   3          2HH2      ARG   3 -13.240   6.724   0.810
   37   HH22  ARG   3          1HH2      ARG   3 -14.795   6.349   1.515
   38    H    LYS   4           H        LYS   4 -10.476   5.004  -3.954
   39    HA   LYS   4           HA       LYS   4  -8.079   4.338  -5.473
   40    HB2  LYS   4           HB2      LYS   4  -8.634   6.886  -3.963
   41    HB3  LYS   4           HB3      LYS   4  -7.529   6.648  -5.308
   42    HG2  LYS   4           HG2      LYS   4 -10.525   6.441  -5.502
   43    HG3  LYS   4           HG3      LYS   4  -9.586   7.878  -5.904
   44    HD2  LYS   4           HD2      LYS   4  -8.484   6.746  -7.696
   45    HD3  LYS   4           HD3      LYS   4  -9.169   5.193  -7.207
   46    HE2  LYS   4           HE2      LYS   4 -10.297   6.237  -9.170
   47    HE3  LYS   4           HE3      LYS   4 -11.374   5.900  -7.816
   48    HZ1  LYS   4           HZ1      LYS   4 -10.163   8.558  -8.364
   49    HZ2  LYS   4           HZ2      LYS   4 -11.344   8.196  -7.201
   50    HZ3  LYS   4           HZ3      LYS   4 -11.718   8.099  -8.853
   51    H    ILE   5           H        ILE   5  -6.457   3.302  -4.463
   52    HA   ILE   5           HA       ILE   5  -5.855   4.030  -1.669
   53    HB   ILE   5           HB       ILE   5  -5.941   1.193  -2.731
   54   HG12  ILE   5          2HG1      ILE   5  -7.713   2.505  -0.660
   55   HG13  ILE   5          3HG1      ILE   5  -8.184   2.211  -2.330
   56   HG21  ILE   5          2HG2      ILE   5  -4.169   1.503  -1.093
   57   HG22  ILE   5          1HG2      ILE   5  -5.473   0.526  -0.418
   58   HG23  ILE   5          3HG2      ILE   5  -5.318   2.224   0.035
   59   HD11  ILE   5          3HD1      ILE   5  -9.097   0.526  -0.841
   60   HD12  ILE   5          2HD1      ILE   5  -7.473   0.106  -0.298
   61   HD13  ILE   5          1HD1      ILE   5  -7.947  -0.190  -1.971
   62    H    ILE   6           H        ILE   6  -3.686   4.202  -1.214
   63    HA   ILE   6           HA       ILE   6  -1.817   3.144  -3.233
   64    HB   ILE   6           HB       ILE   6  -0.166   4.837  -2.610
   65   HG12  ILE   6          2HG1      ILE   6  -1.177   5.204  -0.265
   66   HG13  ILE   6          3HG1      ILE   6  -0.514   6.605  -1.100
   67   HG21  ILE   6          2HG2      ILE   6  -1.235   6.785  -3.648
   68   HG22  ILE   6          1HG2      ILE   6  -2.807   6.012  -3.448
   69   HG23  ILE   6          3HG2      ILE   6  -1.592   5.282  -4.498
   70   HD11  ILE   6          3HD1      ILE   6  -2.598   7.151  -0.007
   71   HD12  ILE   6          2HD1      ILE   6  -3.427   5.870  -0.892
   72   HD13  ILE   6          1HD1      ILE   6  -2.775   7.262  -1.759
   73    H    ALA   7           H        ALA   7   0.061   2.108  -2.450
   74    HA   ALA   7           HA       ALA   7   0.148   1.565   0.422
   75    HB1  ALA   7           HB1      ALA   7  -0.103  -0.633  -1.631
   76    HB2  ALA   7           HB2      ALA   7   0.136  -0.848   0.103
   77    HB3  ALA   7           HB3      ALA   7  -1.360  -0.135  -0.498
   78    H    VAL   8           H        VAL   8   2.191   1.372   1.144
   79    HA   VAL   8           HA       VAL   8   4.307   1.227  -0.893
   80    HB   VAL   8           HB       VAL   8   4.527   2.217   1.953
   81   HG11  VAL   8          2HG1      VAL   8   6.620   1.331   1.083
   82   HG12  VAL   8          1HG1      VAL   8   6.705   3.087   1.230
   83   HG13  VAL   8          3HG1      VAL   8   6.470   2.344  -0.353
   84   HG21  VAL   8          3HG2      VAL   8   4.697   4.457   0.940
   85   HG22  VAL   8          2HG2      VAL   8   3.125   3.706   0.660
   86   HG23  VAL   8          1HG2      VAL   8   4.322   3.756  -0.634
   87    H    THR   9           H        THR   9   5.631  -0.438  -0.963
   88    HA   THR   9           HA       THR   9   5.736  -2.294   1.326
   89    HB   THR   9           HB       THR   9   6.356  -4.044  -0.409
   90    HG1  THR   9           HG1      THR   9   5.812  -1.852  -2.061
   91   HG21  THR   9          3HG2      THR   9   4.140  -3.993   0.616
   92   HG22  THR   9          1HG2      THR   9   4.030  -4.466  -1.079
   93   HG23  THR   9          2HG2      THR   9   3.595  -2.828  -0.590
   94    H    ALA  10           H        ALA  10   7.719  -2.541   2.215
   95    HA   ALA  10           HA       ALA  10  10.103  -2.103   0.620
   96    HB1  ALA  10           HB1      ALA  10   9.505  -0.334   2.986
   97    HB2  ALA  10           HB2      ALA  10  10.997  -0.342   2.046
   98    HB3  ALA  10           HB3      ALA  10   9.484   0.167   1.296
   99    H    CYS  11           H        CYS  11  11.598  -3.491   1.214
  100    HA   CYS  11           HA       CYS  11  12.041  -4.083   4.020
  101    HB2  CYS  11           HB2      CYS  11  10.440  -5.839   3.201
  102    HB3  CYS  11           HB3      CYS  11  11.643  -6.318   2.011
  103    HG   CYS  11           HG       CYS  11  11.289  -7.361   5.071
  104    H    ALA  12           H        ALA  12  14.194  -4.792   4.407
  105    HA   ALA  12           HA       ALA  12  16.009  -4.025   2.256
  106    HB1  ALA  12           HB1      ALA  12  16.327  -2.968   4.428
  107    HB2  ALA  12           HB2      ALA  12  16.561  -4.548   5.176
  108    HB3  ALA  12           HB3      ALA  12  17.729  -3.948   3.998
  109    H    THR  13           H        THR  13  16.404  -6.451   4.819
  110    HA   THR  13           HA       THR  13  17.535  -8.272   2.845
  111    HB   THR  13           HB       THR  13  17.994  -9.617   5.045
  112    HG1  THR  13           HG1      THR  13  16.921  -8.489   6.577
  113   HG21  THR  13          3HG2      THR  13  20.066  -8.328   5.400
  114   HG22  THR  13          1HG2      THR  13  19.415  -7.027   4.405
  115   HG23  THR  13          2HG2      THR  13  19.746  -8.604   3.688
  116    H    GLY  14           H        GLY  14  15.837  -9.152   1.793
  117    HA2  GLY  14           HA1      GLY  14  14.460 -11.256   2.080
  118    HA3  GLY  14           HA2      GLY  14  13.702 -10.391   3.414
  119    H    VAL  15           H        VAL  15  14.661  -9.401   0.137
  120    HA   VAL  15           HA       VAL  15  12.422  -7.708  -0.167
  121    HB   VAL  15           HB       VAL  15  13.148  -7.449  -2.491
  122   HG11  VAL  15          2HG1      VAL  15  14.208  -6.120  -0.753
  123   HG12  VAL  15          1HG1      VAL  15  15.360  -6.507  -2.030
  124   HG13  VAL  15          3HG1      VAL  15  15.410  -7.387  -0.503
  125   HG21  VAL  15          3HG2      VAL  15  13.835  -9.736  -2.961
  126   HG22  VAL  15          2HG2      VAL  15  15.184  -9.572  -1.838
  127   HG23  VAL  15          1HG2      VAL  15  15.141  -8.605  -3.313
  128    H    ALA  16           H        ALA  16  12.783 -11.075  -0.581
  129    HA   ALA  16           HA       ALA  16  10.907 -11.635  -2.573
  130    HB1  ALA  16           HB1      ALA  16  10.636 -13.810  -1.505
  131    HB2  ALA  16           HB2      ALA  16  12.337 -13.347  -1.550
  132    HB3  ALA  16           HB3      ALA  16  11.425 -13.207  -0.048
  133    H    HIS  17           H        HIS  17  10.509 -10.732   0.794
  134    HA   HIS  17           HA       HIS  17   7.712 -11.090   0.986
  135    HB2  HIS  17           HB2      HIS  17   9.606  -9.201   2.387
  136    HB3  HIS  17           HB3      HIS  17   7.887  -9.252   2.749
  137    HD1  HIS  17           HD1      HIS  17  10.921 -10.469   4.034
  138    HD2  HIS  17           HD2      HIS  17   7.177 -12.165   3.408
  139    HE1  HIS  17           HE1      HIS  17  10.801 -12.437   5.583
  140    HE2  HIS  17           HE2      HIS  17   8.453 -13.320   5.339
  141    H    THR  18           H        THR  18   9.665  -8.243   0.195
  142    HA   THR  18           HA       THR  18   7.677  -6.363  -0.134
  143    HB   THR  18           HB       THR  18  10.142  -6.470  -1.866
  144    HG1  THR  18           HG1      THR  18  11.346  -5.910  -0.153
  145   HG21  THR  18          3HG2      THR  18   8.598  -4.635  -2.310
  146   HG22  THR  18          1HG2      THR  18  10.080  -4.030  -1.574
  147   HG23  THR  18          2HG2      THR  18   8.616  -4.190  -0.603
  148    H    TYR  19           H        TYR  19   9.160  -8.392  -2.670
  149    HA   TYR  19           HA       TYR  19   7.547  -7.319  -4.735
  150    HB2  TYR  19           HB2      TYR  19   9.276  -9.781  -4.585
  151    HB3  TYR  19           HB3      TYR  19   8.389  -9.335  -6.041
  152    HD1  TYR  19           HD1      TYR  19   8.971  -7.290  -7.268
  153    HD2  TYR  19           HD2      TYR  19  11.247  -8.574  -3.914
  154    HE1  TYR  19           HE1      TYR  19  10.790  -5.775  -7.931
  155    HE2  TYR  19           HE2      TYR  19  13.073  -7.064  -4.566
  156    HH   TYR  19           HH       TYR  19  12.682  -4.605  -6.894
  157    H    MET  20           H        MET  20   7.334 -10.343  -2.876
  158    HA   MET  20           HA       MET  20   5.170 -11.423  -4.309
  159    HB2  MET  20           HB2      MET  20   6.592 -12.736  -2.777
  160    HB3  MET  20           HB3      MET  20   5.899 -11.874  -1.410
  161    HG2  MET  20           HG2      MET  20   4.875 -14.042  -1.636
  162    HG3  MET  20           HG3      MET  20   3.694 -12.777  -1.971
  163    HE1  MET  20           HE1      MET  20   6.061 -15.497  -3.548
  164    HE2  MET  20           HE2      MET  20   5.742 -15.276  -5.270
  165    HE3  MET  20           HE3      MET  20   6.569 -14.015  -4.357
  166    H    ALA  21           H        ALA  21   5.282  -9.356  -1.436
  167    HA   ALA  21           HA       ALA  21   2.517  -9.334  -0.920
  168    HB1  ALA  21           HB1      ALA  21   2.952  -7.345   0.410
  169    HB2  ALA  21           HB2      ALA  21   4.198  -8.561   0.693
  170    HB3  ALA  21           HB3      ALA  21   4.539  -7.174  -0.341
  171    H    ALA  22           H        ALA  22   4.571  -7.141  -2.806
  172    HA   ALA  22           HA       ALA  22   2.567  -5.327  -3.565
  173    HB1  ALA  22           HB1      ALA  22   4.937  -4.826  -3.780
  174    HB2  ALA  22           HB2      ALA  22   5.108  -6.076  -5.014
  175    HB3  ALA  22           HB3      ALA  22   4.126  -4.647  -5.336
  176    H    GLN  23           H        GLN  23   3.496  -8.451  -4.889
  177    HA   GLN  23           HA       GLN  23   1.978  -8.120  -7.309
  178    HB2  GLN  23           HB2      GLN  23   3.063 -10.645  -6.051
  179    HB3  GLN  23           HB3      GLN  23   2.362 -10.534  -7.656
  180    HG2  GLN  23           HG2      GLN  23   4.946  -9.380  -6.669
  181    HG3  GLN  23           HG3      GLN  23   4.691 -10.559  -7.950
  182   HE21  GLN  23          1HE2      GLN  23   4.732  -7.229  -7.092
  183   HE22  GLN  23          2HE2      GLN  23   4.557  -6.589  -8.689
  184    H    ALA  24           H        ALA  24   1.525 -10.035  -4.330
  185    HA   ALA  24           HA       ALA  24  -0.982 -11.094  -5.058
  186    HB1  ALA  24           HB1      ALA  24   0.402 -12.070  -3.303
  187    HB2  ALA  24           HB2      ALA  24   0.150 -10.641  -2.299
  188    HB3  ALA  24           HB3      ALA  24  -1.211 -11.690  -2.698
  189    H    LEU  25           H        LEU  25  -0.099  -8.253  -3.161
  190    HA   LEU  25           HA       LEU  25  -2.674  -7.424  -2.429
  191    HB2  LEU  25           HB2      LEU  25  -0.644  -6.536  -1.426
  192    HB3  LEU  25           HB3      LEU  25  -0.172  -5.821  -2.953
  193    HG   LEU  25           HG       LEU  25  -2.166  -4.330  -2.811
  194   HD11  LEU  25          2HD1      LEU  25  -3.307  -4.105  -0.665
  195   HD12  LEU  25          1HD1      LEU  25  -2.388  -5.465  -0.022
  196   HD13  LEU  25          3HD1      LEU  25  -3.540  -5.721  -1.332
  197   HD21  LEU  25          3HD2      LEU  25  -1.167  -2.837  -1.199
  198   HD22  LEU  25          2HD2      LEU  25   0.104  -3.661  -2.107
  199   HD23  LEU  25          1HD2      LEU  25  -0.283  -4.175  -0.463
  200    H    LYS  26           H        LYS  26  -0.717  -6.716  -5.285
  201    HA   LYS  26           HA       LYS  26  -2.458  -4.833  -6.468
  202    HB2  LYS  26           HB2      LYS  26  -0.012  -5.334  -7.034
  203    HB3  LYS  26           HB3      LYS  26  -0.616  -6.690  -7.972
  204    HG2  LYS  26           HG2      LYS  26  -1.955  -5.111  -9.320
  205    HG3  LYS  26           HG3      LYS  26  -1.225  -3.779  -8.422
  206    HD2  LYS  26           HD2      LYS  26   0.184  -5.777 -10.187
  207    HD3  LYS  26           HD3      LYS  26  -0.042  -4.057 -10.499
  208    HE2  LYS  26           HE2      LYS  26   1.324  -3.561  -8.489
  209    HE3  LYS  26           HE3      LYS  26   1.617  -5.290  -8.298
  210    HZ1  LYS  26           HZ1      LYS  26   3.474  -4.501  -9.443
  211    HZ2  LYS  26           HZ2      LYS  26   2.560  -3.484 -10.440
  212    HZ3  LYS  26           HZ3      LYS  26   2.510  -5.163 -10.674
  213    H    LYS  27           H        LYS  27  -2.075  -8.330  -6.891
  214    HA   LYS  27           HA       LYS  27  -4.004  -8.718  -8.881
  215    HB2  LYS  27           HB2      LYS  27  -2.942 -10.515  -6.713
  216    HB3  LYS  27           HB3      LYS  27  -4.135 -11.070  -7.876
  217    HG2  LYS  27           HG2      LYS  27  -2.586 -10.621  -9.700
  218    HG3  LYS  27           HG3      LYS  27  -1.398 -10.004  -8.548
  219    HD2  LYS  27           HD2      LYS  27  -1.165 -12.156  -7.531
  220    HD3  LYS  27           HD3      LYS  27  -2.518 -12.804  -8.460
  221    HE2  LYS  27           HE2      LYS  27   0.102 -11.836  -9.608
  222    HE3  LYS  27           HE3      LYS  27  -0.340 -13.523  -9.351
  223    HZ1  LYS  27           HZ1      LYS  27  -2.279 -13.081 -10.859
  224    HZ2  LYS  27           HZ2      LYS  27  -0.761 -13.047 -11.603
  225    HZ3  LYS  27           HZ3      LYS  27  -1.557 -11.594 -11.248
  226    H    GLY  28           H        GLY  28  -4.291  -8.904  -5.353
  227    HA2  GLY  28           HA1      GLY  28  -7.010  -9.613  -5.256
  228    HA3  GLY  28           HA2      GLY  28  -6.110  -8.835  -3.963
  229    H    ALA  29           H        ALA  29  -5.464  -6.412  -5.136
  230    HA   ALA  29           HA       ALA  29  -7.830  -4.945  -4.710
  231    HB1  ALA  29           HB1      ALA  29  -6.547  -2.994  -5.400
  232    HB2  ALA  29           HB2      ALA  29  -5.596  -4.022  -4.328
  233    HB3  ALA  29           HB3      ALA  29  -5.293  -4.040  -6.065
  234    H    LYS  30           H        LYS  30  -6.187  -5.959  -7.657
  235    HA   LYS  30           HA       LYS  30  -7.905  -4.582  -9.449
  236    HB2  LYS  30           HB2      LYS  30  -5.652  -5.411 -10.068
  237    HB3  LYS  30           HB3      LYS  30  -6.242  -7.063  -9.935
  238    HG2  LYS  30           HG2      LYS  30  -6.193  -6.441 -12.244
  239    HG3  LYS  30           HG3      LYS  30  -7.875  -6.575 -11.729
  240    HD2  LYS  30           HD2      LYS  30  -7.878  -4.094 -11.388
  241    HD3  LYS  30           HD3      LYS  30  -6.279  -4.050 -12.131
  242    HE2  LYS  30           HE2      LYS  30  -8.834  -5.017 -13.405
  243    HE3  LYS  30           HE3      LYS  30  -7.989  -3.513 -13.763
  244    HZ1  LYS  30           HZ1      LYS  30  -6.096  -4.829 -14.548
  245    HZ2  LYS  30           HZ2      LYS  30  -7.508  -5.168 -15.425
  246    HZ3  LYS  30           HZ3      LYS  30  -6.961  -6.258 -14.250
  247    H    LYS  31           H        LYS  31  -7.921  -7.807  -8.030
  248    HA   LYS  31           HA       LYS  31 -10.033  -8.892  -9.553
  249    HB2  LYS  31           HB2      LYS  31  -8.423 -10.171  -8.105
  250    HB3  LYS  31           HB3      LYS  31  -9.304  -9.577  -6.700
  251    HG2  LYS  31           HG2      LYS  31  -9.997 -11.830  -7.255
  252    HG3  LYS  31           HG3      LYS  31 -11.325 -10.695  -7.502
  253    HD2  LYS  31           HD2      LYS  31 -10.898 -10.684  -9.898
  254    HD3  LYS  31           HD3      LYS  31  -9.519 -11.761  -9.675
  255    HE2  LYS  31           HE2      LYS  31 -11.451 -13.011 -10.437
  256    HE3  LYS  31           HE3      LYS  31 -11.018 -13.487  -8.796
  257    HZ1  LYS  31           HZ1      LYS  31 -12.811 -12.184  -7.929
  258    HZ2  LYS  31           HZ2      LYS  31 -13.430 -13.189  -9.147
  259    HZ3  LYS  31           HZ3      LYS  31 -13.165 -11.547  -9.462
  260    H    MET  32           H        MET  32  -9.955  -7.047  -6.569
  261    HA   MET  32           HA       MET  32 -12.759  -7.250  -6.057
  262    HB2  MET  32           HB2      MET  32 -10.673  -5.331  -5.009
  263    HB3  MET  32           HB3      MET  32 -12.319  -5.437  -4.403
  264    HG2  MET  32           HG2      MET  32 -10.374  -7.732  -4.375
  265    HG3  MET  32           HG3      MET  32 -10.592  -6.610  -3.032
  266    HE1  MET  32           HE1      MET  32 -13.696  -6.055  -3.112
  267    HE2  MET  32           HE2      MET  32 -14.313  -7.287  -2.012
  268    HE3  MET  32           HE3      MET  32 -12.834  -6.409  -1.615
  269    H    GLY  33           H        GLY  33 -10.791  -5.277  -8.067
  270    HA2  GLY  33           HA1      GLY  33 -11.590  -3.966  -9.833
  271    HA3  GLY  33           HA2      GLY  33 -13.176  -3.957  -9.079
  272    H    ASN  34           H        ASN  34  -9.933  -2.929  -7.995
  273    HA   ASN  34           HA       ASN  34 -11.069  -0.253  -7.521
  274    HB2  ASN  34           HB2      ASN  34  -9.127  -1.726  -5.723
  275    HB3  ASN  34           HB3      ASN  34  -9.648  -0.060  -5.504
  276   HD21  ASN  34          1HD2      ASN  34 -10.501  -3.387  -5.214
  277   HD22  ASN  34          2HD2      ASN  34 -11.968  -3.148  -4.332
  278    H    LEU  35           H        LEU  35  -9.028   1.243  -6.909
  279    HA   LEU  35           HA       LEU  35  -6.968   0.762  -8.962
  280    HB2  LEU  35           HB2      LEU  35  -8.210   3.374  -8.099
  281    HB3  LEU  35           HB3      LEU  35  -6.767   3.264  -9.089
  282    HG   LEU  35           HG       LEU  35  -9.507   2.250  -9.852
  283   HD11  LEU  35          2HD1      LEU  35  -9.448   4.055 -11.505
  284   HD12  LEU  35          1HD1      LEU  35  -7.915   4.615 -10.835
  285   HD13  LEU  35          3HD1      LEU  35  -9.382   4.676  -9.857
  286   HD21  LEU  35          3HD2      LEU  35  -8.509   1.844 -12.049
  287   HD22  LEU  35          2HD2      LEU  35  -7.724   0.878 -10.800
  288   HD23  LEU  35          1HD2      LEU  35  -6.932   2.324 -11.425
  289    H    ILE  36           H        ILE  36  -5.134   0.255  -7.973
  290    HA   ILE  36           HA       ILE  36  -4.532   1.591  -5.428
  291    HB   ILE  36           HB       ILE  36  -5.140  -0.798  -5.130
  292   HG12  ILE  36          2HG1      ILE  36  -2.244  -0.167  -4.523
  293   HG13  ILE  36          3HG1      ILE  36  -3.619   0.368  -3.565
  294   HG21  ILE  36          2HG2      ILE  36  -2.643  -1.331  -6.738
  295   HG22  ILE  36          1HG2      ILE  36  -4.298  -1.679  -7.237
  296   HG23  ILE  36          3HG2      ILE  36  -3.590  -2.541  -5.872
  297   HD11  ILE  36          3HD1      ILE  36  -4.166  -1.959  -3.062
  298   HD12  ILE  36          2HD1      ILE  36  -2.533  -1.539  -2.542
  299   HD13  ILE  36          1HD1      ILE  36  -2.776  -2.487  -4.010
  300    H    LYS  37           H        LYS  37  -2.495   2.301  -5.085
  301    HA   LYS  37           HA       LYS  37  -0.559   2.009  -7.292
  302    HB2  LYS  37           HB2      LYS  37  -1.062   4.277  -5.366
  303    HB3  LYS  37           HB3      LYS  37   0.429   4.149  -6.285
  304    HG2  LYS  37           HG2      LYS  37  -2.266   4.183  -7.601
  305    HG3  LYS  37           HG3      LYS  37  -1.380   5.660  -7.212
  306    HD2  LYS  37           HD2      LYS  37   0.534   4.792  -8.541
  307    HD3  LYS  37           HD3      LYS  37  -0.465   3.413  -9.006
  308    HE2  LYS  37           HE2      LYS  37  -2.025   4.848 -10.125
  309    HE3  LYS  37           HE3      LYS  37  -1.206   6.287  -9.519
  310    HZ1  LYS  37           HZ1      LYS  37  -0.007   4.298 -11.374
  311    HZ2  LYS  37           HZ2      LYS  37   0.722   5.730 -10.835
  312    HZ3  LYS  37           HZ3      LYS  37  -0.648   5.800 -11.834
  313    H    VAL  38           H        VAL  38   0.740   0.375  -6.659
  314    HA   VAL  38           HA       VAL  38   1.528   0.200  -3.848
  315    HB   VAL  38           HB       VAL  38   2.093  -1.798  -6.047
  316   HG11  VAL  38          2HG1      VAL  38   2.211  -2.044  -3.045
  317   HG12  VAL  38          1HG1      VAL  38   3.596  -1.952  -4.134
  318   HG13  VAL  38          3HG1      VAL  38   2.510  -3.341  -4.200
  319   HG21  VAL  38          3HG2      VAL  38  -0.144  -1.779  -4.022
  320   HG22  VAL  38          2HG2      VAL  38   0.235  -3.107  -5.118
  321   HG23  VAL  38          1HG2      VAL  38  -0.314  -1.560  -5.764
  322    H    GLU  39           H        GLU  39   3.327   1.141  -3.255
  323    HA   GLU  39           HA       GLU  39   5.418   1.695  -5.220
  324    HB2  GLU  39           HB2      GLU  39   4.660   3.543  -3.798
  325    HB3  GLU  39           HB3      GLU  39   5.060   2.617  -2.360
  326    HG2  GLU  39           HG2      GLU  39   7.376   2.776  -2.781
  327    HG3  GLU  39           HG3      GLU  39   7.110   3.375  -4.417
  328    H    THR  40           H        THR  40   7.358   0.691  -5.201
  329    HA   THR  40           HA       THR  40   7.773  -1.330  -3.106
  330    HB   THR  40           HB       THR  40   8.569  -1.519  -6.017
  331    HG1  THR  40           HG1      THR  40   6.516  -2.853  -4.547
  332   HG21  THR  40          3HG2      THR  40   8.730  -3.554  -3.791
  333   HG22  THR  40          1HG2      THR  40  10.099  -2.723  -4.529
  334   HG23  THR  40          2HG2      THR  40   9.130  -3.846  -5.483
  335    H    GLN  41           H        GLN  41   9.375  -0.702  -1.823
  336    HA   GLN  41           HA       GLN  41  11.699   0.647  -3.017
  337    HB2  GLN  41           HB2      GLN  41  10.656   0.503  -0.201
  338    HB3  GLN  41           HB3      GLN  41  12.320   0.961  -0.527
  339    HG2  GLN  41           HG2      GLN  41  11.460   2.796  -1.970
  340    HG3  GLN  41           HG3      GLN  41   9.832   2.377  -1.437
  341   HE21  GLN  41          1HE2      GLN  41  12.566   2.104   0.690
  342   HE22  GLN  41          2HE2      GLN  41  12.146   3.419   1.724
  343    H    GLY  42           H        GLY  42  13.268  -0.669  -3.604
  344    HA2  GLY  42           HA1      GLY  42  13.802  -3.168  -2.255
  345    HA3  GLY  42           HA2      GLY  42  14.773  -2.435  -3.532
  346    H    ALA  43           H        ALA  43  13.795  -1.803  -0.209
  347    HA   ALA  43           HA       ALA  43  14.911  -1.194   1.664
  348    HB1  ALA  43           HB1      ALA  43  16.692  -2.765   1.059
  349    HB2  ALA  43           HB2      ALA  43  17.458  -1.514   0.080
  350    HB3  ALA  43           HB3      ALA  43  17.332  -1.313   1.828
  351    H    THR  44           H        THR  44  17.027   0.252  -0.819
  352    HA   THR  44           HA       THR  44  16.127   2.884   0.152
  353    HB   THR  44           HB       THR  44  18.738   2.259  -1.245
  354    HG1  THR  44           HG1      THR  44  18.819   1.315   0.779
  355   HG21  THR  44          3HG2      THR  44  19.397   4.487  -0.453
  356   HG22  THR  44          1HG2      THR  44  17.790   4.717   0.237
  357   HG23  THR  44          2HG2      THR  44  17.987   4.573  -1.510
  358    H    GLY  45           H        GLY  45  16.711   0.875  -2.653
  359    HA2  GLY  45           HA1      GLY  45  16.244   2.976  -4.563
  360    HA3  GLY  45           HA2      GLY  45  16.432   1.266  -4.913
  361    H    ILE  46           H        ILE  46  14.303   3.823  -4.825
  362    HA   ILE  46           HA       ILE  46  11.911   2.238  -4.368
  363    HB   ILE  46           HB       ILE  46  12.097   5.086  -5.385
  364   HG12  ILE  46          2HG1      ILE  46  11.811   4.119  -2.528
  365   HG13  ILE  46          3HG1      ILE  46  13.268   4.831  -3.215
  366   HG21  ILE  46          2HG2      ILE  46   9.940   4.008  -5.746
  367   HG22  ILE  46          1HG2      ILE  46   9.812   5.271  -4.521
  368   HG23  ILE  46          3HG2      ILE  46   9.860   3.576  -4.038
  369   HD11  ILE  46          3HD1      ILE  46  10.612   6.217  -2.916
  370   HD12  ILE  46          2HD1      ILE  46  12.089   6.930  -3.562
  371   HD13  ILE  46          1HD1      ILE  46  12.017   6.432  -1.872
  372    H    GLU  47           H        GLU  47  10.915   1.118  -5.959
  373    HA   GLU  47           HA       GLU  47  11.926   1.508  -8.681
  374    HB2  GLU  47           HB2      GLU  47  10.274  -0.757  -7.573
  375    HB3  GLU  47           HB3      GLU  47  11.058  -0.706  -9.147
  376    HG2  GLU  47           HG2      GLU  47  13.232  -0.390  -7.817
  377    HG3  GLU  47           HG3      GLU  47  12.293  -0.967  -6.440
  378    H    ASN  48           H        ASN  48   9.129   2.100  -6.825
  379    HA   ASN  48           HA       ASN  48   7.813   3.081  -9.245
  380    HB2  ASN  48           HB2      ASN  48   6.819   0.837  -8.653
  381    HB3  ASN  48           HB3      ASN  48   6.290   1.543  -7.128
  382   HD21  ASN  48          1HD2      ASN  48   4.114   1.281  -7.556
  383   HD22  ASN  48          2HD2      ASN  48   3.279   2.196  -8.770
  384    H    GLU  49           H        GLU  49   8.514   5.108  -8.518
  385    HA   GLU  49           HA       GLU  49   7.961   5.993  -5.848
  386    HB2  GLU  49           HB2      GLU  49   9.943   6.780  -7.037
  387    HB3  GLU  49           HB3      GLU  49   8.931   7.516  -8.272
  388    HG2  GLU  49           HG2      GLU  49   7.960   8.979  -6.506
  389    HG3  GLU  49           HG3      GLU  49   9.146   8.317  -5.382
  390    H    LEU  50           H        LEU  50   5.974   6.454  -5.225
  391    HA   LEU  50           HA       LEU  50   4.001   7.466  -7.083
  392    HB2  LEU  50           HB2      LEU  50   3.820   7.146  -4.085
  393    HB3  LEU  50           HB3      LEU  50   2.481   7.418  -5.183
  394    HG   LEU  50           HG       LEU  50   4.210   4.946  -5.074
  395   HD11  LEU  50          2HD1      LEU  50   2.177   3.850  -4.292
  396   HD12  LEU  50          1HD1      LEU  50   1.329   5.396  -4.313
  397   HD13  LEU  50          3HD1      LEU  50   2.670   5.141  -3.196
  398   HD21  LEU  50          3HD2      LEU  50   2.619   4.024  -6.707
  399   HD22  LEU  50          2HD2      LEU  50   3.511   5.401  -7.355
  400   HD23  LEU  50          1HD2      LEU  50   1.841   5.603  -6.825
  401    H    THR  51           H        THR  51   3.845   9.534  -7.599
  402    HA   THR  51           HA       THR  51   5.250  11.525  -6.043
  403    HB   THR  51           HB       THR  51   4.471  13.114  -7.808
  404    HG1  THR  51           HG1      THR  51   3.043  10.820  -8.587
  405   HG21  THR  51          3HG2      THR  51   6.611  11.989  -8.041
  406   HG22  THR  51          1HG2      THR  51   5.835  12.159  -9.615
  407   HG23  THR  51          2HG2      THR  51   5.821  10.601  -8.789
  408    H    GLU  52           H        GLU  52   4.000  13.728  -5.858
  409    HA   GLU  52           HA       GLU  52   2.072  13.509  -3.885
  410    HB2  GLU  52           HB2      GLU  52   2.699  15.753  -5.797
  411    HB3  GLU  52           HB3      GLU  52   1.492  15.915  -4.532
  412    HG2  GLU  52           HG2      GLU  52   3.684  16.863  -3.928
  413    HG3  GLU  52           HG3      GLU  52   3.146  15.597  -2.828
  414    H    LYS  53           H        LYS  53   1.683  13.889  -7.363
  415    HA   LYS  53           HA       LYS  53  -1.057  14.163  -7.565
  416    HB2  LYS  53           HB2      LYS  53   0.335  14.339  -9.505
  417    HB3  LYS  53           HB3      LYS  53   0.902  12.684  -9.324
  418    HG2  LYS  53           HG2      LYS  53  -1.348  11.864  -9.828
  419    HG3  LYS  53           HG3      LYS  53  -1.904  13.527 -10.022
  420    HD2  LYS  53           HD2      LYS  53  -1.449  12.531 -12.187
  421    HD3  LYS  53           HD3      LYS  53  -0.310  13.837 -11.859
  422    HE2  LYS  53           HE2      LYS  53   0.908  12.019 -12.816
  423    HE3  LYS  53           HE3      LYS  53   1.335  12.119 -11.110
  424    HZ1  LYS  53           HZ1      LYS  53  -0.788  10.288 -12.047
  425    HZ2  LYS  53           HZ2      LYS  53   0.126  10.207 -10.621
  426    HZ3  LYS  53           HZ3      LYS  53   0.842   9.835 -12.107
  427    H    ASP  54           H        ASP  54   0.781  11.111  -7.546
  428    HA   ASP  54           HA       ASP  54  -1.505   9.450  -7.761
  429    HB2  ASP  54           HB2      ASP  54   1.164   8.626  -6.611
  430    HB3  ASP  54           HB3      ASP  54  -0.020   7.607  -7.420
  431    H    VAL  55           H        VAL  55   0.406  10.607  -5.088
  432    HA   VAL  55           HA       VAL  55  -0.779   9.006  -3.086
  433    HB   VAL  55           HB       VAL  55   0.871  11.520  -3.027
  434   HG11  VAL  55          2HG1      VAL  55  -0.557  11.661  -1.080
  435   HG12  VAL  55          1HG1      VAL  55   1.082  11.208  -0.597
  436   HG13  VAL  55          3HG1      VAL  55  -0.189   9.987  -0.666
  437   HG21  VAL  55          3HG2      VAL  55   1.888   9.347  -3.639
  438   HG22  VAL  55          2HG2      VAL  55   1.397   8.726  -2.060
  439   HG23  VAL  55          1HG2      VAL  55   2.560  10.051  -2.166
  440    H    ASN  56           H        ASN  56  -1.628  12.132  -4.456
  441    HA   ASN  56           HA       ASN  56  -3.653  12.612  -2.465
  442    HB2  ASN  56           HB2      ASN  56  -2.779  14.018  -4.952
  443    HB3  ASN  56           HB3      ASN  56  -4.357  14.395  -4.265
  444   HD21  ASN  56          1HD2      ASN  56  -0.918  14.540  -3.806
  445   HD22  ASN  56          2HD2      ASN  56  -0.944  15.655  -2.480
  446    H    ILE  57           H        ILE  57  -3.450  10.938  -5.472
  447    HA   ILE  57           HA       ILE  57  -6.234  10.834  -6.033
  448    HB   ILE  57           HB       ILE  57  -4.033   8.898  -6.786
  449   HG12  ILE  57          2HG1      ILE  57  -5.418  11.042  -8.413
  450   HG13  ILE  57          3HG1      ILE  57  -3.816  11.197  -7.702
  451   HG21  ILE  57          2HG2      ILE  57  -6.188   7.770  -6.825
  452   HG22  ILE  57          1HG2      ILE  57  -5.594   8.026  -8.465
  453   HG23  ILE  57          3HG2      ILE  57  -6.866   9.062  -7.817
  454   HD11  ILE  57          3HD1      ILE  57  -3.013   9.369  -9.095
  455   HD12  ILE  57          2HD1      ILE  57  -3.695  10.670 -10.071
  456   HD13  ILE  57          1HD1      ILE  57  -4.621   9.194  -9.798
  457    H    GLY  58           H        GLY  58  -4.044   8.440  -4.527
  458    HA2  GLY  58           HA1      GLY  58  -6.215   6.795  -3.635
  459    HA3  GLY  58           HA2      GLY  58  -4.528   6.639  -3.163
  460    H    GLU  59           H        GLU  59  -7.273   6.764  -1.706
  461    HA   GLU  59           HA       GLU  59  -6.777   9.060   0.011
  462    HB2  GLU  59           HB2      GLU  59  -8.934   8.409   1.099
  463    HB3  GLU  59           HB3      GLU  59  -9.061   8.797  -0.608
  464    HG2  GLU  59           HG2      GLU  59  -8.916   6.294  -1.024
  465    HG3  GLU  59           HG3      GLU  59  -9.199   6.110   0.707
  466    H    VAL  60           H        VAL  60  -6.945   5.515   0.304
  467    HA   VAL  60           HA       VAL  60  -5.938   5.688   3.025
  468    HB   VAL  60           HB       VAL  60  -6.595   3.215   1.421
  469   HG11  VAL  60          2HG1      VAL  60  -5.106   2.829   3.278
  470   HG12  VAL  60          1HG1      VAL  60  -6.694   2.142   3.616
  471   HG13  VAL  60          3HG1      VAL  60  -6.210   3.663   4.367
  472   HG21  VAL  60          3HG2      VAL  60  -8.603   4.563   1.637
  473   HG22  VAL  60          2HG2      VAL  60  -8.332   4.719   3.375
  474   HG23  VAL  60          1HG2      VAL  60  -8.702   3.139   2.680
  475    H    VAL  61           H        VAL  61  -3.896   5.218   3.583
  476    HA   VAL  61           HA       VAL  61  -2.063   4.324   1.454
  477    HB   VAL  61           HB       VAL  61  -1.304   5.673   4.043
  478   HG11  VAL  61          2HG1      VAL  61   0.249   5.207   1.508
  479   HG12  VAL  61          1HG1      VAL  61   0.425   4.300   3.010
  480   HG13  VAL  61          3HG1      VAL  61   0.841   6.013   2.961
  481   HG21  VAL  61          3HG2      VAL  61  -0.957   7.715   2.730
  482   HG22  VAL  61          2HG2      VAL  61  -2.649   7.217   2.742
  483   HG23  VAL  61          1HG2      VAL  61  -1.650   6.915   1.320
  484    H    ILE  62           H        ILE  62  -1.750   2.170   1.615
  485    HA   ILE  62           HA       ILE  62  -1.769   0.932   4.263
  486    HB   ILE  62           HB       ILE  62  -1.490  -0.342   1.527
  487   HG12  ILE  62          2HG1      ILE  62  -3.871  -0.222   3.395
  488   HG13  ILE  62          3HG1      ILE  62  -3.692   0.715   1.915
  489   HG21  ILE  62          2HG2      ILE  62  -1.928  -2.458   2.691
  490   HG22  ILE  62          1HG2      ILE  62  -1.908  -1.605   4.234
  491   HG23  ILE  62          3HG2      ILE  62  -0.443  -1.692   3.256
  492   HD11  ILE  62          3HD1      ILE  62  -3.677  -1.342   0.611
  493   HD12  ILE  62          2HD1      ILE  62  -5.142  -1.204   1.583
  494   HD13  ILE  62          1HD1      ILE  62  -3.844  -2.285   2.093
  495    H    PHE  63           H        PHE  63   0.025   0.403   5.328
  496    HA   PHE  63           HA       PHE  63   2.574   0.580   3.872
  497    HB2  PHE  63           HB2      PHE  63   1.852   1.342   6.684
  498    HB3  PHE  63           HB3      PHE  63   3.514   0.939   6.266
  499    HD1  PHE  63           HD1      PHE  63   4.485   2.192   4.204
  500    HD2  PHE  63           HD2      PHE  63   1.140   3.526   6.471
  501    HE1  PHE  63           HE1      PHE  63   4.857   4.482   3.392
  502    HE2  PHE  63           HE2      PHE  63   1.505   5.821   5.660
  503    HZ   PHE  63           HZ       PHE  63   3.360   6.295   4.113
  504    H    ALA  64           H        ALA  64   3.156  -1.400   3.366
  505    HA   ALA  64           HA       ALA  64   3.258  -3.384   5.544
  506    HB1  ALA  64           HB1      ALA  64   1.759  -4.095   3.732
  507    HB2  ALA  64           HB2      ALA  64   3.073  -3.907   2.573
  508    HB3  ALA  64           HB3      ALA  64   3.179  -5.132   3.836
  509    H    VAL  65           H        VAL  65   5.272  -2.849   6.302
  510    HA   VAL  65           HA       VAL  65   7.515  -3.096   4.437
  511    HB   VAL  65           HB       VAL  65   8.561  -1.033   5.321
  512   HG11  VAL  65          2HG1      VAL  65   7.190   0.572   4.086
  513   HG12  VAL  65          1HG1      VAL  65   5.861  -0.586   4.057
  514   HG13  VAL  65          3HG1      VAL  65   7.362  -0.944   3.203
  515   HG21  VAL  65          3HG2      VAL  65   5.884  -0.602   6.641
  516   HG22  VAL  65          2HG2      VAL  65   7.163   0.606   6.523
  517   HG23  VAL  65          1HG2      VAL  65   7.426  -0.868   7.453
  518    H    ASP  66           H        ASP  66   9.476  -3.626   5.359
  519    HA   ASP  66           HA       ASP  66   9.463  -4.237   8.240
  520    HB2  ASP  66           HB2      ASP  66  11.062  -5.293   5.933
  521    HB3  ASP  66           HB3      ASP  66  11.756  -5.333   7.549
  522    H    THR  67           H        THR  67  10.613  -2.089   5.882
  523    HA   THR  67           HA       THR  67  12.559  -0.972   7.779
  524    HB   THR  67           HB       THR  67  13.705  -2.134   5.892
  525    HG1  THR  67           HG1      THR  67  15.178  -0.521   5.649
  526   HG21  THR  67          3HG2      THR  67  12.059  -1.745   4.134
  527   HG22  THR  67          1HG2      THR  67  13.643  -1.136   3.652
  528   HG23  THR  67          2HG2      THR  67  12.393  -0.014   4.188
  529    H    LYS  68           H        LYS  68  13.212   1.321   6.503
  530    HA   LYS  68           HA       LYS  68  10.871   2.897   7.042
  531    HB2  LYS  68           HB2      LYS  68  12.384   4.811   6.742
  532    HB3  LYS  68           HB3      LYS  68  13.069   3.610   7.830
  533    HG2  LYS  68           HG2      LYS  68  14.397   2.730   5.921
  534    HG3  LYS  68           HG3      LYS  68  13.800   4.072   4.947
  535    HD2  LYS  68           HD2      LYS  68  14.808   5.655   6.515
  536    HD3  LYS  68           HD3      LYS  68  15.399   4.309   7.493
  537    HE2  LYS  68           HE2      LYS  68  16.677   3.512   5.517
  538    HE3  LYS  68           HE3      LYS  68  16.173   4.964   4.653
  539    HZ1  LYS  68           HZ1      LYS  68  17.275   6.302   6.337
  540    HZ2  LYS  68           HZ2      LYS  68  18.367   5.230   5.603
  541    HZ3  LYS  68           HZ3      LYS  68  17.771   4.898   7.150
  542    H    VAL  69           H        VAL  69  10.157   4.629   5.638
  543    HA   VAL  69           HA       VAL  69  10.306   3.942   2.776
  544    HB   VAL  69           HB       VAL  69   8.063   5.364   4.237
  545   HG11  VAL  69          2HG1      VAL  69   8.266   6.040   1.898
  546   HG12  VAL  69          1HG1      VAL  69   6.807   5.082   2.156
  547   HG13  VAL  69          3HG1      VAL  69   8.221   4.348   1.400
  548   HG21  VAL  69          3HG2      VAL  69   8.186   2.533   3.201
  549   HG22  VAL  69          2HG2      VAL  69   6.761   3.320   3.877
  550   HG23  VAL  69          1HG2      VAL  69   8.169   3.021   4.897
  551    H    ARG  70           H        ARG  70  10.667   5.663   1.313
  552    HA   ARG  70           HA       ARG  70  11.830   8.029   2.576
  553    HB2  ARG  70           HB2      ARG  70  11.902   7.136  -0.310
  554    HB3  ARG  70           HB3      ARG  70  12.744   8.534   0.344
  555    HG2  ARG  70           HG2      ARG  70  13.828   6.806   1.950
  556    HG3  ARG  70           HG3      ARG  70  13.309   5.630   0.740
  557    HD2  ARG  70           HD2      ARG  70  15.557   6.289   0.228
  558    HD3  ARG  70           HD3      ARG  70  14.485   6.989  -0.986
  559    HE   ARG  70           HE       ARG  70  15.080   8.715   1.265
  560   HH11  ARG  70          2HH1      ARG  70  15.975   7.750  -1.997
  561   HH12  ARG  70          1HH1      ARG  70  16.862   9.218  -2.313
  562   HH21  ARG  70          2HH2      ARG  70  16.242  10.629   0.843
  563   HH22  ARG  70          1HH2      ARG  70  16.998  10.855  -0.707
  564    H    ASN  71           H        ASN  71   9.301   7.159   0.265
  565    HA   ASN  71           HA       ASN  71   8.586   9.907  -0.194
  566    HB2  ASN  71           HB2      ASN  71   7.320   7.308  -1.045
  567    HB3  ASN  71           HB3      ASN  71   6.600   8.879  -1.413
  568   HD21  ASN  71          1HD2      ASN  71   7.603   6.870  -3.243
  569   HD22  ASN  71          2HD2      ASN  71   8.865   7.638  -4.157
  570    H    LYS  72           H        LYS  72   8.098   7.890   2.344
  571    HA   LYS  72           HA       LYS  72   5.456   7.950   3.062
  572    HB2  LYS  72           HB2      LYS  72   6.157   7.703   5.358
  573    HB3  LYS  72           HB3      LYS  72   7.226   6.775   4.317
  574    HG2  LYS  72           HG2      LYS  72   8.932   8.484   4.489
  575    HG3  LYS  72           HG3      LYS  72   7.851   9.491   5.457
  576    HD2  LYS  72           HD2      LYS  72   7.773   7.686   7.156
  577    HD3  LYS  72           HD3      LYS  72   8.958   6.787   6.206
  578    HE2  LYS  72           HE2      LYS  72  10.070   7.973   7.999
  579    HE3  LYS  72           HE3      LYS  72  10.538   8.659   6.444
  580    HZ1  LYS  72           HZ1      LYS  72   8.447   9.797   8.220
  581    HZ2  LYS  72           HZ2      LYS  72   9.055  10.491   6.792
  582    HZ3  LYS  72           HZ3      LYS  72  10.050  10.342   8.155
  583    H    GLU  73           H        GLU  73   7.672  10.613   3.023
  584    HA   GLU  73           HA       GLU  73   6.579  12.414   4.795
  585    HB2  GLU  73           HB2      GLU  73   7.621  13.063   2.034
  586    HB3  GLU  73           HB3      GLU  73   7.524  14.167   3.399
  587    HG2  GLU  73           HG2      GLU  73   9.263  11.718   3.210
  588    HG3  GLU  73           HG3      GLU  73   9.793  13.393   3.076
  589    H    ARG  74           H        ARG  74   5.501  11.704   1.475
  590    HA   ARG  74           HA       ARG  74   3.469  13.742   1.572
  591    HB2  ARG  74           HB2      ARG  74   2.871  12.919  -0.662
  592    HB3  ARG  74           HB3      ARG  74   4.599  13.218  -0.520
  593    HG2  ARG  74           HG2      ARG  74   4.631  10.647   0.097
  594    HG3  ARG  74           HG3      ARG  74   3.131  10.661  -0.834
  595    HD2  ARG  74           HD2      ARG  74   5.005  10.148  -2.282
  596    HD3  ARG  74           HD3      ARG  74   4.317  11.713  -2.687
  597    HE   ARG  74           HE       ARG  74   6.387  12.192  -0.919
  598   HH11  ARG  74          2HH1      ARG  74   6.042  10.762  -4.097
  599   HH12  ARG  74          1HH1      ARG  74   7.543  11.410  -4.692
  600   HH21  ARG  74          2HH2      ARG  74   8.380  13.019  -1.691
  601   HH22  ARG  74          1HH2      ARG  74   8.882  12.674  -3.315
  602    H    PHE  75           H        PHE  75   3.650  10.324   2.206
  603    HA   PHE  75           HA       PHE  75   0.820   9.873   2.143
  604    HB2  PHE  75           HB2      PHE  75   3.028   8.214   3.378
  605    HB3  PHE  75           HB3      PHE  75   1.374   7.683   3.110
  606    HD1  PHE  75           HD1      PHE  75   0.553   7.358   0.786
  607    HD2  PHE  75           HD2      PHE  75   4.635   8.161   1.649
  608    HE1  PHE  75           HE1      PHE  75   1.189   6.498  -1.428
  609    HE2  PHE  75           HE2      PHE  75   5.278   7.307  -0.563
  610    HZ   PHE  75           HZ       PHE  75   3.555   6.469  -2.106
  611    H    ASP  76           H        ASP  76   3.168  10.857   4.520
  612    HA   ASP  76           HA       ASP  76   1.679  10.262   6.848
  613    HB2  ASP  76           HB2      ASP  76   4.117  10.723   6.840
  614    HB3  ASP  76           HB3      ASP  76   3.776  12.407   6.457
  615    H    GLY  77           H        GLY  77   0.040  11.277   7.803
  616    HA2  GLY  77           HA1      GLY  77  -1.201  13.258   8.390
  617    HA3  GLY  77           HA2      GLY  77  -0.673  13.986   6.876
  618    H    LYS  78           H        LYS  78  -1.225  11.102   5.818
  619    HA   LYS  78           HA       LYS  78  -4.061  11.560   5.239
  620    HB2  LYS  78           HB2      LYS  78  -1.913   9.926   3.887
  621    HB3  LYS  78           HB3      LYS  78  -3.615   9.777   3.464
  622    HG2  LYS  78           HG2      LYS  78  -3.720  11.962   2.639
  623    HG3  LYS  78           HG3      LYS  78  -2.221  12.429   3.438
  624    HD2  LYS  78           HD2      LYS  78  -1.981  12.158   0.994
  625    HD3  LYS  78           HD3      LYS  78  -0.933  11.085   1.916
  626    HE2  LYS  78           HE2      LYS  78  -2.081  10.074  -0.074
  627    HE3  LYS  78           HE3      LYS  78  -2.273   9.203   1.434
  628    HZ1  LYS  78           HZ1      LYS  78  -4.265  11.054   0.216
  629    HZ2  LYS  78           HZ2      LYS  78  -4.483  10.196   1.662
  630    HZ3  LYS  78           HZ3      LYS  78  -4.349   9.367   0.192
  631    H    VAL  79           H        VAL  79  -5.228   9.296   4.873
  632    HA   VAL  79           HA       VAL  79  -5.081   8.053   7.493
  633    HB   VAL  79           HB       VAL  79  -7.293   8.634   6.718
  634   HG11  VAL  79          2HG1      VAL  79  -8.319   7.543   4.781
  635   HG12  VAL  79          1HG1      VAL  79  -6.770   6.790   4.402
  636   HG13  VAL  79          3HG1      VAL  79  -6.938   8.544   4.332
  637   HG21  VAL  79          3HG2      VAL  79  -6.887   5.650   6.720
  638   HG22  VAL  79          2HG2      VAL  79  -8.426   6.475   6.971
  639   HG23  VAL  79          1HG2      VAL  79  -7.117   6.676   8.136
  640    H    VAL  80           H        VAL  80  -4.067   6.175   7.911
  641    HA   VAL  80           HA       VAL  80  -3.140   4.669   5.551
  642    HB   VAL  80           HB       VAL  80  -0.982   4.393   6.434
  643   HG11  VAL  80          2HG1      VAL  80  -1.335   6.592   5.455
  644   HG12  VAL  80          1HG1      VAL  80  -0.142   6.661   6.750
  645   HG13  VAL  80          3HG1      VAL  80  -1.785   7.235   7.035
  646   HG21  VAL  80          3HG2      VAL  80  -1.528   3.888   8.725
  647   HG22  VAL  80          2HG2      VAL  80  -1.978   5.567   9.024
  648   HG23  VAL  80          1HG2      VAL  80  -0.299   5.153   8.672
  649    H    LEU  81           H        LEU  81  -2.521   2.489   5.906
  650    HA   LEU  81           HA       LEU  81  -3.659   1.205   8.296
  651    HB2  LEU  81           HB2      LEU  81  -5.120   0.957   6.259
  652    HB3  LEU  81           HB3      LEU  81  -3.802   0.114   5.476
  653    HG   LEU  81           HG       LEU  81  -5.724  -1.266   6.506
  654   HD11  LEU  81          2HD1      LEU  81  -2.858  -1.924   7.158
  655   HD12  LEU  81          1HD1      LEU  81  -3.699  -2.283   5.650
  656   HD13  LEU  81          3HD1      LEU  81  -4.196  -3.072   7.148
  657   HD21  LEU  81          3HD2      LEU  81  -5.783  -0.126   8.666
  658   HD22  LEU  81          2HD2      LEU  81  -4.141  -0.672   9.003
  659   HD23  LEU  81          1HD2      LEU  81  -5.448  -1.847   8.857
  660    H    GLU  82           H        GLU  82  -1.867   0.636   9.362
  661    HA   GLU  82           HA       GLU  82   0.535  -0.135   7.883
  662    HB2  GLU  82           HB2      GLU  82   0.606   1.565   9.707
  663    HB3  GLU  82           HB3      GLU  82   0.159   0.303  10.846
  664    HG2  GLU  82           HG2      GLU  82   2.225  -0.932  10.087
  665    HG3  GLU  82           HG3      GLU  82   2.688   0.554   9.259
  666    H    VAL  83           H        VAL  83   1.039  -2.206   7.568
  667    HA   VAL  83           HA       VAL  83   0.418  -4.185   9.641
  668    HB   VAL  83           HB       VAL  83  -0.198  -5.841   7.823
  669   HG11  VAL  83          2HG1      VAL  83  -2.533  -5.150   7.719
  670   HG12  VAL  83          1HG1      VAL  83  -2.084  -3.529   8.251
  671   HG13  VAL  83          3HG1      VAL  83  -1.865  -4.906   9.333
  672   HG21  VAL  83          3HG2      VAL  83   0.635  -4.566   5.912
  673   HG22  VAL  83          2HG2      VAL  83  -0.591  -3.330   6.196
  674   HG23  VAL  83          1HG2      VAL  83  -1.074  -4.959   5.723
  675    HA   PRO  84           HA       PRO  84   4.454  -5.871   8.629
  676    HB2  PRO  84           HB2      PRO  84   3.243  -8.567   8.486
  677    HB3  PRO  84           HB3      PRO  84   4.528  -7.968   9.539
  678    HG2  PRO  84           HG2      PRO  84   2.079  -8.462  10.494
  679    HG3  PRO  84           HG3      PRO  84   3.044  -7.096  11.084
  680    HD2  PRO  84           HD2      PRO  84   0.758  -7.109   9.152
  681    HD3  PRO  84           HD3      PRO  84   1.134  -5.955  10.449
  682    H    VAL  85           H        VAL  85   5.620  -6.581   6.832
  683    HA   VAL  85           HA       VAL  85   4.366  -6.203   4.328
  684    HB   VAL  85           HB       VAL  85   6.758  -5.730   4.775
  685   HG11  VAL  85          2HG1      VAL  85   7.064  -8.723   4.683
  686   HG12  VAL  85          1HG1      VAL  85   7.318  -7.686   6.087
  687   HG13  VAL  85          3HG1      VAL  85   8.386  -7.556   4.690
  688   HG21  VAL  85          3HG2      VAL  85   7.617  -6.533   2.616
  689   HG22  VAL  85          2HG2      VAL  85   5.987  -5.870   2.486
  690   HG23  VAL  85          1HG2      VAL  85   6.231  -7.616   2.486
  691    H    SER  86           H        SER  86   4.855  -9.011   6.264
  692    HA   SER  86           HA       SER  86   4.540 -10.951   4.196
  693    HB2  SER  86           HB2      SER  86   4.046 -12.406   6.322
  694    HB3  SER  86           HB3      SER  86   5.671 -11.781   6.040
  695    HG   SER  86           HG       SER  86   4.160 -11.386   8.153
  696    H    ALA  87           H        ALA  87   2.358  -8.950   5.911
  697    HA   ALA  87           HA       ALA  87   0.163 -10.696   6.183
  698    HB1  ALA  87           HB1      ALA  87  -1.173  -8.736   6.635
  699    HB2  ALA  87           HB2      ALA  87   0.378  -8.624   7.466
  700    HB3  ALA  87           HB3      ALA  87   0.095  -7.692   5.995
  701    HA   PRO  88           HA       PRO  88  -1.690  -8.709   2.159
  702    HB2  PRO  88           HB2      PRO  88   0.679  -7.750   0.690
  703    HB3  PRO  88           HB3      PRO  88  -0.875  -6.955   0.959
  704    HG2  PRO  88           HG2      PRO  88   1.339  -6.129   2.208
  705    HG3  PRO  88           HG3      PRO  88  -0.238  -6.117   3.020
  706    HD2  PRO  88           HD2      PRO  88   2.009  -8.086   3.270
  707    HD3  PRO  88           HD3      PRO  88   0.991  -7.372   4.540
  708    H    ILE  89           H        ILE  89   0.982 -10.705   2.507
  709    HA   ILE  89           HA       ILE  89   0.891 -11.838  -0.151
  710    HB   ILE  89           HB       ILE  89   2.299 -12.790   2.354
  711   HG12  ILE  89          2HG1      ILE  89   3.380 -11.415  -0.117
  712   HG13  ILE  89          3HG1      ILE  89   3.106 -10.630   1.433
  713   HG21  ILE  89          2HG2      ILE  89   2.559 -13.776  -0.485
  714   HG22  ILE  89          1HG2      ILE  89   1.849 -14.661   0.866
  715   HG23  ILE  89          3HG2      ILE  89   3.570 -14.273   0.872
  716   HD11  ILE  89          3HD1      ILE  89   5.446 -11.161   1.138
  717   HD12  ILE  89          2HD1      ILE  89   5.051 -12.861   0.893
  718   HD13  ILE  89          1HD1      ILE  89   4.766 -12.108   2.462
  719    H    LYS  90           H        LYS  90  -0.156 -12.718   3.113
  720    HA   LYS  90           HA       LYS  90  -1.449 -15.123   2.067
  721    HB2  LYS  90           HB2      LYS  90  -0.011 -15.309   4.069
  722    HB3  LYS  90           HB3      LYS  90  -1.076 -14.206   4.927
  723    HG2  LYS  90           HG2      LYS  90  -1.559 -16.465   5.583
  724    HG3  LYS  90           HG3      LYS  90  -2.918 -15.820   4.658
  725    HD2  LYS  90           HD2      LYS  90  -1.979 -16.957   2.638
  726    HD3  LYS  90           HD3      LYS  90  -0.784 -17.720   3.690
  727    HE2  LYS  90           HE2      LYS  90  -2.631 -19.236   3.311
  728    HE3  LYS  90           HE3      LYS  90  -2.619 -18.721   4.997
  729    HZ1  LYS  90           HZ1      LYS  90  -4.356 -17.123   4.491
  730    HZ2  LYS  90           HZ2      LYS  90  -4.853 -18.687   4.075
  731    HZ3  LYS  90           HZ3      LYS  90  -4.362 -17.603   2.862
  732    H    ASP  91           H        ASP  91  -2.215 -11.976   3.335
  733    HA   ASP  91           HA       ASP  91  -5.078 -12.641   3.203
  734    HB2  ASP  91           HB2      ASP  91  -3.539 -11.580   5.494
  735    HB3  ASP  91           HB3      ASP  91  -5.078 -10.787   5.176
  736    H    ALA  92           H        ALA  92  -3.762 -11.435   1.107
  737    HA   ALA  92           HA       ALA  92  -3.502  -8.683   1.082
  738    HB1  ALA  92           HB1      ALA  92  -2.792 -10.134  -0.752
  739    HB2  ALA  92           HB2      ALA  92  -4.480 -10.430  -1.172
  740    HB3  ALA  92           HB3      ALA  92  -3.803  -8.809  -1.332
  741    H    GLU  93           H        GLU  93  -6.416 -10.563   0.211
  742    HA   GLU  93           HA       GLU  93  -8.074  -8.363  -0.330
  743    HB2  GLU  93           HB2      GLU  93  -9.128 -10.900   0.899
  744    HB3  GLU  93           HB3      GLU  93  -9.908  -9.845  -0.267
  745    HG2  GLU  93           HG2      GLU  93  -9.343 -11.628  -1.578
  746    HG3  GLU  93           HG3      GLU  93  -7.949 -10.575  -1.819
  747    H    LYS  94           H        LYS  94  -7.176  -9.898   2.667
  748    HA   LYS  94           HA       LYS  94  -9.221  -8.733   4.277
  749    HB2  LYS  94           HB2      LYS  94  -7.719 -10.819   4.705
  750    HB3  LYS  94           HB3      LYS  94  -6.561  -9.652   5.323
  751    HG2  LYS  94           HG2      LYS  94  -7.799 -10.553   7.152
  752    HG3  LYS  94           HG3      LYS  94  -8.280  -8.871   6.925
  753    HD2  LYS  94           HD2      LYS  94 -10.204 -10.347   7.352
  754    HD3  LYS  94           HD3      LYS  94 -10.293  -9.567   5.772
  755    HE2  LYS  94           HE2      LYS  94 -10.943 -11.921   5.644
  756    HE3  LYS  94           HE3      LYS  94  -9.485 -11.607   4.707
  757    HZ1  LYS  94           HZ1      LYS  94  -9.370 -13.663   6.024
  758    HZ2  LYS  94           HZ2      LYS  94  -9.513 -12.756   7.448
  759    HZ3  LYS  94           HZ3      LYS  94  -8.155 -12.558   6.449
  760    H    VAL  95           H        VAL  95  -5.873  -7.946   3.501
  761    HA   VAL  95           HA       VAL  95  -5.588  -5.706   5.183
  762    HB   VAL  95           HB       VAL  95  -4.243  -6.224   2.519
  763   HG11  VAL  95          2HG1      VAL  95  -3.419  -4.443   4.810
  764   HG12  VAL  95          1HG1      VAL  95  -4.015  -3.907   3.239
  765   HG13  VAL  95          3HG1      VAL  95  -2.474  -4.758   3.355
  766   HG21  VAL  95          3HG2      VAL  95  -2.429  -7.198   3.819
  767   HG22  VAL  95          2HG2      VAL  95  -3.937  -8.069   4.102
  768   HG23  VAL  95          1HG2      VAL  95  -3.335  -6.932   5.309
  769    H    ILE  96           H        ILE  96  -6.793  -6.062   1.886
  770    HA   ILE  96           HA       ILE  96  -7.185  -3.332   1.313
  771    HB   ILE  96           HB       ILE  96  -8.761  -5.709   0.298
  772   HG12  ILE  96          2HG1      ILE  96  -6.386  -4.294  -0.936
  773   HG13  ILE  96          3HG1      ILE  96  -6.295  -5.828  -0.074
  774   HG21  ILE  96          2HG2      ILE  96  -8.471  -2.928  -0.837
  775   HG22  ILE  96          1HG2      ILE  96  -9.922  -3.598  -0.092
  776   HG23  ILE  96          3HG2      ILE  96  -9.318  -4.270  -1.607
  777   HD11  ILE  96          3HD1      ILE  96  -6.306  -6.154  -2.480
  778   HD12  ILE  96          2HD1      ILE  96  -7.851  -5.312  -2.597
  779   HD13  ILE  96          1HD1      ILE  96  -7.748  -6.850  -1.740
  780    H    ASN  97           H        ASN  97  -9.291  -5.761   2.793
  781    HA   ASN  97           HA       ASN  97 -11.532  -4.099   3.181
  782    HB2  ASN  97           HB2      ASN  97 -10.583  -6.668   4.369
  783    HB3  ASN  97           HB3      ASN  97 -11.868  -5.797   5.197
  784   HD21  ASN  97          1HD2      ASN  97 -10.963  -7.511   2.306
  785   HD22  ASN  97          2HD2      ASN  97 -12.571  -7.728   1.695
  786    H    ALA  98           H        ALA  98  -8.645  -4.676   5.110
  787    HA   ALA  98           HA       ALA  98  -9.416  -3.244   7.405
  788    HB1  ALA  98           HB1      ALA  98  -6.626  -3.603   6.315
  789    HB2  ALA  98           HB2      ALA  98  -7.066  -3.194   7.973
  790    HB3  ALA  98           HB3      ALA  98  -7.485  -4.775   7.315
  791    H    ALA  99           H        ALA  99  -7.799  -2.221   4.423
  792    HA   ALA  99           HA       ALA  99  -7.322   0.450   5.099
  793    HB1  ALA  99           HB1      ALA  99  -7.982  -0.725   2.397
  794    HB2  ALA  99           HB2      ALA  99  -7.247   0.852   2.685
  795    HB3  ALA  99           HB3      ALA  99  -6.374  -0.619   3.114
  796    H    LEU 100           H        LEU 100 -10.127  -1.145   3.681
  797    HA   LEU 100           HA       LEU 100 -11.710   1.167   3.351
  798    HB2  LEU 100           HB2      LEU 100 -12.555  -1.704   3.754
  799    HB3  LEU 100           HB3      LEU 100 -13.604  -0.411   3.204
  800    HG   LEU 100           HG       LEU 100 -11.180  -1.438   1.722
  801   HD11  LEU 100          2HD1      LEU 100 -12.998  -3.058   1.759
  802   HD12  LEU 100          1HD1      LEU 100 -12.792  -2.369   0.150
  803   HD13  LEU 100          3HD1      LEU 100 -14.119  -1.827   1.179
  804   HD21  LEU 100          3HD2      LEU 100 -13.267   0.601   0.962
  805   HD22  LEU 100          2HD2      LEU 100 -12.043  -0.055  -0.126
  806   HD23  LEU 100          1HD2      LEU 100 -11.558   0.907   1.270
  807    H    ALA 101           H        ALA 101 -11.045  -0.884   6.083
  808    HA   ALA 101           HA       ALA 101 -13.247  -0.050   7.674
  809    HB1  ALA 101           HB1      ALA 101 -10.621  -1.258   8.528
  810    HB2  ALA 101           HB2      ALA 101 -12.070  -1.114   9.525
  811    HB3  ALA 101           HB3      ALA 101 -12.084  -2.146   8.096
  812    H    LEU 102           H        LEU 102 -10.262   1.431   6.871
  813    HA   LEU 102           HA       LEU 102 -10.171   3.104   9.228
  814    HB2  LEU 102           HB2      LEU 102  -8.488   2.698   6.828
  815    HB3  LEU 102           HB3      LEU 102  -8.429   4.289   7.556
  816    HG   LEU 102           HG       LEU 102  -6.621   2.819   8.351
  817   HD11  LEU 102          2HD1      LEU 102  -7.391   4.610   9.782
  818   HD12  LEU 102          1HD1      LEU 102  -6.942   3.205  10.751
  819   HD13  LEU 102          3HD1      LEU 102  -8.643   3.566  10.452
  820   HD21  LEU 102          3HD2      LEU 102  -7.748   0.675   8.230
  821   HD22  LEU 102          2HD2      LEU 102  -8.860   1.166   9.508
  822   HD23  LEU 102          1HD2      LEU 102  -7.146   0.960   9.864
  823    H    ILE 103           H        ILE 103 -11.649   3.216   6.138
  824    HA   ILE 103           HA       ILE 103 -12.130   6.109   6.431
  825    HB   ILE 103           HB       ILE 103 -12.675   6.058   3.975
  826   HG12  ILE 103          2HG1      ILE 103 -11.374   3.329   4.156
  827   HG13  ILE 103          3HG1      ILE 103 -13.067   3.637   3.790
  828   HG21  ILE 103          2HG2      ILE 103 -10.576   6.950   4.767
  829   HG22  ILE 103          1HG2      ILE 103 -10.307   6.045   3.277
  830   HG23  ILE 103          3HG2      ILE 103  -9.879   5.332   4.831
  831   HD11  ILE 103          3HD1      ILE 103 -10.725   4.483   2.105
  832   HD12  ILE 103          2HD1      ILE 103 -12.426   4.752   1.727
  833   HD13  ILE 103          1HD1      ILE 103 -11.785   3.110   1.792
  834    H    ASP 104           H        ASP 104 -13.624   3.003   6.213
  835    HA   ASP 104           HA       ASP 104 -16.286   4.258   6.251
  836    HB2  ASP 104           HB2      ASP 104 -15.545   3.318   3.953
  837    HB3  ASP 104           HB3      ASP 104 -15.743   1.740   4.692
  838    H    GLU 105           H        GLU 105 -14.606   1.153   6.446
  839    HA   GLU 105           HA       GLU 105 -14.586  -0.523   7.952
  840    HB2  GLU 105           HB2      GLU 105 -14.321   1.245   9.662
  841    HB3  GLU 105           HB3      GLU 105 -16.073   1.341   9.808
  842    HG2  GLU 105           HG2      GLU 105 -16.032  -1.112  10.400
  843    HG3  GLU 105           HG3      GLU 105 -14.281  -0.960  10.519
  844    H    LYS 106           H        LYS 106 -15.826  -2.005   6.917
  845    HA   LYS 106           HA       LYS 106 -18.261  -2.557   8.379
  846    HB2  LYS 106           HB2      LYS 106 -19.029  -1.357   6.341
  847    HB3  LYS 106           HB3      LYS 106 -18.276  -2.608   5.358
  848    HG2  LYS 106           HG2      LYS 106 -19.757  -4.274   6.223
  849    HG3  LYS 106           HG3      LYS 106 -20.420  -3.141   7.400
  850    HD2  LYS 106           HD2      LYS 106 -21.250  -1.755   5.512
  851    HD3  LYS 106           HD3      LYS 106 -20.693  -3.009   4.399
  852    HE2  LYS 106           HE2      LYS 106 -23.086  -3.224   4.891
  853    HE3  LYS 106           HE3      LYS 106 -22.172  -4.627   5.442
  854    HZ1  LYS 106           HZ1      LYS 106 -23.791  -3.912   7.092
  855    HZ2  LYS 106           HZ2      LYS 106 -23.077  -2.374   7.158
  856    HZ3  LYS 106           HZ3      LYS 106 -22.214  -3.735   7.687
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1 -16.098  -1.452  -7.855
    2    H2   MET   1           H2       MET   1 -17.495  -1.606  -6.909
    3    H3   MET   1           H3       MET   1 -16.018  -2.211  -6.337
    4    HA   MET   1           HA       MET   1 -16.789   0.619  -6.735
    5    HB2  MET   1           HB2      MET   1 -15.983  -0.971  -4.291
    6    HB3  MET   1           HB3      MET   1 -16.210   0.772  -4.310
    7    HG2  MET   1           HG2      MET   1 -18.547   0.485  -4.887
    8    HG3  MET   1           HG3      MET   1 -18.332  -1.264  -4.941
    9    HE1  MET   1           HE1      MET   1 -20.510  -0.614  -1.705
   10    HE2  MET   1           HE2      MET   1 -20.557   0.309  -3.205
   11    HE3  MET   1           HE3      MET   1 -20.444  -1.451  -3.256
   12    H    LYS   2           H        LYS   2 -15.215   1.607  -7.795
   13    HA   LYS   2           HA       LYS   2 -12.493   0.695  -7.589
   14    HB2  LYS   2           HB2      LYS   2 -12.060   2.643  -9.167
   15    HB3  LYS   2           HB3      LYS   2 -13.089   1.349  -9.762
   16    HG2  LYS   2           HG2      LYS   2 -15.068   2.702  -9.251
   17    HG3  LYS   2           HG3      LYS   2 -14.018   4.006  -8.691
   18    HD2  LYS   2           HD2      LYS   2 -13.047   4.218 -10.896
   19    HD3  LYS   2           HD3      LYS   2 -13.985   2.837 -11.471
   20    HE2  LYS   2           HE2      LYS   2 -16.052   4.058 -11.100
   21    HE3  LYS   2           HE3      LYS   2 -15.149   5.422 -10.443
   22    HZ1  LYS   2           HZ1      LYS   2 -15.790   5.774 -12.758
   23    HZ2  LYS   2           HZ2      LYS   2 -14.912   4.394 -13.219
   24    HZ3  LYS   2           HZ3      LYS   2 -14.103   5.737 -12.578
   25    H    ARG   3           H        ARG   3 -12.216   1.085  -5.326
   26    HA   ARG   3           HA       ARG   3 -12.022   3.834  -4.436
   27    HB2  ARG   3           HB2      ARG   3 -12.458   1.463  -3.129
   28    HB3  ARG   3           HB3      ARG   3 -10.752   1.736  -2.804
   29    HG2  ARG   3           HG2      ARG   3 -12.148   2.648  -1.031
   30    HG3  ARG   3           HG3      ARG   3 -11.265   3.928  -1.871
   31    HD2  ARG   3           HD2      ARG   3 -13.199   4.582  -3.082
   32    HD3  ARG   3           HD3      ARG   3 -14.088   3.152  -2.569
   33    HE   ARG   3           HE       ARG   3 -13.922   4.167  -0.251
   34   HH11  ARG   3          2HH1      ARG   3 -13.880   6.141  -3.147
   35   HH12  ARG   3          1HH1      ARG   3 -14.690   7.478  -2.400
   36   HH21  ARG   3          2HH2      ARG   3 -14.968   5.910   0.736
   37   HH22  ARG   3          1HH2      ARG   3 -15.280   7.362  -0.171
   38    H    LYS   4           H        LYS   4 -10.174   5.010  -4.337
   39    HA   LYS   4           HA       LYS   4  -7.865   3.866  -5.698
   40    HB2  LYS   4           HB2      LYS   4  -7.107   6.336  -5.621
   41    HB3  LYS   4           HB3      LYS   4  -8.408   5.874  -6.710
   42    HG2  LYS   4           HG2      LYS   4  -9.911   6.551  -4.659
   43    HG3  LYS   4           HG3      LYS   4  -8.492   7.508  -4.233
   44    HD2  LYS   4           HD2      LYS   4  -9.952   8.882  -5.547
   45    HD3  LYS   4           HD3      LYS   4  -8.541   8.481  -6.531
   46    HE2  LYS   4           HE2      LYS   4  -9.865   6.629  -7.550
   47    HE3  LYS   4           HE3      LYS   4 -11.274   7.208  -6.663
   48    HZ1  LYS   4           HZ1      LYS   4 -11.406   8.118  -8.814
   49    HZ2  LYS   4           HZ2      LYS   4  -9.779   8.593  -8.813
   50    HZ3  LYS   4           HZ3      LYS   4 -10.892   9.394  -7.817
   51    H    ILE   5           H        ILE   5  -6.250   3.085  -4.641
   52    HA   ILE   5           HA       ILE   5  -5.676   4.049  -1.909
   53    HB   ILE   5           HB       ILE   5  -5.580   1.166  -2.826
   54   HG12  ILE   5          2HG1      ILE   5  -7.621   2.482  -1.019
   55   HG13  ILE   5          3HG1      ILE   5  -7.902   2.070  -2.708
   56   HG21  ILE   5          2HG2      ILE   5  -5.287   2.384  -0.081
   57   HG22  ILE   5          1HG2      ILE   5  -3.996   1.677  -1.051
   58   HG23  ILE   5          3HG2      ILE   5  -5.300   0.658  -0.443
   59   HD11  ILE   5          3HD1      ILE   5  -7.582  -0.287  -2.196
   60   HD12  ILE   5          2HD1      ILE   5  -8.866   0.414  -1.212
   61   HD13  ILE   5          1HD1      ILE   5  -7.277   0.115  -0.505
   62    H    ILE   6           H        ILE   6  -3.505   4.284  -1.435
   63    HA   ILE   6           HA       ILE   6  -1.607   3.274  -3.444
   64    HB   ILE   6           HB       ILE   6   0.006   4.980  -2.729
   65   HG12  ILE   6          2HG1      ILE   6  -1.056   5.310  -0.423
   66   HG13  ILE   6          3HG1      ILE   6  -0.475   6.753  -1.244
   67   HG21  ILE   6          2HG2      ILE   6  -1.354   5.405  -4.669
   68   HG22  ILE   6          1HG2      ILE   6  -1.087   6.910  -3.790
   69   HG23  ILE   6          3HG2      ILE   6  -2.637   6.077  -3.663
   70   HD11  ILE   6          3HD1      ILE   6  -2.610   7.138  -0.158
   71   HD12  ILE   6          2HD1      ILE   6  -3.340   5.837  -1.100
   72   HD13  ILE   6          1HD1      ILE   6  -2.759   7.292  -1.907
   73    H    ALA   7           H        ALA   7   0.103   2.043  -2.760
   74    HA   ALA   7           HA       ALA   7   0.285   1.505   0.117
   75    HB1  ALA   7           HB1      ALA   7  -1.267  -0.144  -0.793
   76    HB2  ALA   7           HB2      ALA   7  -0.057  -0.632  -1.980
   77    HB3  ALA   7           HB3      ALA   7   0.234  -0.903  -0.263
   78    H    VAL   8           H        VAL   8   2.319   1.268   0.809
   79    HA   VAL   8           HA       VAL   8   4.414   1.020  -1.246
   80    HB   VAL   8           HB       VAL   8   4.680   2.133   1.554
   81   HG11  VAL   8          2HG1      VAL   8   6.737   1.115   0.730
   82   HG12  VAL   8          1HG1      VAL   8   6.892   2.870   0.810
   83   HG13  VAL   8          3HG1      VAL   8   6.634   2.079  -0.745
   84   HG21  VAL   8          3HG2      VAL   8   3.339   3.609   0.165
   85   HG22  VAL   8          2HG2      VAL   8   4.561   3.555  -1.106
   86   HG23  VAL   8          1HG2      VAL   8   4.932   4.316   0.442
   87    H    THR   9           H        THR   9   5.214  -0.950  -1.398
   88    HA   THR   9           HA       THR   9   5.435  -2.613   1.006
   89    HB   THR   9           HB       THR   9   6.068  -4.412  -0.687
   90    HG1  THR   9           HG1      THR   9   6.153  -2.379  -2.324
   91   HG21  THR   9          3HG2      THR   9   3.753  -4.817  -1.344
   92   HG22  THR   9          1HG2      THR   9   3.339  -3.149  -0.949
   93   HG23  THR   9          2HG2      THR   9   3.836  -4.260   0.327
   94    H    ALA  10           H        ALA  10   7.313  -2.505   2.065
   95    HA   ALA  10           HA       ALA  10   9.791  -2.253   0.513
   96    HB1  ALA  10           HB1      ALA  10   9.138  -0.558   2.922
   97    HB2  ALA  10           HB2      ALA  10  10.679  -0.584   2.063
   98    HB3  ALA  10           HB3      ALA  10   9.226   0.002   1.252
   99    H    CYS  11           H        CYS  11  10.837  -4.059   0.948
  100    HA   CYS  11           HA       CYS  11  10.923  -4.974   3.743
  101    HB2  CYS  11           HB2      CYS  11   9.656  -6.502   2.253
  102    HB3  CYS  11           HB3      CYS  11  11.089  -6.679   1.247
  103    HG   CYS  11           HG       CYS  11  10.708  -7.740   4.476
  104    H    ALA  12           H        ALA  12  12.863  -5.052   4.651
  105    HA   ALA  12           HA       ALA  12  15.231  -4.821   2.931
  106    HB1  ALA  12           HB1      ALA  12  16.391  -4.009   4.938
  107    HB2  ALA  12           HB2      ALA  12  14.971  -3.032   4.563
  108    HB3  ALA  12           HB3      ALA  12  14.907  -4.215   5.869
  109    H    THR  13           H        THR  13  13.488  -7.021   4.747
  110    HA   THR  13           HA       THR  13  15.727  -8.594   5.680
  111    HB   THR  13           HB       THR  13  12.811  -9.381   5.620
  112    HG1  THR  13           HG1      THR  13  12.845  -8.561   7.836
  113   HG21  THR  13          3HG2      THR  13  15.103 -10.250   7.388
  114   HG22  THR  13          1HG2      THR  13  14.399 -11.194   6.075
  115   HG23  THR  13          2HG2      THR  13  13.435 -10.815   7.503
  116    H    GLY  14           H        GLY  14  13.061  -8.996   3.356
  117    HA2  GLY  14           HA1      GLY  14  14.802 -10.782   1.793
  118    HA3  GLY  14           HA2      GLY  14  13.154 -11.269   2.174
  119    H    VAL  15           H        VAL  15  15.132  -9.677  -0.007
  120    HA   VAL  15           HA       VAL  15  13.534  -7.640  -1.043
  121    HB   VAL  15           HB       VAL  15  15.404  -9.437  -2.598
  122   HG11  VAL  15          2HG1      VAL  15  15.656  -7.489  -4.087
  123   HG12  VAL  15          1HG1      VAL  15  14.407  -6.645  -3.170
  124   HG13  VAL  15          3HG1      VAL  15  14.004  -8.109  -4.068
  125   HG21  VAL  15          3HG2      VAL  15  17.108  -7.744  -2.128
  126   HG22  VAL  15          2HG2      VAL  15  16.499  -8.476  -0.644
  127   HG23  VAL  15          1HG2      VAL  15  15.959  -6.865  -1.119
  128    H    ALA  16           H        ALA  16  13.405 -11.107  -1.596
  129    HA   ALA  16           HA       ALA  16  11.646 -11.197  -3.759
  130    HB1  ALA  16           HB1      ALA  16  12.789 -13.169  -2.867
  131    HB2  ALA  16           HB2      ALA  16  11.785 -13.099  -1.419
  132    HB3  ALA  16           HB3      ALA  16  11.050 -13.434  -2.987
  133    H    HIS  17           H        HIS  17  11.032 -10.625  -0.343
  134    HA   HIS  17           HA       HIS  17   8.223 -10.999  -0.433
  135    HB2  HIS  17           HB2      HIS  17  10.023  -9.555   1.497
  136    HB3  HIS  17           HB3      HIS  17   8.275  -9.532   1.677
  137    HD1  HIS  17           HD1      HIS  17   9.702 -10.724   3.958
  138    HD2  HIS  17           HD2      HIS  17   8.670 -12.977   0.608
  139    HE1  HIS  17           HE1      HIS  17   9.646 -13.114   4.732
  140    HE2  HIS  17           HE2      HIS  17   9.108 -14.474   2.685
  141    H    THR  18           H        THR  18  10.307  -8.253  -1.082
  142    HA   THR  18           HA       THR  18   8.425  -6.197  -1.001
  143    HB   THR  18           HB       THR  18  10.750  -6.403  -2.927
  144    HG1  THR  18           HG1      THR  18  11.693  -5.094  -1.047
  145   HG21  THR  18          3HG2      THR  18  10.776  -3.947  -2.738
  146   HG22  THR  18          1HG2      THR  18   9.340  -4.019  -1.716
  147   HG23  THR  18          2HG2      THR  18   9.252  -4.538  -3.399
  148    H    TYR  19           H        TYR  19   9.467  -8.175  -3.775
  149    HA   TYR  19           HA       TYR  19   7.496  -7.030  -5.515
  150    HB2  TYR  19           HB2      TYR  19   9.327  -9.414  -5.825
  151    HB3  TYR  19           HB3      TYR  19   8.230  -8.858  -7.085
  152    HD1  TYR  19           HD1      TYR  19  11.298  -8.103  -5.222
  153    HD2  TYR  19           HD2      TYR  19   8.666  -6.814  -8.304
  154    HE1  TYR  19           HE1      TYR  19  13.000  -6.505  -6.001
  155    HE2  TYR  19           HE2      TYR  19  10.358  -5.216  -9.093
  156    HH   TYR  19           HH       TYR  19  12.295  -4.047  -8.324
  157    H    MET  20           H        MET  20   7.752  -9.894  -3.537
  158    HA   MET  20           HA       MET  20   5.569 -11.335  -4.568
  159    HB2  MET  20           HB2      MET  20   7.254 -12.295  -3.046
  160    HB3  MET  20           HB3      MET  20   6.645 -11.286  -1.741
  161    HG2  MET  20           HG2      MET  20   4.469 -12.431  -1.908
  162    HG3  MET  20           HG3      MET  20   5.149 -13.479  -3.156
  163    HE1  MET  20           HE1      MET  20   8.117 -13.858  -2.092
  164    HE2  MET  20           HE2      MET  20   7.977 -15.345  -1.155
  165    HE3  MET  20           HE3      MET  20   7.158 -15.202  -2.712
  166    H    ALA  21           H        ALA  21   5.773  -9.028  -1.870
  167    HA   ALA  21           HA       ALA  21   3.064  -9.238  -1.107
  168    HB1  ALA  21           HB1      ALA  21   5.001  -6.971  -0.646
  169    HB2  ALA  21           HB2      ALA  21   3.469  -7.205   0.196
  170    HB3  ALA  21           HB3      ALA  21   4.774  -8.372   0.400
  171    H    ALA  22           H        ALA  22   4.778  -6.871  -3.128
  172    HA   ALA  22           HA       ALA  22   2.635  -5.155  -3.619
  173    HB1  ALA  22           HB1      ALA  22   3.903  -4.379  -5.557
  174    HB2  ALA  22           HB2      ALA  22   4.951  -4.593  -4.153
  175    HB3  ALA  22           HB3      ALA  22   4.953  -5.791  -5.446
  176    H    GLN  23           H        GLN  23   3.662  -8.059  -5.380
  177    HA   GLN  23           HA       GLN  23   1.713  -7.789  -7.439
  178    HB2  GLN  23           HB2      GLN  23   3.333 -10.167  -6.514
  179    HB3  GLN  23           HB3      GLN  23   2.259 -10.203  -7.906
  180    HG2  GLN  23           HG2      GLN  23   3.585  -8.482  -8.993
  181    HG3  GLN  23           HG3      GLN  23   4.646  -8.397  -7.586
  182   HE21  GLN  23          1HE2      GLN  23   6.044 -10.102  -7.155
  183   HE22  GLN  23          2HE2      GLN  23   6.467 -11.267  -8.362
  184    H    ALA  24           H        ALA  24   1.850  -9.762  -4.474
  185    HA   ALA  24           HA       ALA  24  -0.600 -11.108  -4.927
  186    HB1  ALA  24           HB1      ALA  24   0.791 -10.575  -2.303
  187    HB2  ALA  24           HB2      ALA  24  -0.452 -11.791  -2.598
  188    HB3  ALA  24           HB3      ALA  24   1.122 -11.931  -3.381
  189    H    LEU  25           H        LEU  25   0.240  -8.241  -3.054
  190    HA   LEU  25           HA       LEU  25  -2.294  -7.652  -2.018
  191    HB2  LEU  25           HB2      LEU  25  -0.329  -6.565  -1.183
  192    HB3  LEU  25           HB3      LEU  25   0.035  -5.892  -2.757
  193    HG   LEU  25           HG       LEU  25  -1.987  -4.470  -2.587
  194   HD11  LEU  25          2HD1      LEU  25  -3.310  -5.837  -1.079
  195   HD12  LEU  25          1HD1      LEU  25  -3.075  -4.224  -0.406
  196   HD13  LEU  25          3HD1      LEU  25  -2.135  -5.582   0.210
  197   HD21  LEU  25          3HD2      LEU  25  -0.071  -4.190  -0.278
  198   HD22  LEU  25          2HD2      LEU  25  -1.039  -2.908  -1.005
  199   HD23  LEU  25          1HD2      LEU  25   0.252  -3.677  -1.935
  200    H    LYS  26           H        LYS  26  -0.730  -6.527  -5.008
  201    HA   LYS  26           HA       LYS  26  -2.916  -4.929  -5.845
  202    HB2  LYS  26           HB2      LYS  26  -0.611  -4.588  -6.637
  203    HB3  LYS  26           HB3      LYS  26  -0.671  -6.133  -7.469
  204    HG2  LYS  26           HG2      LYS  26  -2.224  -5.345  -9.048
  205    HG3  LYS  26           HG3      LYS  26  -2.593  -3.914  -8.085
  206    HD2  LYS  26           HD2      LYS  26  -1.154  -3.422 -10.034
  207    HD3  LYS  26           HD3      LYS  26  -0.397  -3.010  -8.496
  208    HE2  LYS  26           HE2      LYS  26   1.206  -4.081  -9.957
  209    HE3  LYS  26           HE3      LYS  26   0.865  -5.111  -8.569
  210    HZ1  LYS  26           HZ1      LYS  26   0.923  -6.386 -10.617
  211    HZ2  LYS  26           HZ2      LYS  26  -0.303  -5.424 -11.285
  212    HZ3  LYS  26           HZ3      LYS  26  -0.637  -6.416  -9.951
  213    H    LYS  27           H        LYS  27  -2.083  -8.290  -6.267
  214    HA   LYS  27           HA       LYS  27  -3.869  -8.941  -8.337
  215    HB2  LYS  27           HB2      LYS  27  -2.023 -10.392  -7.381
  216    HB3  LYS  27           HB3      LYS  27  -3.099 -10.737  -6.035
  217    HG2  LYS  27           HG2      LYS  27  -3.150 -12.530  -7.656
  218    HG3  LYS  27           HG3      LYS  27  -4.716 -11.719  -7.588
  219    HD2  LYS  27           HD2      LYS  27  -4.292 -10.553  -9.618
  220    HD3  LYS  27           HD3      LYS  27  -2.599 -11.050  -9.620
  221    HE2  LYS  27           HE2      LYS  27  -4.941 -12.934  -9.856
  222    HE3  LYS  27           HE3      LYS  27  -4.011 -12.316 -11.221
  223    HZ1  LYS  27           HZ1      LYS  27  -2.930 -13.958  -8.991
  224    HZ2  LYS  27           HZ2      LYS  27  -2.033 -13.362 -10.300
  225    HZ3  LYS  27           HZ3      LYS  27  -3.255 -14.508 -10.562
  226    H    GLY  28           H        GLY  28  -4.238  -9.060  -4.809
  227    HA2  GLY  28           HA1      GLY  28  -6.961  -9.841  -4.791
  228    HA3  GLY  28           HA2      GLY  28  -6.102  -9.062  -3.469
  229    H    ALA  29           H        ALA  29  -5.373  -6.686  -4.752
  230    HA   ALA  29           HA       ALA  29  -7.657  -5.110  -4.325
  231    HB1  ALA  29           HB1      ALA  29  -5.360  -4.292  -4.074
  232    HB2  ALA  29           HB2      ALA  29  -5.142  -4.381  -5.821
  233    HB3  ALA  29           HB3      ALA  29  -6.313  -3.255  -5.133
  234    H    LYS  30           H        LYS  30  -6.041  -6.051  -7.342
  235    HA   LYS  30           HA       LYS  30  -7.843  -4.747  -9.076
  236    HB2  LYS  30           HB2      LYS  30  -5.569  -5.556  -9.700
  237    HB3  LYS  30           HB3      LYS  30  -6.167  -7.206  -9.615
  238    HG2  LYS  30           HG2      LYS  30  -7.735  -6.735 -11.425
  239    HG3  LYS  30           HG3      LYS  30  -7.137  -5.076 -11.509
  240    HD2  LYS  30           HD2      LYS  30  -4.902  -5.918 -12.058
  241    HD3  LYS  30           HD3      LYS  30  -5.511  -7.572 -11.989
  242    HE2  LYS  30           HE2      LYS  30  -7.084  -7.035 -13.810
  243    HE3  LYS  30           HE3      LYS  30  -6.392  -5.416 -13.898
  244    HZ1  LYS  30           HZ1      LYS  30  -5.449  -6.887 -15.570
  245    HZ2  LYS  30           HZ2      LYS  30  -4.907  -7.948 -14.359
  246    HZ3  LYS  30           HZ3      LYS  30  -4.264  -6.383 -14.470
  247    H    LYS  31           H        LYS  31  -7.851  -7.857  -7.502
  248    HA   LYS  31           HA       LYS  31  -9.938  -9.063  -8.986
  249    HB2  LYS  31           HB2      LYS  31  -8.285 -10.228  -7.479
  250    HB3  LYS  31           HB3      LYS  31  -9.189  -9.588  -6.108
  251    HG2  LYS  31           HG2      LYS  31 -11.121 -10.857  -6.699
  252    HG3  LYS  31           HG3      LYS  31 -10.395 -11.352  -8.229
  253    HD2  LYS  31           HD2      LYS  31 -10.280 -13.150  -6.578
  254    HD3  LYS  31           HD3      LYS  31  -8.667 -12.585  -7.013
  255    HE2  LYS  31           HE2      LYS  31  -8.756 -12.906  -4.636
  256    HE3  LYS  31           HE3      LYS  31  -8.669 -11.177  -4.970
  257    HZ1  LYS  31           HZ1      LYS  31 -10.290 -11.619  -3.260
  258    HZ2  LYS  31           HZ2      LYS  31 -11.111 -12.709  -4.264
  259    HZ3  LYS  31           HZ3      LYS  31 -11.082 -11.056  -4.652
  260    H    MET  32           H        MET  32  -9.851  -6.832  -6.308
  261    HA   MET  32           HA       MET  32 -12.628  -7.200  -5.617
  262    HB2  MET  32           HB2      MET  32 -10.538  -5.215  -4.731
  263    HB3  MET  32           HB3      MET  32 -12.192  -5.192  -4.142
  264    HG2  MET  32           HG2      MET  32 -10.392  -7.587  -3.900
  265    HG3  MET  32           HG3      MET  32 -10.513  -6.327  -2.663
  266    HE1  MET  32           HE1      MET  32 -12.481  -9.222  -0.967
  267    HE2  MET  32           HE2      MET  32 -11.009  -9.328  -1.929
  268    HE3  MET  32           HE3      MET  32 -11.217  -8.007  -0.779
  269    H    GLY  33           H        GLY  33 -10.739  -5.096  -7.642
  270    HA2  GLY  33           HA1      GLY  33 -11.753  -4.072  -9.547
  271    HA3  GLY  33           HA2      GLY  33 -13.257  -3.957  -8.647
  272    H    ASN  34           H        ASN  34 -10.418  -3.104  -6.951
  273    HA   ASN  34           HA       ASN  34 -11.135  -0.275  -7.199
  274    HB2  ASN  34           HB2      ASN  34  -9.731  -0.020  -5.092
  275    HB3  ASN  34           HB3      ASN  34 -11.250  -0.885  -4.920
  276   HD21  ASN  34          1HD2      ASN  34  -7.779  -1.222  -5.084
  277   HD22  ASN  34          2HD2      ASN  34  -7.712  -2.780  -4.356
  278    H    LEU  35           H        LEU  35  -9.241   1.240  -6.875
  279    HA   LEU  35           HA       LEU  35  -7.155   0.450  -8.786
  280    HB2  LEU  35           HB2      LEU  35  -7.944   3.198  -7.805
  281    HB3  LEU  35           HB3      LEU  35  -6.778   2.853  -9.067
  282    HG   LEU  35           HG       LEU  35  -9.731   2.239  -9.228
  283   HD11  LEU  35          2HD1      LEU  35  -9.308   4.636  -9.234
  284   HD12  LEU  35          1HD1      LEU  35  -9.813   4.082 -10.831
  285   HD13  LEU  35          3HD1      LEU  35  -8.113   4.434 -10.516
  286   HD21  LEU  35          3HD2      LEU  35  -7.549   2.055 -11.305
  287   HD22  LEU  35          2HD2      LEU  35  -9.270   1.796 -11.590
  288   HD23  LEU  35          1HD2      LEU  35  -8.374   0.699 -10.541
  289    H    ILE  36           H        ILE  36  -5.057   0.294  -8.139
  290    HA   ILE  36           HA       ILE  36  -4.363   1.388  -5.519
  291    HB   ILE  36           HB       ILE  36  -5.031  -0.967  -5.177
  292   HG12  ILE  36          2HG1      ILE  36  -2.073  -0.482  -4.773
  293   HG13  ILE  36          3HG1      ILE  36  -3.347   0.147  -3.735
  294   HG21  ILE  36          2HG2      ILE  36  -4.395  -1.884  -7.328
  295   HG22  ILE  36          1HG2      ILE  36  -3.599  -2.767  -6.025
  296   HG23  ILE  36          3HG2      ILE  36  -2.692  -1.589  -6.974
  297   HD11  ILE  36          3HD1      ILE  36  -2.284  -1.827  -2.780
  298   HD12  ILE  36          2HD1      ILE  36  -2.753  -2.765  -4.199
  299   HD13  ILE  36          1HD1      ILE  36  -3.989  -2.111  -3.125
  300    H    LYS  37           H        LYS  37  -2.356   2.123  -5.315
  301    HA   LYS  37           HA       LYS  37  -0.508   1.773  -7.591
  302    HB2  LYS  37           HB2      LYS  37  -1.534   4.135  -6.424
  303    HB3  LYS  37           HB3      LYS  37   0.133   4.022  -5.886
  304    HG2  LYS  37           HG2      LYS  37  -0.879   4.128  -8.715
  305    HG3  LYS  37           HG3      LYS  37   0.086   5.334  -7.864
  306    HD2  LYS  37           HD2      LYS  37   1.829   3.440  -7.638
  307    HD3  LYS  37           HD3      LYS  37   0.911   2.656  -8.926
  308    HE2  LYS  37           HE2      LYS  37   2.358   5.288  -9.003
  309    HE3  LYS  37           HE3      LYS  37   2.655   3.854  -9.980
  310    HZ1  LYS  37           HZ1      LYS  37   0.429   5.796 -10.184
  311    HZ2  LYS  37           HZ2      LYS  37   0.314   4.247 -10.869
  312    HZ3  LYS  37           HZ3      LYS  37   1.530   5.308 -11.383
  313    H    VAL  38           H        VAL  38   0.835   0.156  -6.909
  314    HA   VAL  38           HA       VAL  38   1.746   0.161  -4.141
  315    HB   VAL  38           HB       VAL  38   2.880  -2.020  -4.840
  316   HG11  VAL  38          2HG1      VAL  38  -0.122  -1.788  -4.896
  317   HG12  VAL  38          1HG1      VAL  38   0.896  -1.979  -3.468
  318   HG13  VAL  38          3HG1      VAL  38   0.772  -3.286  -4.646
  319   HG21  VAL  38          3HG2      VAL  38   1.906  -3.147  -6.791
  320   HG22  VAL  38          2HG2      VAL  38   2.811  -1.703  -7.248
  321   HG23  VAL  38          1HG2      VAL  38   1.047  -1.664  -7.207
  322    H    GLU  39           H        GLU  39   3.666   0.809  -3.520
  323    HA   GLU  39           HA       GLU  39   5.682   1.422  -5.567
  324    HB2  GLU  39           HB2      GLU  39   5.011   3.274  -4.070
  325    HB3  GLU  39           HB3      GLU  39   5.527   2.325  -2.682
  326    HG2  GLU  39           HG2      GLU  39   7.818   2.330  -3.540
  327    HG3  GLU  39           HG3      GLU  39   7.295   3.305  -4.913
  328    H    THR  40           H        THR  40   7.651   0.456  -5.540
  329    HA   THR  40           HA       THR  40   8.013  -1.713  -3.604
  330    HB   THR  40           HB       THR  40   9.832  -2.264  -5.516
  331    HG1  THR  40           HG1      THR  40   8.902  -1.726  -7.552
  332   HG21  THR  40          3HG2      THR  40   8.184  -3.801  -6.491
  333   HG22  THR  40          1HG2      THR  40   6.886  -2.923  -5.682
  334   HG23  THR  40          2HG2      THR  40   8.090  -3.792  -4.730
  335    H    GLN  41           H        GLN  41   9.314  -1.161  -1.983
  336    HA   GLN  41           HA       GLN  41  11.788   0.313  -2.608
  337    HB2  GLN  41           HB2      GLN  41   9.985   1.758  -1.566
  338    HB3  GLN  41           HB3      GLN  41  10.106   0.754  -0.131
  339    HG2  GLN  41           HG2      GLN  41  12.363   1.453   0.243
  340    HG3  GLN  41           HG3      GLN  41  12.404   2.303  -1.301
  341   HE21  GLN  41          1HE2      GLN  41   9.678   3.329  -0.967
  342   HE22  GLN  41          2HE2      GLN  41   9.794   4.594   0.194
  343    H    GLY  42           H        GLY  42  13.469  -0.028  -0.885
  344    HA2  GLY  42           HA1      GLY  42  13.042  -2.372   0.797
  345    HA3  GLY  42           HA2      GLY  42  14.250  -2.536  -0.470
  346    H    ALA  43           H        ALA  43  15.948  -0.851  -0.506
  347    HA   ALA  43           HA       ALA  43  16.470   0.595   1.932
  348    HB1  ALA  43           HB1      ALA  43  18.620  -0.486   2.395
  349    HB2  ALA  43           HB2      ALA  43  17.290  -1.636   2.542
  350    HB3  ALA  43           HB3      ALA  43  18.316  -1.652   1.107
  351    H    THR  44           H        THR  44  17.280   2.463   1.304
  352    HA   THR  44           HA       THR  44  18.173   4.113   0.042
  353    HB   THR  44           HB       THR  44  20.426   3.705  -0.934
  354    HG1  THR  44           HG1      THR  44  19.624   1.130  -0.817
  355   HG21  THR  44          3HG2      THR  44  21.540   3.197   1.193
  356   HG22  THR  44          1HG2      THR  44  20.005   2.634   1.854
  357   HG23  THR  44          2HG2      THR  44  20.202   4.328   1.401
  358    H    GLY  45           H        GLY  45  16.166   2.407  -1.276
  359    HA2  GLY  45           HA1      GLY  45  16.640   3.233  -3.996
  360    HA3  GLY  45           HA2      GLY  45  16.708   1.492  -3.774
  361    H    ILE  46           H        ILE  46  14.771   4.006  -4.587
  362    HA   ILE  46           HA       ILE  46  12.311   2.532  -3.894
  363    HB   ILE  46           HB       ILE  46  12.546   5.406  -4.817
  364   HG12  ILE  46          2HG1      ILE  46  12.085   4.324  -2.026
  365   HG13  ILE  46          3HG1      ILE  46  13.562   5.098  -2.591
  366   HG21  ILE  46          2HG2      ILE  46  10.419   4.323  -5.353
  367   HG22  ILE  46          1HG2      ILE  46  10.213   5.579  -4.133
  368   HG23  ILE  46          3HG2      ILE  46  10.218   3.881  -3.657
  369   HD11  ILE  46          3HD1      ILE  46  10.859   6.403  -2.400
  370   HD12  ILE  46          2HD1      ILE  46  12.349   7.179  -2.937
  371   HD13  ILE  46          1HD1      ILE  46  12.198   6.617  -1.271
  372    H    GLU  47           H        GLU  47  11.206   1.584  -5.544
  373    HA   GLU  47           HA       GLU  47  12.420   1.817  -8.182
  374    HB2  GLU  47           HB2      GLU  47  12.051  -0.412  -7.244
  375    HB3  GLU  47           HB3      GLU  47  10.328  -0.086  -7.126
  376    HG2  GLU  47           HG2      GLU  47  10.188   0.083  -9.554
  377    HG3  GLU  47           HG3      GLU  47  11.917  -0.241  -9.677
  378    H    ASN  48           H        ASN  48   9.064   1.671  -6.962
  379    HA   ASN  48           HA       ASN  48   7.999   2.623  -9.416
  380    HB2  ASN  48           HB2      ASN  48   6.768   1.169  -7.782
  381    HB3  ASN  48           HB3      ASN  48   6.615   2.571  -6.727
  382   HD21  ASN  48          1HD2      ASN  48   5.604   1.082  -9.680
  383   HD22  ASN  48          2HD2      ASN  48   4.264   2.129 -10.000
  384    H    GLU  49           H        GLU  49   8.456   4.135  -6.241
  385    HA   GLU  49           HA       GLU  49   8.606   6.289  -5.553
  386    HB2  GLU  49           HB2      GLU  49  10.286   6.382  -7.432
  387    HB3  GLU  49           HB3      GLU  49   9.006   6.999  -8.465
  388    HG2  GLU  49           HG2      GLU  49  10.239   8.863  -7.750
  389    HG3  GLU  49           HG3      GLU  49   8.742   8.882  -6.819
  390    H    LEU  50           H        LEU  50   6.453   6.380  -4.885
  391    HA   LEU  50           HA       LEU  50   4.294   6.886  -6.647
  392    HB2  LEU  50           HB2      LEU  50   4.516   7.273  -3.663
  393    HB3  LEU  50           HB3      LEU  50   3.020   7.410  -4.568
  394    HG   LEU  50           HG       LEU  50   4.698   4.914  -4.293
  395   HD11  LEU  50          2HD1      LEU  50   3.506   5.465  -2.256
  396   HD12  LEU  50          1HD1      LEU  50   2.779   4.060  -3.038
  397   HD13  LEU  50          3HD1      LEU  50   2.003   5.640  -3.163
  398   HD21  LEU  50          3HD2      LEU  50   2.061   5.336  -5.692
  399   HD22  LEU  50          2HD2      LEU  50   2.884   3.793  -5.468
  400   HD23  LEU  50          1HD2      LEU  50   3.612   5.040  -6.479
  401    H    THR  51           H        THR  51   4.036   8.624  -7.792
  402    HA   THR  51           HA       THR  51   5.247  11.124  -7.162
  403    HB   THR  51           HB       THR  51   3.597  11.734  -9.199
  404    HG1  THR  51           HG1      THR  51   2.552   9.777  -9.410
  405   HG21  THR  51          3HG2      THR  51   6.142  10.123  -9.425
  406   HG22  THR  51          1HG2      THR  51   6.038  11.873  -9.227
  407   HG23  THR  51          2HG2      THR  51   5.434  11.114 -10.700
  408    H    GLU  52           H        GLU  52   4.101  13.155  -6.997
  409    HA   GLU  52           HA       GLU  52   2.387  13.223  -4.832
  410    HB2  GLU  52           HB2      GLU  52   2.789  15.299  -6.987
  411    HB3  GLU  52           HB3      GLU  52   1.980  15.596  -5.454
  412    HG2  GLU  52           HG2      GLU  52   4.846  14.761  -5.813
  413    HG3  GLU  52           HG3      GLU  52   4.272  16.377  -5.403
  414    H    LYS  53           H        LYS  53   1.576  13.326  -8.282
  415    HA   LYS  53           HA       LYS  53  -1.138  13.842  -8.105
  416    HB2  LYS  53           HB2      LYS  53   0.461  12.167 -10.018
  417    HB3  LYS  53           HB3      LYS  53  -1.284  12.304 -10.177
  418    HG2  LYS  53           HG2      LYS  53  -1.031  14.762 -10.326
  419    HG3  LYS  53           HG3      LYS  53   0.721  14.545 -10.304
  420    HD2  LYS  53           HD2      LYS  53  -0.200  14.813 -12.588
  421    HD3  LYS  53           HD3      LYS  53   0.634  13.275 -12.355
  422    HE2  LYS  53           HE2      LYS  53  -1.438  12.958 -13.597
  423    HE3  LYS  53           HE3      LYS  53  -1.518  12.156 -12.030
  424    HZ1  LYS  53           HZ1      LYS  53  -2.808  14.030 -11.184
  425    HZ2  LYS  53           HZ2      LYS  53  -3.571  13.317 -12.518
  426    HZ3  LYS  53           HZ3      LYS  53  -2.737  14.786 -12.704
  427    H    ASP  54           H        ASP  54   0.409  10.636  -8.156
  428    HA   ASP  54           HA       ASP  54  -1.947   9.165  -7.742
  429    HB2  ASP  54           HB2      ASP  54   0.895   8.394  -7.051
  430    HB3  ASP  54           HB3      ASP  54  -0.463   7.285  -7.218
  431    H    VAL  55           H        VAL  55   0.322  10.620  -5.532
  432    HA   VAL  55           HA       VAL  55  -0.549   9.392  -3.157
  433    HB   VAL  55           HB       VAL  55   0.697  12.109  -3.596
  434   HG11  VAL  55          2HG1      VAL  55  -0.451  12.049  -1.452
  435   HG12  VAL  55          1HG1      VAL  55   1.299  12.028  -1.223
  436   HG13  VAL  55          3HG1      VAL  55   0.366  10.541  -1.046
  437   HG21  VAL  55          3HG2      VAL  55   2.078  10.245  -4.342
  438   HG22  VAL  55          2HG2      VAL  55   1.890   9.469  -2.769
  439   HG23  VAL  55          1HG2      VAL  55   2.759  10.997  -2.899
  440    H    ASN  56           H        ASN  56  -1.654  12.276  -4.864
  441    HA   ASN  56           HA       ASN  56  -3.587  12.898  -2.805
  442    HB2  ASN  56           HB2      ASN  56  -2.943  14.143  -5.473
  443    HB3  ASN  56           HB3      ASN  56  -4.338  14.645  -4.522
  444   HD21  ASN  56          1HD2      ASN  56  -0.855  14.570  -4.687
  445   HD22  ASN  56          2HD2      ASN  56  -0.579  15.741  -3.436
  446    H    ILE  57           H        ILE  57  -3.455  11.019  -5.673
  447    HA   ILE  57           HA       ILE  57  -6.272  10.865  -6.129
  448    HB   ILE  57           HB       ILE  57  -4.015   9.018  -6.936
  449   HG12  ILE  57          2HG1      ILE  57  -5.673  10.979  -8.538
  450   HG13  ILE  57          3HG1      ILE  57  -4.029  11.258  -7.978
  451   HG21  ILE  57          2HG2      ILE  57  -6.908   8.912  -7.785
  452   HG22  ILE  57          1HG2      ILE  57  -6.088   7.740  -6.753
  453   HG23  ILE  57          3HG2      ILE  57  -5.601   7.923  -8.438
  454   HD11  ILE  57          3HD1      ILE  57  -4.069  10.636 -10.321
  455   HD12  ILE  57          2HD1      ILE  57  -4.897   9.132  -9.921
  456   HD13  ILE  57          1HD1      ILE  57  -3.247   9.405  -9.360
  457    H    GLY  58           H        GLY  58  -3.989   8.443  -4.830
  458    HA2  GLY  58           HA1      GLY  58  -5.868   6.716  -3.709
  459    HA3  GLY  58           HA2      GLY  58  -4.207   6.894  -3.158
  460    H    GLU  59           H        GLU  59  -7.164   6.815  -2.033
  461    HA   GLU  59           HA       GLU  59  -7.164   9.208  -0.399
  462    HB2  GLU  59           HB2      GLU  59  -9.050   6.842  -0.398
  463    HB3  GLU  59           HB3      GLU  59  -9.323   8.389   0.397
  464    HG2  GLU  59           HG2      GLU  59  -9.389   9.522  -1.723
  465    HG3  GLU  59           HG3      GLU  59  -8.970   8.035  -2.568
  466    H    VAL  60           H        VAL  60  -7.350   5.719   0.288
  467    HA   VAL  60           HA       VAL  60  -6.082   6.198   2.874
  468    HB   VAL  60           HB       VAL  60  -6.548   3.764   3.290
  469   HG11  VAL  60          2HG1      VAL  60  -8.929   5.480   2.598
  470   HG12  VAL  60          1HG1      VAL  60  -8.039   5.499   4.120
  471   HG13  VAL  60          3HG1      VAL  60  -8.947   4.063   3.649
  472   HG21  VAL  60          3HG2      VAL  60  -6.643   3.008   0.974
  473   HG22  VAL  60          2HG2      VAL  60  -8.084   3.988   0.701
  474   HG23  VAL  60          1HG2      VAL  60  -8.144   2.624   1.817
  475    H    VAL  61           H        VAL  61  -4.175   5.222   3.486
  476    HA   VAL  61           HA       VAL  61  -2.504   4.272   1.250
  477    HB   VAL  61           HB       VAL  61  -1.504   5.455   3.838
  478   HG11  VAL  61          2HG1      VAL  61   0.106   4.122   2.599
  479   HG12  VAL  61          1HG1      VAL  61   0.552   5.827   2.569
  480   HG13  VAL  61          3HG1      VAL  61  -0.188   5.085   1.151
  481   HG21  VAL  61          3HG2      VAL  61  -2.891   7.136   2.764
  482   HG22  VAL  61          2HG2      VAL  61  -2.025   6.906   1.245
  483   HG23  VAL  61          1HG2      VAL  61  -1.190   7.577   2.645
  484    H    ILE  62           H        ILE  62  -1.400   2.360   1.484
  485    HA   ILE  62           HA       ILE  62  -1.702   0.984   4.082
  486    HB   ILE  62           HB       ILE  62  -1.575  -0.284   1.331
  487   HG12  ILE  62          2HG1      ILE  62  -3.844  -0.149   3.333
  488   HG13  ILE  62          3HG1      ILE  62  -3.750   0.771   1.834
  489   HG21  ILE  62          2HG2      ILE  62  -1.976  -2.403   2.515
  490   HG22  ILE  62          1HG2      ILE  62  -1.844  -1.552   4.055
  491   HG23  ILE  62          3HG2      ILE  62  -0.446  -1.659   2.984
  492   HD11  ILE  62          3HD1      ILE  62  -3.839  -1.290   0.549
  493   HD12  ILE  62          2HD1      ILE  62  -5.229  -1.154   1.627
  494   HD13  ILE  62          1HD1      ILE  62  -3.893  -2.228   2.042
  495    H    PHE  63           H        PHE  63   0.123   0.356   5.059
  496    HA   PHE  63           HA       PHE  63   2.609   0.471   3.486
  497    HB2  PHE  63           HB2      PHE  63   2.062   1.255   6.337
  498    HB3  PHE  63           HB3      PHE  63   3.690   0.863   5.794
  499    HD1  PHE  63           HD2      PHE  63   4.632   2.170   3.838
  500    HD2  PHE  63           HD1      PHE  63   1.181   3.388   6.008
  501    HE1  PHE  63           HE2      PHE  63   4.919   4.462   2.996
  502    HE2  PHE  63           HE1      PHE  63   1.465   5.685   5.170
  503    HZ   PHE  63           HZ       PHE  63   3.335   6.223   3.664
  504    H    ALA  64           H        ALA  64   3.221  -1.506   3.030
  505    HA   ALA  64           HA       ALA  64   3.166  -3.511   5.188
  506    HB1  ALA  64           HB1      ALA  64   3.212  -3.975   2.205
  507    HB2  ALA  64           HB2      ALA  64   3.183  -5.223   3.452
  508    HB3  ALA  64           HB3      ALA  64   1.800  -4.147   3.250
  509    H    VAL  65           H        VAL  65   5.124  -3.064   6.110
  510    HA   VAL  65           HA       VAL  65   7.496  -3.295   4.415
  511    HB   VAL  65           HB       VAL  65   8.482  -1.239   5.370
  512   HG11  VAL  65          2HG1      VAL  65   7.174   0.375   4.070
  513   HG12  VAL  65          1HG1      VAL  65   5.868  -0.803   3.936
  514   HG13  VAL  65          3HG1      VAL  65   7.433  -1.129   3.185
  515   HG21  VAL  65          3HG2      VAL  65   7.048   0.389   6.514
  516   HG22  VAL  65          2HG2      VAL  65   7.189  -1.110   7.432
  517   HG23  VAL  65          1HG2      VAL  65   5.724  -0.776   6.508
  518    H    ASP  66           H        ASP  66   9.416  -3.736   5.517
  519    HA   ASP  66           HA       ASP  66   9.158  -4.486   8.351
  520    HB2  ASP  66           HB2      ASP  66  11.329  -5.075   6.324
  521    HB3  ASP  66           HB3      ASP  66  11.454  -5.480   8.029
  522    H    THR  67           H        THR  67  10.761  -2.378   6.116
  523    HA   THR  67           HA       THR  67  12.327  -1.156   8.275
  524    HB   THR  67           HB       THR  67  13.643  -2.076   6.400
  525    HG1  THR  67           HG1      THR  67  14.562   0.162   5.767
  526   HG21  THR  67          3HG2      THR  67  13.532  -0.999   4.185
  527   HG22  THR  67          1HG2      THR  67  12.122  -0.083   4.721
  528   HG23  THR  67          2HG2      THR  67  12.040  -1.842   4.604
  529    H    LYS  68           H        LYS  68  12.873   1.268   7.226
  530    HA   LYS  68           HA       LYS  68  10.393   2.673   7.623
  531    HB2  LYS  68           HB2      LYS  68  11.768   4.690   7.511
  532    HB3  LYS  68           HB3      LYS  68  12.523   3.501   8.566
  533    HG2  LYS  68           HG2      LYS  68  14.169   2.975   6.981
  534    HG3  LYS  68           HG3      LYS  68  13.285   3.765   5.676
  535    HD2  LYS  68           HD2      LYS  68  13.636   5.936   6.854
  536    HD3  LYS  68           HD3      LYS  68  14.665   5.082   8.007
  537    HE2  LYS  68           HE2      LYS  68  16.189   4.449   6.248
  538    HE3  LYS  68           HE3      LYS  68  15.126   5.150   5.028
  539    HZ1  LYS  68           HZ1      LYS  68  16.530   6.646   7.174
  540    HZ2  LYS  68           HZ2      LYS  68  15.496   7.328   6.014
  541    HZ3  LYS  68           HZ3      LYS  68  16.961   6.620   5.534
  542    H    VAL  69           H        VAL  69   9.520   4.236   6.162
  543    HA   VAL  69           HA       VAL  69  10.247   3.802   3.334
  544    HB   VAL  69           HB       VAL  69   7.606   4.775   4.452
  545   HG11  VAL  69          2HG1      VAL  69   8.408   4.091   1.625
  546   HG12  VAL  69          1HG1      VAL  69   8.077   5.705   2.256
  547   HG13  VAL  69          3HG1      VAL  69   6.781   4.513   2.161
  548   HG21  VAL  69          3HG2      VAL  69   7.979   2.414   4.941
  549   HG22  VAL  69          2HG2      VAL  69   8.325   2.107   3.241
  550   HG23  VAL  69          1HG2      VAL  69   6.710   2.616   3.734
  551    H    ARG  70           H        ARG  70  10.973   5.544   2.197
  552    HA   ARG  70           HA       ARG  70  11.461   8.033   3.463
  553    HB2  ARG  70           HB2      ARG  70  12.841   7.327   1.594
  554    HB3  ARG  70           HB3      ARG  70  11.441   7.301   0.526
  555    HG2  ARG  70           HG2      ARG  70  11.223   9.803   1.127
  556    HG3  ARG  70           HG3      ARG  70  12.893   9.652   1.673
  557    HD2  ARG  70           HD2      ARG  70  13.554   8.860  -0.534
  558    HD3  ARG  70           HD3      ARG  70  11.882   8.965  -1.082
  559    HE   ARG  70           HE       ARG  70  13.051  11.431  -0.081
  560   HH11  ARG  70          2HH1      ARG  70  12.173   9.467  -2.838
  561   HH12  ARG  70          1HH1      ARG  70  12.402  10.738  -3.997
  562   HH21  ARG  70          2HH2      ARG  70  13.331  13.140  -1.600
  563   HH22  ARG  70          1HH2      ARG  70  13.066  12.827  -3.287
  564    H    ASN  71           H        ASN  71   9.139   7.088   0.953
  565    HA   ASN  71           HA       ASN  71   8.106   9.718   0.690
  566    HB2  ASN  71           HB2      ASN  71   7.118   7.094  -0.417
  567    HB3  ASN  71           HB3      ASN  71   6.447   8.665  -0.844
  568   HD21  ASN  71          1HD2      ASN  71   7.748   6.749  -2.601
  569   HD22  ASN  71          2HD2      ASN  71   9.107   7.600  -3.285
  570    H    LYS  72           H        LYS  72   7.519   7.449   3.043
  571    HA   LYS  72           HA       LYS  72   4.775   7.607   3.491
  572    HB2  LYS  72           HB2      LYS  72   5.179   6.884   5.712
  573    HB3  LYS  72           HB3      LYS  72   6.419   6.134   4.724
  574    HG2  LYS  72           HG2      LYS  72   7.715   6.806   6.447
  575    HG3  LYS  72           HG3      LYS  72   7.780   8.286   5.493
  576    HD2  LYS  72           HD2      LYS  72   7.339   8.779   7.845
  577    HD3  LYS  72           HD3      LYS  72   5.962   9.235   6.840
  578    HE2  LYS  72           HE2      LYS  72   4.792   7.214   7.472
  579    HE3  LYS  72           HE3      LYS  72   6.190   6.658   8.389
  580    HZ1  LYS  72           HZ1      LYS  72   4.521   9.048   9.003
  581    HZ2  LYS  72           HZ2      LYS  72   5.916   8.596   9.848
  582    HZ3  LYS  72           HZ3      LYS  72   4.555   7.586   9.867
  583    H    GLU  73           H        GLU  73   7.245   9.952   3.870
  584    HA   GLU  73           HA       GLU  73   6.323  11.776   5.670
  585    HB2  GLU  73           HB2      GLU  73   7.366  13.497   4.127
  586    HB3  GLU  73           HB3      GLU  73   8.396  12.141   4.571
  587    HG2  GLU  73           HG2      GLU  73   7.821  11.053   2.424
  588    HG3  GLU  73           HG3      GLU  73   6.906  12.489   1.981
  589    H    ARG  74           H        ARG  74   5.190  11.423   2.303
  590    HA   ARG  74           HA       ARG  74   3.424  13.687   2.545
  591    HB2  ARG  74           HB2      ARG  74   2.773  13.129   0.245
  592    HB3  ARG  74           HB3      ARG  74   4.518  13.222   0.425
  593    HG2  ARG  74           HG2      ARG  74   4.214  10.608   0.822
  594    HG3  ARG  74           HG3      ARG  74   2.785  10.901  -0.173
  595    HD2  ARG  74           HD2      ARG  74   4.625  10.300  -1.605
  596    HD3  ARG  74           HD3      ARG  74   4.232  12.000  -1.834
  597    HE   ARG  74           HE       ARG  74   6.208  12.069   0.015
  598   HH11  ARG  74          2HH1      ARG  74   5.946  10.513  -3.111
  599   HH12  ARG  74          1HH1      ARG  74   7.620  10.728  -3.500
  600   HH21  ARG  74          2HH2      ARG  74   8.418  12.410  -0.514
  601   HH22  ARG  74          1HH2      ARG  74   9.021  11.792  -2.025
  602    H    PHE  75           H        PHE  75   3.193  10.237   2.892
  603    HA   PHE  75           HA       PHE  75   0.311  10.206   2.874
  604    HB2  PHE  75           HB2      PHE  75   2.238   8.052   3.756
  605    HB3  PHE  75           HB3      PHE  75   0.542   7.849   3.341
  606    HD1  PHE  75           HD2      PHE  75  -0.013   8.866   0.887
  607    HD2  PHE  75           HD1      PHE  75   3.734   7.335   2.196
  608    HE1  PHE  75           HE2      PHE  75   0.620   8.426  -1.446
  609    HE2  PHE  75           HE1      PHE  75   4.376   6.897  -0.136
  610    HZ   PHE  75           HZ       PHE  75   2.817   7.442  -1.960
  611    H    ASP  76           H        ASP  76   2.732  10.984   5.055
  612    HA   ASP  76           HA       ASP  76   1.770   9.924   7.468
  613    HB2  ASP  76           HB2      ASP  76   4.056  10.855   7.078
  614    HB3  ASP  76           HB3      ASP  76   3.355  12.470   7.092
  615    H    GLY  77           H        GLY  77   0.972  12.847   5.712
  616    HA2  GLY  77           HA1      GLY  77  -0.776  13.781   7.849
  617    HA3  GLY  77           HA2      GLY  77  -0.465  14.597   6.322
  618    H    LYS  78           H        LYS  78  -1.102  11.330   5.878
  619    HA   LYS  78           HA       LYS  78  -3.917  11.889   5.216
  620    HB2  LYS  78           HB2      LYS  78  -1.887  10.150   3.800
  621    HB3  LYS  78           HB3      LYS  78  -3.613  10.077   3.465
  622    HG2  LYS  78           HG2      LYS  78  -3.644  12.261   2.593
  623    HG3  LYS  78           HG3      LYS  78  -2.058  12.638   3.265
  624    HD2  LYS  78           HD2      LYS  78  -1.958  12.283   0.841
  625    HD3  LYS  78           HD3      LYS  78  -1.013  11.074   1.712
  626    HE2  LYS  78           HE2      LYS  78  -2.239  10.018  -0.072
  627    HE3  LYS  78           HE3      LYS  78  -2.884   9.490   1.476
  628    HZ1  LYS  78           HZ1      LYS  78  -4.590  10.048  -0.224
  629    HZ2  LYS  78           HZ2      LYS  78  -4.085  11.667  -0.148
  630    HZ3  LYS  78           HZ3      LYS  78  -4.755  10.924   1.220
  631    H    VAL  79           H        VAL  79  -4.881   9.397   4.809
  632    HA   VAL  79           HA       VAL  79  -4.642   8.269   7.495
  633    HB   VAL  79           HB       VAL  79  -6.897   8.852   6.930
  634   HG11  VAL  79          2HG1      VAL  79  -6.728   8.843   4.517
  635   HG12  VAL  79          1HG1      VAL  79  -8.087   7.849   5.041
  636   HG13  VAL  79          3HG1      VAL  79  -6.587   7.084   4.514
  637   HG21  VAL  79          3HG2      VAL  79  -6.547   5.860   6.784
  638   HG22  VAL  79          2HG2      VAL  79  -8.030   6.707   7.223
  639   HG23  VAL  79          1HG2      VAL  79  -6.607   6.828   8.256
  640    H    VAL  80           H        VAL  80  -3.496   6.477   7.804
  641    HA   VAL  80           HA       VAL  80  -3.005   4.763   5.462
  642    HB   VAL  80           HB       VAL  80  -0.756   4.449   6.036
  643   HG11  VAL  80          2HG1      VAL  80   0.197   6.710   6.186
  644   HG12  VAL  80          1HG1      VAL  80  -1.399   7.339   6.591
  645   HG13  VAL  80          3HG1      VAL  80  -1.114   6.604   5.014
  646   HG21  VAL  80          3HG2      VAL  80  -0.972   4.054   8.402
  647   HG22  VAL  80          2HG2      VAL  80  -1.326   5.759   8.692
  648   HG23  VAL  80          1HG2      VAL  80   0.271   5.273   8.121
  649    H    LEU  81           H        LEU  81  -2.591   2.560   5.854
  650    HA   LEU  81           HA       LEU  81  -3.314   1.538   8.521
  651    HB2  LEU  81           HB2      LEU  81  -5.051   1.241   6.654
  652    HB3  LEU  81           HB3      LEU  81  -3.918   0.137   5.913
  653    HG   LEU  81           HG       LEU  81  -5.760  -0.944   7.220
  654   HD11  LEU  81          2HD1      LEU  81  -4.336  -2.589   8.329
  655   HD12  LEU  81          1HD1      LEU  81  -2.957  -1.500   8.175
  656   HD13  LEU  81          3HD1      LEU  81  -3.721  -2.167   6.731
  657   HD21  LEU  81          3HD2      LEU  81  -4.281   0.231   9.568
  658   HD22  LEU  81          2HD2      LEU  81  -5.563  -0.976   9.666
  659   HD23  LEU  81          1HD2      LEU  81  -5.916   0.637   9.048
  660    H    GLU  82           H        GLU  82  -1.532   0.690   9.386
  661    HA   GLU  82           HA       GLU  82   0.656  -0.110   7.623
  662    HB2  GLU  82           HB2      GLU  82   1.064   1.554   9.426
  663    HB3  GLU  82           HB3      GLU  82   0.652   0.329  10.616
  664    HG2  GLU  82           HG2      GLU  82   2.539  -1.041   9.801
  665    HG3  GLU  82           HG3      GLU  82   2.977   0.272   8.709
  666    H    VAL  83           H        VAL  83   1.315  -2.149   7.397
  667    HA   VAL  83           HA       VAL  83   0.606  -4.167   9.397
  668    HB   VAL  83           HB       VAL  83   0.026  -5.783   7.555
  669   HG11  VAL  83          2HG1      VAL  83  -1.730  -4.854   8.928
  670   HG12  VAL  83          1HG1      VAL  83  -2.285  -4.979   7.258
  671   HG13  VAL  83          3HG1      VAL  83  -1.802  -3.413   7.913
  672   HG21  VAL  83          3HG2      VAL  83  -0.203  -3.276   5.892
  673   HG22  VAL  83          2HG2      VAL  83  -0.703  -4.894   5.400
  674   HG23  VAL  83          1HG2      VAL  83   1.003  -4.547   5.688
  675    HA   PRO  84           HA       PRO  84   4.665  -5.827   8.406
  676    HB2  PRO  84           HB2      PRO  84   3.465  -8.525   8.299
  677    HB3  PRO  84           HB3      PRO  84   4.742  -7.908   9.352
  678    HG2  PRO  84           HG2      PRO  84   2.288  -8.415  10.289
  679    HG3  PRO  84           HG3      PRO  84   3.239  -7.042  10.884
  680    HD2  PRO  84           HD2      PRO  84   0.976  -7.074   8.923
  681    HD3  PRO  84           HD3      PRO  84   1.323  -5.916  10.224
  682    H    VAL  85           H        VAL  85   5.817  -6.727   6.617
  683    HA   VAL  85           HA       VAL  85   4.572  -6.262   4.120
  684    HB   VAL  85           HB       VAL  85   7.012  -5.994   4.572
  685   HG11  VAL  85          2HG1      VAL  85   7.420  -8.037   5.804
  686   HG12  VAL  85          1HG1      VAL  85   8.469  -7.954   4.389
  687   HG13  VAL  85          3HG1      VAL  85   7.048  -8.999   4.374
  688   HG21  VAL  85          3HG2      VAL  85   7.760  -6.811   2.371
  689   HG22  VAL  85          2HG2      VAL  85   6.212  -5.967   2.298
  690   HG23  VAL  85          1HG2      VAL  85   6.261  -7.729   2.226
  691    H    SER  86           H        SER  86   4.922  -9.107   6.055
  692    HA   SER  86           HA       SER  86   4.432 -11.009   3.981
  693    HB2  SER  86           HB2      SER  86   5.632 -11.569   6.074
  694    HB3  SER  86           HB3      SER  86   4.145 -11.307   6.983
  695    HG   SER  86           HG       SER  86   4.003 -13.400   6.628
  696    H    ALA  87           H        ALA  87   2.447  -8.904   5.799
  697    HA   ALA  87           HA       ALA  87   0.153 -10.490   6.124
  698    HB1  ALA  87           HB1      ALA  87   0.295  -7.488   5.975
  699    HB2  ALA  87           HB2      ALA  87  -1.019  -8.446   6.657
  700    HB3  ALA  87           HB3      ALA  87   0.571  -8.458   7.421
  701    HA   PRO  88           HA       PRO  88  -1.752  -8.394   2.233
  702    HB2  PRO  88           HB2      PRO  88  -0.119  -7.208   0.424
  703    HB3  PRO  88           HB3      PRO  88  -0.825  -6.339   1.793
  704    HG2  PRO  88           HG2      PRO  88   1.908  -7.534   1.519
  705    HG3  PRO  88           HG3      PRO  88   1.445  -5.941   2.146
  706    HD2  PRO  88           HD2      PRO  88   2.020  -8.000   3.783
  707    HD3  PRO  88           HD3      PRO  88   0.779  -6.797   4.188
  708    H    ILE  89           H        ILE  89   1.048 -10.302   2.301
  709    HA   ILE  89           HA       ILE  89   0.832 -11.348  -0.369
  710    HB   ILE  89           HB       ILE  89   2.243 -12.518   2.038
  711   HG12  ILE  89          2HG1      ILE  89   3.366 -10.851  -0.224
  712   HG13  ILE  89          3HG1      ILE  89   3.037 -10.246   1.396
  713   HG21  ILE  89          2HG2      ILE  89   1.814 -14.174   0.310
  714   HG22  ILE  89          1HG2      ILE  89   3.534 -13.792   0.389
  715   HG23  ILE  89          3HG2      ILE  89   2.539 -13.117  -0.901
  716   HD11  ILE  89          3HD1      ILE  89   5.397 -10.733   1.086
  717   HD12  ILE  89          2HD1      ILE  89   5.010 -12.407   0.684
  718   HD13  ILE  89          1HD1      ILE  89   4.691 -11.792   2.307
  719    H    LYS  90           H        LYS  90  -0.151 -12.317   2.870
  720    HA   LYS  90           HA       LYS  90  -1.541 -14.659   1.804
  721    HB2  LYS  90           HB2      LYS  90  -0.057 -14.881   3.788
  722    HB3  LYS  90           HB3      LYS  90  -1.124 -13.802   4.673
  723    HG2  LYS  90           HG2      LYS  90  -2.970 -15.450   4.261
  724    HG3  LYS  90           HG3      LYS  90  -1.744 -16.554   3.634
  725    HD2  LYS  90           HD2      LYS  90  -1.831 -15.367   6.407
  726    HD3  LYS  90           HD3      LYS  90  -2.217 -17.033   5.973
  727    HE2  LYS  90           HE2      LYS  90   0.074 -17.397   5.244
  728    HE3  LYS  90           HE3      LYS  90   0.470 -15.712   5.586
  729    HZ1  LYS  90           HZ1      LYS  90  -0.414 -17.711   7.603
  730    HZ2  LYS  90           HZ2      LYS  90   0.023 -16.103   7.914
  731    HZ3  LYS  90           HZ3      LYS  90   1.188 -17.200   7.364
  732    H    ASP  91           H        ASP  91  -2.169 -11.646   3.551
  733    HA   ASP  91           HA       ASP  91  -5.048 -12.292   3.534
  734    HB2  ASP  91           HB2      ASP  91  -3.443 -10.696   5.543
  735    HB3  ASP  91           HB3      ASP  91  -5.199 -10.812   5.551
  736    H    ALA  92           H        ALA  92  -3.844 -11.025   1.331
  737    HA   ALA  92           HA       ALA  92  -3.946  -8.236   1.337
  738    HB1  ALA  92           HB1      ALA  92  -3.048  -9.564  -0.525
  739    HB2  ALA  92           HB2      ALA  92  -4.684 -10.079  -0.938
  740    HB3  ALA  92           HB3      ALA  92  -4.233  -8.380  -1.076
  741    H    GLU  93           H        GLU  93  -6.531 -10.598   0.889
  742    HA   GLU  93           HA       GLU  93  -8.630  -8.860   0.253
  743    HB2  GLU  93           HB2      GLU  93  -8.785 -11.350   1.966
  744    HB3  GLU  93           HB3      GLU  93 -10.092 -10.635   1.035
  745    HG2  GLU  93           HG2      GLU  93  -7.596 -11.602  -0.304
  746    HG3  GLU  93           HG3      GLU  93  -8.902 -12.711   0.113
  747    H    LYS  94           H        LYS  94  -7.237  -9.791   3.344
  748    HA   LYS  94           HA       LYS  94  -9.291  -8.587   4.933
  749    HB2  LYS  94           HB2      LYS  94  -7.932 -10.512   5.708
  750    HB3  LYS  94           HB3      LYS  94  -6.511  -9.479   5.727
  751    HG2  LYS  94           HG2      LYS  94  -7.111  -9.453   7.932
  752    HG3  LYS  94           HG3      LYS  94  -7.942  -8.017   7.341
  753    HD2  LYS  94           HD2      LYS  94  -9.217 -10.735   7.648
  754    HD3  LYS  94           HD3      LYS  94  -9.331  -9.438   8.834
  755    HE2  LYS  94           HE2      LYS  94 -10.424  -8.020   7.147
  756    HE3  LYS  94           HE3      LYS  94 -10.342  -9.351   5.993
  757    HZ1  LYS  94           HZ1      LYS  94 -11.678 -10.672   7.600
  758    HZ2  LYS  94           HZ2      LYS  94 -12.503  -9.340   6.953
  759    HZ3  LYS  94           HZ3      LYS  94 -11.884  -9.268   8.531
  760    H    VAL  95           H        VAL  95  -6.036  -7.710   3.909
  761    HA   VAL  95           HA       VAL  95  -5.814  -5.362   5.462
  762    HB   VAL  95           HB       VAL  95  -3.972  -6.668   4.285
  763   HG11  VAL  95          2HG1      VAL  95  -3.285  -5.930   2.079
  764   HG12  VAL  95          1HG1      VAL  95  -4.756  -4.962   1.955
  765   HG13  VAL  95          3HG1      VAL  95  -4.863  -6.722   2.058
  766   HG21  VAL  95          3HG2      VAL  95  -3.525  -4.622   5.494
  767   HG22  VAL  95          2HG2      VAL  95  -3.978  -3.670   4.079
  768   HG23  VAL  95          1HG2      VAL  95  -2.542  -4.693   4.032
  769    H    ILE  96           H        ILE  96  -6.909  -5.979   2.185
  770    HA   ILE  96           HA       ILE  96  -7.482  -3.359   1.379
  771    HB   ILE  96           HB       ILE  96  -8.809  -5.979   0.647
  772   HG12  ILE  96          2HG1      ILE  96  -6.955  -4.167  -0.919
  773   HG13  ILE  96          3HG1      ILE  96  -6.438  -5.593  -0.024
  774   HG21  ILE  96          2HG2      ILE  96 -10.450  -4.219   0.320
  775   HG22  ILE  96          1HG2      ILE  96  -9.849  -4.782  -1.239
  776   HG23  ILE  96          3HG2      ILE  96  -9.275  -3.254  -0.571
  777   HD11  ILE  96          3HD1      ILE  96  -8.361  -5.576  -2.332
  778   HD12  ILE  96          2HD1      ILE  96  -7.811  -7.000  -1.450
  779   HD13  ILE  96          1HD1      ILE  96  -6.663  -6.053  -2.399
  780    H    ASN  97           H        ASN  97  -9.595  -5.730   2.970
  781    HA   ASN  97           HA       ASN  97 -11.844  -4.068   3.189
  782    HB2  ASN  97           HB2      ASN  97 -10.942  -6.574   4.536
  783    HB3  ASN  97           HB3      ASN  97 -12.289  -5.684   5.240
  784   HD21  ASN  97          1HD2      ASN  97 -11.169  -7.480   2.467
  785   HD22  ASN  97          2HD2      ASN  97 -12.732  -7.739   1.770
  786    H    ALA  98           H        ALA  98  -9.052  -4.500   5.270
  787    HA   ALA  98           HA       ALA  98 -10.027  -3.041   7.482
  788    HB1  ALA  98           HB1      ALA  98  -7.158  -3.435   6.646
  789    HB2  ALA  98           HB2      ALA  98  -7.734  -2.980   8.250
  790    HB3  ALA  98           HB3      ALA  98  -8.106  -4.577   7.598
  791    H    ALA  99           H        ALA  99  -8.286  -2.095   4.574
  792    HA   ALA  99           HA       ALA  99  -7.688   0.556   5.303
  793    HB1  ALA  99           HB1      ALA  99  -8.199  -0.581   2.554
  794    HB2  ALA  99           HB2      ALA  99  -7.408   0.956   2.906
  795    HB3  ALA  99           HB3      ALA  99  -6.649  -0.559   3.395
  796    H    LEU 100           H        LEU 100 -10.477  -0.833   3.579
  797    HA   LEU 100           HA       LEU 100 -11.867   1.581   3.187
  798    HB2  LEU 100           HB2      LEU 100 -12.707  -1.289   3.311
  799    HB3  LEU 100           HB3      LEU 100 -13.913  -0.029   3.215
  800    HG   LEU 100           HG       LEU 100 -13.411  -1.016   1.024
  801   HD11  LEU 100          2HD1      LEU 100 -13.106   1.080  -0.189
  802   HD12  LEU 100          1HD1      LEU 100 -12.581   1.862   1.301
  803   HD13  LEU 100          3HD1      LEU 100 -14.234   1.264   1.155
  804   HD21  LEU 100          3HD2      LEU 100 -10.675   0.194   1.361
  805   HD22  LEU 100          2HD2      LEU 100 -11.304  -0.586  -0.091
  806   HD23  LEU 100          1HD2      LEU 100 -11.043  -1.531   1.376
  807    H    ALA 101           H        ALA 101 -11.608  -0.538   5.942
  808    HA   ALA 101           HA       ALA 101 -13.883   0.366   7.352
  809    HB1  ALA 101           HB1      ALA 101 -12.878  -0.688   9.298
  810    HB2  ALA 101           HB2      ALA 101 -12.728  -1.728   7.883
  811    HB3  ALA 101           HB3      ALA 101 -11.335  -0.811   8.454
  812    H    LEU 102           H        LEU 102 -10.871   1.856   6.727
  813    HA   LEU 102           HA       LEU 102 -10.768   3.451   9.100
  814    HB2  LEU 102           HB2      LEU 102  -9.396   3.808   6.438
  815    HB3  LEU 102           HB3      LEU 102  -9.030   4.721   7.889
  816    HG   LEU 102           HG       LEU 102  -8.666   1.743   7.553
  817   HD11  LEU 102          2HD1      LEU 102  -6.282   2.254   7.625
  818   HD12  LEU 102          1HD1      LEU 102  -6.648   3.978   7.700
  819   HD13  LEU 102          3HD1      LEU 102  -7.065   3.049   6.259
  820   HD21  LEU 102          3HD2      LEU 102  -9.240   2.374   9.848
  821   HD22  LEU 102          2HD2      LEU 102  -7.935   3.561   9.848
  822   HD23  LEU 102          1HD2      LEU 102  -7.562   1.840   9.723
  823    H    ILE 103           H        ILE 103 -12.387   3.734   6.039
  824    HA   ILE 103           HA       ILE 103 -13.215   6.453   6.791
  825    HB   ILE 103           HB       ILE 103 -13.320   6.998   4.327
  826   HG12  ILE 103          2HG1      ILE 103 -11.493   4.590   4.108
  827   HG13  ILE 103          3HG1      ILE 103 -13.148   4.654   3.514
  828   HG21  ILE 103          2HG2      ILE 103 -10.614   6.478   5.555
  829   HG22  ILE 103          1HG2      ILE 103 -11.615   7.910   5.795
  830   HG23  ILE 103          3HG2      ILE 103 -10.938   7.565   4.203
  831   HD11  ILE 103          3HD1      ILE 103 -11.534   4.968   1.722
  832   HD12  ILE 103          2HD1      ILE 103 -10.871   6.373   2.555
  833   HD13  ILE 103          1HD1      ILE 103 -12.526   6.407   1.946
  834    H    ASP 104           H        ASP 104 -14.073   3.620   4.802
  835    HA   ASP 104           HA       ASP 104 -16.780   4.683   4.506
  836    HB2  ASP 104           HB2      ASP 104 -15.342   2.409   3.139
  837    HB3  ASP 104           HB3      ASP 104 -17.046   2.769   2.885
  838    H    GLU 105           H        GLU 105 -15.263   1.562   5.309
  839    HA   GLU 105           HA       GLU 105 -17.742   0.397   6.079
  840    HB2  GLU 105           HB2      GLU 105 -14.900  -0.516   6.515
  841    HB3  GLU 105           HB3      GLU 105 -16.322  -1.486   6.880
  842    HG2  GLU 105           HG2      GLU 105 -15.571  -0.432   4.161
  843    HG3  GLU 105           HG3      GLU 105 -15.331  -2.083   4.730
  844    H    LYS 106           H        LYS 106 -15.195   2.042   7.773
  845    HA   LYS 106           HA       LYS 106 -15.075   2.941   9.855
  846    HB2  LYS 106           HB2      LYS 106 -17.333   3.791   9.204
  847    HB3  LYS 106           HB3      LYS 106 -18.045   2.386   9.982
  848    HG2  LYS 106           HG2      LYS 106 -17.109   3.110  12.129
  849    HG3  LYS 106           HG3      LYS 106 -16.426   4.533  11.336
  850    HD2  LYS 106           HD2      LYS 106 -18.711   5.201  10.662
  851    HD3  LYS 106           HD3      LYS 106 -19.351   3.829  11.566
  852    HE2  LYS 106           HE2      LYS 106 -19.534   5.842  12.891
  853    HE3  LYS 106           HE3      LYS 106 -18.358   4.752  13.622
  854    HZ1  LYS 106           HZ1      LYS 106 -16.578   6.060  12.770
  855    HZ2  LYS 106           HZ2      LYS 106 -17.656   7.115  13.547
  856    HZ3  LYS 106           HZ3      LYS 106 -17.636   7.020  11.852
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1 -13.547  -1.637  -4.117
    2    H2   MET   1           H2       MET   1 -14.961  -2.557  -4.193
    3    H3   MET   1           H3       MET   1 -15.049  -0.894  -3.884
    4    HA   MET   1           HA       MET   1 -14.151  -2.185  -6.389
    5    HB2  MET   1           HB2      MET   1 -16.597  -0.546  -5.695
    6    HB3  MET   1           HB3      MET   1 -16.126  -0.935  -7.344
    7    HG2  MET   1           HG2      MET   1 -16.259  -3.345  -6.738
    8    HG3  MET   1           HG3      MET   1 -16.929  -2.860  -5.181
    9    HE1  MET   1           HE1      MET   1 -19.071  -4.413  -5.633
   10    HE2  MET   1           HE2      MET   1 -20.026  -4.326  -7.113
   11    HE3  MET   1           HE3      MET   1 -18.355  -4.889  -7.172
   12    H    LYS   2           H        LYS   2 -14.904   0.162  -7.896
   13    HA   LYS   2           HA       LYS   2 -12.505   1.262  -8.369
   14    HB2  LYS   2           HB2      LYS   2 -15.185   2.616  -8.611
   15    HB3  LYS   2           HB3      LYS   2 -13.706   3.237  -9.326
   16    HG2  LYS   2           HG2      LYS   2 -14.964   0.574  -9.953
   17    HG3  LYS   2           HG3      LYS   2 -15.083   2.030 -10.943
   18    HD2  LYS   2           HD2      LYS   2 -12.596   2.021 -11.129
   19    HD3  LYS   2           HD3      LYS   2 -12.585   0.470 -10.288
   20    HE2  LYS   2           HE2      LYS   2 -12.454   0.052 -12.642
   21    HE3  LYS   2           HE3      LYS   2 -14.047  -0.446 -12.076
   22    HZ1  LYS   2           HZ1      LYS   2 -13.421   2.110 -13.460
   23    HZ2  LYS   2           HZ2      LYS   2 -14.959   1.634 -12.921
   24    HZ3  LYS   2           HZ3      LYS   2 -14.187   0.768 -14.159
   25    H    ARG   3           H        ARG   3 -11.250   1.800  -6.609
   26    HA   ARG   3           HA       ARG   3 -11.595   4.558  -5.824
   27    HB2  ARG   3           HB2      ARG   3 -12.723   3.087  -4.104
   28    HB3  ARG   3           HB3      ARG   3 -11.138   2.445  -3.719
   29    HG2  ARG   3           HG2      ARG   3 -11.862   4.207  -2.166
   30    HG3  ARG   3           HG3      ARG   3 -10.371   4.612  -3.019
   31    HD2  ARG   3           HD2      ARG   3 -11.776   6.556  -2.982
   32    HD3  ARG   3           HD3      ARG   3 -11.715   5.932  -4.627
   33    HE   ARG   3           HE       ARG   3 -13.942   4.920  -4.141
   34   HH11  ARG   3          2HH1      ARG   3 -12.822   7.682  -2.318
   35   HH12  ARG   3          1HH1      ARG   3 -14.413   8.298  -2.010
   36   HH21  ARG   3          2HH2      ARG   3 -16.048   5.745  -3.771
   37   HH22  ARG   3          1HH2      ARG   3 -16.243   7.209  -2.837
   38    H    LYS   4           H        LYS   4  -9.623   5.571  -5.454
   39    HA   LYS   4           HA       LYS   4  -7.266   4.132  -6.254
   40    HB2  LYS   4           HB2      LYS   4  -7.683   6.986  -5.371
   41    HB3  LYS   4           HB3      LYS   4  -6.114   6.331  -5.823
   42    HG2  LYS   4           HG2      LYS   4  -8.537   6.457  -7.606
   43    HG3  LYS   4           HG3      LYS   4  -7.163   7.566  -7.656
   44    HD2  LYS   4           HD2      LYS   4  -6.982   4.584  -8.095
   45    HD3  LYS   4           HD3      LYS   4  -7.075   5.779  -9.387
   46    HE2  LYS   4           HE2      LYS   4  -4.910   5.728  -7.288
   47    HE3  LYS   4           HE3      LYS   4  -4.766   4.963  -8.869
   48    HZ1  LYS   4           HZ1      LYS   4  -5.218   7.204  -9.843
   49    HZ2  LYS   4           HZ2      LYS   4  -3.748   7.079  -9.014
   50    HZ3  LYS   4           HZ3      LYS   4  -5.060   7.860  -8.289
   51    H    ILE   5           H        ILE   5  -6.023   3.017  -4.983
   52    HA   ILE   5           HA       ILE   5  -5.707   3.865  -2.179
   53    HB   ILE   5           HB       ILE   5  -5.757   1.016  -3.202
   54   HG12  ILE   5          2HG1      ILE   5  -7.709   2.476  -1.406
   55   HG13  ILE   5          3HG1      ILE   5  -7.997   2.056  -3.090
   56   HG21  ILE   5          2HG2      ILE   5  -4.164   1.329  -1.375
   57   HG22  ILE   5          1HG2      ILE   5  -5.546   0.363  -0.861
   58   HG23  ILE   5          3HG2      ILE   5  -5.432   2.057  -0.388
   59   HD11  ILE   5          3HD1      ILE   5  -7.578   0.113  -0.830
   60   HD12  ILE   5          2HD1      ILE   5  -7.855  -0.314  -2.518
   61   HD13  ILE   5          1HD1      ILE   5  -9.115   0.509  -1.600
   62    H    ILE   6           H        ILE   6  -3.628   4.099  -1.536
   63    HA   ILE   6           HA       ILE   6  -1.555   3.192  -3.414
   64    HB   ILE   6           HB       ILE   6  -0.073   4.928  -2.352
   65   HG12  ILE   6          2HG1      ILE   6  -1.645   5.269  -0.359
   66   HG13  ILE   6          3HG1      ILE   6  -0.939   6.709  -1.076
   67   HG21  ILE   6          2HG2      ILE   6  -2.478   5.874  -3.892
   68   HG22  ILE   6          1HG2      ILE   6  -0.985   5.217  -4.561
   69   HG23  ILE   6          3HG2      ILE   6  -0.965   6.763  -3.714
   70   HD11  ILE   6          3HD1      ILE   6  -3.257   7.082  -0.524
   71   HD12  ILE   6          2HD1      ILE   6  -3.745   5.696  -1.501
   72   HD13  ILE   6          1HD1      ILE   6  -3.043   7.119  -2.274
   73    H    ALA   7           H        ALA   7   0.029   1.886  -2.707
   74    HA   ALA   7           HA       ALA   7   0.154   1.308   0.171
   75    HB1  ALA   7           HB1      ALA   7  -0.088  -0.792  -1.979
   76    HB2  ALA   7           HB2      ALA   7   0.131  -1.088  -0.254
   77    HB3  ALA   7           HB3      ALA   7  -1.353  -0.336  -0.838
   78    H    VAL   8           H        VAL   8   2.177   1.167   0.902
   79    HA   VAL   8           HA       VAL   8   4.322   0.913  -1.097
   80    HB   VAL   8           HB       VAL   8   4.489   2.106   1.676
   81   HG11  VAL   8          2HG1      VAL   8   6.716   2.853   0.992
   82   HG12  VAL   8          1HG1      VAL   8   6.526   2.020  -0.552
   83   HG13  VAL   8          3HG1      VAL   8   6.593   1.096   0.949
   84   HG21  VAL   8          3HG2      VAL   8   3.166   3.481   0.137
   85   HG22  VAL   8          2HG2      VAL   8   4.502   3.468  -1.016
   86   HG23  VAL   8          1HG2      VAL   8   4.696   4.253   0.551
   87    H    THR   9           H        THR   9   5.612  -0.769  -1.041
   88    HA   THR   9           HA       THR   9   5.636  -2.494   1.346
   89    HB   THR   9           HB       THR   9   6.418  -4.290  -0.298
   90    HG1  THR   9           HG1      THR   9   5.614  -2.236  -2.085
   91   HG21  THR   9          3HG2      THR   9   4.123  -4.813  -1.038
   92   HG22  THR   9          1HG2      THR   9   3.619  -3.187  -0.572
   93   HG23  THR   9          2HG2      THR   9   4.182  -4.323   0.655
   94    H    ALA  10           H        ALA  10   7.496  -2.346   2.438
   95    HA   ALA  10           HA       ALA  10   9.982  -1.947   0.938
   96    HB1  ALA  10           HB1      ALA  10   9.221   0.287   1.589
   97    HB2  ALA  10           HB2      ALA  10   9.177  -0.220   3.277
   98    HB3  ALA  10           HB3      ALA  10  10.715  -0.157   2.416
   99    H    CYS  11           H        CYS  11  11.049  -3.740   1.456
  100    HA   CYS  11           HA       CYS  11  11.701  -4.175   4.249
  101    HB2  CYS  11           HB2      CYS  11   9.722  -5.595   3.899
  102    HB3  CYS  11           HB3      CYS  11  10.514  -6.364   2.528
  103    HG   CYS  11           HG       CYS  11  12.026  -6.475   5.561
  104    H    ALA  12           H        ALA  12  13.796  -4.564   4.426
  105    HA   ALA  12           HA       ALA  12  15.266  -5.356   1.996
  106    HB1  ALA  12           HB1      ALA  12  16.272  -3.848   4.407
  107    HB2  ALA  12           HB2      ALA  12  17.203  -4.235   2.960
  108    HB3  ALA  12           HB3      ALA  12  15.828  -3.133   2.859
  109    H    THR  13           H        THR  13  14.455  -6.287   5.194
  110    HA   THR  13           HA       THR  13  16.680  -8.054   5.592
  111    HB   THR  13           HB       THR  13  15.302  -8.946   7.485
  112    HG1  THR  13           HG1      THR  13  13.501  -6.819   7.127
  113   HG21  THR  13          3HG2      THR  13  15.394  -6.885   8.828
  114   HG22  THR  13          1HG2      THR  13  15.602  -5.942   7.354
  115   HG23  THR  13          2HG2      THR  13  16.845  -7.092   7.848
  116    H    GLY  14           H        GLY  14  13.318  -8.382   4.573
  117    HA2  GLY  14           HA1      GLY  14  13.994 -11.043   3.486
  118    HA3  GLY  14           HA2      GLY  14  12.440 -10.708   4.241
  119    H    VAL  15           H        VAL  15  14.515  -9.914   1.514
  120    HA   VAL  15           HA       VAL  15  12.824  -8.104   0.225
  121    HB   VAL  15           HB       VAL  15  14.153  -8.571  -1.798
  122   HG11  VAL  15          2HG1      VAL  15  16.313  -7.856  -0.886
  123   HG12  VAL  15          1HG1      VAL  15  15.758  -8.284   0.733
  124   HG13  VAL  15          3HG1      VAL  15  14.966  -6.982  -0.154
  125   HG21  VAL  15          3HG2      VAL  15  15.496 -10.678  -0.113
  126   HG22  VAL  15          2HG2      VAL  15  15.999 -10.161  -1.723
  127   HG23  VAL  15          1HG2      VAL  15  14.452 -10.982  -1.503
  128    H    ALA  16           H        ALA  16  12.807 -11.603   0.245
  129    HA   ALA  16           HA       ALA  16  11.221 -11.985  -2.073
  130    HB1  ALA  16           HB1      ALA  16  11.450 -13.745   0.363
  131    HB2  ALA  16           HB2      ALA  16  10.821 -14.225  -1.213
  132    HB3  ALA  16           HB3      ALA  16  12.521 -13.785  -1.037
  133    H    HIS  17           H        HIS  17  10.498 -11.075   1.185
  134    HA   HIS  17           HA       HIS  17   7.691 -11.695   1.090
  135    HB2  HIS  17           HB2      HIS  17   9.173  -9.805   2.942
  136    HB3  HIS  17           HB3      HIS  17   7.536 -10.400   3.177
  137    HD1  HIS  17           HD1      HIS  17   7.472 -12.136   4.935
  138    HD2  HIS  17           HD2      HIS  17  11.028 -12.264   2.778
  139    HE1  HIS  17           HE1      HIS  17   8.835 -13.968   5.980
  140    HE2  HIS  17           HE2      HIS  17  11.064 -13.869   4.809
  141    H    THR  18           H        THR  18   9.734  -8.907   0.548
  142    HA   THR  18           HA       THR  18   7.820  -6.893   0.356
  143    HB   THR  18           HB       THR  18  10.272  -6.902  -1.375
  144    HG1  THR  18           HG1      THR  18  11.442  -6.307   0.574
  145   HG21  THR  18          3HG2      THR  18  10.387  -4.561  -0.661
  146   HG22  THR  18          1HG2      THR  18   8.982  -4.805   0.378
  147   HG23  THR  18          2HG2      THR  18   8.815  -4.926  -1.373
  148    H    TYR  19           H        TYR  19   9.409  -8.683  -2.287
  149    HA   TYR  19           HA       TYR  19   7.876  -7.460  -4.322
  150    HB2  TYR  19           HB2      TYR  19   9.510 -10.001  -4.364
  151    HB3  TYR  19           HB3      TYR  19   8.840  -9.219  -5.793
  152    HD1  TYR  19           HD2      TYR  19   9.374  -6.499  -5.660
  153    HD2  TYR  19           HD1      TYR  19  11.786  -9.651  -4.131
  154    HE1  TYR  19           HE2      TYR  19  11.347  -5.050  -5.810
  155    HE2  TYR  19           HE1      TYR  19  13.773  -8.205  -4.274
  156    HH   TYR  19           HH       TYR  19  14.505  -6.202  -5.571
  157    H    MET  20           H        MET  20   7.358 -10.287  -2.363
  158    HA   MET  20           HA       MET  20   5.329 -11.457  -3.953
  159    HB2  MET  20           HB2      MET  20   6.433 -12.708  -2.159
  160    HB3  MET  20           HB3      MET  20   5.733 -11.620  -0.964
  161    HG2  MET  20           HG2      MET  20   4.424 -13.599  -0.983
  162    HG3  MET  20           HG3      MET  20   3.475 -12.321  -1.751
  163    HE1  MET  20           HE1      MET  20   6.496 -14.285  -3.326
  164    HE2  MET  20           HE2      MET  20   5.692 -15.526  -2.367
  165    HE3  MET  20           HE3      MET  20   5.670 -15.621  -4.127
  166    H    ALA  21           H        ALA  21   5.116  -9.477  -0.998
  167    HA   ALA  21           HA       ALA  21   2.331  -9.231  -0.982
  168    HB1  ALA  21           HB1      ALA  21   4.366  -7.310   0.143
  169    HB2  ALA  21           HB2      ALA  21   2.662  -7.400   0.588
  170    HB3  ALA  21           HB3      ALA  21   3.742  -8.744   0.956
  171    H    ALA  22           H        ALA  22   4.820  -7.228  -2.471
  172    HA   ALA  22           HA       ALA  22   3.317  -5.042  -3.260
  173    HB1  ALA  22           HB1      ALA  22   5.565  -6.347  -4.791
  174    HB2  ALA  22           HB2      ALA  22   4.988  -4.693  -4.998
  175    HB3  ALA  22           HB3      ALA  22   5.752  -5.179  -3.484
  176    H    GLN  23           H        GLN  23   3.998  -7.969  -5.198
  177    HA   GLN  23           HA       GLN  23   2.229  -7.153  -7.285
  178    HB2  GLN  23           HB2      GLN  23   3.499  -9.841  -6.737
  179    HB3  GLN  23           HB3      GLN  23   2.619  -9.424  -8.202
  180    HG2  GLN  23           HG2      GLN  23   4.262  -7.637  -8.639
  181    HG3  GLN  23           HG3      GLN  23   5.168  -8.166  -7.222
  182   HE21  GLN  23          1HE2      GLN  23   6.981  -8.695  -8.391
  183   HE22  GLN  23          2HE2      GLN  23   7.052 -10.074  -9.441
  184    H    ALA  24           H        ALA  24   1.926  -9.236  -4.462
  185    HA   ALA  24           HA       ALA  24  -0.494 -10.499  -5.109
  186    HB1  ALA  24           HB1      ALA  24  -0.745 -10.922  -2.736
  187    HB2  ALA  24           HB2      ALA  24   0.938 -11.151  -3.207
  188    HB3  ALA  24           HB3      ALA  24   0.453  -9.682  -2.361
  189    H    LEU  25           H        LEU  25   0.153  -7.448  -3.450
  190    HA   LEU  25           HA       LEU  25  -2.504  -6.643  -3.035
  191    HB2  LEU  25           HB2      LEU  25   0.006  -5.041  -3.495
  192    HB3  LEU  25           HB3      LEU  25  -1.530  -4.308  -3.079
  193    HG   LEU  25           HG       LEU  25  -0.046  -6.295  -1.361
  194   HD11  LEU  25          2HD1      LEU  25   1.122  -4.147  -1.530
  195   HD12  LEU  25          1HD1      LEU  25   0.441  -4.397   0.078
  196   HD13  LEU  25          3HD1      LEU  25  -0.357  -3.311  -1.059
  197   HD21  LEU  25          3HD2      LEU  25  -1.677  -5.701   0.342
  198   HD22  LEU  25          2HD2      LEU  25  -2.479  -6.360  -1.085
  199   HD23  LEU  25          1HD2      LEU  25  -2.488  -4.621  -0.793
  200    H    LYS  26           H        LYS  26  -0.343  -6.131  -5.792
  201    HA   LYS  26           HA       LYS  26  -2.065  -4.470  -7.275
  202    HB2  LYS  26           HB2      LYS  26   0.100  -6.338  -8.260
  203    HB3  LYS  26           HB3      LYS  26  -0.634  -5.050  -9.203
  204    HG2  LYS  26           HG2      LYS  26   0.212  -3.406  -7.590
  205    HG3  LYS  26           HG3      LYS  26   0.978  -4.713  -6.688
  206    HD2  LYS  26           HD2      LYS  26   2.653  -3.705  -8.051
  207    HD3  LYS  26           HD3      LYS  26   2.265  -5.273  -8.763
  208    HE2  LYS  26           HE2      LYS  26   0.854  -4.195 -10.418
  209    HE3  LYS  26           HE3      LYS  26   1.153  -2.621  -9.680
  210    HZ1  LYS  26           HZ1      LYS  26   2.534  -2.994 -11.642
  211    HZ2  LYS  26           HZ2      LYS  26   3.225  -4.361 -10.915
  212    HZ3  LYS  26           HZ3      LYS  26   3.483  -2.824 -10.246
  213    H    LYS  27           H        LYS  27  -1.732  -7.966  -7.108
  214    HA   LYS  27           HA       LYS  27  -3.545  -8.558  -9.221
  215    HB2  LYS  27           HB2      LYS  27  -2.707 -10.217  -6.847
  216    HB3  LYS  27           HB3      LYS  27  -3.572 -10.826  -8.244
  217    HG2  LYS  27           HG2      LYS  27  -1.692 -10.371  -9.673
  218    HG3  LYS  27           HG3      LYS  27  -0.837  -9.575  -8.348
  219    HD2  LYS  27           HD2      LYS  27  -0.986 -11.767  -7.104
  220    HD3  LYS  27           HD3      LYS  27  -1.535 -12.489  -8.616
  221    HE2  LYS  27           HE2      LYS  27   0.526 -11.825  -9.710
  222    HE3  LYS  27           HE3      LYS  27   1.066 -11.017  -8.238
  223    HZ1  LYS  27           HZ1      LYS  27   0.961 -13.200  -7.114
  224    HZ2  LYS  27           HZ2      LYS  27   2.104 -13.146  -8.363
  225    HZ3  LYS  27           HZ3      LYS  27   0.613 -13.927  -8.608
  226    H    GLY  28           H        GLY  28  -3.864  -8.620  -5.695
  227    HA2  GLY  28           HA1      GLY  28  -6.569  -9.295  -5.544
  228    HA3  GLY  28           HA2      GLY  28  -5.672  -8.437  -4.302
  229    H    ALA  29           H        ALA  29  -5.105  -6.291  -6.380
  230    HA   ALA  29           HA       ALA  29  -7.066  -4.449  -5.730
  231    HB1  ALA  29           HB1      ALA  29  -6.227  -3.116  -7.606
  232    HB2  ALA  29           HB2      ALA  29  -4.912  -3.809  -6.657
  233    HB3  ALA  29           HB3      ALA  29  -5.352  -4.523  -8.208
  234    H    LYS  30           H        LYS  30  -6.815  -6.458  -8.665
  235    HA   LYS  30           HA       LYS  30  -9.175  -5.390  -9.837
  236    HB2  LYS  30           HB2      LYS  30  -7.648  -7.929 -10.431
  237    HB3  LYS  30           HB3      LYS  30  -9.020  -7.373 -11.376
  238    HG2  LYS  30           HG2      LYS  30  -7.185  -6.659 -12.597
  239    HG3  LYS  30           HG3      LYS  30  -7.667  -5.218 -11.702
  240    HD2  LYS  30           HD2      LYS  30  -5.929  -5.624 -10.060
  241    HD3  LYS  30           HD3      LYS  30  -5.476  -7.120 -10.881
  242    HE2  LYS  30           HE2      LYS  30  -4.970  -5.760 -12.911
  243    HE3  LYS  30           HE3      LYS  30  -5.257  -4.312 -11.947
  244    HZ1  LYS  30           HZ1      LYS  30  -3.425  -4.816 -10.562
  245    HZ2  LYS  30           HZ2      LYS  30  -2.881  -5.013 -12.154
  246    HZ3  LYS  30           HZ3      LYS  30  -3.253  -6.371 -11.216
  247    H    LYS  31           H        LYS  31  -8.518  -7.943  -7.616
  248    HA   LYS  31           HA       LYS  31 -10.961  -9.371  -7.922
  249    HB2  LYS  31           HB2      LYS  31  -8.845 -10.284  -6.935
  250    HB3  LYS  31           HB3      LYS  31  -9.122  -9.276  -5.524
  251    HG2  LYS  31           HG2      LYS  31 -11.144 -10.483  -5.007
  252    HG3  LYS  31           HG3      LYS  31 -10.990 -11.429  -6.491
  253    HD2  LYS  31           HD2      LYS  31  -8.879 -12.357  -5.684
  254    HD3  LYS  31           HD3      LYS  31  -9.022 -11.408  -4.204
  255    HE2  LYS  31           HE2      LYS  31 -11.058 -12.604  -3.621
  256    HE3  LYS  31           HE3      LYS  31 -10.963 -13.525  -5.123
  257    HZ1  LYS  31           HZ1      LYS  31 -10.108 -14.766  -3.212
  258    HZ2  LYS  31           HZ2      LYS  31  -8.925 -13.573  -2.959
  259    HZ3  LYS  31           HZ3      LYS  31  -8.902 -14.503  -4.376
  260    H    MET  32           H        MET  32  -9.912  -6.633  -6.021
  261    HA   MET  32           HA       MET  32 -12.468  -6.495  -4.618
  262    HB2  MET  32           HB2      MET  32 -10.046  -4.688  -4.508
  263    HB3  MET  32           HB3      MET  32 -11.476  -4.516  -3.505
  264    HG2  MET  32           HG2      MET  32  -9.793  -7.004  -3.497
  265    HG3  MET  32           HG3      MET  32  -9.447  -5.623  -2.462
  266    HE1  MET  32           HE1      MET  32 -13.035  -8.496  -2.068
  267    HE2  MET  32           HE2      MET  32 -12.794  -7.556  -3.541
  268    HE3  MET  32           HE3      MET  32 -11.603  -8.767  -3.061
  269    H    GLY  33           H        GLY  33 -11.009  -5.377  -7.458
  270    HA2  GLY  33           HA1      GLY  33 -12.028  -4.294  -9.228
  271    HA3  GLY  33           HA2      GLY  33 -13.418  -3.979  -8.204
  272    H    ASN  34           H        ASN  34 -10.299  -3.070  -7.046
  273    HA   ASN  34           HA       ASN  34 -10.975  -0.257  -7.581
  274    HB2  ASN  34           HB2      ASN  34  -9.622   0.231  -5.497
  275    HB3  ASN  34           HB3      ASN  34 -11.153  -0.593  -5.245
  276   HD21  ASN  34          1HD2      ASN  34  -8.259  -2.171  -6.440
  277   HD22  ASN  34          2HD2      ASN  34  -8.013  -3.150  -5.044
  278    H    LEU  35           H        LEU  35  -8.900   1.164  -7.286
  279    HA   LEU  35           HA       LEU  35  -6.875  -0.030  -9.058
  280    HB2  LEU  35           HB2      LEU  35  -7.594   2.887  -8.758
  281    HB3  LEU  35           HB3      LEU  35  -6.482   2.203  -9.927
  282    HG   LEU  35           HG       LEU  35  -9.461   1.701  -9.857
  283   HD11  LEU  35          2HD1      LEU  35  -8.941   3.987 -10.506
  284   HD12  LEU  35          1HD1      LEU  35  -9.519   3.057 -11.889
  285   HD13  LEU  35          3HD1      LEU  35  -7.797   3.396 -11.712
  286   HD21  LEU  35          3HD2      LEU  35  -9.116   0.634 -12.023
  287   HD22  LEU  35          2HD2      LEU  35  -8.215  -0.197 -10.755
  288   HD23  LEU  35          1HD2      LEU  35  -7.375   0.876 -11.876
  289    H    ILE  36           H        ILE  36  -5.133  -0.563  -7.885
  290    HA   ILE  36           HA       ILE  36  -4.413   1.172  -5.633
  291    HB   ILE  36           HB       ILE  36  -4.927  -1.262  -5.162
  292   HG12  ILE  36          2HG1      ILE  36  -2.132  -0.339  -4.454
  293   HG13  ILE  36          3HG1      ILE  36  -3.601   0.186  -3.638
  294   HG21  ILE  36          2HG2      ILE  36  -2.298  -1.686  -6.577
  295   HG22  ILE  36          1HG2      ILE  36  -3.877  -2.260  -7.113
  296   HG23  ILE  36          3HG2      ILE  36  -3.162  -2.901  -5.634
  297   HD11  ILE  36          3HD1      ILE  36  -2.453  -1.533  -2.369
  298   HD12  ILE  36          2HD1      ILE  36  -2.548  -2.631  -3.745
  299   HD13  ILE  36          1HD1      ILE  36  -4.023  -2.112  -2.928
  300    H    LYS  37           H        LYS  37  -2.392   1.976  -5.432
  301    HA   LYS  37           HA       LYS  37  -0.508   1.477  -7.643
  302    HB2  LYS  37           HB2      LYS  37  -0.938   3.970  -5.984
  303    HB3  LYS  37           HB3      LYS  37   0.423   3.747  -7.073
  304    HG2  LYS  37           HG2      LYS  37  -2.470   3.703  -7.905
  305    HG3  LYS  37           HG3      LYS  37  -1.392   5.092  -8.053
  306    HD2  LYS  37           HD2      LYS  37  -0.975   2.405  -9.368
  307    HD3  LYS  37           HD3      LYS  37  -1.605   3.846 -10.169
  308    HE2  LYS  37           HE2      LYS  37   1.100   3.677  -8.844
  309    HE3  LYS  37           HE3      LYS  37   0.821   3.433 -10.566
  310    HZ1  LYS  37           HZ1      LYS  37  -0.033   5.921  -9.206
  311    HZ2  LYS  37           HZ2      LYS  37   0.229   5.653 -10.860
  312    HZ3  LYS  37           HZ3      LYS  37   1.546   5.731  -9.793
  313    H    VAL  38           H        VAL  38   0.903   0.029  -6.888
  314    HA   VAL  38           HA       VAL  38   1.653   0.124  -4.065
  315    HB   VAL  38           HB       VAL  38   2.222  -2.022  -6.114
  316   HG11  VAL  38          2HG1      VAL  38   3.878  -1.984  -4.317
  317   HG12  VAL  38          1HG1      VAL  38   2.844  -3.408  -4.199
  318   HG13  VAL  38          3HG1      VAL  38   2.585  -2.038  -3.120
  319   HG21  VAL  38          3HG2      VAL  38   0.157  -1.909  -3.917
  320   HG22  VAL  38          2HG2      VAL  38   0.492  -3.309  -4.937
  321   HG23  VAL  38          1HG2      VAL  38  -0.160  -1.834  -5.650
  322    H    GLU  39           H        GLU  39   3.483   0.907  -3.412
  323    HA   GLU  39           HA       GLU  39   5.683   1.333  -5.315
  324    HB2  GLU  39           HB2      GLU  39   4.963   3.318  -4.099
  325    HB3  GLU  39           HB3      GLU  39   5.116   2.479  -2.566
  326    HG2  GLU  39           HG2      GLU  39   7.489   2.431  -2.738
  327    HG3  GLU  39           HG3      GLU  39   7.435   3.014  -4.401
  328    H    THR  40           H        THR  40   7.766   0.557  -4.795
  329    HA   THR  40           HA       THR  40   7.909  -1.327  -2.555
  330    HB   THR  40           HB       THR  40   8.878  -1.927  -5.358
  331    HG1  THR  40           HG1      THR  40   6.730  -2.998  -3.804
  332   HG21  THR  40          3HG2      THR  40   9.410  -4.155  -4.465
  333   HG22  THR  40          1HG2      THR  40   8.947  -3.614  -2.851
  334   HG23  THR  40          2HG2      THR  40  10.342  -2.894  -3.656
  335    H    GLN  41           H        GLN  41   9.543  -0.807  -1.285
  336    HA   GLN  41           HA       GLN  41  12.003   0.272  -2.509
  337    HB2  GLN  41           HB2      GLN  41  10.797   0.907   0.186
  338    HB3  GLN  41           HB3      GLN  41  12.432   1.345  -0.274
  339    HG2  GLN  41           HG2      GLN  41  11.305   2.578  -2.241
  340    HG3  GLN  41           HG3      GLN  41   9.835   2.434  -1.273
  341   HE21  GLN  41          1HE2      GLN  41  13.010   2.733   0.103
  342   HE22  GLN  41          2HE2      GLN  41  12.820   4.320   0.753
  343    H    GLY  42           H        GLY  42  13.936  -0.581  -1.807
  344    HA2  GLY  42           HA1      GLY  42  13.796  -2.906  -0.034
  345    HA3  GLY  42           HA2      GLY  42  15.197  -2.401  -0.979
  346    H    ALA  43           H        ALA  43  16.142  -0.286  -0.352
  347    HA   ALA  43           HA       ALA  43  15.642   0.540   2.409
  348    HB1  ALA  43           HB1      ALA  43  18.037   0.596   2.925
  349    HB2  ALA  43           HB2      ALA  43  17.499  -1.045   2.565
  350    HB3  ALA  43           HB3      ALA  43  18.393  -0.123   1.355
  351    H    THR  44           H        THR  44  17.570   1.119  -0.516
  352    HA   THR  44           HA       THR  44  16.986   4.000  -0.237
  353    HB   THR  44           HB       THR  44  19.302   2.859  -1.800
  354    HG1  THR  44           HG1      THR  44  19.047   3.284   0.961
  355   HG21  THR  44          3HG2      THR  44  20.221   5.110  -1.513
  356   HG22  THR  44          1HG2      THR  44  18.782   5.585  -0.611
  357   HG23  THR  44          2HG2      THR  44  18.651   5.159  -2.318
  358    H    GLY  45           H        GLY  45  16.947   1.170  -2.256
  359    HA2  GLY  45           HA1      GLY  45  16.425   2.660  -4.693
  360    HA3  GLY  45           HA2      GLY  45  16.579   0.917  -4.543
  361    H    ILE  46           H        ILE  46  14.533   3.107  -5.511
  362    HA   ILE  46           HA       ILE  46  12.151   1.791  -4.377
  363    HB   ILE  46           HB       ILE  46  12.271   4.404  -5.900
  364   HG12  ILE  46          2HG1      ILE  46  12.046   3.964  -2.913
  365   HG13  ILE  46          3HG1      ILE  46  13.481   4.549  -3.745
  366   HG21  ILE  46          2HG2      ILE  46  10.004   4.736  -5.047
  367   HG22  ILE  46          1HG2      ILE  46  10.071   3.165  -4.249
  368   HG23  ILE  46          3HG2      ILE  46  10.113   3.263  -6.009
  369   HD11  ILE  46          3HD1      ILE  46  12.291   6.544  -4.441
  370   HD12  ILE  46          2HD1      ILE  46  12.230   6.358  -2.688
  371   HD13  ILE  46          1HD1      ILE  46  10.821   5.952  -3.669
  372    H    GLU  47           H        GLU  47  10.945   0.537  -5.701
  373    HA   GLU  47           HA       GLU  47  11.849   0.187  -8.437
  374    HB2  GLU  47           HB2      GLU  47  11.323  -1.741  -6.945
  375    HB3  GLU  47           HB3      GLU  47   9.633  -1.258  -6.973
  376    HG2  GLU  47           HG2      GLU  47   9.514  -1.654  -9.349
  377    HG3  GLU  47           HG3      GLU  47  11.239  -2.017  -9.404
  378    H    ASN  48           H        ASN  48   9.095   1.553  -6.753
  379    HA   ASN  48           HA       ASN  48   8.097   2.616  -9.270
  380    HB2  ASN  48           HB2      ASN  48   6.902   0.439  -8.909
  381    HB3  ASN  48           HB3      ASN  48   6.275   1.088  -7.403
  382   HD21  ASN  48          1HD2      ASN  48   4.699   2.671  -7.448
  383   HD22  ASN  48          2HD2      ASN  48   3.820   3.063  -8.886
  384    H    GLU  49           H        GLU  49   8.559   4.672  -8.570
  385    HA   GLU  49           HA       GLU  49   7.972   5.611  -5.963
  386    HB2  GLU  49           HB2      GLU  49   8.553   7.817  -6.826
  387    HB3  GLU  49           HB3      GLU  49   9.722   6.607  -7.343
  388    HG2  GLU  49           HG2      GLU  49   8.497   6.458  -9.494
  389    HG3  GLU  49           HG3      GLU  49   7.514   7.819  -8.967
  390    H    LEU  50           H        LEU  50   6.123   6.283  -5.095
  391    HA   LEU  50           HA       LEU  50   3.803   6.699  -6.799
  392    HB2  LEU  50           HB2      LEU  50   4.104   6.843  -3.799
  393    HB3  LEU  50           HB3      LEU  50   2.587   7.005  -4.664
  394    HG   LEU  50           HG       LEU  50   4.324   4.541  -4.528
  395   HD11  LEU  50          2HD1      LEU  50   2.387   3.575  -3.378
  396   HD12  LEU  50          1HD1      LEU  50   1.579   5.143  -3.436
  397   HD13  LEU  50          3HD1      LEU  50   3.061   4.949  -2.500
  398   HD21  LEU  50          3HD2      LEU  50   3.321   4.737  -6.737
  399   HD22  LEU  50          2HD2      LEU  50   1.736   4.999  -6.008
  400   HD23  LEU  50          1HD2      LEU  50   2.549   3.446  -5.816
  401    H    THR  51           H        THR  51   2.839   8.624  -7.222
  402    HA   THR  51           HA       THR  51   4.418  11.002  -6.641
  403    HB   THR  51           HB       THR  51   2.982  12.123  -8.284
  404    HG1  THR  51           HG1      THR  51   1.699   9.606  -8.698
  405   HG21  THR  51          3HG2      THR  51   3.977   9.441  -9.258
  406   HG22  THR  51          1HG2      THR  51   4.950  10.902  -9.090
  407   HG23  THR  51          2HG2      THR  51   3.639  10.846 -10.267
  408    H    GLU  52           H        GLU  52   3.374  12.981  -5.922
  409    HA   GLU  52           HA       GLU  52   1.827  12.666  -3.608
  410    HB2  GLU  52           HB2      GLU  52   3.273  14.629  -4.111
  411    HB3  GLU  52           HB3      GLU  52   2.097  15.158  -5.304
  412    HG2  GLU  52           HG2      GLU  52   1.774  16.422  -3.314
  413    HG3  GLU  52           HG3      GLU  52   0.410  15.319  -3.496
  414    H    LYS  53           H        LYS  53   0.903  13.318  -6.949
  415    HA   LYS  53           HA       LYS  53  -1.821  13.886  -6.397
  416    HB2  LYS  53           HB2      LYS  53  -2.196  13.497  -8.806
  417    HB3  LYS  53           HB3      LYS  53  -0.846  14.580  -8.499
  418    HG2  LYS  53           HG2      LYS  53   0.698  12.678  -8.855
  419    HG3  LYS  53           HG3      LYS  53  -0.692  11.676  -9.273
  420    HD2  LYS  53           HD2      LYS  53   0.381  12.490 -11.286
  421    HD3  LYS  53           HD3      LYS  53  -1.218  13.218 -11.121
  422    HE2  LYS  53           HE2      LYS  53  -0.215  15.254 -10.242
  423    HE3  LYS  53           HE3      LYS  53   1.386  14.526 -10.346
  424    HZ1  LYS  53           HZ1      LYS  53   0.896  16.013 -12.213
  425    HZ2  LYS  53           HZ2      LYS  53  -0.403  15.020 -12.665
  426    HZ3  LYS  53           HZ3      LYS  53   1.184  14.422 -12.727
  427    H    ASP  54           H        ASP  54  -0.074  10.877  -7.045
  428    HA   ASP  54           HA       ASP  54  -2.337   9.178  -7.139
  429    HB2  ASP  54           HB2      ASP  54   0.556   8.748  -6.483
  430    HB3  ASP  54           HB3      ASP  54  -0.598   7.463  -6.156
  431    H    VAL  55           H        VAL  55  -0.333  10.352  -4.525
  432    HA   VAL  55           HA       VAL  55  -1.556   8.787  -2.491
  433    HB   VAL  55           HB       VAL  55   0.050  11.322  -2.143
  434   HG11  VAL  55          2HG1      VAL  55  -1.044  10.613  -0.120
  435   HG12  VAL  55          1HG1      VAL  55   0.686  10.273  -0.001
  436   HG13  VAL  55          3HG1      VAL  55  -0.450   8.968  -0.339
  437   HG21  VAL  55          3HG2      VAL  55   1.323   9.817  -3.546
  438   HG22  VAL  55          2HG2      VAL  55   1.009   8.475  -2.445
  439   HG23  VAL  55          1HG2      VAL  55   2.012   9.827  -1.924
  440    H    ASN  56           H        ASN  56  -2.158  11.957  -3.841
  441    HA   ASN  56           HA       ASN  56  -3.888  12.848  -1.749
  442    HB2  ASN  56           HB2      ASN  56  -2.983  13.871  -4.353
  443    HB3  ASN  56           HB3      ASN  56  -4.604  14.375  -3.886
  444   HD21  ASN  56          1HD2      ASN  56  -1.225  14.482  -3.079
  445   HD22  ASN  56          2HD2      ASN  56  -1.337  15.793  -1.953
  446    H    ILE  57           H        ILE  57  -4.460  11.571  -5.020
  447    HA   ILE  57           HA       ILE  57  -7.292  11.727  -4.797
  448    HB   ILE  57           HB       ILE  57  -5.635  10.051  -6.691
  449   HG12  ILE  57          2HG1      ILE  57  -5.114  12.426  -6.890
  450   HG13  ILE  57          3HG1      ILE  57  -6.030  11.887  -8.294
  451   HG21  ILE  57          2HG2      ILE  57  -7.960   9.277  -6.517
  452   HG22  ILE  57          1HG2      ILE  57  -7.622   9.982  -8.097
  453   HG23  ILE  57          3HG2      ILE  57  -8.523  10.906  -6.895
  454   HD11  ILE  57          3HD1      ILE  57  -7.109  13.435  -5.949
  455   HD12  ILE  57          2HD1      ILE  57  -8.059  12.859  -7.319
  456   HD13  ILE  57          1HD1      ILE  57  -6.791  14.059  -7.568
  457    H    GLY  58           H        GLY  58  -4.905   9.281  -4.033
  458    HA2  GLY  58           HA1      GLY  58  -6.669   7.155  -3.481
  459    HA3  GLY  58           HA2      GLY  58  -5.074   7.376  -2.772
  460    H    GLU  59           H        GLU  59  -7.786   6.572  -1.681
  461    HA   GLU  59           HA       GLU  59  -8.382   8.717   0.186
  462    HB2  GLU  59           HB2      GLU  59  -9.563   5.942  -0.027
  463    HB3  GLU  59           HB3      GLU  59 -10.173   7.243   0.985
  464    HG2  GLU  59           HG2      GLU  59 -10.085   7.222  -2.021
  465    HG3  GLU  59           HG3      GLU  59 -11.510   6.983  -1.013
  466    H    VAL  60           H        VAL  60  -7.157   5.404   0.256
  467    HA   VAL  60           HA       VAL  60  -6.175   5.897   2.981
  468    HB   VAL  60           HB       VAL  60  -6.508   3.433   3.409
  469   HG11  VAL  60          2HG1      VAL  60  -8.904   3.660   3.910
  470   HG12  VAL  60          1HG1      VAL  60  -8.958   5.117   2.918
  471   HG13  VAL  60          3HG1      VAL  60  -7.984   5.086   4.388
  472   HG21  VAL  60          3HG2      VAL  60  -8.207   3.647   0.927
  473   HG22  VAL  60          2HG2      VAL  60  -8.201   2.279   2.042
  474   HG23  VAL  60          1HG2      VAL  60  -6.750   2.672   1.119
  475    H    VAL  61           H        VAL  61  -4.232   4.964   3.538
  476    HA   VAL  61           HA       VAL  61  -2.598   4.029   1.272
  477    HB   VAL  61           HB       VAL  61  -1.656   5.291   3.850
  478   HG11  VAL  61          2HG1      VAL  61  -0.013   3.833   2.814
  479   HG12  VAL  61          1HG1      VAL  61   0.482   5.522   2.689
  480   HG13  VAL  61          3HG1      VAL  61  -0.192   4.694   1.285
  481   HG21  VAL  61          3HG2      VAL  61  -2.944   6.910   2.556
  482   HG22  VAL  61          2HG2      VAL  61  -1.963   6.570   1.133
  483   HG23  VAL  61          1HG2      VAL  61  -1.229   7.324   2.549
  484    H    ILE  62           H        ILE  62  -1.462   2.136   1.474
  485    HA   ILE  62           HA       ILE  62  -1.716   0.708   4.045
  486    HB   ILE  62           HB       ILE  62  -1.480  -0.363   1.226
  487   HG12  ILE  62          2HG1      ILE  62  -3.742   0.231   2.051
  488   HG13  ILE  62          3HG1      ILE  62  -3.569  -1.491   1.725
  489   HG21  ILE  62          2HG2      ILE  62  -1.184  -1.882   3.815
  490   HG22  ILE  62          1HG2      ILE  62   0.027  -1.688   2.547
  491   HG23  ILE  62          3HG2      ILE  62  -1.432  -2.631   2.238
  492   HD11  ILE  62          3HD1      ILE  62  -3.437  -0.196   4.440
  493   HD12  ILE  62          2HD1      ILE  62  -3.296  -1.922   4.105
  494   HD13  ILE  62          1HD1      ILE  62  -4.811  -1.081   3.777
  495    H    PHE  63           H        PHE  63   0.092   0.224   5.122
  496    HA   PHE  63           HA       PHE  63   2.639   0.476   3.674
  497    HB2  PHE  63           HB2      PHE  63   1.859   1.393   6.403
  498    HB3  PHE  63           HB3      PHE  63   3.520   0.888   6.119
  499    HD1  PHE  63           HD2      PHE  63   4.649   1.945   4.010
  500    HD2  PHE  63           HD1      PHE  63   1.294   3.594   6.046
  501    HE1  PHE  63           HE2      PHE  63   5.175   4.155   3.075
  502    HE2  PHE  63           HE1      PHE  63   1.816   5.809   5.111
  503    HZ   PHE  63           HZ       PHE  63   3.760   6.087   3.624
  504    H    ALA  64           H        ALA  64   3.152  -1.558   3.208
  505    HA   ALA  64           HA       ALA  64   3.303  -3.458   5.455
  506    HB1  ALA  64           HB1      ALA  64   2.039  -4.254   3.478
  507    HB2  ALA  64           HB2      ALA  64   3.481  -4.026   2.489
  508    HB3  ALA  64           HB3      ALA  64   3.481  -5.222   3.783
  509    H    VAL  65           H        VAL  65   5.209  -2.776   6.396
  510    HA   VAL  65           HA       VAL  65   7.582  -2.809   4.673
  511    HB   VAL  65           HB       VAL  65   8.443  -0.751   5.658
  512   HG11  VAL  65          2HG1      VAL  65   5.703  -0.410   4.451
  513   HG12  VAL  65          1HG1      VAL  65   7.223  -0.579   3.569
  514   HG13  VAL  65          3HG1      VAL  65   6.934   0.847   4.567
  515   HG21  VAL  65          3HG2      VAL  65   6.966   0.710   6.990
  516   HG22  VAL  65          2HG2      VAL  65   7.349  -0.804   7.810
  517   HG23  VAL  65          1HG2      VAL  65   5.772  -0.587   7.050
  518    H    ASP  66           H        ASP  66   9.538  -3.053   5.683
  519    HA   ASP  66           HA       ASP  66   9.561  -3.671   8.558
  520    HB2  ASP  66           HB2      ASP  66  10.190  -5.770   8.040
  521    HB3  ASP  66           HB3      ASP  66  10.317  -5.374   6.334
  522    H    THR  67           H        THR  67  10.976  -2.210   5.767
  523    HA   THR  67           HA       THR  67  13.060  -1.007   7.449
  524    HB   THR  67           HB       THR  67  14.169  -0.506   5.180
  525    HG1  THR  67           HG1      THR  67  13.499  -1.705   3.456
  526   HG21  THR  67          3HG2      THR  67  15.213  -2.732   5.114
  527   HG22  THR  67          1HG2      THR  67  13.937  -3.349   6.167
  528   HG23  THR  67          2HG2      THR  67  15.058  -2.124   6.763
  529    H    LYS  68           H        LYS  68  13.756   1.033   5.670
  530    HA   LYS  68           HA       LYS  68  11.701   2.908   6.459
  531    HB2  LYS  68           HB2      LYS  68  13.926   3.465   7.085
  532    HB3  LYS  68           HB3      LYS  68  14.525   3.195   5.458
  533    HG2  LYS  68           HG2      LYS  68  13.254   5.155   4.692
  534    HG3  LYS  68           HG3      LYS  68  12.733   5.440   6.356
  535    HD2  LYS  68           HD2      LYS  68  15.005   5.770   7.067
  536    HD3  LYS  68           HD3      LYS  68  15.612   5.298   5.481
  537    HE2  LYS  68           HE2      LYS  68  14.557   7.264   4.488
  538    HE3  LYS  68           HE3      LYS  68  13.929   7.731   6.071
  539    HZ1  LYS  68           HZ1      LYS  68  15.995   8.908   5.434
  540    HZ2  LYS  68           HZ2      LYS  68  16.815   7.423   5.442
  541    HZ3  LYS  68           HZ3      LYS  68  16.147   8.028   6.874
  542    H    VAL  69           H        VAL  69  10.429   4.028   5.156
  543    HA   VAL  69           HA       VAL  69  10.853   3.889   2.248
  544    HB   VAL  69           HB       VAL  69   8.806   2.809   2.529
  545   HG11  VAL  69          2HG1      VAL  69   8.099   4.833   4.647
  546   HG12  VAL  69          1HG1      VAL  69   8.540   3.145   4.909
  547   HG13  VAL  69          3HG1      VAL  69   7.039   3.546   4.074
  548   HG21  VAL  69          3HG2      VAL  69   8.012   5.706   2.263
  549   HG22  VAL  69          2HG2      VAL  69   7.066   4.311   1.749
  550   HG23  VAL  69          1HG2      VAL  69   8.595   4.682   0.949
  551    H    ARG  70           H        ARG  70  11.052   5.797   1.172
  552    HA   ARG  70           HA       ARG  70  11.551   8.073   2.901
  553    HB2  ARG  70           HB2      ARG  70  13.003   8.833   1.301
  554    HB3  ARG  70           HB3      ARG  70  13.010   7.125   0.896
  555    HG2  ARG  70           HG2      ARG  70  12.329   7.574  -1.155
  556    HG3  ARG  70           HG3      ARG  70  10.896   8.396  -0.530
  557    HD2  ARG  70           HD2      ARG  70  13.625   9.610  -0.956
  558    HD3  ARG  70           HD3      ARG  70  12.179   9.909  -1.921
  559    HE   ARG  70           HE       ARG  70  11.257  10.747   0.347
  560   HH11  ARG  70          2HH1      ARG  70  14.554  11.128  -0.786
  561   HH12  ARG  70          1HH1      ARG  70  14.835  12.572   0.150
  562   HH21  ARG  70          2HH2      ARG  70  11.623  12.660   1.557
  563   HH22  ARG  70          1HH2      ARG  70  13.170  13.458   1.438
  564    H    ASN  71           H        ASN  71   9.220   7.023   0.596
  565    HA   ASN  71           HA       ASN  71   8.196   9.672   0.122
  566    HB2  ASN  71           HB2      ASN  71   7.346   6.944  -0.801
  567    HB3  ASN  71           HB3      ASN  71   6.323   8.362  -1.068
  568   HD21  ASN  71          1HD2      ASN  71   7.810   6.625  -2.960
  569   HD22  ASN  71          2HD2      ASN  71   8.821   7.710  -3.860
  570    H    LYS  72           H        LYS  72   7.979   7.570   2.641
  571    HA   LYS  72           HA       LYS  72   5.351   7.458   3.428
  572    HB2  LYS  72           HB2      LYS  72   7.254   6.409   4.648
  573    HB3  LYS  72           HB3      LYS  72   7.682   7.995   5.277
  574    HG2  LYS  72           HG2      LYS  72   5.465   8.132   6.356
  575    HG3  LYS  72           HG3      LYS  72   5.115   6.505   5.775
  576    HD2  LYS  72           HD2      LYS  72   7.456   7.169   7.555
  577    HD3  LYS  72           HD3      LYS  72   5.885   6.650   8.164
  578    HE2  LYS  72           HE2      LYS  72   6.103   4.584   6.806
  579    HE3  LYS  72           HE3      LYS  72   7.728   5.098   6.354
  580    HZ1  LYS  72           HZ1      LYS  72   8.305   5.095   8.735
  581    HZ2  LYS  72           HZ2      LYS  72   7.854   3.562   8.171
  582    HZ3  LYS  72           HZ3      LYS  72   6.764   4.479   9.095
  583    H    GLU  73           H        GLU  73   7.496  10.209   3.438
  584    HA   GLU  73           HA       GLU  73   6.204  11.994   5.108
  585    HB2  GLU  73           HB2      GLU  73   7.400  12.668   2.420
  586    HB3  GLU  73           HB3      GLU  73   7.140  13.779   3.755
  587    HG2  GLU  73           HG2      GLU  73   8.777  12.593   5.091
  588    HG3  GLU  73           HG3      GLU  73   9.014  11.427   3.786
  589    H    ARG  74           H        ARG  74   5.347  11.086   1.808
  590    HA   ARG  74           HA       ARG  74   3.396  13.067   1.357
  591    HB2  ARG  74           HB2      ARG  74   4.105  10.456   0.143
  592    HB3  ARG  74           HB3      ARG  74   2.464  11.021  -0.135
  593    HG2  ARG  74           HG2      ARG  74   3.221  12.264  -1.789
  594    HG3  ARG  74           HG3      ARG  74   4.121  13.221  -0.616
  595    HD2  ARG  74           HD2      ARG  74   5.084  10.792  -2.118
  596    HD3  ARG  74           HD3      ARG  74   5.609  12.456  -2.352
  597    HE   ARG  74           HE       ARG  74   6.304  10.701  -0.113
  598   HH11  ARG  74          2HH1      ARG  74   6.630  13.804  -1.704
  599   HH12  ARG  74          1HH1      ARG  74   8.121  14.199  -0.896
  600   HH21  ARG  74          2HH2      ARG  74   8.290  11.222   0.927
  601   HH22  ARG  74          1HH2      ARG  74   9.053  12.743   0.595
  602    H    PHE  75           H        PHE  75   3.206   9.816   2.682
  603    HA   PHE  75           HA       PHE  75   0.340   9.939   2.932
  604    HB2  PHE  75           HB2      PHE  75   2.112   7.807   4.097
  605    HB3  PHE  75           HB3      PHE  75   0.462   7.667   3.500
  606    HD1  PHE  75           HD2      PHE  75   0.022   7.487   1.102
  607    HD2  PHE  75           HD1      PHE  75   3.985   7.738   2.597
  608    HE1  PHE  75           HE2      PHE  75   0.889   6.727  -1.068
  609    HE2  PHE  75           HE1      PHE  75   4.863   6.977   0.432
  610    HZ   PHE  75           HZ       PHE  75   3.311   6.469  -1.408
  611    H    ASP  76           H        ASP  76   2.769  11.255   4.656
  612    HA   ASP  76           HA       ASP  76   2.317  10.557   7.331
  613    HB2  ASP  76           HB2      ASP  76   4.310  11.769   6.629
  614    HB3  ASP  76           HB3      ASP  76   3.333  13.146   6.135
  615    H    GLY  77           H        GLY  77   0.992  13.222   5.390
  616    HA2  GLY  77           HA1      GLY  77  -0.832  13.954   7.533
  617    HA3  GLY  77           HA2      GLY  77  -0.662  14.764   5.984
  618    H    LYS  78           H        LYS  78  -0.907  11.492   5.439
  619    HA   LYS  78           HA       LYS  78  -3.775  11.772   4.864
  620    HB2  LYS  78           HB2      LYS  78  -1.545  10.437   3.442
  621    HB3  LYS  78           HB3      LYS  78  -3.081   9.581   3.440
  622    HG2  LYS  78           HG2      LYS  78  -3.004  10.898   1.473
  623    HG3  LYS  78           HG3      LYS  78  -4.151  11.664   2.569
  624    HD2  LYS  78           HD2      LYS  78  -3.026  13.552   2.120
  625    HD3  LYS  78           HD3      LYS  78  -1.802  12.913   3.223
  626    HE2  LYS  78           HE2      LYS  78  -0.580  11.952   1.384
  627    HE3  LYS  78           HE3      LYS  78  -1.843  12.418   0.248
  628    HZ1  LYS  78           HZ1      LYS  78  -0.069  14.253   1.768
  629    HZ2  LYS  78           HZ2      LYS  78  -1.372  14.759   0.814
  630    HZ3  LYS  78           HZ3      LYS  78  -0.049  13.976   0.091
  631    H    VAL  79           H        VAL  79  -4.648   9.279   4.609
  632    HA   VAL  79           HA       VAL  79  -4.455   8.285   7.367
  633    HB   VAL  79           HB       VAL  79  -6.571   7.672   5.288
  634   HG11  VAL  79          2HG1      VAL  79  -6.516   7.144   8.257
  635   HG12  VAL  79          1HG1      VAL  79  -6.331   5.933   6.990
  636   HG13  VAL  79          3HG1      VAL  79  -7.860   6.795   7.168
  637   HG21  VAL  79          3HG2      VAL  79  -8.017   9.190   6.560
  638   HG22  VAL  79          2HG2      VAL  79  -6.619  10.032   5.890
  639   HG23  VAL  79          1HG2      VAL  79  -6.656   9.608   7.601
  640    H    VAL  80           H        VAL  80  -3.295   6.471   7.710
  641    HA   VAL  80           HA       VAL  80  -2.950   4.653   5.423
  642    HB   VAL  80           HB       VAL  80  -0.676   4.385   5.783
  643   HG11  VAL  80          2HG1      VAL  80  -1.276   7.268   6.409
  644   HG12  VAL  80          1HG1      VAL  80  -1.054   6.546   4.814
  645   HG13  VAL  80          3HG1      VAL  80   0.305   6.655   5.932
  646   HG21  VAL  80          3HG2      VAL  80  -0.746   3.972   8.179
  647   HG22  VAL  80          2HG2      VAL  80  -0.955   5.698   8.483
  648   HG23  VAL  80          1HG2      VAL  80   0.546   5.102   7.771
  649    H    LEU  81           H        LEU  81  -2.715   2.478   5.849
  650    HA   LEU  81           HA       LEU  81  -3.158   1.606   8.628
  651    HB2  LEU  81           HB2      LEU  81  -5.017   1.195   6.889
  652    HB3  LEU  81           HB3      LEU  81  -3.923   0.038   6.163
  653    HG   LEU  81           HG       LEU  81  -5.696  -0.917   7.675
  654   HD11  LEU  81          2HD1      LEU  81  -3.752  -2.220   7.089
  655   HD12  LEU  81          1HD1      LEU  81  -4.188  -2.505   8.774
  656   HD13  LEU  81          3HD1      LEU  81  -2.822  -1.461   8.381
  657   HD21  LEU  81          3HD2      LEU  81  -5.299  -0.797  10.086
  658   HD22  LEU  81          2HD2      LEU  81  -5.655   0.789   9.402
  659   HD23  LEU  81          1HD2      LEU  81  -3.995   0.357   9.812
  660    H    GLU  82           H        GLU  82  -1.226   0.980   9.361
  661    HA   GLU  82           HA       GLU  82   0.734  -0.099   7.468
  662    HB2  GLU  82           HB2      GLU  82   1.310   1.883   8.878
  663    HB3  GLU  82           HB3      GLU  82   1.155   0.867  10.302
  664    HG2  GLU  82           HG2      GLU  82   3.009  -0.474   9.636
  665    HG3  GLU  82           HG3      GLU  82   3.088   0.326   8.066
  666    H    VAL  83           H        VAL  83   1.474  -2.119   7.557
  667    HA   VAL  83           HA       VAL  83   0.930  -3.805   9.887
  668    HB   VAL  83           HB       VAL  83   0.136  -5.655   8.376
  669   HG11  VAL  83          2HG1      VAL  83  -1.459  -4.478   9.744
  670   HG12  VAL  83          1HG1      VAL  83  -2.176  -4.805   8.165
  671   HG13  VAL  83          3HG1      VAL  83  -1.583  -3.189   8.548
  672   HG21  VAL  83          3HG2      VAL  83   0.961  -4.740   6.261
  673   HG22  VAL  83          2HG2      VAL  83  -0.208  -3.424   6.376
  674   HG23  VAL  83          1HG2      VAL  83  -0.767  -5.087   6.187
  675    HA   PRO  84           HA       PRO  84   4.842  -5.775   8.868
  676    HB2  PRO  84           HB2      PRO  84   3.439  -8.393   8.894
  677    HB3  PRO  84           HB3      PRO  84   4.845  -7.860   9.822
  678    HG2  PRO  84           HG2      PRO  84   2.471  -8.110  10.991
  679    HG3  PRO  84           HG3      PRO  84   3.551  -6.764  11.404
  680    HD2  PRO  84           HD2      PRO  84   1.126  -6.778   9.647
  681    HD3  PRO  84           HD3      PRO  84   1.655  -5.562  10.828
  682    H    VAL  85           H        VAL  85   5.920  -6.604   7.075
  683    HA   VAL  85           HA       VAL  85   4.667  -6.074   4.625
  684    HB   VAL  85           HB       VAL  85   7.074  -5.772   5.022
  685   HG11  VAL  85          2HG1      VAL  85   7.540  -7.776   6.304
  686   HG12  VAL  85          1HG1      VAL  85   8.602  -7.682   4.898
  687   HG13  VAL  85          3HG1      VAL  85   7.219  -8.777   4.888
  688   HG21  VAL  85          3HG2      VAL  85   6.296  -5.818   2.742
  689   HG22  VAL  85          2HG2      VAL  85   6.394  -7.579   2.709
  690   HG23  VAL  85          1HG2      VAL  85   7.865  -6.616   2.842
  691    H    SER  86           H        SER  86   5.143  -9.099   6.330
  692    HA   SER  86           HA       SER  86   4.606 -10.762   4.061
  693    HB2  SER  86           HB2      SER  86   4.468 -11.508   6.983
  694    HB3  SER  86           HB3      SER  86   4.684 -12.597   5.612
  695    HG   SER  86           HG       SER  86   6.500 -10.848   6.822
  696    H    ALA  87           H        ALA  87   2.602  -9.001   6.208
  697    HA   ALA  87           HA       ALA  87   0.426 -10.722   6.508
  698    HB1  ALA  87           HB1      ALA  87   0.726  -8.681   7.823
  699    HB2  ALA  87           HB2      ALA  87   0.348  -7.713   6.397
  700    HB3  ALA  87           HB3      ALA  87  -0.878  -8.770   7.095
  701    HA   PRO  88           HA       PRO  88  -1.708  -8.738   2.679
  702    HB2  PRO  88           HB2      PRO  88   0.387  -7.428   1.109
  703    HB3  PRO  88           HB3      PRO  88  -1.157  -6.787   1.674
  704    HG2  PRO  88           HG2      PRO  88   1.186  -5.957   2.698
  705    HG3  PRO  88           HG3      PRO  88  -0.284  -6.079   3.684
  706    HD2  PRO  88           HD2      PRO  88   2.028  -7.983   3.490
  707    HD3  PRO  88           HD3      PRO  88   1.166  -7.404   4.932
  708    H    ILE  89           H        ILE  89   0.980 -10.659   2.783
  709    HA   ILE  89           HA       ILE  89   1.279 -11.365   0.048
  710    HB   ILE  89           HB       ILE  89   2.006 -12.807   2.592
  711   HG12  ILE  89          2HG1      ILE  89   3.589 -11.393   0.438
  712   HG13  ILE  89          3HG1      ILE  89   3.345 -10.857   2.096
  713   HG21  ILE  89          2HG2      ILE  89   2.574 -13.715  -0.228
  714   HG22  ILE  89          1HG2      ILE  89   1.496 -14.509   0.919
  715   HG23  ILE  89          3HG2      ILE  89   3.230 -14.440   1.239
  716   HD11  ILE  89          3HD1      ILE  89   4.651 -12.756   2.897
  717   HD12  ILE  89          2HD1      ILE  89   5.570 -11.757   1.771
  718   HD13  ILE  89          1HD1      ILE  89   4.886 -13.290   1.232
  719    H    LYS  90           H        LYS  90  -0.518 -12.909   2.718
  720    HA   LYS  90           HA       LYS  90  -1.956 -14.539   0.759
  721    HB2  LYS  90           HB2      LYS  90  -2.019 -14.573   3.780
  722    HB3  LYS  90           HB3      LYS  90  -2.947 -15.649   2.749
  723    HG2  LYS  90           HG2      LYS  90  -0.850 -16.564   1.855
  724    HG3  LYS  90           HG3      LYS  90   0.052 -15.515   2.952
  725    HD2  LYS  90           HD2      LYS  90  -1.114 -16.570   4.860
  726    HD3  LYS  90           HD3      LYS  90  -1.910 -17.669   3.733
  727    HE2  LYS  90           HE2      LYS  90   0.263 -18.551   3.056
  728    HE3  LYS  90           HE3      LYS  90   1.066 -17.436   4.165
  729    HZ1  LYS  90           HZ1      LYS  90   0.855 -19.632   5.145
  730    HZ2  LYS  90           HZ2      LYS  90  -0.830 -19.593   4.938
  731    HZ3  LYS  90           HZ3      LYS  90  -0.083 -18.511   6.008
  732    H    ASP  91           H        ASP  91  -2.433 -11.931   3.040
  733    HA   ASP  91           HA       ASP  91  -5.334 -12.034   2.598
  734    HB2  ASP  91           HB2      ASP  91  -3.703 -10.807   4.823
  735    HB3  ASP  91           HB3      ASP  91  -5.447 -10.628   4.671
  736    H    ALA  92           H        ALA  92  -3.822 -10.893   0.559
  737    HA   ALA  92           HA       ALA  92  -3.444  -8.122   0.747
  738    HB1  ALA  92           HB1      ALA  92  -2.558  -9.517  -1.082
  739    HB2  ALA  92           HB2      ALA  92  -4.193  -9.702  -1.717
  740    HB3  ALA  92           HB3      ALA  92  -3.435  -8.110  -1.679
  741    H    GLU  93           H        GLU  93  -6.323  -9.958  -0.324
  742    HA   GLU  93           HA       GLU  93  -7.875  -7.639  -0.857
  743    HB2  GLU  93           HB2      GLU  93  -8.965 -10.330  -0.028
  744    HB3  GLU  93           HB3      GLU  93  -9.781  -9.087  -0.965
  745    HG2  GLU  93           HG2      GLU  93  -9.204 -10.471  -2.654
  746    HG3  GLU  93           HG3      GLU  93  -7.729  -9.507  -2.590
  747    H    LYS  94           H        LYS  94  -7.124  -9.407   2.016
  748    HA   LYS  94           HA       LYS  94  -9.295  -8.403   3.600
  749    HB2  LYS  94           HB2      LYS  94  -6.698  -9.703   4.443
  750    HB3  LYS  94           HB3      LYS  94  -8.068  -9.393   5.498
  751    HG2  LYS  94           HG2      LYS  94  -8.168 -11.169   3.071
  752    HG3  LYS  94           HG3      LYS  94  -7.890 -11.737   4.718
  753    HD2  LYS  94           HD2      LYS  94 -10.055 -10.852   5.403
  754    HD3  LYS  94           HD3      LYS  94 -10.335 -10.240   3.771
  755    HE2  LYS  94           HE2      LYS  94 -10.316 -12.497   2.891
  756    HE3  LYS  94           HE3      LYS  94  -9.926 -13.141   4.485
  757    HZ1  LYS  94           HZ1      LYS  94 -12.414 -11.648   3.843
  758    HZ2  LYS  94           HZ2      LYS  94 -12.044 -12.423   5.305
  759    HZ3  LYS  94           HZ3      LYS  94 -12.298 -13.338   3.901
  760    H    VAL  95           H        VAL  95  -5.897  -7.644   3.135
  761    HA   VAL  95           HA       VAL  95  -5.681  -5.646   5.115
  762    HB   VAL  95           HB       VAL  95  -3.854  -6.901   3.801
  763   HG11  VAL  95          2HG1      VAL  95  -4.493  -6.289   1.575
  764   HG12  VAL  95          1HG1      VAL  95  -2.861  -5.712   1.936
  765   HG13  VAL  95          3HG1      VAL  95  -4.216  -4.583   1.946
  766   HG21  VAL  95          3HG2      VAL  95  -3.541  -3.972   4.384
  767   HG22  VAL  95          2HG2      VAL  95  -2.223  -5.129   4.199
  768   HG23  VAL  95          1HG2      VAL  95  -3.360  -5.292   5.540
  769    H    ILE  96           H        ILE  96  -6.534  -5.574   1.714
  770    HA   ILE  96           HA       ILE  96  -6.831  -2.793   1.406
  771    HB   ILE  96           HB       ILE  96  -8.271  -5.061   0.016
  772   HG12  ILE  96          2HG1      ILE  96  -5.987  -3.278  -0.862
  773   HG13  ILE  96          3HG1      ILE  96  -5.826  -4.946  -0.325
  774   HG21  ILE  96          2HG2      ILE  96  -8.230  -2.136  -0.719
  775   HG22  ILE  96          1HG2      ILE  96  -9.621  -3.027  -0.101
  776   HG23  ILE  96          3HG2      ILE  96  -8.942  -3.434  -1.678
  777   HD11  ILE  96          3HD1      ILE  96  -5.733  -4.762  -2.750
  778   HD12  ILE  96          2HD1      ILE  96  -7.334  -4.024  -2.762
  779   HD13  ILE  96          1HD1      ILE  96  -7.138  -5.695  -2.232
  780    H    ASN  97           H        ASN  97  -9.183  -5.279   2.367
  781    HA   ASN  97           HA       ASN  97 -11.371  -3.569   2.765
  782    HB2  ASN  97           HB2      ASN  97 -10.641  -6.297   3.729
  783    HB3  ASN  97           HB3      ASN  97 -11.979  -5.466   4.516
  784   HD21  ASN  97          1HD2      ASN  97 -10.824  -6.885   1.553
  785   HD22  ASN  97          2HD2      ASN  97 -12.360  -6.944   0.756
  786    H    ALA  98           H        ALA  98  -8.746  -4.546   4.905
  787    HA   ALA  98           HA       ALA  98  -9.687  -3.359   7.265
  788    HB1  ALA  98           HB1      ALA  98  -7.811  -4.948   7.182
  789    HB2  ALA  98           HB2      ALA  98  -6.821  -3.716   6.398
  790    HB3  ALA  98           HB3      ALA  98  -7.393  -3.469   8.047
  791    H    ALA  99           H        ALA  99  -7.766  -2.059   4.592
  792    HA   ALA  99           HA       ALA  99  -7.364   0.516   5.710
  793    HB1  ALA  99           HB1      ALA  99  -6.006  -0.319   3.866
  794    HB2  ALA  99           HB2      ALA  99  -7.423  -0.328   2.816
  795    HB3  ALA  99           HB3      ALA  99  -6.790   1.198   3.428
  796    H    LEU 100           H        LEU 100  -9.775  -0.776   3.454
  797    HA   LEU 100           HA       LEU 100 -11.248   1.564   3.048
  798    HB2  LEU 100           HB2      LEU 100 -12.186  -1.305   3.074
  799    HB3  LEU 100           HB3      LEU 100 -13.123   0.043   2.459
  800    HG   LEU 100           HG       LEU 100 -10.477  -0.895   1.340
  801   HD11  LEU 100          2HD1      LEU 100 -11.804  -1.645  -0.570
  802   HD12  LEU 100          1HD1      LEU 100 -13.281  -1.176   0.271
  803   HD13  LEU 100          3HD1      LEU 100 -12.279  -2.479   0.911
  804   HD21  LEU 100          3HD2      LEU 100 -10.948   0.668  -0.485
  805   HD22  LEU 100          2HD2      LEU 100 -10.806   1.511   1.058
  806   HD23  LEU 100          1HD2      LEU 100 -12.398   1.217   0.358
  807    H    ALA 101           H        ALA 101 -11.163  -0.645   5.719
  808    HA   ALA 101           HA       ALA 101 -13.560   0.085   6.995
  809    HB1  ALA 101           HB1      ALA 101 -10.995  -0.902   8.234
  810    HB2  ALA 101           HB2      ALA 101 -12.585  -0.894   9.000
  811    HB3  ALA 101           HB3      ALA 101 -12.289  -1.912   7.589
  812    H    LEU 102           H        LEU 102 -10.557   1.767   6.677
  813    HA   LEU 102           HA       LEU 102 -10.909   3.437   8.992
  814    HB2  LEU 102           HB2      LEU 102  -8.994   3.361   6.711
  815    HB3  LEU 102           HB3      LEU 102  -9.140   4.849   7.621
  816    HG   LEU 102           HG       LEU 102  -7.275   3.527   8.436
  817   HD11  LEU 102          2HD1      LEU 102  -9.575   3.575  10.381
  818   HD12  LEU 102          1HD1      LEU 102  -8.466   4.903  10.040
  819   HD13  LEU 102          3HD1      LEU 102  -7.870   3.430  10.807
  820   HD21  LEU 102          3HD2      LEU 102  -7.622   1.361   9.516
  821   HD22  LEU 102          2HD2      LEU 102  -8.060   1.309   7.809
  822   HD23  LEU 102          1HD2      LEU 102  -9.319   1.395   9.040
  823    H    ILE 103           H        ILE 103 -12.189   3.443   5.819
  824    HA   ILE 103           HA       ILE 103 -12.952   6.271   6.138
  825    HB   ILE 103           HB       ILE 103 -13.326   6.282   3.651
  826   HG12  ILE 103          2HG1      ILE 103 -11.692   3.737   3.769
  827   HG13  ILE 103          3HG1      ILE 103 -13.401   3.820   3.358
  828   HG21  ILE 103          2HG2      ILE 103 -10.956   6.614   3.134
  829   HG22  ILE 103          1HG2      ILE 103 -10.520   5.811   4.642
  830   HG23  ILE 103          3HG2      ILE 103 -11.399   7.339   4.680
  831   HD11  ILE 103          3HD1      ILE 103 -12.040   3.604   1.370
  832   HD12  ILE 103          2HD1      ILE 103 -11.144   5.060   1.804
  833   HD13  ILE 103          1HD1      ILE 103 -12.855   5.167   1.394
  834    H    ASP 104           H        ASP 104 -14.148   3.039   5.482
  835    HA   ASP 104           HA       ASP 104 -16.872   4.107   5.730
  836    HB2  ASP 104           HB2      ASP 104 -16.350   3.745   3.317
  837    HB3  ASP 104           HB3      ASP 104 -16.091   2.039   3.669
  838    H    GLU 105           H        GLU 105 -14.780   1.279   5.794
  839    HA   GLU 105           HA       GLU 105 -14.804  -0.639   6.994
  840    HB2  GLU 105           HB2      GLU 105 -15.388   1.225   8.811
  841    HB3  GLU 105           HB3      GLU 105 -16.913   0.357   8.851
  842    HG2  GLU 105           HG2      GLU 105 -14.207  -0.877   9.313
  843    HG3  GLU 105           HG3      GLU 105 -15.327  -0.384  10.579
  844    H    LYS 106           H        LYS 106 -15.862  -1.359   4.982
  845    HA   LYS 106           HA       LYS 106 -17.981  -3.116   5.459
  846    HB2  LYS 106           HB2      LYS 106 -19.360  -1.071   5.501
  847    HB3  LYS 106           HB3      LYS 106 -18.749  -0.624   3.917
  848    HG2  LYS 106           HG2      LYS 106 -19.737  -2.891   3.161
  849    HG3  LYS 106           HG3      LYS 106 -20.665  -2.795   4.660
  850    HD2  LYS 106           HD2      LYS 106 -22.083  -1.784   3.132
  851    HD3  LYS 106           HD3      LYS 106 -21.255  -0.404   3.849
  852    HE2  LYS 106           HE2      LYS 106 -20.648  -1.712   1.198
  853    HE3  LYS 106           HE3      LYS 106 -21.366  -0.124   1.451
  854    HZ1  LYS 106           HZ1      LYS 106 -19.075   0.158   0.913
  855    HZ2  LYS 106           HZ2      LYS 106 -18.588  -0.960   2.093
  856    HZ3  LYS 106           HZ3      LYS 106 -19.251   0.531   2.562
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1 -16.218   3.578  -6.260
    2    H2   MET   1           H2       MET   1 -16.615   2.378  -5.132
    3    H3   MET   1           H3       MET   1 -17.820   3.040  -6.123
    4    HA   MET   1           HA       MET   1 -17.189   0.855  -6.891
    5    HB2  MET   1           HB2      MET   1 -17.858   2.638  -8.521
    6    HB3  MET   1           HB3      MET   1 -16.153   3.000  -8.753
    7    HG2  MET   1           HG2      MET   1 -15.843   0.621  -9.478
    8    HG3  MET   1           HG3      MET   1 -17.597   0.455  -9.445
    9    HE1  MET   1           HE1      MET   1 -16.154  -0.303 -12.066
   10    HE2  MET   1           HE2      MET   1 -17.908  -0.231 -11.887
   11    HE3  MET   1           HE3      MET   1 -17.127   0.556 -13.259
   12    H    LYS   2           H        LYS   2 -14.508   3.030  -7.730
   13    HA   LYS   2           HA       LYS   2 -12.657   0.818  -7.116
   14    HB2  LYS   2           HB2      LYS   2 -12.181   3.120  -9.015
   15    HB3  LYS   2           HB3      LYS   2 -11.119   1.749  -8.745
   16    HG2  LYS   2           HG2      LYS   2 -12.934   0.280  -9.649
   17    HG3  LYS   2           HG3      LYS   2 -13.807   1.751 -10.088
   18    HD2  LYS   2           HD2      LYS   2 -11.826   2.467 -11.406
   19    HD3  LYS   2           HD3      LYS   2 -11.075   0.911 -11.056
   20    HE2  LYS   2           HE2      LYS   2 -12.027   0.696 -13.196
   21    HE3  LYS   2           HE3      LYS   2 -13.114  -0.156 -12.102
   22    HZ1  LYS   2           HZ1      LYS   2 -14.316   1.215 -13.690
   23    HZ2  LYS   2           HZ2      LYS   2 -13.518   2.604 -13.132
   24    HZ3  LYS   2           HZ3      LYS   2 -14.575   1.764 -12.107
   25    H    ARG   3           H        ARG   3 -12.139   1.288  -5.031
   26    HA   ARG   3           HA       ARG   3 -11.716   3.874  -4.005
   27    HB2  ARG   3           HB2      ARG   3 -12.149   1.874  -2.606
   28    HB3  ARG   3           HB3      ARG   3 -10.551   1.264  -3.011
   29    HG2  ARG   3           HG2      ARG   3 -10.541   2.291  -0.822
   30    HG3  ARG   3           HG3      ARG   3  -9.540   3.222  -1.941
   31    HD2  ARG   3           HD2      ARG   3 -10.906   4.701  -0.578
   32    HD3  ARG   3           HD3      ARG   3 -11.375   4.795  -2.273
   33    HE   ARG   3           HE       ARG   3 -13.002   2.898  -1.021
   34   HH11  ARG   3          2HH1      ARG   3 -12.490   6.370  -1.119
   35   HH12  ARG   3          1HH1      ARG   3 -14.092   6.733  -0.528
   36   HH21  ARG   3          2HH2      ARG   3 -15.091   3.386  -0.264
   37   HH22  ARG   3          1HH2      ARG   3 -15.560   5.044  -0.054
   38    H    LYS   4           H        LYS   4  -9.991   5.176  -3.975
   39    HA   LYS   4           HA       LYS   4  -7.733   4.512  -5.644
   40    HB2  LYS   4           HB2      LYS   4  -8.022   6.977  -3.936
   41    HB3  LYS   4           HB3      LYS   4  -7.087   6.784  -5.409
   42    HG2  LYS   4           HG2      LYS   4 -10.090   6.803  -5.213
   43    HG3  LYS   4           HG3      LYS   4  -9.075   8.127  -5.785
   44    HD2  LYS   4           HD2      LYS   4  -8.323   6.775  -7.655
   45    HD3  LYS   4           HD3      LYS   4  -9.256   5.399  -7.062
   46    HE2  LYS   4           HE2      LYS   4 -10.380   8.053  -7.947
   47    HE3  LYS   4           HE3      LYS   4 -10.422   6.554  -8.874
   48    HZ1  LYS   4           HZ1      LYS   4 -11.737   7.007  -6.244
   49    HZ2  LYS   4           HZ2      LYS   4 -11.777   5.564  -7.130
   50    HZ3  LYS   4           HZ3      LYS   4 -12.520   6.957  -7.750
   51    H    ILE   5           H        ILE   5  -6.161   3.275  -4.826
   52    HA   ILE   5           HA       ILE   5  -5.477   3.618  -1.976
   53    HB   ILE   5           HB       ILE   5  -5.225   1.120  -3.660
   54   HG12  ILE   5          2HG1      ILE   5  -7.094   1.754  -1.366
   55   HG13  ILE   5          3HG1      ILE   5  -7.559   1.687  -3.062
   56   HG21  ILE   5          2HG2      ILE   5  -4.612   0.018  -1.560
   57   HG22  ILE   5          1HG2      ILE   5  -4.655   1.577  -0.737
   58   HG23  ILE   5          3HG2      ILE   5  -3.460   1.279  -2.000
   59   HD11  ILE   5          3HD1      ILE   5  -6.568  -0.600  -1.375
   60   HD12  ILE   5          2HD1      ILE   5  -6.922  -0.695  -3.101
   61   HD13  ILE   5          1HD1      ILE   5  -8.214  -0.341  -1.953
   62    H    ILE   6           H        ILE   6  -3.459   4.266  -1.537
   63    HA   ILE   6           HA       ILE   6  -1.372   3.614  -3.506
   64    HB   ILE   6           HB       ILE   6   0.019   5.428  -2.625
   65   HG12  ILE   6          2HG1      ILE   6  -1.166   5.488  -0.344
   66   HG13  ILE   6          3HG1      ILE   6  -0.665   7.027  -1.032
   67   HG21  ILE   6          2HG2      ILE   6  -1.348   5.834  -4.583
   68   HG22  ILE   6          1HG2      ILE   6  -1.201   7.304  -3.618
   69   HG23  ILE   6          3HG2      ILE   6  -2.689   6.357  -3.563
   70   HD11  ILE   6          3HD1      ILE   6  -2.881   7.135  -0.020
   71   HD12  ILE   6          2HD1      ILE   6  -3.450   5.892  -1.134
   72   HD13  ILE   6          1HD1      ILE   6  -2.937   7.461  -1.752
   73    H    ALA   7           H        ALA   7   0.161   2.250  -2.852
   74    HA   ALA   7           HA       ALA   7   0.315   1.654   0.024
   75    HB1  ALA   7           HB1      ALA   7   0.062  -0.407  -2.165
   76    HB2  ALA   7           HB2      ALA   7   0.298  -0.741  -0.449
   77    HB3  ALA   7           HB3      ALA   7  -1.190   0.026  -1.002
   78    H    VAL   8           H        VAL   8   2.317   1.162   0.773
   79    HA   VAL   8           HA       VAL   8   4.472   1.056  -1.235
   80    HB   VAL   8           HB       VAL   8   4.665   2.199   1.558
   81   HG11  VAL   8          2HG1      VAL   8   6.758   1.203   0.798
   82   HG12  VAL   8          1HG1      VAL   8   6.888   2.959   0.865
   83   HG13  VAL   8          3HG1      VAL   8   6.683   2.151  -0.689
   84   HG21  VAL   8          3HG2      VAL   8   4.923   4.375   0.441
   85   HG22  VAL   8          2HG2      VAL   8   3.346   3.650   0.127
   86   HG23  VAL   8          1HG2      VAL   8   4.600   3.604  -1.112
   87    H    THR   9           H        THR   9   5.586  -0.756  -1.254
   88    HA   THR   9           HA       THR   9   5.627  -2.415   1.171
   89    HB   THR   9           HB       THR   9   6.429  -4.250  -0.353
   90    HG1  THR   9           HG1      THR   9   6.035  -2.201  -2.250
   91   HG21  THR   9          3HG2      THR   9   4.230  -4.724  -1.311
   92   HG22  THR   9          1HG2      THR   9   3.747  -3.050  -1.039
   93   HG23  THR   9          2HG2      THR   9   4.088  -4.103   0.335
   94    H    ALA  10           H        ALA  10   7.535  -2.738   2.210
   95    HA   ALA  10           HA       ALA  10  10.022  -2.012   0.864
   96    HB1  ALA  10           HB1      ALA  10  10.718  -0.494   2.646
   97    HB2  ALA  10           HB2      ALA  10   9.259   0.090   1.845
   98    HB3  ALA  10           HB3      ALA  10   9.148  -0.683   3.427
   99    H    CYS  11           H        CYS  11  11.255  -3.728   1.164
  100    HA   CYS  11           HA       CYS  11  11.766  -4.644   3.861
  101    HB2  CYS  11           HB2      CYS  11   9.814  -6.006   3.048
  102    HB3  CYS  11           HB3      CYS  11  10.840  -6.613   1.754
  103    HG   CYS  11           HG       CYS  11  12.158  -7.010   4.801
  104    H    ALA  12           H        ALA  12  13.867  -5.027   4.073
  105    HA   ALA  12           HA       ALA  12  15.477  -5.217   1.622
  106    HB1  ALA  12           HB1      ALA  12  17.343  -4.435   2.974
  107    HB2  ALA  12           HB2      ALA  12  15.978  -3.329   3.106
  108    HB3  ALA  12           HB3      ALA  12  16.329  -4.455   4.416
  109    H    THR  13           H        THR  13  14.516  -6.919   4.446
  110    HA   THR  13           HA       THR  13  16.577  -8.959   4.111
  111    HB   THR  13           HB       THR  13  15.411 -10.019   6.089
  112    HG1  THR  13           HG1      THR  13  14.229  -7.503   6.576
  113   HG21  THR  13          3HG2      THR  13  16.511  -7.228   6.449
  114   HG22  THR  13          1HG2      THR  13  17.461  -8.708   6.329
  115   HG23  THR  13          2HG2      THR  13  16.390  -8.459   7.707
  116    H    GLY  14           H        GLY  14  16.210 -10.485   2.631
  117    HA2  GLY  14           HA1      GLY  14  15.075 -11.989   1.297
  118    HA3  GLY  14           HA2      GLY  14  13.714 -11.864   2.411
  119    H    VAL  15           H        VAL  15  15.407 -10.095  -0.111
  120    HA   VAL  15           HA       VAL  15  13.654  -8.018  -0.542
  121    HB   VAL  15           HB       VAL  15  15.918  -8.218  -1.529
  122   HG11  VAL  15          2HG1      VAL  15  15.819 -10.503  -2.325
  123   HG12  VAL  15          1HG1      VAL  15  16.213  -9.408  -3.651
  124   HG13  VAL  15          3HG1      VAL  15  14.580 -10.060  -3.502
  125   HG21  VAL  15          3HG2      VAL  15  15.405  -7.088  -3.638
  126   HG22  VAL  15          2HG2      VAL  15  14.395  -6.497  -2.318
  127   HG23  VAL  15          1HG2      VAL  15  13.727  -7.613  -3.508
  128    H    ALA  16           H        ALA  16  13.243 -11.342  -1.487
  129    HA   ALA  16           HA       ALA  16  11.367 -11.064  -3.553
  130    HB1  ALA  16           HB1      ALA  16  11.534 -13.232  -1.463
  131    HB2  ALA  16           HB2      ALA  16  10.657 -13.332  -2.991
  132    HB3  ALA  16           HB3      ALA  16  12.415 -13.195  -2.992
  133    H    HIS  17           H        HIS  17  11.077 -10.599  -0.128
  134    HA   HIS  17           HA       HIS  17   8.314 -10.898   0.237
  135    HB2  HIS  17           HB2      HIS  17  10.303  -9.072   1.594
  136    HB3  HIS  17           HB3      HIS  17   8.625  -9.211   2.106
  137    HD1  HIS  17           HD1      HIS  17  11.271 -10.058   3.740
  138    HD2  HIS  17           HD2      HIS  17   8.602 -12.571   1.783
  139    HE1  HIS  17           HE1      HIS  17  11.446 -12.272   4.915
  140    HE2  HIS  17           HE2      HIS  17   9.739 -13.749   3.795
  141    H    THR  18           H        THR  18  10.211  -8.037  -0.605
  142    HA   THR  18           HA       THR  18   8.092  -6.213  -0.655
  143    HB   THR  18           HB       THR  18  10.553  -5.984  -2.376
  144    HG1  THR  18           HG1      THR  18  11.735  -5.571  -0.580
  145   HG21  THR  18          3HG2      THR  18  10.381  -3.617  -1.765
  146   HG22  THR  18          1HG2      THR  18   8.966  -3.971  -0.773
  147   HG23  THR  18          2HG2      THR  18   8.891  -4.182  -2.522
  148    H    TYR  19           H        TYR  19   9.152  -8.569  -2.973
  149    HA   TYR  19           HA       TYR  19   7.681  -7.280  -5.134
  150    HB2  TYR  19           HB2      TYR  19   9.411  -9.754  -5.071
  151    HB3  TYR  19           HB3      TYR  19   8.540  -9.210  -6.504
  152    HD1  TYR  19           HD1      TYR  19   8.921  -6.539  -6.923
  153    HD2  TYR  19           HD2      TYR  19  11.651  -9.191  -5.021
  154    HE1  TYR  19           HE1      TYR  19  10.773  -5.036  -7.503
  155    HE2  TYR  19           HE2      TYR  19  13.514  -7.692  -5.600
  156    HH   TYR  19           HH       TYR  19  13.050  -4.515  -6.696
  157    H    MET  20           H        MET  20   7.602 -10.274  -3.247
  158    HA   MET  20           HA       MET  20   5.351 -11.394  -4.525
  159    HB2  MET  20           HB2      MET  20   6.909 -12.658  -3.059
  160    HB3  MET  20           HB3      MET  20   6.258 -11.799  -1.668
  161    HG2  MET  20           HG2      MET  20   5.257 -13.973  -1.807
  162    HG3  MET  20           HG3      MET  20   4.040 -12.745  -2.153
  163    HE1  MET  20           HE1      MET  20   3.632 -15.817  -2.800
  164    HE2  MET  20           HE2      MET  20   2.423 -14.596  -3.202
  165    HE3  MET  20           HE3      MET  20   2.948 -15.757  -4.425
  166    H    ALA  21           H        ALA  21   5.695  -9.281  -1.704
  167    HA   ALA  21           HA       ALA  21   2.972  -9.266  -0.974
  168    HB1  ALA  21           HB1      ALA  21   4.773  -8.505   0.511
  169    HB2  ALA  21           HB2      ALA  21   5.023  -7.102  -0.526
  170    HB3  ALA  21           HB3      ALA  21   3.498  -7.298   0.340
  171    H    ALA  22           H        ALA  22   4.860  -7.120  -3.081
  172    HA   ALA  22           HA       ALA  22   2.829  -5.244  -3.592
  173    HB1  ALA  22           HB1      ALA  22   5.165  -4.800  -4.098
  174    HB2  ALA  22           HB2      ALA  22   5.158  -6.057  -5.334
  175    HB3  ALA  22           HB3      ALA  22   4.176  -4.607  -5.545
  176    H    GLN  23           H        GLN  23   3.716  -8.244  -5.314
  177    HA   GLN  23           HA       GLN  23   1.762  -7.767  -7.358
  178    HB2  GLN  23           HB2      GLN  23   2.331  -9.979  -8.210
  179    HB3  GLN  23           HB3      GLN  23   3.773  -9.029  -7.895
  180    HG2  GLN  23           HG2      GLN  23   4.228 -10.266  -5.900
  181    HG3  GLN  23           HG3      GLN  23   2.687 -11.115  -6.023
  182   HE21  GLN  23          1HE2      GLN  23   2.902 -11.422  -8.909
  183   HE22  GLN  23          2HE2      GLN  23   4.070 -12.671  -9.172
  184    H    ALA  24           H        ALA  24   1.879  -9.716  -4.408
  185    HA   ALA  24           HA       ALA  24  -0.592 -11.046  -4.865
  186    HB1  ALA  24           HB1      ALA  24  -0.509 -11.623  -2.502
  187    HB2  ALA  24           HB2      ALA  24   1.068 -11.861  -3.253
  188    HB3  ALA  24           HB3      ALA  24   0.776 -10.444  -2.244
  189    H    LEU  25           H        LEU  25   0.331  -8.098  -3.169
  190    HA   LEU  25           HA       LEU  25  -2.218  -7.335  -2.264
  191    HB2  LEU  25           HB2      LEU  25  -0.117  -6.340  -1.483
  192    HB3  LEU  25           HB3      LEU  25   0.149  -5.638  -3.065
  193    HG   LEU  25           HG       LEU  25  -1.859  -4.227  -2.753
  194   HD11  LEU  25          2HD1      LEU  25  -3.096  -5.656  -1.216
  195   HD12  LEU  25          1HD1      LEU  25  -2.852  -4.055  -0.519
  196   HD13  LEU  25          3HD1      LEU  25  -1.866  -5.413   0.023
  197   HD21  LEU  25          3HD2      LEU  25   0.160  -4.007  -0.523
  198   HD22  LEU  25          2HD2      LEU  25  -0.833  -2.706  -1.177
  199   HD23  LEU  25          1HD2      LEU  25   0.414  -3.453  -2.179
  200    H    LYS  26           H        LYS  26  -0.506  -6.742  -5.294
  201    HA   LYS  26           HA       LYS  26  -2.398  -5.062  -6.511
  202    HB2  LYS  26           HB2      LYS  26  -0.054  -5.535  -7.307
  203    HB3  LYS  26           HB3      LYS  26  -0.630  -7.090  -7.888
  204    HG2  LYS  26           HG2      LYS  26  -2.197  -5.932  -9.385
  205    HG3  LYS  26           HG3      LYS  26  -1.558  -4.385  -8.821
  206    HD2  LYS  26           HD2      LYS  26  -0.003  -6.551 -10.235
  207    HD3  LYS  26           HD3      LYS  26  -0.530  -5.018 -10.935
  208    HE2  LYS  26           HE2      LYS  26   0.900  -3.781  -9.448
  209    HE3  LYS  26           HE3      LYS  26   1.312  -5.247  -8.558
  210    HZ1  LYS  26           HZ1      LYS  26   3.091  -4.691 -10.044
  211    HZ2  LYS  26           HZ2      LYS  26   2.040  -4.626 -11.371
  212    HZ3  LYS  26           HZ3      LYS  26   2.344  -6.108 -10.603
  213    H    LYS  27           H        LYS  27  -2.079  -8.588  -6.431
  214    HA   LYS  27           HA       LYS  27  -4.286  -9.220  -8.055
  215    HB2  LYS  27           HB2      LYS  27  -3.029 -10.721  -5.773
  216    HB3  LYS  27           HB3      LYS  27  -4.298 -11.388  -6.781
  217    HG2  LYS  27           HG2      LYS  27  -1.574 -10.507  -7.710
  218    HG3  LYS  27           HG3      LYS  27  -2.106 -12.174  -7.474
  219    HD2  LYS  27           HD2      LYS  27  -3.865 -11.789  -9.189
  220    HD3  LYS  27           HD3      LYS  27  -3.173 -10.192  -9.483
  221    HE2  LYS  27           HE2      LYS  27  -2.349 -11.755 -11.133
  222    HE3  LYS  27           HE3      LYS  27  -1.030 -11.260 -10.072
  223    HZ1  LYS  27           HZ1      LYS  27  -1.317 -13.333  -8.837
  224    HZ2  LYS  27           HZ2      LYS  27  -0.973 -13.634 -10.464
  225    HZ3  LYS  27           HZ3      LYS  27  -2.560 -13.804  -9.889
  226    H    GLY  28           H        GLY  28  -4.007  -8.897  -4.538
  227    HA2  GLY  28           HA1      GLY  28  -6.681  -9.383  -3.875
  228    HA3  GLY  28           HA2      GLY  28  -5.567  -8.415  -2.921
  229    H    ALA  29           H        ALA  29  -5.094  -6.391  -4.874
  230    HA   ALA  29           HA       ALA  29  -7.277  -4.671  -4.369
  231    HB1  ALA  29           HB1      ALA  29  -6.128  -3.076  -5.796
  232    HB2  ALA  29           HB2      ALA  29  -4.980  -3.871  -4.722
  233    HB3  ALA  29           HB3      ALA  29  -5.082  -4.352  -6.414
  234    H    LYS  30           H        LYS  30  -6.238  -6.378  -7.309
  235    HA   LYS  30           HA       LYS  30  -8.415  -5.471  -8.900
  236    HB2  LYS  30           HB2      LYS  30  -6.156  -6.491  -9.647
  237    HB3  LYS  30           HB3      LYS  30  -6.951  -8.043  -9.403
  238    HG2  LYS  30           HG2      LYS  30  -8.709  -7.374 -10.980
  239    HG3  LYS  30           HG3      LYS  30  -7.864  -5.847 -11.247
  240    HD2  LYS  30           HD2      LYS  30  -5.863  -7.244 -11.935
  241    HD3  LYS  30           HD3      LYS  30  -6.967  -8.624 -11.965
  242    HE2  LYS  30           HE2      LYS  30  -7.193  -6.088 -13.572
  243    HE3  LYS  30           HE3      LYS  30  -6.765  -7.684 -14.186
  244    HZ1  LYS  30           HZ1      LYS  30  -9.384  -6.861 -13.042
  245    HZ2  LYS  30           HZ2      LYS  30  -8.997  -8.448 -13.498
  246    HZ3  LYS  30           HZ3      LYS  30  -9.058  -7.220 -14.666
  247    H    LYS  31           H        LYS  31  -7.961  -8.069  -6.657
  248    HA   LYS  31           HA       LYS  31 -10.099  -9.750  -7.345
  249    HB2  LYS  31           HB2      LYS  31  -8.370 -10.440  -5.787
  250    HB3  LYS  31           HB3      LYS  31  -8.801  -9.152  -4.676
  251    HG2  LYS  31           HG2      LYS  31  -9.680 -11.116  -3.749
  252    HG3  LYS  31           HG3      LYS  31 -11.056 -10.271  -4.456
  253    HD2  LYS  31           HD2      LYS  31 -11.001 -11.725  -6.390
  254    HD3  LYS  31           HD3      LYS  31  -9.546 -12.520  -5.786
  255    HE2  LYS  31           HE2      LYS  31 -12.228 -12.503  -4.407
  256    HE3  LYS  31           HE3      LYS  31 -11.586 -13.836  -5.362
  257    HZ1  LYS  31           HZ1      LYS  31 -11.269 -14.142  -2.958
  258    HZ2  LYS  31           HZ2      LYS  31 -10.305 -12.750  -2.900
  259    HZ3  LYS  31           HZ3      LYS  31  -9.795 -14.099  -3.791
  260    H    MET  32           H        MET  32  -9.892  -6.891  -5.311
  261    HA   MET  32           HA       MET  32 -12.733  -7.052  -4.674
  262    HB2  MET  32           HB2      MET  32 -10.584  -5.154  -3.723
  263    HB3  MET  32           HB3      MET  32 -12.251  -5.147  -3.164
  264    HG2  MET  32           HG2      MET  32 -10.299  -7.414  -2.850
  265    HG3  MET  32           HG3      MET  32 -10.763  -6.272  -1.595
  266    HE1  MET  32           HE1      MET  32 -13.274  -6.099  -0.630
  267    HE2  MET  32           HE2      MET  32 -13.905  -5.957  -2.272
  268    HE3  MET  32           HE3      MET  32 -14.589  -7.147  -1.164
  269    H    GLY  33           H        GLY  33 -10.766  -5.655  -7.005
  270    HA2  GLY  33           HA1      GLY  33 -11.399  -4.387  -8.831
  271    HA3  GLY  33           HA2      GLY  33 -12.998  -4.236  -8.123
  272    H    ASN  34           H        ASN  34  -9.695  -3.180  -7.275
  273    HA   ASN  34           HA       ASN  34 -10.776  -0.454  -6.943
  274    HB2  ASN  34           HB2      ASN  34  -8.566  -1.718  -5.302
  275    HB3  ASN  34           HB3      ASN  34  -9.187  -0.082  -5.115
  276   HD21  ASN  34          1HD2      ASN  34  -9.678  -3.418  -4.468
  277   HD22  ASN  34          2HD2      ASN  34 -11.051  -3.235  -3.434
  278    H    LEU  35           H        LEU  35  -8.794   1.135  -6.821
  279    HA   LEU  35           HA       LEU  35  -6.921   0.451  -8.996
  280    HB2  LEU  35           HB2      LEU  35  -7.989   3.149  -8.151
  281    HB3  LEU  35           HB3      LEU  35  -6.740   2.911  -9.357
  282    HG   LEU  35           HG       LEU  35  -9.591   1.942  -9.570
  283   HD11  LEU  35          2HD1      LEU  35  -9.790   3.631 -11.330
  284   HD12  LEU  35          1HD1      LEU  35  -8.155   4.190 -10.977
  285   HD13  LEU  35          3HD1      LEU  35  -9.426   4.359  -9.764
  286   HD21  LEU  35          3HD2      LEU  35  -7.320   1.825 -11.552
  287   HD22  LEU  35          2HD2      LEU  35  -8.993   1.372 -11.878
  288   HD23  LEU  35          1HD2      LEU  35  -8.041   0.453 -10.711
  289    H    ILE  36           H        ILE  36  -4.919   0.110  -8.261
  290    HA   ILE  36           HA       ILE  36  -4.196   1.372  -5.713
  291    HB   ILE  36           HB       ILE  36  -4.637  -1.051  -5.496
  292   HG12  ILE  36          2HG1      ILE  36  -1.733  -0.315  -5.081
  293   HG13  ILE  36          3HG1      ILE  36  -3.048   0.174  -4.022
  294   HG21  ILE  36          2HG2      ILE  36  -3.917  -1.775  -7.708
  295   HG22  ILE  36          1HG2      ILE  36  -3.063  -2.664  -6.447
  296   HG23  ILE  36          3HG2      ILE  36  -2.248  -1.361  -7.312
  297   HD11  ILE  36          3HD1      ILE  36  -3.512  -2.150  -3.502
  298   HD12  ILE  36          2HD1      ILE  36  -1.841  -1.730  -3.123
  299   HD13  ILE  36          1HD1      ILE  36  -2.208  -2.658  -4.576
  300    H    LYS  37           H        LYS  37  -2.283   2.261  -5.489
  301    HA   LYS  37           HA       LYS  37  -0.357   2.141  -7.719
  302    HB2  LYS  37           HB2      LYS  37  -1.309   4.368  -7.429
  303    HB3  LYS  37           HB3      LYS  37  -0.951   4.332  -5.711
  304    HG2  LYS  37           HG2      LYS  37   0.747   5.640  -6.448
  305    HG3  LYS  37           HG3      LYS  37   1.517   4.060  -6.564
  306    HD2  LYS  37           HD2      LYS  37   0.124   5.409  -8.866
  307    HD3  LYS  37           HD3      LYS  37   1.847   5.582  -8.536
  308    HE2  LYS  37           HE2      LYS  37   2.030   3.092  -8.689
  309    HE3  LYS  37           HE3      LYS  37   0.352   3.063  -9.232
  310    HZ1  LYS  37           HZ1      LYS  37   2.633   4.407 -10.574
  311    HZ2  LYS  37           HZ2      LYS  37   1.017   4.560 -11.061
  312    HZ3  LYS  37           HZ3      LYS  37   1.780   3.053 -11.131
  313    H    VAL  38           H        VAL  38   1.067   0.567  -7.064
  314    HA   VAL  38           HA       VAL  38   1.775   0.479  -4.214
  315    HB   VAL  38           HB       VAL  38   0.934  -1.623  -5.107
  316   HG11  VAL  38          2HG1      VAL  38   3.270  -1.535  -7.006
  317   HG12  VAL  38          1HG1      VAL  38   1.565  -1.402  -7.433
  318   HG13  VAL  38          3HG1      VAL  38   2.193  -2.910  -6.769
  319   HG21  VAL  38          3HG2      VAL  38   3.876  -1.717  -4.459
  320   HG22  VAL  38          2HG2      VAL  38   2.780  -3.099  -4.416
  321   HG23  VAL  38          1HG2      VAL  38   2.541  -1.749  -3.308
  322    H    GLU  39           H        GLU  39   3.690   0.996  -3.481
  323    HA   GLU  39           HA       GLU  39   5.849   1.625  -5.370
  324    HB2  GLU  39           HB2      GLU  39   4.866   3.074  -3.293
  325    HB3  GLU  39           HB3      GLU  39   6.156   2.201  -2.479
  326    HG2  GLU  39           HG2      GLU  39   6.504   3.895  -4.942
  327    HG3  GLU  39           HG3      GLU  39   6.834   4.424  -3.295
  328    H    THR  40           H        THR  40   7.989   0.852  -4.933
  329    HA   THR  40           HA       THR  40   8.071  -1.588  -3.288
  330    HB   THR  40           HB       THR  40   9.371  -1.304  -6.002
  331    HG1  THR  40           HG1      THR  40   6.815  -2.020  -5.281
  332   HG21  THR  40          3HG2      THR  40   9.684  -3.734  -5.810
  333   HG22  THR  40          1HG2      THR  40   8.975  -3.692  -4.194
  334   HG23  THR  40          2HG2      THR  40  10.503  -2.868  -4.511
  335    H    GLN  41           H        GLN  41   9.266  -0.669  -1.639
  336    HA   GLN  41           HA       GLN  41  11.824   0.552  -2.349
  337    HB2  GLN  41           HB2      GLN  41  10.342   0.283   0.257
  338    HB3  GLN  41           HB3      GLN  41  12.026   0.776   0.199
  339    HG2  GLN  41           HG2      GLN  41  11.318   2.651  -1.315
  340    HG3  GLN  41           HG3      GLN  41   9.651   2.214  -0.948
  341   HE21  GLN  41          1HE2      GLN  41  12.210   1.906   1.383
  342   HE22  GLN  41          2HE2      GLN  41  11.692   3.181   2.425
  343    H    GLY  42           H        GLY  42  13.333  -0.875  -2.852
  344    HA2  GLY  42           HA1      GLY  42  13.460  -3.527  -1.760
  345    HA3  GLY  42           HA2      GLY  42  14.701  -2.746  -2.734
  346    H    ALA  43           H        ALA  43  14.310  -0.535  -0.598
  347    HA   ALA  43           HA       ALA  43  15.362  -1.510   1.840
  348    HB1  ALA  43           HB1      ALA  43  17.413  -1.791   0.551
  349    HB2  ALA  43           HB2      ALA  43  17.305  -0.128  -0.025
  350    HB3  ALA  43           HB3      ALA  43  17.597  -0.453   1.683
  351    H    THR  44           H        THR  44  16.946   1.273   1.662
  352    HA   THR  44           HA       THR  44  14.675   2.908   2.423
  353    HB   THR  44           HB       THR  44  17.455   3.992   2.065
  354    HG1  THR  44           HG1      THR  44  16.786   2.787   4.513
  355   HG21  THR  44          3HG2      THR  44  15.656   5.509   2.758
  356   HG22  THR  44          1HG2      THR  44  16.836   5.300   4.050
  357   HG23  THR  44          2HG2      THR  44  15.289   4.458   4.125
  358    H    GLY  45           H        GLY  45  16.055   1.959  -0.414
  359    HA2  GLY  45           HA1      GLY  45  15.770   4.486  -1.843
  360    HA3  GLY  45           HA2      GLY  45  16.381   2.976  -2.507
  361    H    ILE  46           H        ILE  46  14.577   4.447  -3.943
  362    HA   ILE  46           HA       ILE  46  11.991   3.093  -3.527
  363    HB   ILE  46           HB       ILE  46  12.549   5.863  -4.601
  364   HG12  ILE  46          2HG1      ILE  46  10.831   6.395  -2.722
  365   HG13  ILE  46          3HG1      ILE  46  11.264   4.809  -2.098
  366   HG21  ILE  46          2HG2      ILE  46  10.826   4.942  -5.952
  367   HG22  ILE  46          1HG2      ILE  46  10.072   6.051  -4.804
  368   HG23  ILE  46          3HG2      ILE  46   9.984   4.306  -4.541
  369   HD11  ILE  46          3HD1      ILE  46  13.150   7.109  -2.546
  370   HD12  ILE  46          2HD1      ILE  46  13.591   5.519  -1.923
  371   HD13  ILE  46          1HD1      ILE  46  12.515   6.562  -0.994
  372    H    GLU  47           H        GLU  47  11.000   2.126  -5.277
  373    HA   GLU  47           HA       GLU  47  12.610   2.018  -7.742
  374    HB2  GLU  47           HB2      GLU  47  10.651   0.095  -6.532
  375    HB3  GLU  47           HB3      GLU  47  11.074   0.008  -8.234
  376    HG2  GLU  47           HG2      GLU  47  13.463  -0.210  -7.544
  377    HG3  GLU  47           HG3      GLU  47  12.902  -0.332  -5.877
  378    H    ASN  48           H        ASN  48   9.165   1.913  -6.810
  379    HA   ASN  48           HA       ASN  48   8.380   2.505  -9.532
  380    HB2  ASN  48           HB2      ASN  48   7.089   0.898  -8.178
  381    HB3  ASN  48           HB3      ASN  48   6.706   2.174  -7.026
  382   HD21  ASN  48          1HD2      ASN  48   6.053   0.842 -10.152
  383   HD22  ASN  48          2HD2      ASN  48   4.663   1.814 -10.499
  384    H    GLU  49           H        GLU  49   8.260   4.045  -6.378
  385    HA   GLU  49           HA       GLU  49   8.117   6.204  -5.710
  386    HB2  GLU  49           HB2      GLU  49   9.733   6.686  -7.533
  387    HB3  GLU  49           HB3      GLU  49   8.383   6.942  -8.630
  388    HG2  GLU  49           HG2      GLU  49   7.606   8.754  -7.067
  389    HG3  GLU  49           HG3      GLU  49   9.151   8.581  -6.235
  390    H    LEU  50           H        LEU  50   6.148   6.467  -4.904
  391    HA   LEU  50           HA       LEU  50   3.826   6.656  -6.612
  392    HB2  LEU  50           HB2      LEU  50   3.998   7.266  -3.660
  393    HB3  LEU  50           HB3      LEU  50   2.552   6.928  -4.591
  394    HG   LEU  50           HG       LEU  50   4.701   5.005  -3.740
  395   HD11  LEU  50          2HD1      LEU  50   1.716   5.076  -3.341
  396   HD12  LEU  50          1HD1      LEU  50   2.944   5.439  -2.127
  397   HD13  LEU  50          3HD1      LEU  50   2.798   3.804  -2.774
  398   HD21  LEU  50          3HD2      LEU  50   4.210   4.566  -6.091
  399   HD22  LEU  50          2HD2      LEU  50   2.486   4.502  -5.721
  400   HD23  LEU  50          1HD2      LEU  50   3.576   3.287  -5.053
  401    H    THR  51           H        THR  51   3.693   8.438  -7.800
  402    HA   THR  51           HA       THR  51   5.015  10.840  -7.277
  403    HB   THR  51           HB       THR  51   3.737  11.805  -9.094
  404    HG1  THR  51           HG1      THR  51   2.160   9.504  -9.442
  405   HG21  THR  51          3HG2      THR  51   5.512  10.251  -9.707
  406   HG22  THR  51          1HG2      THR  51   4.177  10.145 -10.855
  407   HG23  THR  51          2HG2      THR  51   4.381   8.900  -9.623
  408    H    GLU  52           H        GLU  52   4.226  12.892  -6.687
  409    HA   GLU  52           HA       GLU  52   2.699  12.954  -4.364
  410    HB2  GLU  52           HB2      GLU  52   4.345  14.679  -5.167
  411    HB3  GLU  52           HB3      GLU  52   3.116  15.251  -6.284
  412    HG2  GLU  52           HG2      GLU  52   3.164  16.673  -4.361
  413    HG3  GLU  52           HG3      GLU  52   1.656  15.764  -4.372
  414    H    LYS  53           H        LYS  53   1.751  13.447  -7.725
  415    HA   LYS  53           HA       LYS  53  -0.877  14.363  -7.162
  416    HB2  LYS  53           HB2      LYS  53   0.256  13.119  -9.673
  417    HB3  LYS  53           HB3      LYS  53  -1.309  13.918  -9.560
  418    HG2  LYS  53           HG2      LYS  53  -0.175  16.000  -8.909
  419    HG3  LYS  53           HG3      LYS  53   1.380  15.190  -9.099
  420    HD2  LYS  53           HD2      LYS  53   0.824  14.765 -11.471
  421    HD3  LYS  53           HD3      LYS  53  -0.671  15.679 -11.257
  422    HE2  LYS  53           HE2      LYS  53   2.139  16.723 -10.922
  423    HE3  LYS  53           HE3      LYS  53   1.039  17.088 -12.252
  424    HZ1  LYS  53           HZ1      LYS  53   0.648  17.824  -9.398
  425    HZ2  LYS  53           HZ2      LYS  53  -0.467  18.123 -10.642
  426    HZ3  LYS  53           HZ3      LYS  53   1.048  18.883 -10.660
  427    H    ASP  54           H        ASP  54   0.427  11.135  -7.963
  428    HA   ASP  54           HA       ASP  54  -2.083   9.824  -7.943
  429    HB2  ASP  54           HB2      ASP  54   0.743   8.869  -7.665
  430    HB3  ASP  54           HB3      ASP  54  -0.584   7.762  -7.337
  431    H    VAL  55           H        VAL  55   0.165  10.690  -5.445
  432    HA   VAL  55           HA       VAL  55  -1.002   9.103  -3.393
  433    HB   VAL  55           HB       VAL  55   0.787  11.530  -3.276
  434   HG11  VAL  55          2HG1      VAL  55  -0.504  11.411  -1.220
  435   HG12  VAL  55          1HG1      VAL  55   1.172  10.950  -0.925
  436   HG13  VAL  55          3HG1      VAL  55  -0.076   9.711  -1.034
  437   HG21  VAL  55          3HG2      VAL  55   1.303   8.588  -2.875
  438   HG22  VAL  55          2HG2      VAL  55   2.495   9.871  -2.674
  439   HG23  VAL  55          1HG2      VAL  55   1.797   9.557  -4.264
  440    H    ASN  56           H        ASN  56  -1.545  12.397  -4.541
  441    HA   ASN  56           HA       ASN  56  -3.352  13.067  -2.431
  442    HB2  ASN  56           HB2      ASN  56  -2.594  14.331  -5.032
  443    HB3  ASN  56           HB3      ASN  56  -4.058  14.872  -4.217
  444   HD21  ASN  56          1HD2      ASN  56  -0.583  14.629  -4.004
  445   HD22  ASN  56          2HD2      ASN  56  -0.389  15.806  -2.746
  446    H    ILE  57           H        ILE  57  -3.662  11.613  -5.599
  447    HA   ILE  57           HA       ILE  57  -6.512  11.619  -5.653
  448    HB   ILE  57           HB       ILE  57  -4.520   9.856  -7.094
  449   HG12  ILE  57          2HG1      ILE  57  -4.385  12.201  -7.740
  450   HG13  ILE  57          3HG1      ILE  57  -5.103  11.262  -9.045
  451   HG21  ILE  57          2HG2      ILE  57  -7.493  10.103  -7.547
  452   HG22  ILE  57          1HG2      ILE  57  -6.652   8.696  -6.898
  453   HG23  ILE  57          3HG2      ILE  57  -6.366   9.203  -8.563
  454   HD11  ILE  57          3HD1      ILE  57  -6.596  12.974  -7.071
  455   HD12  ILE  57          2HD1      ILE  57  -7.321  12.031  -8.374
  456   HD13  ILE  57          1HD1      ILE  57  -6.248  13.380  -8.752
  457    H    GLY  58           H        GLY  58  -4.084   9.171  -4.775
  458    HA2  GLY  58           HA1      GLY  58  -5.871   7.179  -3.898
  459    HA3  GLY  58           HA2      GLY  58  -4.199   7.356  -3.375
  460    H    GLU  59           H        GLU  59  -6.822   6.754  -1.953
  461    HA   GLU  59           HA       GLU  59  -6.977   9.071  -0.167
  462    HB2  GLU  59           HB2      GLU  59  -8.805   6.674  -0.372
  463    HB3  GLU  59           HB3      GLU  59  -9.087   8.117   0.594
  464    HG2  GLU  59           HG2      GLU  59  -9.160   9.461  -1.455
  465    HG3  GLU  59           HG3      GLU  59  -8.911   8.000  -2.408
  466    H    VAL  60           H        VAL  60  -6.982   5.513   0.121
  467    HA   VAL  60           HA       VAL  60  -5.903   5.782   2.825
  468    HB   VAL  60           HB       VAL  60  -6.244   3.263   2.910
  469   HG11  VAL  60          2HG1      VAL  60  -8.641   5.045   2.499
  470   HG12  VAL  60          1HG1      VAL  60  -7.756   4.802   4.006
  471   HG13  VAL  60          3HG1      VAL  60  -8.664   3.470   3.291
  472   HG21  VAL  60          3HG2      VAL  60  -7.787   2.286   1.301
  473   HG22  VAL  60          2HG2      VAL  60  -6.342   2.884   0.488
  474   HG23  VAL  60          1HG2      VAL  60  -7.842   3.806   0.409
  475    H    VAL  61           H        VAL  61  -3.950   5.053   3.439
  476    HA   VAL  61           HA       VAL  61  -2.129   4.207   1.287
  477    HB   VAL  61           HB       VAL  61  -1.349   5.410   3.941
  478   HG11  VAL  61          2HG1      VAL  61   0.783   5.824   2.819
  479   HG12  VAL  61          1HG1      VAL  61   0.159   5.070   1.352
  480   HG13  VAL  61          3HG1      VAL  61   0.377   4.107   2.814
  481   HG21  VAL  61          3HG2      VAL  61  -1.029   7.533   2.762
  482   HG22  VAL  61          2HG2      VAL  61  -2.718   7.027   2.727
  483   HG23  VAL  61          1HG2      VAL  61  -1.704   6.823   1.298
  484    H    ILE  62           H        ILE  62  -1.585   2.143   1.337
  485    HA   ILE  62           HA       ILE  62  -1.736   0.716   3.898
  486    HB   ILE  62           HB       ILE  62  -1.820  -0.270   1.051
  487   HG12  ILE  62          2HG1      ILE  62  -3.880  -1.438   1.949
  488   HG13  ILE  62          3HG1      ILE  62  -3.669  -0.512   3.428
  489   HG21  ILE  62          2HG2      ILE  62  -0.291  -1.757   2.179
  490   HG22  ILE  62          1HG2      ILE  62  -1.835  -2.576   1.933
  491   HG23  ILE  62          3HG2      ILE  62  -1.415  -1.945   3.526
  492   HD11  ILE  62          3HD1      ILE  62  -4.161   0.623   0.686
  493   HD12  ILE  62          2HD1      ILE  62  -3.935   1.557   2.163
  494   HD13  ILE  62          1HD1      ILE  62  -5.336   0.498   1.997
  495    H    PHE  63           H        PHE  63   0.071   0.289   4.941
  496    HA   PHE  63           HA       PHE  63   2.585   0.263   3.415
  497    HB2  PHE  63           HB2      PHE  63   1.975   0.960   6.269
  498    HB3  PHE  63           HB3      PHE  63   3.597   0.464   5.796
  499    HD1  PHE  63           HD2      PHE  63   4.636   1.741   3.799
  500    HD2  PHE  63           HD1      PHE  63   1.377   3.177   6.119
  501    HE1  PHE  63           HE2      PHE  63   5.130   4.033   3.063
  502    HE2  PHE  63           HE1      PHE  63   1.860   5.474   5.384
  503    HZ   PHE  63           HZ       PHE  63   3.739   5.902   3.853
  504    H    ALA  64           H        ALA  64   2.951  -1.756   2.813
  505    HA   ALA  64           HA       ALA  64   2.929  -3.829   4.902
  506    HB1  ALA  64           HB1      ALA  64   3.100  -4.136   1.900
  507    HB2  ALA  64           HB2      ALA  64   3.062  -5.452   3.073
  508    HB3  ALA  64           HB3      ALA  64   1.658  -4.401   2.879
  509    H    VAL  65           H        VAL  65   4.846  -3.368   5.913
  510    HA   VAL  65           HA       VAL  65   7.262  -3.398   4.251
  511    HB   VAL  65           HB       VAL  65   8.188  -1.476   5.468
  512   HG11  VAL  65          2HG1      VAL  65   6.798   0.278   4.425
  513   HG12  VAL  65          1HG1      VAL  65   5.562  -0.935   4.095
  514   HG13  VAL  65          3HG1      VAL  65   7.148  -1.062   3.332
  515   HG21  VAL  65          3HG2      VAL  65   5.431  -1.224   6.666
  516   HG22  VAL  65          2HG2      VAL  65   6.738  -0.053   6.837
  517   HG23  VAL  65          1HG2      VAL  65   6.902  -1.666   7.531
  518    H    ASP  66           H        ASP  66   9.204  -3.745   5.396
  519    HA   ASP  66           HA       ASP  66   8.901  -4.847   8.115
  520    HB2  ASP  66           HB2      ASP  66   9.494  -6.622   6.541
  521    HB3  ASP  66           HB3      ASP  66  10.847  -5.668   5.940
  522    H    THR  67           H        THR  67  10.743  -2.914   5.874
  523    HA   THR  67           HA       THR  67  12.307  -1.803   8.098
  524    HB   THR  67           HB       THR  67  13.630  -2.659   6.182
  525    HG1  THR  67           HG1      THR  67  14.833  -1.104   7.000
  526   HG21  THR  67          3HG2      THR  67  13.592  -1.498   4.036
  527   HG22  THR  67          1HG2      THR  67  12.265  -0.482   4.597
  528   HG23  THR  67          2HG2      THR  67  12.019  -2.216   4.387
  529    H    LYS  68           H        LYS  68  12.868   0.705   6.987
  530    HA   LYS  68           HA       LYS  68  10.261   1.951   7.410
  531    HB2  LYS  68           HB2      LYS  68  11.504   3.990   7.879
  532    HB3  LYS  68           HB3      LYS  68  12.117   2.656   8.844
  533    HG2  LYS  68           HG2      LYS  68  13.930   2.394   7.110
  534    HG3  LYS  68           HG3      LYS  68  13.377   3.929   6.434
  535    HD2  LYS  68           HD2      LYS  68  14.367   3.464   9.248
  536    HD3  LYS  68           HD3      LYS  68  15.234   4.300   7.956
  537    HE2  LYS  68           HE2      LYS  68  13.638   6.067   7.927
  538    HE3  LYS  68           HE3      LYS  68  12.554   5.184   9.002
  539    HZ1  LYS  68           HZ1      LYS  68  14.080   5.428  10.788
  540    HZ2  LYS  68           HZ2      LYS  68  13.863   6.965  10.102
  541    HZ3  LYS  68           HZ3      LYS  68  15.272   6.080   9.778
  542    H    VAL  69           H        VAL  69  10.012   4.145   6.202
  543    HA   VAL  69           HA       VAL  69  10.553   3.628   3.351
  544    HB   VAL  69           HB       VAL  69   8.241   4.465   2.864
  545   HG11  VAL  69          2HG1      VAL  69   7.107   2.381   3.433
  546   HG12  VAL  69          1HG1      VAL  69   8.405   1.980   4.559
  547   HG13  VAL  69          3HG1      VAL  69   8.737   2.079   2.828
  548   HG21  VAL  69          3HG2      VAL  69   6.615   4.662   4.550
  549   HG22  VAL  69          2HG2      VAL  69   8.022   5.546   5.141
  550   HG23  VAL  69          1HG2      VAL  69   7.670   3.935   5.764
  551    H    ARG  70           H        ARG  70  10.701   5.436   2.014
  552    HA   ARG  70           HA       ARG  70  11.162   7.970   3.393
  553    HB2  ARG  70           HB2      ARG  70  12.909   7.220   1.858
  554    HB3  ARG  70           HB3      ARG  70  11.744   7.131   0.545
  555    HG2  ARG  70           HG2      ARG  70  11.406   9.549   0.680
  556    HG3  ARG  70           HG3      ARG  70  12.575   9.636   1.996
  557    HD2  ARG  70           HD2      ARG  70  14.353   8.945   0.550
  558    HD3  ARG  70           HD3      ARG  70  13.221   8.591  -0.756
  559    HE   ARG  70           HE       ARG  70  12.909  11.274  -0.043
  560   HH11  ARG  70          2HH1      ARG  70  15.378   9.216  -1.449
  561   HH12  ARG  70          1HH1      ARG  70  16.022  10.478  -2.458
  562   HH21  ARG  70          2HH2      ARG  70  13.759  12.918  -1.335
  563   HH22  ARG  70          1HH2      ARG  70  15.102  12.597  -2.389
  564    H    ASN  71           H        ASN  71   8.975   6.440   1.160
  565    HA   ASN  71           HA       ASN  71   7.827   8.787   0.062
  566    HB2  ASN  71           HB2      ASN  71   6.660   6.012   0.300
  567    HB3  ASN  71           HB3      ASN  71   5.956   7.310  -0.648
  568   HD21  ASN  71          1HD2      ASN  71   8.416   4.896  -0.479
  569   HD22  ASN  71          2HD2      ASN  71   9.011   5.095  -2.090
  570    H    LYS  72           H        LYS  72   7.581   7.471   3.143
  571    HA   LYS  72           HA       LYS  72   4.945   7.697   3.907
  572    HB2  LYS  72           HB2      LYS  72   6.669   6.758   5.324
  573    HB3  LYS  72           HB3      LYS  72   7.428   8.328   5.502
  574    HG2  LYS  72           HG2      LYS  72   6.214   7.775   7.487
  575    HG3  LYS  72           HG3      LYS  72   5.415   9.122   6.676
  576    HD2  LYS  72           HD2      LYS  72   3.790   7.539   5.713
  577    HD3  LYS  72           HD3      LYS  72   4.582   6.224   6.583
  578    HE2  LYS  72           HE2      LYS  72   3.270   8.632   7.836
  579    HE3  LYS  72           HE3      LYS  72   2.582   7.011   7.753
  580    HZ1  LYS  72           HZ1      LYS  72   4.297   6.183   9.164
  581    HZ2  LYS  72           HZ2      LYS  72   3.651   7.563   9.908
  582    HZ3  LYS  72           HZ3      LYS  72   5.143   7.649   9.112
  583    H    GLU  73           H        GLU  73   7.268  10.237   3.381
  584    HA   GLU  73           HA       GLU  73   6.232  12.299   4.890
  585    HB2  GLU  73           HB2      GLU  73   7.490  12.490   2.152
  586    HB3  GLU  73           HB3      GLU  73   7.335  13.811   3.302
  587    HG2  GLU  73           HG2      GLU  73   8.916  11.288   3.738
  588    HG3  GLU  73           HG3      GLU  73   9.584  12.855   3.286
  589    H    ARG  74           H        ARG  74   5.258  11.360   1.588
  590    HA   ARG  74           HA       ARG  74   3.509  13.606   1.312
  591    HB2  ARG  74           HB2      ARG  74   2.861  12.538  -0.804
  592    HB3  ARG  74           HB3      ARG  74   4.606  12.649  -0.621
  593    HG2  ARG  74           HG2      ARG  74   4.290  10.207   0.358
  594    HG3  ARG  74           HG3      ARG  74   2.843  10.264  -0.651
  595    HD2  ARG  74           HD2      ARG  74   4.707   9.331  -1.899
  596    HD3  ARG  74           HD3      ARG  74   4.228  10.889  -2.563
  597    HE   ARG  74           HE       ARG  74   6.393  10.979  -0.655
  598   HH11  ARG  74          2HH1      ARG  74   5.534  10.635  -4.023
  599   HH12  ARG  74          1HH1      ARG  74   6.991  11.378  -4.614
  600   HH21  ARG  74          2HH2      ARG  74   8.319  11.973  -1.420
  601   HH22  ARG  74          1HH2      ARG  74   8.575  12.150  -3.127
  602    H    PHE  75           H        PHE  75   3.169  10.604   2.849
  603    HA   PHE  75           HA       PHE  75   0.306  10.450   2.429
  604    HB2  PHE  75           HB2      PHE  75   2.104   8.710   4.118
  605    HB3  PHE  75           HB3      PHE  75   0.446   8.365   3.650
  606    HD1  PHE  75           HD1      PHE  75   0.256   8.808   0.875
  607    HD2  PHE  75           HD2      PHE  75   3.563   7.316   3.082
  608    HE1  PHE  75           HE1      PHE  75   1.074   7.655  -1.137
  609    HE2  PHE  75           HE2      PHE  75   4.393   6.162   1.078
  610    HZ   PHE  75           HZ       PHE  75   3.146   6.331  -1.038
  611    H    ASP  76           H        ASP  76   2.224  12.251   4.376
  612    HA   ASP  76           HA       ASP  76   1.085  11.911   6.933
  613    HB2  ASP  76           HB2      ASP  76   3.146  13.134   6.724
  614    HB3  ASP  76           HB3      ASP  76   2.394  14.318   5.656
  615    H    GLY  77           H        GLY  77  -0.732  12.668   7.856
  616    HA2  GLY  77           HA1      GLY  77  -2.647  13.952   8.134
  617    HA3  GLY  77           HA2      GLY  77  -2.256  14.809   6.650
  618    H    LYS  78           H        LYS  78  -2.032  11.585   6.003
  619    HA   LYS  78           HA       LYS  78  -4.763  11.539   4.918
  620    HB2  LYS  78           HB2      LYS  78  -2.265  10.094   4.006
  621    HB3  LYS  78           HB3      LYS  78  -3.854   9.904   3.278
  622    HG2  LYS  78           HG2      LYS  78  -3.866  12.165   2.526
  623    HG3  LYS  78           HG3      LYS  78  -2.407  12.535   3.444
  624    HD2  LYS  78           HD2      LYS  78  -1.929  12.254   1.060
  625    HD3  LYS  78           HD3      LYS  78  -1.121  11.024   2.031
  626    HE2  LYS  78           HE2      LYS  78  -2.120  10.102  -0.016
  627    HE3  LYS  78           HE3      LYS  78  -2.800   9.399   1.444
  628    HZ1  LYS  78           HZ1      LYS  78  -4.070  11.606  -0.086
  629    HZ2  LYS  78           HZ2      LYS  78  -4.745  10.747   1.200
  630    HZ3  LYS  78           HZ3      LYS  78  -4.466   9.974  -0.279
  631    H    VAL  79           H        VAL  79  -5.303   9.016   4.465
  632    HA   VAL  79           HA       VAL  79  -5.496   7.929   7.159
  633    HB   VAL  79           HB       VAL  79  -6.760   6.892   4.614
  634   HG11  VAL  79          2HG1      VAL  79  -8.289   5.727   6.113
  635   HG12  VAL  79          1HG1      VAL  79  -7.415   6.359   7.510
  636   HG13  VAL  79          3HG1      VAL  79  -6.620   5.237   6.403
  637   HG21  VAL  79          3HG2      VAL  79  -8.799   8.025   5.374
  638   HG22  VAL  79          2HG2      VAL  79  -7.494   9.165   5.043
  639   HG23  VAL  79          1HG2      VAL  79  -7.894   8.742   6.708
  640    H    VAL  80           H        VAL  80  -4.311   6.256   7.876
  641    HA   VAL  80           HA       VAL  80  -2.631   4.897   5.872
  642    HB   VAL  80           HB       VAL  80  -1.821   5.687   8.677
  643   HG11  VAL  80          2HG1      VAL  80   0.426   4.974   7.996
  644   HG12  VAL  80          1HG1      VAL  80  -0.230   4.411   6.458
  645   HG13  VAL  80          3HG1      VAL  80  -0.729   3.639   7.964
  646   HG21  VAL  80          3HG2      VAL  80  -0.300   7.268   7.584
  647   HG22  VAL  80          2HG2      VAL  80  -1.987   7.629   7.217
  648   HG23  VAL  80          1HG2      VAL  80  -0.975   6.828   6.015
  649    H    LEU  81           H        LEU  81  -2.441   2.758   5.961
  650    HA   LEU  81           HA       LEU  81  -3.414   1.320   8.343
  651    HB2  LEU  81           HB2      LEU  81  -4.951   1.269   6.299
  652    HB3  LEU  81           HB3      LEU  81  -3.696   0.355   5.494
  653    HG   LEU  81           HG       LEU  81  -5.621  -0.980   6.442
  654   HD11  LEU  81          2HD1      LEU  81  -3.474  -2.003   5.839
  655   HD12  LEU  81          1HD1      LEU  81  -4.230  -2.799   7.220
  656   HD13  LEU  81          3HD1      LEU  81  -2.882  -1.691   7.471
  657   HD21  LEU  81          3HD2      LEU  81  -5.573  -1.481   8.829
  658   HD22  LEU  81          2HD2      LEU  81  -5.880   0.232   8.540
  659   HD23  LEU  81          1HD2      LEU  81  -4.280  -0.303   9.055
  660    H    GLU  82           H        GLU  82  -1.659   0.447   9.256
  661    HA   GLU  82           HA       GLU  82   0.632  -0.243   7.537
  662    HB2  GLU  82           HB2      GLU  82   0.884   1.526   9.325
  663    HB3  GLU  82           HB3      GLU  82   0.629   0.262  10.517
  664    HG2  GLU  82           HG2      GLU  82   2.629  -0.885   9.758
  665    HG3  GLU  82           HG3      GLU  82   2.873   0.339   8.512
  666    H    VAL  83           H        VAL  83   1.159  -2.330   7.303
  667    HA   VAL  83           HA       VAL  83   0.507  -4.232   9.442
  668    HB   VAL  83           HB       VAL  83  -0.215  -5.915   7.718
  669   HG11  VAL  83          2HG1      VAL  83  -1.940  -3.462   8.013
  670   HG12  VAL  83          1HG1      VAL  83  -1.850  -4.822   9.132
  671   HG13  VAL  83          3HG1      VAL  83  -2.502  -5.056   7.511
  672   HG21  VAL  83          3HG2      VAL  83  -0.428  -3.486   5.938
  673   HG22  VAL  83          2HG2      VAL  83  -1.015  -5.104   5.557
  674   HG23  VAL  83          1HG2      VAL  83   0.715  -4.816   5.743
  675    HA   PRO  84           HA       PRO  84   4.476  -6.082   8.554
  676    HB2  PRO  84           HB2      PRO  84   3.138  -8.726   8.488
  677    HB3  PRO  84           HB3      PRO  84   4.457  -8.162   9.517
  678    HG2  PRO  84           HG2      PRO  84   1.999  -8.494  10.500
  679    HG3  PRO  84           HG3      PRO  84   3.022  -7.144  11.026
  680    HD2  PRO  84           HD2      PRO  84   0.731  -7.150   9.102
  681    HD3  PRO  84           HD3      PRO  84   1.161  -5.952  10.341
  682    H    VAL  85           H        VAL  85   5.644  -6.830   6.796
  683    HA   VAL  85           HA       VAL  85   4.427  -6.483   4.271
  684    HB   VAL  85           HB       VAL  85   6.807  -5.993   4.753
  685   HG11  VAL  85          2HG1      VAL  85   7.379  -7.915   6.102
  686   HG12  VAL  85          1HG1      VAL  85   8.454  -7.811   4.708
  687   HG13  VAL  85          3HG1      VAL  85   7.139  -8.986   4.720
  688   HG21  VAL  85          3HG2      VAL  85   7.713  -6.830   2.620
  689   HG22  VAL  85          2HG2      VAL  85   6.089  -6.156   2.454
  690   HG23  VAL  85          1HG2      VAL  85   6.321  -7.905   2.475
  691    H    SER  86           H        SER  86   4.861  -9.270   6.253
  692    HA   SER  86           HA       SER  86   4.611 -11.230   4.192
  693    HB2  SER  86           HB2      SER  86   4.021 -12.631   6.371
  694    HB3  SER  86           HB3      SER  86   5.672 -12.104   6.026
  695    HG   SER  86           HG       SER  86   3.909 -11.263   7.998
  696    H    ALA  87           H        ALA  87   2.347  -9.305   5.939
  697    HA   ALA  87           HA       ALA  87   0.204 -11.130   6.093
  698    HB1  ALA  87           HB1      ALA  87  -1.177  -9.248   6.696
  699    HB2  ALA  87           HB2      ALA  87   0.384  -9.138   7.510
  700    HB3  ALA  87           HB3      ALA  87   0.049  -8.124   6.106
  701    HA   PRO  88           HA       PRO  88  -1.776  -8.912   2.320
  702    HB2  PRO  88           HB2      PRO  88  -0.252  -7.488   0.612
  703    HB3  PRO  88           HB3      PRO  88  -0.935  -6.784   2.084
  704    HG2  PRO  88           HG2      PRO  88   1.825  -7.853   1.609
  705    HG3  PRO  88           HG3      PRO  88   1.336  -6.335   2.387
  706    HD2  PRO  88           HD2      PRO  88   2.020  -8.519   3.814
  707    HD3  PRO  88           HD3      PRO  88   0.780  -7.379   4.368
  708    H    ILE  89           H        ILE  89   0.900 -10.897   2.304
  709    HA   ILE  89           HA       ILE  89   0.956 -11.558  -0.478
  710    HB   ILE  89           HB       ILE  89   1.979 -13.037   1.949
  711   HG12  ILE  89          2HG1      ILE  89   3.387 -11.528  -0.265
  712   HG13  ILE  89          3HG1      ILE  89   3.140 -10.940   1.373
  713   HG21  ILE  89          2HG2      ILE  89   2.321 -13.748  -0.964
  714   HG22  ILE  89          1HG2      ILE  89   1.427 -14.672   0.243
  715   HG23  ILE  89          3HG2      ILE  89   3.179 -14.507   0.379
  716   HD11  ILE  89          3HD1      ILE  89   5.398 -11.748   1.082
  717   HD12  ILE  89          2HD1      ILE  89   4.793 -13.322   0.570
  718   HD13  ILE  89          1HD1      ILE  89   4.529 -12.772   2.222
  719    H    LYS  90           H        LYS  90  -0.560 -12.973   2.397
  720    HA   LYS  90           HA       LYS  90  -2.202 -14.674   0.675
  721    HB2  LYS  90           HB2      LYS  90  -1.201 -15.695   2.687
  722    HB3  LYS  90           HB3      LYS  90  -2.069 -14.544   3.694
  723    HG2  LYS  90           HG2      LYS  90  -4.195 -15.455   2.696
  724    HG3  LYS  90           HG3      LYS  90  -3.214 -16.740   1.995
  725    HD2  LYS  90           HD2      LYS  90  -2.500 -17.438   4.206
  726    HD3  LYS  90           HD3      LYS  90  -3.396 -16.104   4.939
  727    HE2  LYS  90           HE2      LYS  90  -5.471 -17.067   3.896
  728    HE3  LYS  90           HE3      LYS  90  -4.508 -18.475   3.451
  729    HZ1  LYS  90           HZ1      LYS  90  -5.762 -18.751   5.534
  730    HZ2  LYS  90           HZ2      LYS  90  -4.855 -17.499   6.233
  731    HZ3  LYS  90           HZ3      LYS  90  -4.089 -18.934   5.749
  732    H    ASP  91           H        ASP  91  -2.575 -12.231   3.229
  733    HA   ASP  91           HA       ASP  91  -5.460 -12.190   2.756
  734    HB2  ASP  91           HB2      ASP  91  -3.727 -11.143   4.991
  735    HB3  ASP  91           HB3      ASP  91  -5.431 -10.729   4.850
  736    H    ALA  92           H        ALA  92  -4.108 -11.027   0.673
  737    HA   ALA  92           HA       ALA  92  -3.376  -8.330   0.959
  738    HB1  ALA  92           HB1      ALA  92  -2.734  -9.655  -0.981
  739    HB2  ALA  92           HB2      ALA  92  -4.424  -9.765  -1.481
  740    HB3  ALA  92           HB3      ALA  92  -3.605  -8.203  -1.479
  741    H    GLU  93           H        GLU  93  -6.411  -9.820  -0.063
  742    HA   GLU  93           HA       GLU  93  -7.782  -7.364  -0.429
  743    HB2  GLU  93           HB2      GLU  93  -9.790  -8.852  -0.474
  744    HB3  GLU  93           HB3      GLU  93  -8.543  -9.266  -1.631
  745    HG2  GLU  93           HG2      GLU  93  -7.781 -11.047  -0.120
  746    HG3  GLU  93           HG3      GLU  93  -9.085 -10.634   0.994
  747    H    LYS  94           H        LYS  94  -7.179  -9.419   2.283
  748    HA   LYS  94           HA       LYS  94  -9.263  -8.429   3.968
  749    HB2  LYS  94           HB2      LYS  94  -8.139 -10.627   4.293
  750    HB3  LYS  94           HB3      LYS  94  -6.658  -9.780   4.713
  751    HG2  LYS  94           HG2      LYS  94  -7.817 -10.583   6.693
  752    HG3  LYS  94           HG3      LYS  94  -7.744  -8.820   6.669
  753    HD2  LYS  94           HD2      LYS  94 -10.024  -8.654   6.012
  754    HD3  LYS  94           HD3      LYS  94 -10.123 -10.387   5.694
  755    HE2  LYS  94           HE2      LYS  94 -11.209  -9.742   7.810
  756    HE3  LYS  94           HE3      LYS  94  -9.880 -10.876   8.042
  757    HZ1  LYS  94           HZ1      LYS  94 -10.004  -8.953   9.633
  758    HZ2  LYS  94           HZ2      LYS  94  -9.538  -7.949   8.355
  759    HZ3  LYS  94           HZ3      LYS  94  -8.503  -9.183   8.881
  760    H    VAL  95           H        VAL  95  -5.904  -7.638   3.361
  761    HA   VAL  95           HA       VAL  95  -5.571  -5.648   5.328
  762    HB   VAL  95           HB       VAL  95  -4.255  -5.929   2.616
  763   HG11  VAL  95          2HG1      VAL  95  -2.454  -4.555   3.525
  764   HG12  VAL  95          1HG1      VAL  95  -3.388  -4.304   5.002
  765   HG13  VAL  95          3HG1      VAL  95  -3.978  -3.668   3.465
  766   HG21  VAL  95          3HG2      VAL  95  -3.899  -7.880   3.993
  767   HG22  VAL  95          2HG2      VAL  95  -3.400  -6.868   5.350
  768   HG23  VAL  95          1HG2      VAL  95  -2.406  -6.944   3.895
  769    H    ILE  96           H        ILE  96  -6.739  -5.546   2.000
  770    HA   ILE  96           HA       ILE  96  -7.038  -2.759   1.780
  771    HB   ILE  96           HB       ILE  96  -8.544  -4.974   0.387
  772   HG12  ILE  96          2HG1      ILE  96  -6.175  -3.302  -0.485
  773   HG13  ILE  96          3HG1      ILE  96  -6.099  -4.977   0.052
  774   HG21  ILE  96          2HG2      ILE  96  -9.109  -3.289  -1.307
  775   HG22  ILE  96          1HG2      ILE  96  -8.380  -2.038  -0.297
  776   HG23  ILE  96          3HG2      ILE  96  -9.811  -2.905   0.265
  777   HD11  ILE  96          3HD1      ILE  96  -7.489  -3.941  -2.403
  778   HD12  ILE  96          2HD1      ILE  96  -7.520  -5.615  -1.851
  779   HD13  ILE  96          1HD1      ILE  96  -5.996  -4.876  -2.341
  780    H    ASN  97           H        ASN  97  -9.326  -5.284   2.793
  781    HA   ASN  97           HA       ASN  97 -11.531  -3.595   3.218
  782    HB2  ASN  97           HB2      ASN  97 -10.766  -6.299   4.249
  783    HB3  ASN  97           HB3      ASN  97 -12.127  -5.458   4.982
  784   HD21  ASN  97          1HD2      ASN  97 -10.932  -7.047   2.132
  785   HD22  ASN  97          2HD2      ASN  97 -12.459  -7.143   1.318
  786    H    ALA  98           H        ALA  98  -8.778  -4.382   5.238
  787    HA   ALA  98           HA       ALA  98  -9.707  -3.181   7.620
  788    HB1  ALA  98           HB1      ALA  98  -7.795  -4.725   7.544
  789    HB2  ALA  98           HB2      ALA  98  -6.861  -3.508   6.675
  790    HB3  ALA  98           HB3      ALA  98  -7.385  -3.201   8.330
  791    H    ALA  99           H        ALA  99  -7.884  -1.937   4.847
  792    HA   ALA  99           HA       ALA  99  -7.458   0.662   5.855
  793    HB1  ALA  99           HB1      ALA  99  -7.717  -0.250   2.989
  794    HB2  ALA  99           HB2      ALA  99  -7.061   1.299   3.522
  795    HB3  ALA  99           HB3      ALA  99  -6.230  -0.200   3.937
  796    H    LEU 100           H        LEU 100 -10.050  -0.717   3.865
  797    HA   LEU 100           HA       LEU 100 -11.596   1.604   3.589
  798    HB2  LEU 100           HB2      LEU 100 -12.102  -1.323   3.431
  799    HB3  LEU 100           HB3      LEU 100 -13.491  -0.262   3.546
  800    HG   LEU 100           HG       LEU 100 -12.900  -0.907   1.227
  801   HD11  LEU 100          2HD1      LEU 100 -12.670   2.031   1.854
  802   HD12  LEU 100          1HD1      LEU 100 -14.169   1.120   1.665
  803   HD13  LEU 100          3HD1      LEU 100 -13.091   1.340   0.286
  804   HD21  LEU 100          3HD2      LEU 100 -10.478  -0.973   1.433
  805   HD22  LEU 100          2HD2      LEU 100 -10.443   0.769   1.706
  806   HD23  LEU 100          1HD2      LEU 100 -10.970   0.131   0.149
  807    H    ALA 101           H        ALA 101 -11.284  -0.693   6.203
  808    HA   ALA 101           HA       ALA 101 -13.574   0.103   7.668
  809    HB1  ALA 101           HB1      ALA 101 -11.041  -1.188   8.673
  810    HB2  ALA 101           HB2      ALA 101 -12.582  -1.111   9.525
  811    HB3  ALA 101           HB3      ALA 101 -12.446  -2.039   8.031
  812    H    LEU 102           H        LEU 102 -10.534   1.590   7.177
  813    HA   LEU 102           HA       LEU 102 -10.610   3.130   9.628
  814    HB2  LEU 102           HB2      LEU 102  -8.717   2.761   7.396
  815    HB3  LEU 102           HB3      LEU 102  -8.710   4.347   8.138
  816    HG   LEU 102           HG       LEU 102  -6.998   2.895   9.109
  817   HD11  LEU 102          2HD1      LEU 102  -7.939   4.616  10.508
  818   HD12  LEU 102          1HD1      LEU 102  -7.624   3.177  11.478
  819   HD13  LEU 102          3HD1      LEU 102  -9.269   3.558  10.974
  820   HD21  LEU 102          3HD2      LEU 102  -8.102   0.740   8.778
  821   HD22  LEU 102          2HD2      LEU 102  -9.306   1.163   9.995
  822   HD23  LEU 102          1HD2      LEU 102  -7.617   0.959  10.459
  823    H    ILE 103           H        ILE 103 -11.959   3.393   6.514
  824    HA   ILE 103           HA       ILE 103 -12.383   6.283   6.932
  825    HB   ILE 103           HB       ILE 103 -12.701   6.483   4.475
  826   HG12  ILE 103          2HG1      ILE 103 -11.542   3.687   4.408
  827   HG13  ILE 103          3HG1      ILE 103 -13.209   4.103   4.022
  828   HG21  ILE 103          2HG2      ILE 103 -10.616   7.143   5.485
  829   HG22  ILE 103          1HG2      ILE 103 -10.302   6.385   3.923
  830   HG23  ILE 103          3HG2      ILE 103 -10.020   5.486   5.414
  831   HD11  ILE 103          3HD1      ILE 103 -11.922   3.782   2.004
  832   HD12  ILE 103          2HD1      ILE 103 -10.757   5.001   2.527
  833   HD13  ILE 103          1HD1      ILE 103 -12.415   5.470   2.148
  834    H    ASP 104           H        ASP 104 -13.895   3.241   6.586
  835    HA   ASP 104           HA       ASP 104 -16.524   4.490   6.618
  836    HB2  ASP 104           HB2      ASP 104 -15.903   4.144   4.206
  837    HB3  ASP 104           HB3      ASP 104 -15.838   2.414   4.529
  838    H    GLU 105           H        GLU 105 -14.997   1.323   6.140
  839    HA   GLU 105           HA       GLU 105 -15.093  -0.640   7.246
  840    HB2  GLU 105           HB2      GLU 105 -14.719   0.612   9.308
  841    HB3  GLU 105           HB3      GLU 105 -16.443   0.922   9.450
  842    HG2  GLU 105           HG2      GLU 105 -16.850  -1.485   9.670
  843    HG3  GLU 105           HG3      GLU 105 -15.117  -1.779   9.553
  844    H    LYS 106           H        LYS 106 -16.375  -1.632   5.787
  845    HA   LYS 106           HA       LYS 106 -18.070  -2.991   5.171
  846    HB2  LYS 106           HB2      LYS 106 -19.128  -2.430   7.946
  847    HB3  LYS 106           HB3      LYS 106 -19.739  -3.675   6.865
  848    HG2  LYS 106           HG2      LYS 106 -17.567  -4.789   6.909
  849    HG3  LYS 106           HG3      LYS 106 -16.944  -3.532   7.979
  850    HD2  LYS 106           HD2      LYS 106 -18.614  -4.153   9.669
  851    HD3  LYS 106           HD3      LYS 106 -19.218  -5.420   8.598
  852    HE2  LYS 106           HE2      LYS 106 -16.984  -6.466   8.636
  853    HE3  LYS 106           HE3      LYS 106 -16.449  -5.236   9.778
  854    HZ1  LYS 106           HZ1      LYS 106 -18.625  -7.209  10.245
  855    HZ2  LYS 106           HZ2      LYS 106 -18.117  -6.026  11.352
  856    HZ3  LYS 106           HZ3      LYS 106 -17.065  -7.279  10.904
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1 -15.285   5.096  -7.540
    2    H2   MET   1           H2       MET   1 -16.714   5.185  -8.450
    3    H3   MET   1           H3       MET   1 -15.224   5.527  -9.176
    4    HA   MET   1           HA       MET   1 -16.081   2.895  -8.119
    5    HB2  MET   1           HB2      MET   1 -16.875   3.983 -10.454
    6    HB3  MET   1           HB3      MET   1 -15.326   3.332 -10.967
    7    HG2  MET   1           HG2      MET   1 -17.551   1.757  -9.691
    8    HG3  MET   1           HG3      MET   1 -17.178   1.801 -11.410
    9    HE1  MET   1           HE1      MET   1 -17.444  -0.873  -9.568
   10    HE2  MET   1           HE2      MET   1 -17.194  -0.874 -11.314
   11    HE3  MET   1           HE3      MET   1 -16.133  -1.820 -10.272
   12    H    LYS   2           H        LYS   2 -14.498   1.341  -8.017
   13    HA   LYS   2           HA       LYS   2 -12.422   0.506  -7.634
   14    HB2  LYS   2           HB2      LYS   2 -11.445   2.516  -9.676
   15    HB3  LYS   2           HB3      LYS   2 -10.598   1.078  -9.130
   16    HG2  LYS   2           HG2      LYS   2 -12.281  -0.332 -10.170
   17    HG3  LYS   2           HG3      LYS   2 -13.181   1.100 -10.675
   18    HD2  LYS   2           HD2      LYS   2 -11.101   1.820 -11.915
   19    HD3  LYS   2           HD3      LYS   2 -10.453   0.213 -11.590
   20    HE2  LYS   2           HE2      LYS   2 -12.340  -0.790 -12.769
   21    HE3  LYS   2           HE3      LYS   2 -13.006   0.815 -13.078
   22    HZ1  LYS   2           HZ1      LYS   2 -11.838   0.077 -15.012
   23    HZ2  LYS   2           HZ2      LYS   2 -10.446  -0.280 -14.112
   24    HZ3  LYS   2           HZ3      LYS   2 -10.936   1.330 -14.308
   25    H    ARG   3           H        ARG   3 -12.041   1.101  -5.547
   26    HA   ARG   3           HA       ARG   3 -11.731   3.747  -4.674
   27    HB2  ARG   3           HB2      ARG   3 -12.165   1.515  -3.332
   28    HB3  ARG   3           HB3      ARG   3 -10.414   1.522  -3.168
   29    HG2  ARG   3           HG2      ARG   3 -11.177   2.611  -1.253
   30    HG3  ARG   3           HG3      ARG   3 -10.682   3.923  -2.329
   31    HD2  ARG   3           HD2      ARG   3 -13.166   3.861  -3.102
   32    HD3  ARG   3           HD3      ARG   3 -13.435   3.023  -1.576
   33    HE   ARG   3           HE       ARG   3 -12.224   5.709  -1.745
   34   HH11  ARG   3          2HH1      ARG   3 -14.383   3.415  -0.196
   35   HH12  ARG   3          1HH1      ARG   3 -14.973   4.575   0.952
   36   HH21  ARG   3          2HH2      ARG   3 -13.016   7.220  -0.262
   37   HH22  ARG   3          1HH2      ARG   3 -14.223   6.738   0.902
   38    H    LYS   4           H        LYS   4 -10.080   5.094  -4.635
   39    HA   LYS   4           HA       LYS   4  -7.630   4.378  -5.967
   40    HB2  LYS   4           HB2      LYS   4  -8.245   6.958  -4.511
   41    HB3  LYS   4           HB3      LYS   4  -7.058   6.702  -5.781
   42    HG2  LYS   4           HG2      LYS   4 -10.050   6.593  -6.101
   43    HG3  LYS   4           HG3      LYS   4  -8.986   7.900  -6.622
   44    HD2  LYS   4           HD2      LYS   4  -7.835   6.318  -8.126
   45    HD3  LYS   4           HD3      LYS   4  -8.984   5.063  -7.651
   46    HE2  LYS   4           HE2      LYS   4 -10.825   6.423  -8.511
   47    HE3  LYS   4           HE3      LYS   4  -9.680   7.685  -8.968
   48    HZ1  LYS   4           HZ1      LYS   4 -10.158   6.417 -10.898
   49    HZ2  LYS   4           HZ2      LYS   4  -9.889   4.955 -10.093
   50    HZ3  LYS   4           HZ3      LYS   4  -8.587   5.991 -10.411
   51    H    ILE   5           H        ILE   5  -6.195   3.187  -4.861
   52    HA   ILE   5           HA       ILE   5  -5.688   3.913  -2.050
   53    HB   ILE   5           HB       ILE   5  -5.555   1.133  -3.234
   54   HG12  ILE   5          2HG1      ILE   5  -7.583   2.387  -1.364
   55   HG13  ILE   5          3HG1      ILE   5  -7.863   1.938  -3.043
   56   HG21  ILE   5          2HG2      ILE   5  -5.263   2.061  -0.373
   57   HG22  ILE   5          1HG2      ILE   5  -3.950   1.513  -1.415
   58   HG23  ILE   5          3HG2      ILE   5  -5.220   0.389  -0.935
   59   HD11  ILE   5          3HD1      ILE   5  -7.250   0.044  -0.787
   60   HD12  ILE   5          2HD1      ILE   5  -7.509  -0.413  -2.469
   61   HD13  ILE   5          1HD1      ILE   5  -8.823   0.306  -1.538
   62    H    ILE   6           H        ILE   6  -3.644   4.327  -1.513
   63    HA   ILE   6           HA       ILE   6  -1.558   3.619  -3.460
   64    HB   ILE   6           HB       ILE   6  -0.186   5.440  -2.535
   65   HG12  ILE   6          2HG1      ILE   6  -1.415   5.481  -0.281
   66   HG13  ILE   6          3HG1      ILE   6  -0.921   7.024  -0.962
   67   HG21  ILE   6          2HG2      ILE   6  -2.890   6.307  -3.531
   68   HG22  ILE   6          1HG2      ILE   6  -1.508   5.830  -4.521
   69   HG23  ILE   6          3HG2      ILE   6  -1.429   7.297  -3.544
   70   HD11  ILE   6          3HD1      ILE   6  -3.692   5.848  -1.055
   71   HD12  ILE   6          2HD1      ILE   6  -3.205   7.389  -1.761
   72   HD13  ILE   6          1HD1      ILE   6  -3.142   7.159  -0.013
   73    H    ALA   7           H        ALA   7   0.113   2.366  -2.803
   74    HA   ALA   7           HA       ALA   7   0.267   1.726   0.060
   75    HB1  ALA   7           HB1      ALA   7   0.207  -0.332  -2.141
   76    HB2  ALA   7           HB2      ALA   7   0.381  -0.646  -0.415
   77    HB3  ALA   7           HB3      ALA   7  -1.125   0.026  -1.042
   78    H    VAL   8           H        VAL   8   2.274   1.354   0.827
   79    HA   VAL   8           HA       VAL   8   4.463   1.278  -1.141
   80    HB   VAL   8           HB       VAL   8   4.534   2.582   1.589
   81   HG11  VAL   8          2HG1      VAL   8   6.645   2.411  -0.560
   82   HG12  VAL   8          1HG1      VAL   8   6.680   1.591   1.001
   83   HG13  VAL   8          3HG1      VAL   8   6.771   3.351   0.927
   84   HG21  VAL   8          3HG2      VAL   8   4.798   4.681   0.351
   85   HG22  VAL   8          2HG2      VAL   8   3.256   3.902  -0.007
   86   HG23  VAL   8          1HG2      VAL   8   4.582   3.807  -1.166
   87    H    THR   9           H        THR   9   5.401  -0.626  -1.129
   88    HA   THR   9           HA       THR   9   5.495  -2.186   1.352
   89    HB   THR   9           HB       THR   9   6.355  -4.018  -0.184
   90    HG1  THR   9           HG1      THR   9   6.221  -1.945  -1.947
   91   HG21  THR   9          3HG2      THR   9   4.134  -4.549  -1.078
   92   HG22  THR   9          1HG2      THR   9   3.614  -2.892  -0.774
   93   HG23  THR   9          2HG2      THR   9   4.027  -3.948   0.577
   94    H    ALA  10           H        ALA  10   7.351  -2.273   2.498
   95    HA   ALA  10           HA       ALA  10   9.864  -1.628   1.148
   96    HB1  ALA  10           HB1      ALA  10   8.992   0.508   1.948
   97    HB2  ALA  10           HB2      ALA  10   8.900  -0.143   3.584
   98    HB3  ALA  10           HB3      ALA  10  10.468   0.051   2.799
   99    H    CYS  11           H        CYS  11  10.732  -3.608   1.508
  100    HA   CYS  11           HA       CYS  11  11.431  -4.177   4.293
  101    HB2  CYS  11           HB2      CYS  11   9.561  -5.656   3.734
  102    HB3  CYS  11           HB3      CYS  11  10.425  -6.233   2.312
  103    HG   CYS  11           HG       CYS  11  10.428  -7.494   5.276
  104    H    ALA  12           H        ALA  12  13.552  -3.818   4.262
  105    HA   ALA  12           HA       ALA  12  15.191  -4.500   1.993
  106    HB1  ALA  12           HB1      ALA  12  15.971  -3.538   4.749
  107    HB2  ALA  12           HB2      ALA  12  17.045  -3.660   3.355
  108    HB3  ALA  12           HB3      ALA  12  15.701  -2.520   3.335
  109    H    THR  13           H        THR  13  14.396  -5.821   5.116
  110    HA   THR  13           HA       THR  13  16.425  -7.716   5.407
  111    HB   THR  13           HB       THR  13  13.568  -8.085   6.311
  112    HG1  THR  13           HG1      THR  13  13.816  -6.350   7.510
  113   HG21  THR  13          3HG2      THR  13  16.214  -8.892   7.531
  114   HG22  THR  13          1HG2      THR  13  15.078  -9.969   6.719
  115   HG23  THR  13          2HG2      THR  13  14.623  -9.189   8.233
  116    H    GLY  14           H        GLY  14  13.209  -8.004   3.930
  117    HA2  GLY  14           HA1      GLY  14  14.219 -10.321   2.410
  118    HA3  GLY  14           HA2      GLY  14  12.609 -10.323   3.126
  119    H    VAL  15           H        VAL  15  14.649  -8.927   0.664
  120    HA   VAL  15           HA       VAL  15  12.823  -7.049  -0.351
  121    HB   VAL  15           HB       VAL  15  15.208  -6.948  -0.854
  122   HG11  VAL  15          2HG1      VAL  15  15.685  -9.318  -1.065
  123   HG12  VAL  15          1HG1      VAL  15  16.228  -8.445  -2.498
  124   HG13  VAL  15          3HG1      VAL  15  14.740  -9.392  -2.552
  125   HG21  VAL  15          3HG2      VAL  15  15.056  -6.423  -3.247
  126   HG22  VAL  15          2HG2      VAL  15  13.681  -5.791  -2.338
  127   HG23  VAL  15          1HG2      VAL  15  13.498  -7.246  -3.317
  128    H    ALA  16           H        ALA  16  13.172 -10.493  -0.902
  129    HA   ALA  16           HA       ALA  16  11.562 -10.673  -3.221
  130    HB1  ALA  16           HB1      ALA  16  11.389 -13.036  -2.716
  131    HB2  ALA  16           HB2      ALA  16  13.042 -12.483  -2.450
  132    HB3  ALA  16           HB3      ALA  16  11.970 -12.752  -1.076
  133    H    HIS  17           H        HIS  17  10.852 -10.458   0.185
  134    HA   HIS  17           HA       HIS  17   8.112 -11.215   0.056
  135    HB2  HIS  17           HB2      HIS  17   9.607  -9.522   2.072
  136    HB3  HIS  17           HB3      HIS  17   7.938 -10.042   2.266
  137    HD1  HIS  17           HD1      HIS  17   7.924 -11.799   4.000
  138    HD2  HIS  17           HD2      HIS  17  11.145 -12.215   1.397
  139    HE1  HIS  17           HE1      HIS  17   9.122 -13.888   4.725
  140    HE2  HIS  17           HE2      HIS  17  11.148 -14.035   3.232
  141    H    THR  18           H        THR  18   9.845  -8.160  -0.108
  142    HA   THR  18           HA       THR  18   7.731  -6.364  -0.119
  143    HB   THR  18           HB       THR  18  10.285  -6.145  -1.727
  144    HG1  THR  18           HG1      THR  18  11.281  -5.883   0.121
  145   HG21  THR  18          3HG2      THR  18   8.636  -4.425  -2.267
  146   HG22  THR  18          1HG2      THR  18  10.003  -3.732  -1.394
  147   HG23  THR  18          2HG2      THR  18   8.479  -4.027  -0.556
  148    H    TYR  19           H        TYR  19   9.298  -7.983  -2.867
  149    HA   TYR  19           HA       TYR  19   7.680  -6.691  -4.817
  150    HB2  TYR  19           HB2      TYR  19   9.550  -9.055  -4.957
  151    HB3  TYR  19           HB3      TYR  19   8.696  -8.431  -6.364
  152    HD1  TYR  19           HD1      TYR  19  10.098  -6.321  -3.662
  153    HD2  TYR  19           HD2      TYR  19  10.602  -7.765  -7.630
  154    HE1  TYR  19           HE1      TYR  19  11.899  -4.692  -4.018
  155    HE2  TYR  19           HE2      TYR  19  12.405  -6.134  -7.996
  156    HH   TYR  19           HH       TYR  19  13.125  -3.925  -7.061
  157    H    MET  20           H        MET  20   7.587  -9.863  -3.252
  158    HA   MET  20           HA       MET  20   5.488 -10.912  -4.834
  159    HB2  MET  20           HB2      MET  20   6.980 -12.311  -3.431
  160    HB3  MET  20           HB3      MET  20   6.227 -11.634  -1.992
  161    HG2  MET  20           HG2      MET  20   4.074 -12.568  -2.687
  162    HG3  MET  20           HG3      MET  20   4.848 -13.267  -4.110
  163    HE1  MET  20           HE1      MET  20   3.131 -15.028  -2.155
  164    HE2  MET  20           HE2      MET  20   3.992 -15.697  -3.540
  165    HE3  MET  20           HE3      MET  20   4.164 -16.445  -1.953
  166    H    ALA  21           H        ALA  21   5.550  -9.116  -1.791
  167    HA   ALA  21           HA       ALA  21   2.826  -9.303  -1.153
  168    HB1  ALA  21           HB1      ALA  21   4.720  -7.043  -0.534
  169    HB2  ALA  21           HB2      ALA  21   3.190  -7.373   0.277
  170    HB3  ALA  21           HB3      ALA  21   4.527  -8.513   0.420
  171    H    ALA  22           H        ALA  22   4.591  -6.808  -2.965
  172    HA   ALA  22           HA       ALA  22   2.463  -5.075  -3.454
  173    HB1  ALA  22           HB1      ALA  22   3.797  -4.267  -5.358
  174    HB2  ALA  22           HB2      ALA  22   4.775  -4.482  -3.907
  175    HB3  ALA  22           HB3      ALA  22   4.851  -5.674  -5.204
  176    H    GLN  23           H        GLN  23   3.532  -7.919  -5.251
  177    HA   GLN  23           HA       GLN  23   1.687  -7.603  -7.395
  178    HB2  GLN  23           HB2      GLN  23   3.247 -10.007  -6.434
  179    HB3  GLN  23           HB3      GLN  23   2.318  -9.962  -7.927
  180    HG2  GLN  23           HG2      GLN  23   3.741  -8.282  -8.846
  181    HG3  GLN  23           HG3      GLN  23   4.576  -8.075  -7.306
  182   HE21  GLN  23          1HE2      GLN  23   6.569  -8.522  -8.240
  183   HE22  GLN  23          2HE2      GLN  23   7.028 -10.133  -8.704
  184    H    ALA  24           H        ALA  24   1.724  -9.681  -4.502
  185    HA   ALA  24           HA       ALA  24  -0.711 -11.003  -5.039
  186    HB1  ALA  24           HB1      ALA  24   0.640 -10.506  -2.387
  187    HB2  ALA  24           HB2      ALA  24  -0.643 -11.679  -2.687
  188    HB3  ALA  24           HB3      ALA  24   0.930 -11.873  -3.462
  189    H    LEU  25           H        LEU  25   0.058  -8.091  -3.231
  190    HA   LEU  25           HA       LEU  25  -2.528  -7.546  -2.241
  191    HB2  LEU  25           HB2      LEU  25  -0.493  -6.496  -1.391
  192    HB3  LEU  25           HB3      LEU  25  -0.247  -5.693  -2.928
  193    HG   LEU  25           HG       LEU  25  -2.317  -4.390  -2.554
  194   HD11  LEU  25          2HD1      LEU  25  -3.488  -5.961  -1.102
  195   HD12  LEU  25          1HD1      LEU  25  -3.335  -4.381  -0.333
  196   HD13  LEU  25          3HD1      LEU  25  -2.283  -5.707   0.159
  197   HD21  LEU  25          3HD2      LEU  25  -0.332  -4.190  -0.294
  198   HD22  LEU  25          2HD2      LEU  25  -1.360  -2.900  -0.917
  199   HD23  LEU  25          1HD2      LEU  25  -0.069  -3.566  -1.923
  200    H    LYS  26           H        LYS  26  -0.891  -6.697  -5.241
  201    HA   LYS  26           HA       LYS  26  -2.935  -4.988  -6.228
  202    HB2  LYS  26           HB2      LYS  26  -0.554  -4.972  -6.981
  203    HB3  LYS  26           HB3      LYS  26  -0.839  -6.505  -7.790
  204    HG2  LYS  26           HG2      LYS  26  -2.428  -5.478  -9.277
  205    HG3  LYS  26           HG3      LYS  26  -2.304  -3.950  -8.403
  206    HD2  LYS  26           HD2      LYS  26  -0.025  -5.302  -9.847
  207    HD3  LYS  26           HD3      LYS  26  -0.987  -3.973 -10.496
  208    HE2  LYS  26           HE2      LYS  26  -0.252  -2.524  -8.704
  209    HE3  LYS  26           HE3      LYS  26   0.626  -3.853  -7.949
  210    HZ1  LYS  26           HZ1      LYS  26   1.223  -2.781 -10.653
  211    HZ2  LYS  26           HZ2      LYS  26   2.129  -3.927  -9.787
  212    HZ3  LYS  26           HZ3      LYS  26   2.041  -2.324  -9.242
  213    H    LYS  27           H        LYS  27  -2.364  -8.430  -6.327
  214    HA   LYS  27           HA       LYS  27  -4.254  -9.093  -8.319
  215    HB2  LYS  27           HB2      LYS  27  -3.042 -10.619  -6.040
  216    HB3  LYS  27           HB3      LYS  27  -4.289 -11.336  -7.046
  217    HG2  LYS  27           HG2      LYS  27  -1.635 -10.285  -7.998
  218    HG3  LYS  27           HG3      LYS  27  -2.070 -11.983  -7.793
  219    HD2  LYS  27           HD2      LYS  27  -3.814 -11.747  -9.487
  220    HD3  LYS  27           HD3      LYS  27  -3.404 -10.041  -9.682
  221    HE2  LYS  27           HE2      LYS  27  -2.405 -11.363 -11.453
  222    HE3  LYS  27           HE3      LYS  27  -1.153 -10.679 -10.416
  223    HZ1  LYS  27           HZ1      LYS  27  -0.950 -12.809  -9.302
  224    HZ2  LYS  27           HZ2      LYS  27  -0.706 -12.989 -10.969
  225    HZ3  LYS  27           HZ3      LYS  27  -2.175 -13.464 -10.273
  226    H    GLY  28           H        GLY  28  -4.500  -8.822  -4.802
  227    HA2  GLY  28           HA1      GLY  28  -7.217  -9.471  -4.551
  228    HA3  GLY  28           HA2      GLY  28  -6.320  -8.427  -3.455
  229    H    ALA  29           H        ALA  29  -5.631  -6.396  -5.240
  230    HA   ALA  29           HA       ALA  29  -7.932  -4.786  -5.293
  231    HB1  ALA  29           HB1      ALA  29  -5.668  -3.862  -5.233
  232    HB2  ALA  29           HB2      ALA  29  -5.378  -4.458  -6.867
  233    HB3  ALA  29           HB3      ALA  29  -6.590  -3.207  -6.587
  234    H    LYS  30           H        LYS  30  -6.389  -6.775  -7.776
  235    HA   LYS  30           HA       LYS  30  -8.085  -6.017  -9.915
  236    HB2  LYS  30           HB2      LYS  30  -6.420  -8.478  -9.415
  237    HB3  LYS  30           HB3      LYS  30  -7.394  -8.295 -10.865
  238    HG2  LYS  30           HG2      LYS  30  -6.136  -6.255 -11.425
  239    HG3  LYS  30           HG3      LYS  30  -5.130  -6.508  -9.995
  240    HD2  LYS  30           HD2      LYS  30  -4.279  -8.562 -10.865
  241    HD3  LYS  30           HD3      LYS  30  -5.446  -8.552 -12.187
  242    HE2  LYS  30           HE2      LYS  30  -3.297  -7.891 -13.034
  243    HE3  LYS  30           HE3      LYS  30  -4.375  -6.498 -13.060
  244    HZ1  LYS  30           HZ1      LYS  30  -3.328  -5.657 -11.078
  245    HZ2  LYS  30           HZ2      LYS  30  -2.146  -5.958 -12.258
  246    HZ3  LYS  30           HZ3      LYS  30  -2.336  -7.034 -10.964
  247    H    LYS  31           H        LYS  31  -8.312  -8.482  -7.421
  248    HA   LYS  31           HA       LYS  31 -10.510  -9.902  -8.496
  249    HB2  LYS  31           HB2      LYS  31  -9.005 -10.800  -6.749
  250    HB3  LYS  31           HB3      LYS  31  -9.629  -9.613  -5.614
  251    HG2  LYS  31           HG2      LYS  31 -11.922 -10.672  -6.086
  252    HG3  LYS  31           HG3      LYS  31 -10.998 -12.010  -6.771
  253    HD2  LYS  31           HD2      LYS  31 -10.697 -10.928  -3.971
  254    HD3  LYS  31           HD3      LYS  31 -11.593 -12.382  -4.409
  255    HE2  LYS  31           HE2      LYS  31  -8.671 -11.999  -5.015
  256    HE3  LYS  31           HE3      LYS  31  -9.256 -12.740  -3.526
  257    HZ1  LYS  31           HZ1      LYS  31 -10.429 -14.390  -4.938
  258    HZ2  LYS  31           HZ2      LYS  31  -8.744 -14.458  -5.068
  259    HZ3  LYS  31           HZ3      LYS  31  -9.658 -13.730  -6.300
  260    H    MET  32           H        MET  32 -10.321  -7.461  -5.923
  261    HA   MET  32           HA       MET  32 -13.156  -7.317  -5.615
  262    HB2  MET  32           HB2      MET  32 -10.969  -5.487  -4.619
  263    HB3  MET  32           HB3      MET  32 -12.653  -5.412  -4.113
  264    HG2  MET  32           HG2      MET  32 -10.821  -7.769  -3.726
  265    HG3  MET  32           HG3      MET  32 -11.238  -6.582  -2.492
  266    HE1  MET  32           HE1      MET  32 -11.568  -9.695  -2.073
  267    HE2  MET  32           HE2      MET  32 -12.051  -8.527  -0.843
  268    HE3  MET  32           HE3      MET  32 -13.168  -9.801  -1.337
  269    H    GLY  33           H        GLY  33 -10.799  -5.586  -7.513
  270    HA2  GLY  33           HA1      GLY  33 -11.362  -4.427  -9.492
  271    HA3  GLY  33           HA2      GLY  33 -13.003  -4.242  -8.893
  272    H    ASN  34           H        ASN  34  -9.742  -3.346  -7.794
  273    HA   ASN  34           HA       ASN  34 -10.712  -0.585  -7.465
  274    HB2  ASN  34           HB2      ASN  34  -8.957  -2.132  -5.544
  275    HB3  ASN  34           HB3      ASN  34  -9.245  -0.397  -5.449
  276   HD21  ASN  34          1HD2      ASN  34 -10.554  -3.548  -4.934
  277   HD22  ASN  34          2HD2      ASN  34 -11.994  -3.048  -4.119
  278    H    LEU  35           H        LEU  35  -8.769   0.948  -7.186
  279    HA   LEU  35           HA       LEU  35  -6.641   0.093  -9.032
  280    HB2  LEU  35           HB2      LEU  35  -7.849   2.833  -8.642
  281    HB3  LEU  35           HB3      LEU  35  -6.396   2.525  -9.581
  282    HG   LEU  35           HG       LEU  35  -9.149   1.444 -10.196
  283   HD11  LEU  35          2HD1      LEU  35  -7.472   3.508 -11.614
  284   HD12  LEU  35          1HD1      LEU  35  -8.915   3.830 -10.652
  285   HD13  LEU  35          3HD1      LEU  35  -9.041   2.898 -12.142
  286   HD21  LEU  35          3HD2      LEU  35  -8.109   0.630 -12.271
  287   HD22  LEU  35          2HD2      LEU  35  -7.440  -0.145 -10.836
  288   HD23  LEU  35          1HD2      LEU  35  -6.530   1.123 -11.657
  289    H    ILE  36           H        ILE  36  -4.863  -0.301  -7.926
  290    HA   ILE  36           HA       ILE  36  -4.241   1.443  -5.645
  291    HB   ILE  36           HB       ILE  36  -4.880  -0.871  -4.971
  292   HG12  ILE  36          2HG1      ILE  36  -1.986  -0.174  -4.437
  293   HG13  ILE  36          3HG1      ILE  36  -3.366   0.538  -3.606
  294   HG21  ILE  36          2HG2      ILE  36  -2.380  -1.649  -6.463
  295   HG22  ILE  36          1HG2      ILE  36  -4.034  -2.100  -6.880
  296   HG23  ILE  36          3HG2      ILE  36  -3.302  -2.707  -5.393
  297   HD11  ILE  36          3HD1      ILE  36  -2.552  -2.357  -3.543
  298   HD12  ILE  36          2HD1      ILE  36  -3.965  -1.675  -2.740
  299   HD13  ILE  36          1HD1      ILE  36  -2.345  -1.176  -2.248
  300    H    LYS  37           H        LYS  37  -2.214   2.210  -5.460
  301    HA   LYS  37           HA       LYS  37  -0.293   1.489  -7.577
  302    HB2  LYS  37           HB2      LYS  37  -1.071   4.091  -6.394
  303    HB3  LYS  37           HB3      LYS  37   0.651   3.853  -6.652
  304    HG2  LYS  37           HG2      LYS  37  -1.458   3.546  -8.778
  305    HG3  LYS  37           HG3      LYS  37  -0.464   4.984  -8.531
  306    HD2  LYS  37           HD2      LYS  37   1.555   3.558  -8.848
  307    HD3  LYS  37           HD3      LYS  37   0.487   2.218  -9.268
  308    HE2  LYS  37           HE2      LYS  37   1.331   3.286 -11.274
  309    HE3  LYS  37           HE3      LYS  37  -0.408   3.538 -11.134
  310    HZ1  LYS  37           HZ1      LYS  37  -0.017   5.763 -10.331
  311    HZ2  LYS  37           HZ2      LYS  37   0.800   5.547 -11.802
  312    HZ3  LYS  37           HZ3      LYS  37   1.662   5.518 -10.345
  313    H    VAL  38           H        VAL  38   1.054   0.060  -6.714
  314    HA   VAL  38           HA       VAL  38   1.853   0.398  -3.913
  315    HB   VAL  38           HB       VAL  38   2.336  -2.031  -5.636
  316   HG11  VAL  38          2HG1      VAL  38   2.585  -3.157  -3.469
  317   HG12  VAL  38          1HG1      VAL  38   2.340  -1.616  -2.648
  318   HG13  VAL  38          3HG1      VAL  38   3.757  -1.853  -3.672
  319   HG21  VAL  38          3HG2      VAL  38  -0.071  -1.593  -5.501
  320   HG22  VAL  38          2HG2      VAL  38   0.042  -1.525  -3.742
  321   HG23  VAL  38          1HG2      VAL  38   0.375  -3.035  -4.589
  322    H    GLU  39           H        GLU  39   3.731   1.242  -3.490
  323    HA   GLU  39           HA       GLU  39   5.828   1.339  -5.526
  324    HB2  GLU  39           HB2      GLU  39   5.242   3.421  -4.354
  325    HB3  GLU  39           HB3      GLU  39   5.586   2.664  -2.807
  326    HG2  GLU  39           HG2      GLU  39   7.931   2.459  -3.412
  327    HG3  GLU  39           HG3      GLU  39   7.595   3.175  -4.987
  328    H    THR  40           H        THR  40   7.818   0.361  -5.262
  329    HA   THR  40           HA       THR  40   7.998  -1.518  -3.004
  330    HB   THR  40           HB       THR  40   9.710  -2.669  -4.615
  331    HG1  THR  40           HG1      THR  40   9.156  -0.729  -6.143
  332   HG21  THR  40          3HG2      THR  40   7.898  -4.013  -5.595
  333   HG22  THR  40          1HG2      THR  40   6.730  -2.791  -5.088
  334   HG23  THR  40          2HG2      THR  40   7.633  -3.705  -3.879
  335    H    GLN  41           H        GLN  41   9.258  -0.704  -1.497
  336    HA   GLN  41           HA       GLN  41  11.690   0.740  -2.331
  337    HB2  GLN  41           HB2      GLN  41   9.911   2.135  -1.298
  338    HB3  GLN  41           HB3      GLN  41  10.012   1.147   0.150
  339    HG2  GLN  41           HG2      GLN  41  12.139   1.960   0.689
  340    HG3  GLN  41           HG3      GLN  41  12.379   2.635  -0.923
  341   HE21  GLN  41          1HE2      GLN  41   9.627   3.674  -1.014
  342   HE22  GLN  41          2HE2      GLN  41   9.630   5.076  -0.016
  343    H    GLY  42           H        GLY  42  13.272  -0.755  -2.129
  344    HA2  GLY  42           HA1      GLY  42  13.184  -2.676   0.056
  345    HA3  GLY  42           HA2      GLY  42  14.347  -2.646  -1.261
  346    H    ALA  43           H        ALA  43  15.969  -0.932  -1.214
  347    HA   ALA  43           HA       ALA  43  16.505   0.195   1.428
  348    HB1  ALA  43           HB1      ALA  43  18.538  -1.478  -0.051
  349    HB2  ALA  43           HB2      ALA  43  18.789  -0.628   1.474
  350    HB3  ALA  43           HB3      ALA  43  17.661  -1.981   1.395
  351    H    THR  44           H        THR  44  16.188   2.202   0.658
  352    HA   THR  44           HA       THR  44  16.515   4.176  -0.336
  353    HB   THR  44           HB       THR  44  18.832   4.795  -1.073
  354    HG1  THR  44           HG1      THR  44  19.187   2.133  -1.004
  355   HG21  THR  44          3HG2      THR  44  18.050   5.227   1.184
  356   HG22  THR  44          1HG2      THR  44  19.749   4.753   1.207
  357   HG23  THR  44          2HG2      THR  44  18.505   3.594   1.676
  358    H    GLY  45           H        GLY  45  16.580   1.423  -2.196
  359    HA2  GLY  45           HA1      GLY  45  16.728   2.918  -4.716
  360    HA3  GLY  45           HA2      GLY  45  16.722   1.164  -4.556
  361    H    ILE  46           H        ILE  46  14.905   3.753  -5.458
  362    HA   ILE  46           HA       ILE  46  12.371   2.719  -4.415
  363    HB   ILE  46           HB       ILE  46  12.790   5.270  -5.974
  364   HG12  ILE  46          2HG1      ILE  46  14.218   5.301  -3.968
  365   HG13  ILE  46          3HG1      ILE  46  12.895   6.455  -3.833
  366   HG21  ILE  46          2HG2      ILE  46  10.495   4.464  -5.855
  367   HG22  ILE  46          1HG2      ILE  46  10.691   5.948  -4.919
  368   HG23  ILE  46          3HG2      ILE  46  10.603   4.389  -4.096
  369   HD11  ILE  46          3HD1      ILE  46  11.692   4.901  -2.393
  370   HD12  ILE  46          2HD1      ILE  46  13.282   5.291  -1.740
  371   HD13  ILE  46          1HD1      ILE  46  13.013   3.743  -2.541
  372    H    GLU  47           H        GLU  47  11.344   1.277  -5.680
  373    HA   GLU  47           HA       GLU  47  11.368   1.766  -8.585
  374    HB2  GLU  47           HB2      GLU  47  10.928  -0.765  -7.016
  375    HB3  GLU  47           HB3      GLU  47  10.427  -0.612  -8.694
  376    HG2  GLU  47           HG2      GLU  47  12.842   0.065  -9.162
  377    HG3  GLU  47           HG3      GLU  47  13.192  -0.571  -7.554
  378    H    ASN  48           H        ASN  48   9.531   2.160  -9.621
  379    HA   ASN  48           HA       ASN  48   7.449   3.005  -9.916
  380    HB2  ASN  48           HB2      ASN  48   6.691   0.724  -9.224
  381    HB3  ASN  48           HB3      ASN  48   6.630   1.285  -7.559
  382   HD21  ASN  48          1HD2      ASN  48   5.006   2.721  -6.933
  383   HD22  ASN  48          2HD2      ASN  48   3.599   2.991  -7.899
  384    H    GLU  49           H        GLU  49   8.623   4.929  -9.136
  385    HA   GLU  49           HA       GLU  49   8.395   5.870  -6.496
  386    HB2  GLU  49           HB2      GLU  49   8.602   7.486  -9.044
  387    HB3  GLU  49           HB3      GLU  49   8.926   8.076  -7.422
  388    HG2  GLU  49           HG2      GLU  49  10.813   6.552  -7.229
  389    HG3  GLU  49           HG3      GLU  49  10.477   5.925  -8.844
  390    H    LEU  50           H        LEU  50   6.538   6.160  -5.475
  391    HA   LEU  50           HA       LEU  50   4.114   6.649  -6.905
  392    HB2  LEU  50           HB2      LEU  50   4.461   5.250  -4.799
  393    HB3  LEU  50           HB3      LEU  50   4.531   6.773  -3.930
  394    HG   LEU  50           HG       LEU  50   2.294   7.302  -4.524
  395   HD11  LEU  50          2HD1      LEU  50   2.308   6.442  -6.809
  396   HD12  LEU  50          1HD1      LEU  50   0.918   5.837  -5.909
  397   HD13  LEU  50          3HD1      LEU  50   2.309   4.791  -6.191
  398   HD21  LEU  50          3HD2      LEU  50   1.089   5.356  -3.551
  399   HD22  LEU  50          2HD2      LEU  50   2.489   5.871  -2.612
  400   HD23  LEU  50          1HD2      LEU  50   2.591   4.441  -3.638
  401    H    THR  51           H        THR  51   3.897   8.599  -7.792
  402    HA   THR  51           HA       THR  51   5.224  10.873  -6.621
  403    HB   THR  51           HB       THR  51   5.332  10.486  -9.056
  404    HG1  THR  51           HG1      THR  51   5.674  12.581  -8.776
  405   HG21  THR  51          3HG2      THR  51   2.383  11.130  -9.006
  406   HG22  THR  51          1HG2      THR  51   3.105   9.577  -9.424
  407   HG23  THR  51          2HG2      THR  51   3.374  10.979 -10.458
  408    H    GLU  52           H        GLU  52   4.024  13.004  -6.746
  409    HA   GLU  52           HA       GLU  52   2.242  13.042  -4.628
  410    HB2  GLU  52           HB2      GLU  52   2.709  15.125  -6.755
  411    HB3  GLU  52           HB3      GLU  52   1.905  15.414  -5.218
  412    HG2  GLU  52           HG2      GLU  52   3.915  14.941  -4.006
  413    HG3  GLU  52           HG3      GLU  52   4.736  14.428  -5.481
  414    H    LYS  53           H        LYS  53   1.570  13.111  -8.100
  415    HA   LYS  53           HA       LYS  53  -1.127  13.792  -7.995
  416    HB2  LYS  53           HB2      LYS  53   0.400  12.080  -9.949
  417    HB3  LYS  53           HB3      LYS  53  -1.291  12.511 -10.179
  418    HG2  LYS  53           HG2      LYS  53   0.984  14.471  -9.916
  419    HG3  LYS  53           HG3      LYS  53   0.224  13.972 -11.429
  420    HD2  LYS  53           HD2      LYS  53  -1.894  14.897 -10.712
  421    HD3  LYS  53           HD3      LYS  53  -1.217  15.306  -9.137
  422    HE2  LYS  53           HE2      LYS  53   0.322  16.868 -10.191
  423    HE3  LYS  53           HE3      LYS  53  -0.302  16.430 -11.780
  424    HZ1  LYS  53           HZ1      LYS  53  -2.409  17.364 -11.246
  425    HZ2  LYS  53           HZ2      LYS  53  -1.232  18.523 -10.848
  426    HZ3  LYS  53           HZ3      LYS  53  -1.971  17.607  -9.624
  427    H    ASP  54           H        ASP  54   0.353  10.551  -7.947
  428    HA   ASP  54           HA       ASP  54  -2.094   9.155  -7.692
  429    HB2  ASP  54           HB2      ASP  54   0.704   8.326  -6.900
  430    HB3  ASP  54           HB3      ASP  54  -0.686   7.246  -6.925
  431    H    VAL  55           H        VAL  55   0.202  10.403  -5.366
  432    HA   VAL  55           HA       VAL  55  -0.887   9.124  -3.098
  433    HB   VAL  55           HB       VAL  55   0.796  11.631  -3.252
  434   HG11  VAL  55          2HG1      VAL  55   1.451  11.019  -0.936
  435   HG12  VAL  55          1HG1      VAL  55   0.184   9.791  -0.949
  436   HG13  VAL  55          3HG1      VAL  55  -0.242  11.496  -1.092
  437   HG21  VAL  55          3HG2      VAL  55   2.669  10.129  -2.804
  438   HG22  VAL  55          2HG2      VAL  55   1.853   9.709  -4.311
  439   HG23  VAL  55          1HG2      VAL  55   1.573   8.747  -2.858
  440    H    ASN  56           H        ASN  56  -1.488  12.306  -4.543
  441    HA   ASN  56           HA       ASN  56  -3.170  13.190  -2.405
  442    HB2  ASN  56           HB2      ASN  56  -2.627  14.217  -5.175
  443    HB3  ASN  56           HB3      ASN  56  -3.932  14.895  -4.209
  444   HD21  ASN  56          1HD2      ASN  56  -0.490  14.525  -4.522
  445   HD22  ASN  56          2HD2      ASN  56  -0.052  15.763  -3.388
  446    H    ILE  57           H        ILE  57  -3.703  11.513  -5.444
  447    HA   ILE  57           HA       ILE  57  -6.547  11.785  -5.394
  448    HB   ILE  57           HB       ILE  57  -4.765   9.880  -6.916
  449   HG12  ILE  57          2HG1      ILE  57  -4.528  12.217  -7.574
  450   HG13  ILE  57          3HG1      ILE  57  -5.345  11.306  -8.840
  451   HG21  ILE  57          2HG2      ILE  57  -6.750   9.392  -8.304
  452   HG22  ILE  57          1HG2      ILE  57  -7.743  10.293  -7.156
  453   HG23  ILE  57          3HG2      ILE  57  -6.915   8.823  -6.643
  454   HD11  ILE  57          3HD1      ILE  57  -7.492  12.197  -8.078
  455   HD12  ILE  57          2HD1      ILE  57  -6.369  13.475  -8.541
  456   HD13  ILE  57          1HD1      ILE  57  -6.656  13.129  -6.837
  457    H    GLY  58           H        GLY  58  -4.318   9.119  -4.575
  458    HA2  GLY  58           HA1      GLY  58  -6.314   7.322  -3.678
  459    HA3  GLY  58           HA2      GLY  58  -4.613   7.274  -3.232
  460    H    GLU  59           H        GLU  59  -7.320   7.050  -1.750
  461    HA   GLU  59           HA       GLU  59  -6.984   9.276   0.126
  462    HB2  GLU  59           HB2      GLU  59  -9.183   8.406   1.078
  463    HB3  GLU  59           HB3      GLU  59  -9.230   9.133  -0.521
  464    HG2  GLU  59           HG2      GLU  59  -8.764   6.390  -0.899
  465    HG3  GLU  59           HG3      GLU  59 -10.045   6.531   0.306
  466    H    VAL  60           H        VAL  60  -7.113   5.726   0.122
  467    HA   VAL  60           HA       VAL  60  -6.116   5.795   2.880
  468    HB   VAL  60           HB       VAL  60  -6.617   3.327   2.906
  469   HG11  VAL  60          2HG1      VAL  60  -8.095   4.954   3.950
  470   HG12  VAL  60          1HG1      VAL  60  -9.028   3.646   3.223
  471   HG13  VAL  60          3HG1      VAL  60  -8.923   5.209   2.414
  472   HG21  VAL  60          3HG2      VAL  60  -6.658   2.980   0.471
  473   HG22  VAL  60          2HG2      VAL  60  -8.114   3.968   0.365
  474   HG23  VAL  60          1HG2      VAL  60  -8.151   2.437   1.242
  475    H    VAL  61           H        VAL  61  -4.188   5.026   3.428
  476    HA   VAL  61           HA       VAL  61  -2.437   4.146   1.227
  477    HB   VAL  61           HB       VAL  61  -1.513   5.281   3.862
  478   HG11  VAL  61          2HG1      VAL  61   0.142   4.018   2.633
  479   HG12  VAL  61          1HG1      VAL  61   0.551   5.734   2.620
  480   HG13  VAL  61          3HG1      VAL  61  -0.158   4.985   1.190
  481   HG21  VAL  61          3HG2      VAL  61  -2.896   6.978   2.837
  482   HG22  VAL  61          2HG2      VAL  61  -2.037   6.791   1.308
  483   HG23  VAL  61          1HG2      VAL  61  -1.197   7.434   2.718
  484    H    ILE  62           H        ILE  62  -1.419   2.219   1.390
  485    HA   ILE  62           HA       ILE  62  -1.698   0.782   3.953
  486    HB   ILE  62           HB       ILE  62  -1.503  -0.409   1.173
  487   HG12  ILE  62          2HG1      ILE  62  -3.813  -0.347   3.132
  488   HG13  ILE  62          3HG1      ILE  62  -3.695   0.619   1.665
  489   HG21  ILE  62          2HG2      ILE  62  -1.835  -1.760   3.852
  490   HG22  ILE  62          1HG2      ILE  62  -0.392  -1.801   2.839
  491   HG23  ILE  62          3HG2      ILE  62  -1.882  -2.562   2.282
  492   HD11  ILE  62          3HD1      ILE  62  -3.722  -1.426   0.324
  493   HD12  ILE  62          2HD1      ILE  62  -5.154  -1.292   1.347
  494   HD13  ILE  62          1HD1      ILE  62  -3.846  -2.384   1.799
  495    H    PHE  63           H        PHE  63   0.150   0.615   5.008
  496    HA   PHE  63           HA       PHE  63   2.650   0.554   3.471
  497    HB2  PHE  63           HB2      PHE  63   2.033   1.338   6.309
  498    HB3  PHE  63           HB3      PHE  63   3.673   0.934   5.812
  499    HD1  PHE  63           HD2      PHE  63   4.683   2.240   3.889
  500    HD2  PHE  63           HD1      PHE  63   1.185   3.484   5.967
  501    HE1  PHE  63           HE2      PHE  63   5.018   4.534   3.069
  502    HE2  PHE  63           HE1      PHE  63   1.513   5.781   5.148
  503    HZ   PHE  63           HZ       PHE  63   3.431   6.307   3.697
  504    H    ALA  64           H        ALA  64   2.695  -1.582   2.898
  505    HA   ALA  64           HA       ALA  64   2.838  -3.562   5.048
  506    HB1  ALA  64           HB1      ALA  64   1.558  -4.176   3.051
  507    HB2  ALA  64           HB2      ALA  64   2.984  -3.905   2.049
  508    HB3  ALA  64           HB3      ALA  64   2.974  -5.212   3.233
  509    H    VAL  65           H        VAL  65   4.770  -3.127   6.058
  510    HA   VAL  65           HA       VAL  65   7.147  -3.055   4.338
  511    HB   VAL  65           HB       VAL  65   8.076  -1.195   5.667
  512   HG11  VAL  65          2HG1      VAL  65   5.440  -0.624   4.314
  513   HG12  VAL  65          1HG1      VAL  65   7.026  -0.704   3.539
  514   HG13  VAL  65          3HG1      VAL  65   6.667   0.586   4.692
  515   HG21  VAL  65          3HG2      VAL  65   5.312  -1.040   6.872
  516   HG22  VAL  65          2HG2      VAL  65   6.607   0.136   7.106
  517   HG23  VAL  65          1HG2      VAL  65   6.789  -1.508   7.717
  518    H    ASP  66           H        ASP  66   9.093  -2.688   5.959
  519    HA   ASP  66           HA       ASP  66   8.982  -4.330   8.339
  520    HB2  ASP  66           HB2      ASP  66   9.307  -6.018   6.592
  521    HB3  ASP  66           HB3      ASP  66  10.640  -5.090   5.916
  522    H    THR  67           H        THR  67  10.717  -2.418   5.988
  523    HA   THR  67           HA       THR  67  12.557  -1.482   8.081
  524    HB   THR  67           HB       THR  67  13.644  -2.481   6.072
  525    HG1  THR  67           HG1      THR  67  14.743  -0.813   7.228
  526   HG21  THR  67          3HG2      THR  67  13.580  -1.283   3.940
  527   HG22  THR  67          1HG2      THR  67  12.402  -0.153   4.606
  528   HG23  THR  67          2HG2      THR  67  11.974  -1.850   4.397
  529    H    LYS  68           H        LYS  68  13.313   0.923   7.049
  530    HA   LYS  68           HA       LYS  68  11.034   2.539   7.710
  531    HB2  LYS  68           HB2      LYS  68  12.614   4.430   7.488
  532    HB3  LYS  68           HB3      LYS  68  13.207   3.171   8.562
  533    HG2  LYS  68           HG2      LYS  68  14.653   2.327   6.794
  534    HG3  LYS  68           HG3      LYS  68  14.044   3.567   5.698
  535    HD2  LYS  68           HD2      LYS  68  14.940   5.310   7.143
  536    HD3  LYS  68           HD3      LYS  68  15.497   4.091   8.290
  537    HE2  LYS  68           HE2      LYS  68  16.993   3.170   6.593
  538    HE3  LYS  68           HE3      LYS  68  16.420   4.369   5.434
  539    HZ1  LYS  68           HZ1      LYS  68  17.348   6.114   6.749
  540    HZ2  LYS  68           HZ2      LYS  68  18.556   4.945   6.512
  541    HZ3  LYS  68           HZ3      LYS  68  17.752   5.040   8.001
  542    H    VAL  69           H        VAL  69  10.137   4.193   6.439
  543    HA   VAL  69           HA       VAL  69  10.487   3.845   3.534
  544    HB   VAL  69           HB       VAL  69   8.026   4.849   4.981
  545   HG11  VAL  69          2HG1      VAL  69   8.250   5.811   2.768
  546   HG12  VAL  69          1HG1      VAL  69   6.933   4.637   2.789
  547   HG13  VAL  69          3HG1      VAL  69   8.486   4.208   2.071
  548   HG21  VAL  69          3HG2      VAL  69   8.547   2.177   3.685
  549   HG22  VAL  69          2HG2      VAL  69   6.990   2.727   4.308
  550   HG23  VAL  69          1HG2      VAL  69   8.345   2.487   5.410
  551    H    ARG  70           H        ARG  70  11.069   5.602   2.372
  552    HA   ARG  70           HA       ARG  70  11.661   8.044   3.811
  553    HB2  ARG  70           HB2      ARG  70  13.264   7.173   2.182
  554    HB3  ARG  70           HB3      ARG  70  12.060   7.300   0.906
  555    HG2  ARG  70           HG2      ARG  70  12.032   9.725   1.161
  556    HG3  ARG  70           HG3      ARG  70  13.222   9.603   2.458
  557    HD2  ARG  70           HD2      ARG  70  14.842   8.661   0.917
  558    HD3  ARG  70           HD3      ARG  70  13.650   8.685  -0.383
  559    HE   ARG  70           HE       ARG  70  13.804  11.285   0.490
  560   HH11  ARG  70          2HH1      ARG  70  16.074   8.925  -0.768
  561   HH12  ARG  70          1HH1      ARG  70  17.124  10.115  -1.473
  562   HH21  ARG  70          2HH2      ARG  70  15.181  12.860  -0.444
  563   HH22  ARG  70          1HH2      ARG  70  16.599  12.350  -1.313
  564    H    ASN  71           H        ASN  71   9.486   7.012   1.234
  565    HA   ASN  71           HA       ASN  71   8.588   9.658   0.644
  566    HB2  ASN  71           HB2      ASN  71   7.577   6.969  -0.268
  567    HB3  ASN  71           HB3      ASN  71   6.923   8.502  -0.839
  568   HD21  ASN  71          1HD2      ASN  71   8.299   6.381  -2.337
  569   HD22  ASN  71          2HD2      ASN  71   9.665   7.157  -3.070
  570    H    LYS  72           H        LYS  72   7.858   7.656   3.174
  571    HA   LYS  72           HA       LYS  72   5.115   7.833   3.519
  572    HB2  LYS  72           HB2      LYS  72   5.555   7.659   5.959
  573    HB3  LYS  72           HB3      LYS  72   6.394   6.455   4.996
  574    HG2  LYS  72           HG2      LYS  72   8.010   7.091   6.496
  575    HG3  LYS  72           HG3      LYS  72   8.384   8.107   5.107
  576    HD2  LYS  72           HD2      LYS  72   7.090   9.942   6.176
  577    HD3  LYS  72           HD3      LYS  72   6.892   8.918   7.601
  578    HE2  LYS  72           HE2      LYS  72   9.327   8.798   7.842
  579    HE3  LYS  72           HE3      LYS  72   9.514   9.828   6.424
  580    HZ1  LYS  72           HZ1      LYS  72   8.274  10.573   9.015
  581    HZ2  LYS  72           HZ2      LYS  72   8.248  11.557   7.637
  582    HZ3  LYS  72           HZ3      LYS  72   9.725  11.161   8.369
  583    H    GLU  73           H        GLU  73   7.504  10.262   3.726
  584    HA   GLU  73           HA       GLU  73   6.525  12.269   5.255
  585    HB2  GLU  73           HB2      GLU  73   7.437  13.806   3.383
  586    HB3  GLU  73           HB3      GLU  73   8.547  12.696   4.177
  587    HG2  GLU  73           HG2      GLU  73   8.373  11.150   2.319
  588    HG3  GLU  73           HG3      GLU  73   7.185  12.189   1.541
  589    H    ARG  74           H        ARG  74   5.344  11.463   1.973
  590    HA   ARG  74           HA       ARG  74   3.498  13.674   1.996
  591    HB2  ARG  74           HB2      ARG  74   2.792  12.809  -0.187
  592    HB3  ARG  74           HB3      ARG  74   4.539  12.976  -0.083
  593    HG2  ARG  74           HG2      ARG  74   4.351  10.432   0.645
  594    HG3  ARG  74           HG3      ARG  74   2.867  10.541  -0.306
  595    HD2  ARG  74           HD2      ARG  74   4.668   9.829  -1.736
  596    HD3  ARG  74           HD3      ARG  74   4.195  11.470  -2.164
  597    HE   ARG  74           HE       ARG  74   6.226  11.864  -0.434
  598   HH11  ARG  74          2HH1      ARG  74   5.922   9.896  -3.321
  599   HH12  ARG  74          1HH1      ARG  74   7.599  10.052  -3.755
  600   HH21  ARG  74          2HH2      ARG  74   8.424  12.107  -1.018
  601   HH22  ARG  74          1HH2      ARG  74   9.013  11.301  -2.442
  602    H    PHE  75           H        PHE  75   3.344  10.257   2.737
  603    HA   PHE  75           HA       PHE  75   0.474  10.159   2.668
  604    HB2  PHE  75           HB2      PHE  75   2.405   8.152   3.840
  605    HB3  PHE  75           HB3      PHE  75   0.724   7.877   3.405
  606    HD1  PHE  75           HD2      PHE  75   0.081   8.083   0.952
  607    HD2  PHE  75           HD1      PHE  75   4.100   7.808   2.291
  608    HE1  PHE  75           HE2      PHE  75   0.785   7.384  -1.299
  609    HE2  PHE  75           HE1      PHE  75   4.816   7.113   0.052
  610    HZ   PHE  75           HZ       PHE  75   3.155   6.898  -1.750
  611    H    ASP  76           H        ASP  76   2.949  10.859   4.981
  612    HA   ASP  76           HA       ASP  76   1.498  10.465   7.362
  613    HB2  ASP  76           HB2      ASP  76   3.922  10.888   7.346
  614    HB3  ASP  76           HB3      ASP  76   3.633  12.525   6.760
  615    H    GLY  77           H        GLY  77  -0.235  11.467   8.119
  616    HA2  GLY  77           HA1      GLY  77  -1.510  13.457   8.589
  617    HA3  GLY  77           HA2      GLY  77  -0.870  14.165   7.109
  618    H    LYS  78           H        LYS  78  -1.391  11.162   6.204
  619    HA   LYS  78           HA       LYS  78  -4.193  11.624   5.440
  620    HB2  LYS  78           HB2      LYS  78  -1.989  10.046   4.100
  621    HB3  LYS  78           HB3      LYS  78  -3.679   9.909   3.632
  622    HG2  LYS  78           HG2      LYS  78  -3.767  12.152   2.905
  623    HG3  LYS  78           HG3      LYS  78  -2.223  12.535   3.665
  624    HD2  LYS  78           HD2      LYS  78  -2.029  12.309   1.222
  625    HD3  LYS  78           HD3      LYS  78  -1.058  11.113   2.078
  626    HE2  LYS  78           HE2      LYS  78  -2.203  10.126   0.169
  627    HE3  LYS  78           HE3      LYS  78  -2.759   9.425   1.683
  628    HZ1  LYS  78           HZ1      LYS  78  -4.545   9.967   0.045
  629    HZ2  LYS  78           HZ2      LYS  78  -4.201  11.608   0.274
  630    HZ3  LYS  78           HZ3      LYS  78  -4.763  10.672   1.572
  631    H    VAL  79           H        VAL  79  -5.042   9.150   4.802
  632    HA   VAL  79           HA       VAL  79  -5.087   7.880   7.442
  633    HB   VAL  79           HB       VAL  79  -6.878   7.363   5.058
  634   HG11  VAL  79          2HG1      VAL  79  -6.740   5.455   6.568
  635   HG12  VAL  79          1HG1      VAL  79  -8.326   6.219   6.670
  636   HG13  VAL  79          3HG1      VAL  79  -7.131   6.495   7.938
  637   HG21  VAL  79          3HG2      VAL  79  -7.406   8.996   7.539
  638   HG22  VAL  79          2HG2      VAL  79  -8.568   8.651   6.258
  639   HG23  VAL  79          1HG2      VAL  79  -7.146   9.639   5.917
  640    H    VAL  80           H        VAL  80  -3.590   6.322   7.715
  641    HA   VAL  80           HA       VAL  80  -3.057   4.554   5.422
  642    HB   VAL  80           HB       VAL  80  -0.771   4.559   5.741
  643   HG11  VAL  80          2HG1      VAL  80  -0.021   6.882   5.921
  644   HG12  VAL  80          1HG1      VAL  80  -1.601   7.336   6.556
  645   HG13  VAL  80          3HG1      VAL  80  -1.458   6.726   4.908
  646   HG21  VAL  80          3HG2      VAL  80   0.365   5.406   7.782
  647   HG22  VAL  80          2HG2      VAL  80  -0.662   3.999   8.061
  648   HG23  VAL  80          1HG2      VAL  80  -1.221   5.607   8.529
  649    H    LEU  81           H        LEU  81  -2.582   2.414   5.843
  650    HA   LEU  81           HA       LEU  81  -2.973   1.475   8.611
  651    HB2  LEU  81           HB2      LEU  81  -4.699   0.644   7.110
  652    HB3  LEU  81           HB3      LEU  81  -3.479   0.055   5.995
  653    HG   LEU  81           HG       LEU  81  -2.684  -1.370   8.023
  654   HD11  LEU  81          2HD1      LEU  81  -5.534  -0.782   8.801
  655   HD12  LEU  81          1HD1      LEU  81  -4.087  -0.319   9.698
  656   HD13  LEU  81          3HD1      LEU  81  -4.506  -2.024   9.519
  657   HD21  LEU  81          3HD2      LEU  81  -4.283  -3.143   7.374
  658   HD22  LEU  81          2HD2      LEU  81  -3.527  -2.330   6.005
  659   HD23  LEU  81          1HD2      LEU  81  -5.186  -1.938   6.456
  660    H    GLU  82           H        GLU  82  -1.252   0.441   9.530
  661    HA   GLU  82           HA       GLU  82   1.022  -0.119   7.750
  662    HB2  GLU  82           HB2      GLU  82   1.361   1.665   9.477
  663    HB3  GLU  82           HB3      GLU  82   1.122   0.443  10.719
  664    HG2  GLU  82           HG2      GLU  82   3.069  -0.772   9.927
  665    HG3  GLU  82           HG3      GLU  82   3.293   0.404   8.634
  666    H    VAL  83           H        VAL  83   1.090  -2.201   7.284
  667    HA   VAL  83           HA       VAL  83   0.862  -4.144   9.493
  668    HB   VAL  83           HB       VAL  83   0.020  -5.796   7.819
  669   HG11  VAL  83          2HG1      VAL  83  -1.690  -3.339   8.188
  670   HG12  VAL  83          1HG1      VAL  83  -1.533  -4.682   9.320
  671   HG13  VAL  83          3HG1      VAL  83  -2.277  -4.941   7.743
  672   HG21  VAL  83          3HG2      VAL  83  -0.927  -4.953   5.707
  673   HG22  VAL  83          2HG2      VAL  83   0.824  -4.755   5.783
  674   HG23  VAL  83          1HG2      VAL  83  -0.231  -3.367   6.046
  675    HA   PRO  84           HA       PRO  84   4.801  -5.829   8.217
  676    HB2  PRO  84           HB2      PRO  84   3.606  -8.536   8.173
  677    HB3  PRO  84           HB3      PRO  84   4.950  -7.915   9.137
  678    HG2  PRO  84           HG2      PRO  84   2.565  -8.425  10.239
  679    HG3  PRO  84           HG3      PRO  84   3.558  -7.053  10.768
  680    HD2  PRO  84           HD2      PRO  84   1.158  -7.084   8.981
  681    HD3  PRO  84           HD3      PRO  84   1.608  -5.920  10.244
  682    H    VAL  85           H        VAL  85   5.841  -6.389   6.341
  683    HA   VAL  85           HA       VAL  85   4.468  -6.049   3.934
  684    HB   VAL  85           HB       VAL  85   6.856  -5.559   4.229
  685   HG11  VAL  85          2HG1      VAL  85   7.532  -7.465   5.551
  686   HG12  VAL  85          1HG1      VAL  85   8.518  -7.362   4.093
  687   HG13  VAL  85          3HG1      VAL  85   7.218  -8.550   4.199
  688   HG21  VAL  85          3HG2      VAL  85   6.024  -5.731   1.984
  689   HG22  VAL  85          2HG2      VAL  85   6.226  -7.483   1.997
  690   HG23  VAL  85          1HG2      VAL  85   7.641  -6.430   2.052
  691    H    SER  86           H        SER  86   5.309  -8.997   5.639
  692    HA   SER  86           HA       SER  86   4.778 -10.748   3.451
  693    HB2  SER  86           HB2      SER  86   4.977 -11.334   6.415
  694    HB3  SER  86           HB3      SER  86   4.999 -12.538   5.125
  695    HG   SER  86           HG       SER  86   7.080 -11.408   6.112
  696    H    ALA  87           H        ALA  87   2.755  -9.105   5.654
  697    HA   ALA  87           HA       ALA  87   0.745 -11.044   6.051
  698    HB1  ALA  87           HB1      ALA  87   0.461  -8.050   6.215
  699    HB2  ALA  87           HB2      ALA  87  -0.612  -9.254   6.929
  700    HB3  ALA  87           HB3      ALA  87   1.046  -9.095   7.509
  701    HA   PRO  88           HA       PRO  88  -1.864  -8.819   2.638
  702    HB2  PRO  88           HB2      PRO  88  -0.583  -7.306   0.787
  703    HB3  PRO  88           HB3      PRO  88  -1.204  -6.646   2.305
  704    HG2  PRO  88           HG2      PRO  88   1.583  -7.495   1.613
  705    HG3  PRO  88           HG3      PRO  88   1.037  -6.030   2.451
  706    HD2  PRO  88           HD2      PRO  88   2.016  -8.153   3.785
  707    HD3  PRO  88           HD3      PRO  88   0.717  -7.143   4.452
  708    H    ILE  89           H        ILE  89   1.032 -10.494   2.220
  709    HA   ILE  89           HA       ILE  89   0.771 -11.257  -0.497
  710    HB   ILE  89           HB       ILE  89   2.070 -12.706   1.820
  711   HG12  ILE  89          2HG1      ILE  89   3.236 -11.004  -0.394
  712   HG13  ILE  89          3HG1      ILE  89   3.075 -10.528   1.291
  713   HG21  ILE  89          2HG2      ILE  89   2.295 -13.257  -1.136
  714   HG22  ILE  89          1HG2      ILE  89   1.484 -14.278   0.052
  715   HG23  ILE  89          3HG2      ILE  89   3.230 -14.044   0.137
  716   HD11  ILE  89          3HD1      ILE  89   4.628 -12.319   1.923
  717   HD12  ILE  89          2HD1      ILE  89   5.352 -11.171   0.795
  718   HD13  ILE  89          1HD1      ILE  89   4.806 -12.747   0.222
  719    H    LYS  90           H        LYS  90  -0.343 -12.672   2.549
  720    HA   LYS  90           HA       LYS  90  -1.953 -14.616   1.080
  721    HB2  LYS  90           HB2      LYS  90  -0.627 -15.456   2.950
  722    HB3  LYS  90           HB3      LYS  90  -1.409 -14.319   4.038
  723    HG2  LYS  90           HG2      LYS  90  -3.546 -15.440   3.688
  724    HG3  LYS  90           HG3      LYS  90  -2.772 -16.568   2.573
  725    HD2  LYS  90           HD2      LYS  90  -1.326 -17.362   4.373
  726    HD3  LYS  90           HD3      LYS  90  -2.086 -16.229   5.492
  727    HE2  LYS  90           HE2      LYS  90  -4.225 -17.349   5.203
  728    HE3  LYS  90           HE3      LYS  90  -3.508 -18.448   4.025
  729    HZ1  LYS  90           HZ1      LYS  90  -3.663 -19.501   6.175
  730    HZ2  LYS  90           HZ2      LYS  90  -2.777 -18.248   6.898
  731    HZ3  LYS  90           HZ3      LYS  90  -2.032 -19.269   5.769
  732    H    ASP  91           H        ASP  91  -2.358 -12.154   3.623
  733    HA   ASP  91           HA       ASP  91  -5.254 -12.411   3.433
  734    HB2  ASP  91           HB2      ASP  91  -3.453 -10.898   5.329
  735    HB3  ASP  91           HB3      ASP  91  -5.208 -10.790   5.377
  736    H    ALA  92           H        ALA  92  -4.093 -11.310   1.141
  737    HA   ALA  92           HA       ALA  92  -3.773  -8.560   1.034
  738    HB1  ALA  92           HB1      ALA  92  -4.279  -8.730  -1.352
  739    HB2  ALA  92           HB2      ALA  92  -3.221 -10.039  -0.823
  740    HB3  ALA  92           HB3      ALA  92  -4.935 -10.346  -1.099
  741    H    GLU  93           H        GLU  93  -6.758 -10.417   0.510
  742    HA   GLU  93           HA       GLU  93  -8.417  -8.250  -0.100
  743    HB2  GLU  93           HB2      GLU  93  -9.419 -10.680   1.361
  744    HB3  GLU  93           HB3      GLU  93 -10.225  -9.733   0.121
  745    HG2  GLU  93           HG2      GLU  93  -7.978 -11.693  -0.228
  746    HG3  GLU  93           HG3      GLU  93  -9.625 -11.811  -0.840
  747    H    LYS  94           H        LYS  94  -7.517  -9.685   2.987
  748    HA   LYS  94           HA       LYS  94  -9.496  -8.282   4.496
  749    HB2  LYS  94           HB2      LYS  94  -8.392 -10.469   5.148
  750    HB3  LYS  94           HB3      LYS  94  -6.960  -9.532   5.555
  751    HG2  LYS  94           HG2      LYS  94  -8.267  -8.262   7.196
  752    HG3  LYS  94           HG3      LYS  94  -9.684  -9.239   6.804
  753    HD2  LYS  94           HD2      LYS  94  -8.450 -11.257   7.500
  754    HD3  LYS  94           HD3      LYS  94  -7.079 -10.242   7.950
  755    HE2  LYS  94           HE2      LYS  94  -9.840 -10.199   9.164
  756    HE3  LYS  94           HE3      LYS  94  -8.361 -10.787   9.921
  757    HZ1  LYS  94           HZ1      LYS  94  -7.493  -8.447   9.600
  758    HZ2  LYS  94           HZ2      LYS  94  -8.696  -8.652  10.777
  759    HZ3  LYS  94           HZ3      LYS  94  -9.098  -7.995   9.265
  760    H    VAL  95           H        VAL  95  -6.109  -7.774   3.696
  761    HA   VAL  95           HA       VAL  95  -5.658  -5.531   5.354
  762    HB   VAL  95           HB       VAL  95  -4.369  -6.204   2.699
  763   HG11  VAL  95          2HG1      VAL  95  -2.512  -4.807   3.458
  764   HG12  VAL  95          1HG1      VAL  95  -3.422  -4.383   4.908
  765   HG13  VAL  95          3HG1      VAL  95  -4.004  -3.876   3.322
  766   HG21  VAL  95          3HG2      VAL  95  -4.134  -8.005   4.321
  767   HG22  VAL  95          2HG2      VAL  95  -3.506  -6.865   5.513
  768   HG23  VAL  95          1HG2      VAL  95  -2.586  -7.203   4.045
  769    H    ILE  96           H        ILE  96  -6.837  -5.861   2.031
  770    HA   ILE  96           HA       ILE  96  -7.074  -3.125   1.433
  771    HB   ILE  96           HB       ILE  96  -8.693  -5.469   0.409
  772   HG12  ILE  96          2HG1      ILE  96  -6.343  -3.997  -0.809
  773   HG13  ILE  96          3HG1      ILE  96  -6.254  -5.567  -0.019
  774   HG21  ILE  96          2HG2      ILE  96  -9.943  -3.444   0.022
  775   HG22  ILE  96          1HG2      ILE  96  -9.244  -3.986  -1.503
  776   HG23  ILE  96          3HG2      ILE  96  -8.516  -2.639  -0.628
  777   HD11  ILE  96          3HD1      ILE  96  -7.806  -4.928  -2.514
  778   HD12  ILE  96          2HD1      ILE  96  -7.742  -6.498  -1.716
  779   HD13  ILE  96          1HD1      ILE  96  -6.281  -5.811  -2.425
  780    H    ASN  97           H        ASN  97  -9.414  -5.418   2.799
  781    HA   ASN  97           HA       ASN  97 -11.518  -3.538   3.074
  782    HB2  ASN  97           HB2      ASN  97 -10.982  -6.252   4.229
  783    HB3  ASN  97           HB3      ASN  97 -12.314  -5.284   4.854
  784   HD21  ASN  97          1HD2      ASN  97 -11.080  -7.061   2.138
  785   HD22  ASN  97          2HD2      ASN  97 -12.555  -7.085   1.234
  786    H    ALA  98           H        ALA  98  -8.810  -4.419   5.104
  787    HA   ALA  98           HA       ALA  98  -9.695  -3.156   7.479
  788    HB1  ALA  98           HB1      ALA  98  -7.889  -4.805   7.470
  789    HB2  ALA  98           HB2      ALA  98  -6.870  -3.689   6.560
  790    HB3  ALA  98           HB3      ALA  98  -7.370  -3.287   8.203
  791    H    ALA  99           H        ALA  99  -7.859  -2.011   4.684
  792    HA   ALA  99           HA       ALA  99  -7.268   0.559   5.677
  793    HB1  ALA  99           HB1      ALA  99  -6.185  -0.373   3.688
  794    HB2  ALA  99           HB2      ALA  99  -7.714  -0.297   2.813
  795    HB3  ALA  99           HB3      ALA  99  -6.923   1.190   3.340
  796    H    LEU 100           H        LEU 100 -10.034  -0.752   3.924
  797    HA   LEU 100           HA       LEU 100 -11.449   1.706   3.700
  798    HB2  LEU 100           HB2      LEU 100 -12.517  -1.122   3.680
  799    HB3  LEU 100           HB3      LEU 100 -13.375   0.301   3.123
  800    HG   LEU 100           HG       LEU 100 -10.863  -0.818   1.878
  801   HD11  LEU 100          2HD1      LEU 100 -12.798  -2.259   1.533
  802   HD12  LEU 100          1HD1      LEU 100 -12.315  -1.464   0.034
  803   HD13  LEU 100          3HD1      LEU 100 -13.722  -0.883   0.926
  804   HD21  LEU 100          3HD2      LEU 100 -11.335   0.790   0.078
  805   HD22  LEU 100          2HD2      LEU 100 -10.997   1.589   1.614
  806   HD23  LEU 100          1HD2      LEU 100 -12.658   1.455   1.036
  807    H    ALA 101           H        ALA 101 -11.192  -0.754   6.148
  808    HA   ALA 101           HA       ALA 101 -13.430  -0.020   7.714
  809    HB1  ALA 101           HB1      ALA 101 -12.310  -2.175   7.966
  810    HB2  ALA 101           HB2      ALA 101 -10.867  -1.361   8.572
  811    HB3  ALA 101           HB3      ALA 101 -12.367  -1.306   9.500
  812    H    LEU 102           H        LEU 102 -10.425   1.506   7.195
  813    HA   LEU 102           HA       LEU 102 -10.379   2.876   9.737
  814    HB2  LEU 102           HB2      LEU 102  -8.730   3.307   7.250
  815    HB3  LEU 102           HB3      LEU 102  -8.446   4.072   8.803
  816    HG   LEU 102           HG       LEU 102  -8.213   1.130   8.181
  817   HD11  LEU 102          2HD1      LEU 102  -6.156   3.199   8.940
  818   HD12  LEU 102          1HD1      LEU 102  -6.359   2.465   7.349
  819   HD13  LEU 102          3HD1      LEU 102  -5.852   1.476   8.720
  820   HD21  LEU 102          3HD2      LEU 102  -7.459   0.880  10.494
  821   HD22  LEU 102          2HD2      LEU 102  -9.124   1.459  10.415
  822   HD23  LEU 102          1HD2      LEU 102  -7.817   2.581  10.794
  823    H    ILE 103           H        ILE 103 -11.611   3.451   6.541
  824    HA   ILE 103           HA       ILE 103 -12.203   6.233   7.277
  825    HB   ILE 103           HB       ILE 103 -12.793   6.538   4.853
  826   HG12  ILE 103          2HG1      ILE 103 -11.421   3.854   4.564
  827   HG13  ILE 103          3HG1      ILE 103 -13.135   4.149   4.307
  828   HG21  ILE 103          2HG2      ILE 103 -10.460   6.723   4.140
  829   HG22  ILE 103          1HG2      ILE 103  -9.965   5.710   5.497
  830   HG23  ILE 103          3HG2      ILE 103 -10.681   7.294   5.794
  831   HD11  ILE 103          3HD1      ILE 103 -10.899   5.365   2.710
  832   HD12  ILE 103          2HD1      ILE 103 -12.626   5.597   2.439
  833   HD13  ILE 103          1HD1      ILE 103 -11.907   4.003   2.215
  834    H    ASP 104           H        ASP 104 -13.736   3.348   5.870
  835    HA   ASP 104           HA       ASP 104 -16.367   4.546   6.056
  836    HB2  ASP 104           HB2      ASP 104 -15.385   1.841   5.137
  837    HB3  ASP 104           HB3      ASP 104 -17.094   2.228   5.266
  838    H    GLU 105           H        GLU 105 -14.352   2.314   7.786
  839    HA   GLU 105           HA       GLU 105 -14.622   1.015   9.629
  840    HB2  GLU 105           HB2      GLU 105 -16.683   3.129  10.293
  841    HB3  GLU 105           HB3      GLU 105 -16.118   1.905  11.423
  842    HG2  GLU 105           HG2      GLU 105 -13.799   2.805  11.070
  843    HG3  GLU 105           HG3      GLU 105 -14.539   4.139  10.186
  844    H    LYS 106           H        LYS 106 -16.096   0.355   7.267
  845    HA   LYS 106           HA       LYS 106 -18.582  -0.797   8.296
  846    HB2  LYS 106           HB2      LYS 106 -17.556  -0.349   5.491
  847    HB3  LYS 106           HB3      LYS 106 -19.004  -1.284   5.841
  848    HG2  LYS 106           HG2      LYS 106 -20.145   0.589   6.675
  849    HG3  LYS 106           HG3      LYS 106 -18.665   1.538   6.796
  850    HD2  LYS 106           HD2      LYS 106 -20.045   2.243   4.900
  851    HD3  LYS 106           HD3      LYS 106 -18.489   1.604   4.369
  852    HE2  LYS 106           HE2      LYS 106 -19.519  -0.500   3.768
  853    HE3  LYS 106           HE3      LYS 106 -21.071   0.044   4.406
  854    HZ1  LYS 106           HZ1      LYS 106 -20.862   0.228   1.952
  855    HZ2  LYS 106           HZ2      LYS 106 -19.638   1.379   2.173
  856    HZ3  LYS 106           HZ3      LYS 106 -21.215   1.701   2.719
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1 -16.495   1.778  -4.777
    2    H2   MET   1           H2       MET   1 -17.448   0.392  -4.966
    3    H3   MET   1           H3       MET   1 -17.371   1.541  -6.207
    4    HA   MET   1           HA       MET   1 -15.152  -0.174  -5.264
    5    HB2  MET   1           HB2      MET   1 -16.762  -0.131  -7.821
    6    HB3  MET   1           HB3      MET   1 -15.264  -1.030  -7.630
    7    HG2  MET   1           HG2      MET   1 -16.285  -2.342  -5.839
    8    HG3  MET   1           HG3      MET   1 -17.791  -1.446  -6.052
    9    HE1  MET   1           HE1      MET   1 -17.540  -4.649  -6.136
   10    HE2  MET   1           HE2      MET   1 -19.064  -3.782  -6.311
   11    HE3  MET   1           HE3      MET   1 -18.612  -5.013  -7.490
   12    H    LYS   2           H        LYS   2 -13.565  -0.132  -7.372
   13    HA   LYS   2           HA       LYS   2 -11.905   1.011  -8.389
   14    HB2  LYS   2           HB2      LYS   2 -14.100   3.056  -8.705
   15    HB3  LYS   2           HB3      LYS   2 -12.500   3.245  -9.413
   16    HG2  LYS   2           HG2      LYS   2 -12.835   1.104 -10.617
   17    HG3  LYS   2           HG3      LYS   2 -14.485   1.058  -9.995
   18    HD2  LYS   2           HD2      LYS   2 -13.358   3.314 -11.644
   19    HD3  LYS   2           HD3      LYS   2 -14.269   1.962 -12.315
   20    HE2  LYS   2           HE2      LYS   2 -16.169   2.576 -10.854
   21    HE3  LYS   2           HE3      LYS   2 -15.256   3.981 -10.305
   22    HZ1  LYS   2           HZ1      LYS   2 -15.205   4.795 -12.575
   23    HZ2  LYS   2           HZ2      LYS   2 -16.807   4.556 -12.073
   24    HZ3  LYS   2           HZ3      LYS   2 -16.070   3.440 -13.110
   25    H    ARG   3           H        ARG   3 -12.068   1.053  -5.621
   26    HA   ARG   3           HA       ARG   3 -11.639   3.558  -4.438
   27    HB2  ARG   3           HB2      ARG   3 -12.101   1.437  -3.220
   28    HB3  ARG   3           HB3      ARG   3 -10.478   0.890  -3.614
   29    HG2  ARG   3           HG2      ARG   3 -10.545   1.728  -1.358
   30    HG3  ARG   3           HG3      ARG   3  -9.554   2.788  -2.361
   31    HD2  ARG   3           HD2      ARG   3 -10.977   4.112  -0.921
   32    HD3  ARG   3           HD3      ARG   3 -11.464   4.314  -2.602
   33    HE   ARG   3           HE       ARG   3 -13.054   2.287  -1.632
   34   HH11  ARG   3          2HH1      ARG   3 -12.438   5.634  -0.801
   35   HH12  ARG   3          1HH1      ARG   3 -14.015   5.895  -0.112
   36   HH21  ARG   3          2HH2      ARG   3 -15.140   2.635  -0.755
   37   HH22  ARG   3          1HH2      ARG   3 -15.560   4.199  -0.114
   38    H    LYS   4           H        LYS   4 -10.003   4.938  -4.625
   39    HA   LYS   4           HA       LYS   4  -7.581   4.207  -6.001
   40    HB2  LYS   4           HB2      LYS   4  -8.256   6.792  -4.586
   41    HB3  LYS   4           HB3      LYS   4  -6.977   6.542  -5.769
   42    HG2  LYS   4           HG2      LYS   4  -9.943   6.373  -6.288
   43    HG3  LYS   4           HG3      LYS   4  -8.863   7.680  -6.779
   44    HD2  LYS   4           HD2      LYS   4  -7.693   6.246  -8.284
   45    HD3  LYS   4           HD3      LYS   4  -8.521   4.818  -7.661
   46    HE2  LYS   4           HE2      LYS   4  -9.465   5.493  -9.802
   47    HE3  LYS   4           HE3      LYS   4 -10.648   5.686  -8.510
   48    HZ1  LYS   4           HZ1      LYS   4 -10.706   7.587  -9.937
   49    HZ2  LYS   4           HZ2      LYS   4  -9.039   7.841  -9.773
   50    HZ3  LYS   4           HZ3      LYS   4 -10.070   8.066  -8.442
   51    H    ILE   5           H        ILE   5  -6.008   3.162  -4.992
   52    HA   ILE   5           HA       ILE   5  -5.540   3.770  -2.141
   53    HB   ILE   5           HB       ILE   5  -5.252   1.064  -3.469
   54   HG12  ILE   5          2HG1      ILE   5  -7.309   2.066  -1.487
   55   HG13  ILE   5          3HG1      ILE   5  -7.601   1.720  -3.188
   56   HG21  ILE   5          2HG2      ILE   5  -4.928   1.873  -0.579
   57   HG22  ILE   5          1HG2      ILE   5  -3.631   1.403  -1.678
   58   HG23  ILE   5          3HG2      ILE   5  -4.854   0.225  -1.199
   59   HD11  ILE   5          3HD1      ILE   5  -6.786  -0.293  -1.107
   60   HD12  ILE   5          2HD1      ILE   5  -7.113  -0.630  -2.807
   61   HD13  ILE   5          1HD1      ILE   5  -8.412  -0.067  -1.753
   62    H    ILE   6           H        ILE   6  -3.473   4.136  -1.540
   63    HA   ILE   6           HA       ILE   6  -1.355   3.439  -3.457
   64    HB   ILE   6           HB       ILE   6   0.047   5.241  -2.517
   65   HG12  ILE   6          2HG1      ILE   6  -1.245   5.423  -0.336
   66   HG13  ILE   6          3HG1      ILE   6  -0.763   6.942  -1.076
   67   HG21  ILE   6          2HG2      ILE   6  -1.145   5.603  -4.590
   68   HG22  ILE   6          1HG2      ILE   6  -1.054   7.101  -3.665
   69   HG23  ILE   6          3HG2      ILE   6  -2.556   6.178  -3.702
   70   HD11  ILE   6          3HD1      ILE   6  -3.510   5.711  -1.182
   71   HD12  ILE   6          2HD1      ILE   6  -3.034   7.230  -1.943
   72   HD13  ILE   6          1HD1      ILE   6  -3.010   7.078  -0.186
   73    H    ALA   7           H        ALA   7   0.372   2.308  -2.665
   74    HA   ALA   7           HA       ALA   7   0.435   1.735   0.198
   75    HB1  ALA   7           HB1      ALA   7   0.143  -0.413  -1.898
   76    HB2  ALA   7           HB2      ALA   7   0.413  -0.684  -0.175
   77    HB3  ALA   7           HB3      ALA   7  -1.084   0.068  -0.727
   78    H    VAL   8           H        VAL   8   2.427   1.119   0.954
   79    HA   VAL   8           HA       VAL   8   4.551   0.891  -1.071
   80    HB   VAL   8           HB       VAL   8   4.908   1.923   1.747
   81   HG11  VAL   8          2HG1      VAL   8   6.781   1.772  -0.613
   82   HG12  VAL   8          1HG1      VAL   8   6.899   0.868   0.898
   83   HG13  VAL   8          3HG1      VAL   8   7.129   2.616   0.896
   84   HG21  VAL   8          3HG2      VAL   8   5.250   4.128   0.707
   85   HG22  VAL   8          2HG2      VAL   8   3.612   3.519   0.464
   86   HG23  VAL   8          1HG2      VAL   8   4.784   3.448  -0.852
   87    H    THR   9           H        THR   9   5.400  -1.036  -1.179
   88    HA   THR   9           HA       THR   9   5.283  -2.798   1.176
   89    HB   THR   9           HB       THR   9   5.780  -4.615  -0.542
   90    HG1  THR   9           HG1      THR   9   6.382  -2.908  -2.158
   91   HG21  THR   9          3HG2      THR   9   3.192  -3.085  -0.847
   92   HG22  THR   9          1HG2      THR   9   3.542  -4.269   0.414
   93   HG23  THR   9          2HG2      THR   9   3.453  -4.777  -1.272
   94    H    ALA  10           H        ALA  10   7.134  -2.955   2.259
   95    HA   ALA  10           HA       ALA  10   9.666  -2.852   0.775
   96    HB1  ALA  10           HB1      ALA  10   9.093  -1.206   3.234
   97    HB2  ALA  10           HB2      ALA  10  10.628  -1.294   2.370
   98    HB3  ALA  10           HB3      ALA  10   9.215  -0.582   1.588
   99    H    CYS  11           H        CYS  11  11.339  -3.992   1.693
  100    HA   CYS  11           HA       CYS  11  11.230  -4.981   4.371
  101    HB2  CYS  11           HB2      CYS  11   9.694  -6.566   3.181
  102    HB3  CYS  11           HB3      CYS  11  11.037  -7.018   2.139
  103    HG   CYS  11           HG       CYS  11  11.598  -7.311   5.446
  104    H    ALA  12           H        ALA  12  13.261  -5.352   5.085
  105    HA   ALA  12           HA       ALA  12  15.407  -5.184   3.082
  106    HB1  ALA  12           HB1      ALA  12  16.851  -4.508   4.942
  107    HB2  ALA  12           HB2      ALA  12  15.436  -3.462   4.818
  108    HB3  ALA  12           HB3      ALA  12  15.503  -4.709   6.063
  109    H    THR  13           H        THR  13  14.108  -7.111   5.686
  110    HA   THR  13           HA       THR  13  16.246  -8.974   5.839
  111    HB   THR  13           HB       THR  13  14.413 -10.435   6.908
  112    HG1  THR  13           HG1      THR  13  13.003  -7.969   7.043
  113   HG21  THR  13          3HG2      THR  13  15.050  -7.724   8.081
  114   HG22  THR  13          1HG2      THR  13  16.062  -9.165   8.197
  115   HG23  THR  13          2HG2      THR  13  14.484  -9.130   8.984
  116    H    GLY  14           H        GLY  14  13.054  -9.124   4.253
  117    HA2  GLY  14           HA1      GLY  14  14.091 -11.382   2.650
  118    HA3  GLY  14           HA2      GLY  14  12.423 -11.276   3.193
  119    H    VAL  15           H        VAL  15  14.688 -10.406   0.802
  120    HA   VAL  15           HA       VAL  15  13.479  -8.203  -0.414
  121    HB   VAL  15           HB       VAL  15  15.016 -10.415  -1.791
  122   HG11  VAL  15          2HG1      VAL  15  13.888  -8.989  -3.382
  123   HG12  VAL  15          1HG1      VAL  15  15.617  -8.636  -3.403
  124   HG13  VAL  15          3HG1      VAL  15  14.503  -7.548  -2.574
  125   HG21  VAL  15          3HG2      VAL  15  16.016  -7.889  -0.478
  126   HG22  VAL  15          2HG2      VAL  15  16.993  -9.002  -1.432
  127   HG23  VAL  15          1HG2      VAL  15  16.282  -9.538   0.089
  128    H    ALA  16           H        ALA  16  12.973 -11.673  -0.948
  129    HA   ALA  16           HA       ALA  16  11.185 -11.492  -3.095
  130    HB1  ALA  16           HB1      ALA  16  10.535 -13.761  -2.546
  131    HB2  ALA  16           HB2      ALA  16  12.280 -13.573  -2.379
  132    HB3  ALA  16           HB3      ALA  16  11.255 -13.603  -0.944
  133    H    HIS  17           H        HIS  17  10.691 -11.074   0.332
  134    HA   HIS  17           HA       HIS  17   7.869 -11.348   0.369
  135    HB2  HIS  17           HB2      HIS  17   9.711  -9.799   2.207
  136    HB3  HIS  17           HB3      HIS  17   7.996 -10.052   2.510
  137    HD1  HIS  17           HD1      HIS  17  10.197 -11.078   4.454
  138    HD2  HIS  17           HD2      HIS  17   8.403 -13.350   1.472
  139    HE1  HIS  17           HE1      HIS  17  10.455 -13.470   5.185
  140    HE2  HIS  17           HE2      HIS  17   9.200 -14.815   3.456
  141    H    THR  18           H        THR  18  10.041  -8.631  -0.101
  142    HA   THR  18           HA       THR  18   8.227  -6.536  -0.154
  143    HB   THR  18           HB       THR  18  10.667  -6.803  -1.919
  144    HG1  THR  18           HG1      THR  18  11.813  -5.982  -0.137
  145   HG21  THR  18          3HG2      THR  18   9.284  -4.400  -0.727
  146   HG22  THR  18          1HG2      THR  18   9.276  -4.871  -2.426
  147   HG23  THR  18          2HG2      THR  18  10.781  -4.361  -1.659
  148    H    TYR  19           H        TYR  19   9.197  -8.773  -2.712
  149    HA   TYR  19           HA       TYR  19   7.722  -7.343  -4.725
  150    HB2  TYR  19           HB2      TYR  19   9.232  -9.950  -4.754
  151    HB3  TYR  19           HB3      TYR  19   8.343  -9.352  -6.153
  152    HD1  TYR  19           HD1      TYR  19   8.946  -6.999  -6.996
  153    HD2  TYR  19           HD2      TYR  19  11.436  -9.256  -4.388
  154    HE1  TYR  19           HE1      TYR  19  10.866  -5.612  -7.641
  155    HE2  TYR  19           HE2      TYR  19  13.366  -7.870  -5.026
  156    HH   TYR  19           HH       TYR  19  14.035  -6.435  -7.003
  157    H    MET  20           H        MET  20   7.335 -10.401  -2.969
  158    HA   MET  20           HA       MET  20   5.037 -11.277  -4.304
  159    HB2  MET  20           HB2      MET  20   6.381 -12.680  -2.752
  160    HB3  MET  20           HB3      MET  20   5.714 -11.768  -1.402
  161    HG2  MET  20           HG2      MET  20   4.486 -13.805  -1.614
  162    HG3  MET  20           HG3      MET  20   3.445 -12.464  -2.110
  163    HE1  MET  20           HE1      MET  20   2.284 -15.400  -4.429
  164    HE2  MET  20           HE2      MET  20   2.801 -15.503  -2.745
  165    HE3  MET  20           HE3      MET  20   1.770 -14.172  -3.276
  166    H    ALA  21           H        ALA  21   5.387  -9.240  -1.432
  167    HA   ALA  21           HA       ALA  21   2.666  -9.015  -0.798
  168    HB1  ALA  21           HB1      ALA  21   3.294  -7.032   0.470
  169    HB2  ALA  21           HB2      ALA  21   4.467  -8.326   0.716
  170    HB3  ALA  21           HB3      ALA  21   4.850  -6.981  -0.358
  171    H    ALA  22           H        ALA  22   4.742  -7.039  -2.886
  172    HA   ALA  22           HA       ALA  22   2.772  -5.140  -3.588
  173    HB1  ALA  22           HB1      ALA  22   5.212  -5.981  -5.150
  174    HB2  ALA  22           HB2      ALA  22   4.280  -4.502  -5.386
  175    HB3  ALA  22           HB3      ALA  22   5.174  -4.751  -3.887
  176    H    GLN  23           H        GLN  23   3.774  -8.199  -5.049
  177    HA   GLN  23           HA       GLN  23   2.182  -7.990  -7.376
  178    HB2  GLN  23           HB2      GLN  23   3.318 -10.386  -5.935
  179    HB3  GLN  23           HB3      GLN  23   2.455 -10.500  -7.463
  180    HG2  GLN  23           HG2      GLN  23   4.115  -9.100  -8.535
  181    HG3  GLN  23           HG3      GLN  23   4.963  -8.903  -7.003
  182   HE21  GLN  23          1HE2      GLN  23   4.197 -11.079  -9.597
  183   HE22  GLN  23          2HE2      GLN  23   5.399 -12.272  -9.227
  184    H    ALA  24           H        ALA  24   1.625  -9.578  -4.252
  185    HA   ALA  24           HA       ALA  24  -0.906 -10.643  -4.849
  186    HB1  ALA  24           HB1      ALA  24   0.207  -9.798  -2.175
  187    HB2  ALA  24           HB2      ALA  24  -1.198 -10.834  -2.423
  188    HB3  ALA  24           HB3      ALA  24   0.401 -11.380  -2.932
  189    H    LEU  25           H        LEU  25   0.029  -7.556  -3.367
  190    HA   LEU  25           HA       LEU  25  -2.587  -6.597  -2.937
  191    HB2  LEU  25           HB2      LEU  25   0.039  -5.190  -3.329
  192    HB3  LEU  25           HB3      LEU  25  -1.452  -4.306  -3.066
  193    HG   LEU  25           HG       LEU  25  -0.232  -6.296  -1.152
  194   HD11  LEU  25          2HD1      LEU  25  -0.487  -3.295  -0.983
  195   HD12  LEU  25          1HD1      LEU  25   1.003  -4.177  -1.316
  196   HD13  LEU  25          3HD1      LEU  25   0.203  -4.356   0.245
  197   HD21  LEU  25          3HD2      LEU  25  -2.658  -6.321  -1.032
  198   HD22  LEU  25          2HD2      LEU  25  -2.689  -4.561  -0.920
  199   HD23  LEU  25          1HD2      LEU  25  -1.988  -5.515   0.387
  200    H    LYS  26           H        LYS  26  -0.415  -6.253  -5.718
  201    HA   LYS  26           HA       LYS  26  -2.072  -4.488  -7.173
  202    HB2  LYS  26           HB2      LYS  26   0.335  -4.829  -7.636
  203    HB3  LYS  26           HB3      LYS  26  -0.022  -6.443  -8.233
  204    HG2  LYS  26           HG2      LYS  26  -1.370  -5.493 -10.028
  205    HG3  LYS  26           HG3      LYS  26  -1.040  -3.869  -9.420
  206    HD2  LYS  26           HD2      LYS  26   1.102  -5.802 -10.307
  207    HD3  LYS  26           HD3      LYS  26   0.393  -4.569 -11.354
  208    HE2  LYS  26           HE2      LYS  26   1.166  -2.820  -9.861
  209    HE3  LYS  26           HE3      LYS  26   1.800  -4.025  -8.740
  210    HZ1  LYS  26           HZ1      LYS  26   2.723  -3.850 -11.545
  211    HZ2  LYS  26           HZ2      LYS  26   3.473  -4.639 -10.242
  212    HZ3  LYS  26           HZ3      LYS  26   3.441  -2.945 -10.309
  213    H    LYS  27           H        LYS  27  -1.996  -7.983  -6.903
  214    HA   LYS  27           HA       LYS  27  -3.910  -8.425  -8.999
  215    HB2  LYS  27           HB2      LYS  27  -2.904 -10.187  -6.763
  216    HB3  LYS  27           HB3      LYS  27  -4.096 -10.715  -7.936
  217    HG2  LYS  27           HG2      LYS  27  -1.291  -9.817  -8.557
  218    HG3  LYS  27           HG3      LYS  27  -1.861 -11.486  -8.517
  219    HD2  LYS  27           HD2      LYS  27  -2.972  -9.364 -10.350
  220    HD3  LYS  27           HD3      LYS  27  -1.697 -10.493 -10.805
  221    HE2  LYS  27           HE2      LYS  27  -4.461 -11.280  -9.888
  222    HE3  LYS  27           HE3      LYS  27  -3.938 -11.203 -11.571
  223    HZ1  LYS  27           HZ1      LYS  27  -2.911 -13.020  -9.455
  224    HZ2  LYS  27           HZ2      LYS  27  -2.203 -12.864 -10.987
  225    HZ3  LYS  27           HZ3      LYS  27  -3.790 -13.449 -10.843
  226    H    GLY  28           H        GLY  28  -4.021  -8.404  -5.455
  227    HA2  GLY  28           HA1      GLY  28  -6.739  -8.907  -5.100
  228    HA3  GLY  28           HA2      GLY  28  -5.736  -7.998  -3.983
  229    H    ALA  29           H        ALA  29  -5.118  -5.883  -5.839
  230    HA   ALA  29           HA       ALA  29  -7.239  -4.110  -5.466
  231    HB1  ALA  29           HB1      ALA  29  -4.949  -3.392  -5.934
  232    HB2  ALA  29           HB2      ALA  29  -5.092  -4.005  -7.581
  233    HB3  ALA  29           HB3      ALA  29  -6.095  -2.655  -7.054
  234    H    LYS  30           H        LYS  30  -6.303  -5.836  -8.450
  235    HA   LYS  30           HA       LYS  30  -8.583  -4.966  -9.901
  236    HB2  LYS  30           HB2      LYS  30  -6.380  -6.891 -10.356
  237    HB3  LYS  30           HB3      LYS  30  -7.866  -7.190 -11.248
  238    HG2  LYS  30           HG2      LYS  30  -6.373  -5.878 -12.593
  239    HG3  LYS  30           HG3      LYS  30  -7.766  -4.897 -12.142
  240    HD2  LYS  30           HD2      LYS  30  -6.405  -3.881 -10.333
  241    HD3  LYS  30           HD3      LYS  30  -5.015  -4.806 -10.903
  242    HE2  LYS  30           HE2      LYS  30  -5.192  -3.705 -13.092
  243    HE3  LYS  30           HE3      LYS  30  -6.562  -2.767 -12.502
  244    HZ1  LYS  30           HZ1      LYS  30  -3.746  -2.615 -11.572
  245    HZ2  LYS  30           HZ2      LYS  30  -5.032  -1.843 -10.787
  246    HZ3  LYS  30           HZ3      LYS  30  -4.631  -1.414 -12.373
  247    H    LYS  31           H        LYS  31  -7.970  -7.578  -7.723
  248    HA   LYS  31           HA       LYS  31 -10.132  -9.271  -8.322
  249    HB2  LYS  31           HB2      LYS  31  -8.284  -9.931  -6.863
  250    HB3  LYS  31           HB3      LYS  31  -8.735  -8.692  -5.704
  251    HG2  LYS  31           HG2      LYS  31  -9.403 -10.898  -4.955
  252    HG3  LYS  31           HG3      LYS  31 -10.805  -9.864  -5.227
  253    HD2  LYS  31           HD2      LYS  31 -11.308 -10.960  -7.285
  254    HD3  LYS  31           HD3      LYS  31  -9.782 -11.850  -7.246
  255    HE2  LYS  31           HE2      LYS  31 -11.792 -13.180  -6.572
  256    HE3  LYS  31           HE3      LYS  31 -10.493 -13.146  -5.383
  257    HZ1  LYS  31           HZ1      LYS  31 -11.686 -11.539  -4.099
  258    HZ2  LYS  31           HZ2      LYS  31 -12.732 -12.835  -4.423
  259    HZ3  LYS  31           HZ3      LYS  31 -12.885 -11.386  -5.292
  260    H    MET  32           H        MET  32  -9.857  -6.355  -6.370
  261    HA   MET  32           HA       MET  32 -12.706  -6.518  -5.694
  262    HB2  MET  32           HB2      MET  32 -10.487  -4.769  -4.636
  263    HB3  MET  32           HB3      MET  32 -12.176  -4.588  -4.174
  264    HG2  MET  32           HG2      MET  32 -12.128  -6.951  -3.385
  265    HG3  MET  32           HG3      MET  32 -10.390  -6.950  -3.683
  266    HE1  MET  32           HE1      MET  32 -10.895  -6.773   0.263
  267    HE2  MET  32           HE2      MET  32 -12.026  -7.512  -0.871
  268    HE3  MET  32           HE3      MET  32 -10.292  -7.762  -1.067
  269    H    GLY  33           H        GLY  33 -10.923  -5.361  -8.142
  270    HA2  GLY  33           HA1      GLY  33 -11.422  -3.934  -9.870
  271    HA3  GLY  33           HA2      GLY  33 -13.005  -3.716  -9.143
  272    H    ASN  34           H        ASN  34  -9.812  -2.946  -7.772
  273    HA   ASN  34           HA       ASN  34 -10.595  -0.113  -7.883
  274    HB2  ASN  34           HB2      ASN  34  -9.457   0.282  -5.762
  275    HB3  ASN  34           HB3      ASN  34 -10.733  -0.908  -5.577
  276   HD21  ASN  34          1HD2      ASN  34 -10.233  -2.948  -4.949
  277   HD22  ASN  34          2HD2      ASN  34  -8.646  -3.445  -4.482
  278    H    LEU  35           H        LEU  35  -8.535   1.274  -7.349
  279    HA   LEU  35           HA       LEU  35  -6.462   0.362  -9.235
  280    HB2  LEU  35           HB2      LEU  35  -7.581   3.132  -8.805
  281    HB3  LEU  35           HB3      LEU  35  -6.108   2.824  -9.698
  282    HG   LEU  35           HG       LEU  35  -7.538   1.342 -11.221
  283   HD11  LEU  35          2HD1      LEU  35  -9.909   1.906 -11.332
  284   HD12  LEU  35          1HD1      LEU  35  -9.743   2.909  -9.889
  285   HD13  LEU  35          3HD1      LEU  35  -9.497   1.165  -9.785
  286   HD21  LEU  35          3HD2      LEU  35  -6.633   3.495 -11.893
  287   HD22  LEU  35          2HD2      LEU  35  -8.002   4.318 -11.147
  288   HD23  LEU  35          1HD2      LEU  35  -8.258   3.270 -12.541
  289    H    ILE  36           H        ILE  36  -4.614  -0.033  -8.228
  290    HA   ILE  36           HA       ILE  36  -4.033   1.467  -5.766
  291    HB   ILE  36           HB       ILE  36  -4.431  -0.983  -5.461
  292   HG12  ILE  36          2HG1      ILE  36  -1.615  -0.056  -4.842
  293   HG13  ILE  36          3HG1      ILE  36  -3.043   0.334  -3.890
  294   HG21  ILE  36          2HG2      ILE  36  -3.503  -1.793  -7.554
  295   HG22  ILE  36          1HG2      ILE  36  -2.695  -2.560  -6.186
  296   HG23  ILE  36          3HG2      ILE  36  -1.892  -1.259  -7.068
  297   HD11  ILE  36          3HD1      ILE  36  -3.348  -2.050  -3.407
  298   HD12  ILE  36          2HD1      ILE  36  -1.790  -1.442  -2.847
  299   HD13  ILE  36          1HD1      ILE  36  -1.881  -2.407  -4.321
  300    H    LYS  37           H        LYS  37  -2.096   2.395  -5.498
  301    HA   LYS  37           HA       LYS  37  -0.036   1.989  -7.565
  302    HB2  LYS  37           HB2      LYS  37  -0.911   4.403  -6.049
  303    HB3  LYS  37           HB3      LYS  37   0.807   4.237  -6.366
  304    HG2  LYS  37           HG2      LYS  37  -1.363   4.261  -8.456
  305    HG3  LYS  37           HG3      LYS  37  -0.307   5.614  -8.043
  306    HD2  LYS  37           HD2      LYS  37   1.597   3.899  -8.552
  307    HD3  LYS  37           HD3      LYS  37   0.335   3.064  -9.458
  308    HE2  LYS  37           HE2      LYS  37   1.273   5.901  -9.862
  309    HE3  LYS  37           HE3      LYS  37   1.582   4.532 -10.926
  310    HZ1  LYS  37           HZ1      LYS  37  -1.054   5.774 -10.359
  311    HZ2  LYS  37           HZ2      LYS  37  -0.832   4.376 -11.297
  312    HZ3  LYS  37           HZ3      LYS  37  -0.185   5.858 -11.814
  313    H    VAL  38           H        VAL  38   1.281   0.472  -6.753
  314    HA   VAL  38           HA       VAL  38   1.968   0.631  -3.902
  315    HB   VAL  38           HB       VAL  38   0.896  -1.464  -4.461
  316   HG11  VAL  38          2HG1      VAL  38   3.101  -1.876  -6.475
  317   HG12  VAL  38          1HG1      VAL  38   1.405  -1.567  -6.840
  318   HG13  VAL  38          3HG1      VAL  38   1.875  -3.061  -6.028
  319   HG21  VAL  38          3HG2      VAL  38   2.618  -3.036  -3.693
  320   HG22  VAL  38          2HG2      VAL  38   2.628  -1.535  -2.766
  321   HG23  VAL  38          1HG2      VAL  38   3.854  -1.817  -4.002
  322    H    GLU  39           H        GLU  39   3.942   1.203  -3.349
  323    HA   GLU  39           HA       GLU  39   6.033   1.291  -5.399
  324    HB2  GLU  39           HB2      GLU  39   5.659   3.339  -4.071
  325    HB3  GLU  39           HB3      GLU  39   5.992   2.448  -2.593
  326    HG2  GLU  39           HG2      GLU  39   8.274   2.134  -3.206
  327    HG3  GLU  39           HG3      GLU  39   7.985   2.763  -4.824
  328    H    THR  40           H        THR  40   7.138  -0.527  -5.580
  329    HA   THR  40           HA       THR  40   7.548  -2.313  -3.365
  330    HB   THR  40           HB       THR  40   8.978  -2.481  -6.008
  331    HG1  THR  40           HG1      THR  40   7.169  -3.179  -6.986
  332   HG21  THR  40          3HG2      THR  40   7.886  -4.559  -4.106
  333   HG22  THR  40          1HG2      THR  40   9.582  -4.106  -4.288
  334   HG23  THR  40          2HG2      THR  40   8.733  -4.897  -5.616
  335    H    GLN  41           H        GLN  41   8.849  -1.408  -1.821
  336    HA   GLN  41           HA       GLN  41  11.297  -0.045  -2.646
  337    HB2  GLN  41           HB2      GLN  41   9.685   0.809  -0.835
  338    HB3  GLN  41           HB3      GLN  41  10.348  -0.458   0.184
  339    HG2  GLN  41           HG2      GLN  41  12.422   1.111  -1.070
  340    HG3  GLN  41           HG3      GLN  41  11.318   2.109  -0.132
  341   HE21  GLN  41          1HE2      GLN  41  12.783   2.589   1.411
  342   HE22  GLN  41          2HE2      GLN  41  13.321   1.457   2.596
  343    H    GLY  42           H        GLY  42  12.838  -1.422  -3.181
  344    HA2  GLY  42           HA1      GLY  42  13.049  -4.014  -1.882
  345    HA3  GLY  42           HA2      GLY  42  13.971  -3.466  -3.276
  346    H    ALA  43           H        ALA  43  13.516  -2.338   0.049
  347    HA   ALA  43           HA       ALA  43  14.947  -1.783   1.712
  348    HB1  ALA  43           HB1      ALA  43  16.927  -3.509   0.225
  349    HB2  ALA  43           HB2      ALA  43  17.133  -2.887   1.862
  350    HB3  ALA  43           HB3      ALA  43  15.842  -4.035   1.511
  351    H    THR  44           H        THR  44  14.802   0.344   1.043
  352    HA   THR  44           HA       THR  44  15.685   2.399   0.673
  353    HB   THR  44           HB       THR  44  18.277   1.047  -0.107
  354    HG1  THR  44           HG1      THR  44  18.217   0.496   1.966
  355   HG21  THR  44          3HG2      THR  44  17.662   3.851   0.839
  356   HG22  THR  44          1HG2      THR  44  18.123   3.387  -0.799
  357   HG23  THR  44          2HG2      THR  44  19.273   3.206   0.527
  358    H    GLY  45           H        GLY  45  16.252  -0.090  -1.763
  359    HA2  GLY  45           HA1      GLY  45  16.286   1.776  -3.963
  360    HA3  GLY  45           HA2      GLY  45  16.204   0.023  -4.078
  361    H    ILE  46           H        ILE  46  14.660   1.744  -5.697
  362    HA   ILE  46           HA       ILE  46  11.952   1.254  -4.624
  363    HB   ILE  46           HB       ILE  46  12.874   3.714  -6.133
  364   HG12  ILE  46          2HG1      ILE  46  13.505   3.723  -3.755
  365   HG13  ILE  46          3HG1      ILE  46  12.286   4.942  -4.104
  366   HG21  ILE  46          2HG2      ILE  46  10.563   4.531  -5.807
  367   HG22  ILE  46          1HG2      ILE  46  10.116   2.937  -5.198
  368   HG23  ILE  46          3HG2      ILE  46  10.663   3.124  -6.864
  369   HD11  ILE  46          3HD1      ILE  46  11.784   2.262  -2.836
  370   HD12  ILE  46          2HD1      ILE  46  10.563   3.487  -3.180
  371   HD13  ILE  46          1HD1      ILE  46  11.836   3.816  -2.004
  372    H    GLU  47           H        GLU  47  10.640   0.168  -5.990
  373    HA   GLU  47           HA       GLU  47  11.546  -0.301  -8.728
  374    HB2  GLU  47           HB2      GLU  47  10.862  -2.238  -7.401
  375    HB3  GLU  47           HB3      GLU  47   9.270  -1.531  -7.158
  376    HG2  GLU  47           HG2      GLU  47   9.011  -1.581  -9.671
  377    HG3  GLU  47           HG3      GLU  47  10.469  -2.569  -9.706
  378    H    ASN  48           H        ASN  48   8.923   1.283  -6.992
  379    HA   ASN  48           HA       ASN  48   7.896   2.365  -9.493
  380    HB2  ASN  48           HB2      ASN  48   6.624   0.259  -9.117
  381    HB3  ASN  48           HB3      ASN  48   6.114   0.873  -7.553
  382   HD21  ASN  48          1HD2      ASN  48   4.601   2.527  -7.449
  383   HD22  ASN  48          2HD2      ASN  48   3.636   2.976  -8.812
  384    H    GLU  49           H        GLU  49   8.409   4.420  -8.848
  385    HA   GLU  49           HA       GLU  49   8.024   5.559  -6.341
  386    HB2  GLU  49           HB2      GLU  49   7.930   6.849  -9.070
  387    HB3  GLU  49           HB3      GLU  49   7.939   7.751  -7.563
  388    HG2  GLU  49           HG2      GLU  49  10.122   6.729  -7.021
  389    HG3  GLU  49           HG3      GLU  49  10.114   5.963  -8.613
  390    H    LEU  50           H        LEU  50   6.304   6.278  -5.257
  391    HA   LEU  50           HA       LEU  50   3.712   6.328  -6.574
  392    HB2  LEU  50           HB2      LEU  50   4.443   6.852  -3.688
  393    HB3  LEU  50           HB3      LEU  50   2.808   6.775  -4.322
  394    HG   LEU  50           HG       LEU  50   4.793   4.531  -4.056
  395   HD11  LEU  50          2HD1      LEU  50   3.511   5.078  -2.066
  396   HD12  LEU  50          1HD1      LEU  50   3.033   3.511  -2.722
  397   HD13  LEU  50          3HD1      LEU  50   2.010   4.925  -2.979
  398   HD21  LEU  50          3HD2      LEU  50   3.148   3.094  -5.154
  399   HD22  LEU  50          2HD2      LEU  50   3.752   4.346  -6.241
  400   HD23  LEU  50          1HD2      LEU  50   2.156   4.509  -5.511
  401    H    THR  51           H        THR  51   3.392   8.063  -7.777
  402    HA   THR  51           HA       THR  51   4.757  10.501  -7.373
  403    HB   THR  51           HB       THR  51   2.672  11.107  -9.064
  404    HG1  THR  51           HG1      THR  51   1.802   9.168  -9.439
  405   HG21  THR  51          3HG2      THR  51   5.323   9.824  -9.734
  406   HG22  THR  51          1HG2      THR  51   5.036  11.546  -9.485
  407   HG23  THR  51          2HG2      THR  51   4.305  10.719 -10.862
  408    H    GLU  52           H        GLU  52   3.843  12.569  -7.024
  409    HA   GLU  52           HA       GLU  52   2.489  12.707  -4.583
  410    HB2  GLU  52           HB2      GLU  52   4.051  14.404  -5.501
  411    HB3  GLU  52           HB3      GLU  52   2.819  14.876  -6.660
  412    HG2  GLU  52           HG2      GLU  52   1.376  15.617  -4.868
  413    HG3  GLU  52           HG3      GLU  52   2.556  15.075  -3.672
  414    H    LYS  53           H        LYS  53   1.336  13.215  -7.882
  415    HA   LYS  53           HA       LYS  53  -1.263  14.060  -7.324
  416    HB2  LYS  53           HB2      LYS  53  -1.816  13.163  -9.592
  417    HB3  LYS  53           HB3      LYS  53  -0.393  14.198  -9.562
  418    HG2  LYS  53           HG2      LYS  53   1.035  12.201  -9.546
  419    HG3  LYS  53           HG3      LYS  53  -0.404  11.188  -9.634
  420    HD2  LYS  53           HD2      LYS  53  -0.980  12.254 -11.783
  421    HD3  LYS  53           HD3      LYS  53   0.517  13.189 -11.692
  422    HE2  LYS  53           HE2      LYS  53   1.806  11.106 -11.648
  423    HE3  LYS  53           HE3      LYS  53   0.310  10.180 -11.762
  424    HZ1  LYS  53           HZ1      LYS  53   1.418  12.030 -13.797
  425    HZ2  LYS  53           HZ2      LYS  53  -0.111  11.300 -13.901
  426    HZ3  LYS  53           HZ3      LYS  53   1.289  10.343 -13.912
  427    H    ASP  54           H        ASP  54  -0.015  10.755  -7.726
  428    HA   ASP  54           HA       ASP  54  -2.517   9.471  -7.552
  429    HB2  ASP  54           HB2      ASP  54   0.280   8.448  -7.082
  430    HB3  ASP  54           HB3      ASP  54  -1.145   7.414  -7.055
  431    H    VAL  55           H        VAL  55  -0.157  10.400  -5.156
  432    HA   VAL  55           HA       VAL  55  -1.265   8.989  -2.981
  433    HB   VAL  55           HB       VAL  55   0.356  11.538  -3.002
  434   HG11  VAL  55          2HG1      VAL  55   0.846  11.015  -0.658
  435   HG12  VAL  55          1HG1      VAL  55  -0.278   9.657  -0.733
  436   HG13  VAL  55          3HG1      VAL  55  -0.875  11.306  -0.917
  437   HG21  VAL  55          3HG2      VAL  55   1.515   9.658  -4.017
  438   HG22  VAL  55          2HG2      VAL  55   1.154   8.655  -2.612
  439   HG23  VAL  55          1HG2      VAL  55   2.229  10.044  -2.451
  440    H    ASN  56           H        ASN  56  -1.802  12.274  -4.196
  441    HA   ASN  56           HA       ASN  56  -3.580  13.026  -2.113
  442    HB2  ASN  56           HB2      ASN  56  -2.990  14.173  -4.828
  443    HB3  ASN  56           HB3      ASN  56  -4.282  14.827  -3.828
  444   HD21  ASN  56          1HD2      ASN  56  -0.849  14.469  -4.209
  445   HD22  ASN  56          2HD2      ASN  56  -0.399  15.603  -2.983
  446    H    ILE  57           H        ILE  57  -4.029  11.481  -5.227
  447    HA   ILE  57           HA       ILE  57  -6.892  11.659  -5.187
  448    HB   ILE  57           HB       ILE  57  -5.072   9.854  -6.798
  449   HG12  ILE  57          2HG1      ILE  57  -6.509  12.408  -7.560
  450   HG13  ILE  57          3HG1      ILE  57  -4.785  12.277  -7.229
  451   HG21  ILE  57          2HG2      ILE  57  -7.296   8.897  -6.620
  452   HG22  ILE  57          1HG2      ILE  57  -7.019   9.507  -8.252
  453   HG23  ILE  57          3HG2      ILE  57  -8.014  10.427  -7.121
  454   HD11  ILE  57          3HD1      ILE  57  -6.267  10.921  -9.470
  455   HD12  ILE  57          2HD1      ILE  57  -4.543  10.768  -9.135
  456   HD13  ILE  57          1HD1      ILE  57  -5.213  12.328  -9.610
  457    H    GLY  58           H        GLY  58  -4.505   9.171  -4.387
  458    HA2  GLY  58           HA1      GLY  58  -6.264   7.092  -3.755
  459    HA3  GLY  58           HA2      GLY  58  -4.633   7.271  -3.125
  460    H    GLU  59           H        GLU  59  -7.262   6.419  -1.953
  461    HA   GLU  59           HA       GLU  59  -7.876   8.443   0.024
  462    HB2  GLU  59           HB2      GLU  59  -8.876   5.621  -0.393
  463    HB3  GLU  59           HB3      GLU  59  -9.474   6.705   0.856
  464    HG2  GLU  59           HG2      GLU  59  -9.561   7.376  -2.069
  465    HG3  GLU  59           HG3      GLU  59 -10.858   6.518  -1.240
  466    H    VAL  60           H        VAL  60  -7.157   4.985   0.374
  467    HA   VAL  60           HA       VAL  60  -5.931   5.580   2.958
  468    HB   VAL  60           HB       VAL  60  -6.146   3.134   3.385
  469   HG11  VAL  60          2HG1      VAL  60  -7.863   4.705   4.128
  470   HG12  VAL  60          1HG1      VAL  60  -8.561   3.145   3.691
  471   HG13  VAL  60          3HG1      VAL  60  -8.704   4.515   2.589
  472   HG21  VAL  60          3HG2      VAL  60  -7.546   1.788   1.881
  473   HG22  VAL  60          2HG2      VAL  60  -6.079   2.344   1.075
  474   HG23  VAL  60          1HG2      VAL  60  -7.619   3.139   0.748
  475    H    VAL  61           H        VAL  61  -3.916   4.855   3.522
  476    HA   VAL  61           HA       VAL  61  -2.202   3.975   1.289
  477    HB   VAL  61           HB       VAL  61  -1.271   5.259   3.853
  478   HG11  VAL  61          2HG1      VAL  61   0.787   5.651   2.619
  479   HG12  VAL  61          1HG1      VAL  61   0.088   4.898   1.187
  480   HG13  VAL  61          3HG1      VAL  61   0.383   3.936   2.636
  481   HG21  VAL  61          3HG2      VAL  61  -2.720   6.844   2.710
  482   HG22  VAL  61          2HG2      VAL  61  -1.812   6.616   1.216
  483   HG23  VAL  61          1HG2      VAL  61  -1.034   7.357   2.615
  484    H    ILE  62           H        ILE  62  -1.544   1.912   1.417
  485    HA   ILE  62           HA       ILE  62  -1.674   0.601   4.043
  486    HB   ILE  62           HB       ILE  62  -1.418  -0.650   1.295
  487   HG12  ILE  62          2HG1      ILE  62  -3.783  -0.517   3.182
  488   HG13  ILE  62          3HG1      ILE  62  -3.614   0.409   1.695
  489   HG21  ILE  62          2HG2      ILE  62  -1.897  -2.765   2.477
  490   HG22  ILE  62          1HG2      ILE  62  -1.794  -1.902   4.012
  491   HG23  ILE  62          3HG2      ILE  62  -0.372  -2.034   2.977
  492   HD11  ILE  62          3HD1      ILE  62  -3.769  -2.591   1.881
  493   HD12  ILE  62          2HD1      ILE  62  -3.647  -1.648   0.396
  494   HD13  ILE  62          1HD1      ILE  62  -5.082  -1.514   1.411
  495    H    PHE  63           H        PHE  63   0.130   0.388   5.138
  496    HA   PHE  63           HA       PHE  63   2.675   0.359   3.680
  497    HB2  PHE  63           HB2      PHE  63   1.949   1.161   6.483
  498    HB3  PHE  63           HB3      PHE  63   3.610   0.757   6.058
  499    HD1  PHE  63           HD1      PHE  63   4.595   2.000   4.031
  500    HD2  PHE  63           HD2      PHE  63   1.201   3.325   6.215
  501    HE1  PHE  63           HE1      PHE  63   4.965   4.283   3.204
  502    HE2  PHE  63           HE2      PHE  63   1.558   5.614   5.389
  503    HZ   PHE  63           HZ       PHE  63   3.442   6.092   3.880
  504    H    ALA  64           H        ALA  64   3.040  -1.714   3.173
  505    HA   ALA  64           HA       ALA  64   3.226  -3.586   5.437
  506    HB1  ALA  64           HB1      ALA  64   3.242  -4.148   2.467
  507    HB2  ALA  64           HB2      ALA  64   3.378  -5.359   3.740
  508    HB3  ALA  64           HB3      ALA  64   1.891  -4.430   3.565
  509    H    VAL  65           H        VAL  65   5.150  -2.889   6.294
  510    HA   VAL  65           HA       VAL  65   7.462  -2.886   4.492
  511    HB   VAL  65           HB       VAL  65   8.296  -0.806   5.610
  512   HG11  VAL  65          2HG1      VAL  65   5.718  -0.557   4.066
  513   HG12  VAL  65          1HG1      VAL  65   7.331  -0.740   3.375
  514   HG13  VAL  65          3HG1      VAL  65   6.916   0.718   4.280
  515   HG21  VAL  65          3HG2      VAL  65   6.917  -0.846   7.605
  516   HG22  VAL  65          2HG2      VAL  65   5.460  -0.660   6.627
  517   HG23  VAL  65          1HG2      VAL  65   6.642   0.648   6.709
  518    H    ASP  66           H        ASP  66   9.293  -3.580   5.278
  519    HA   ASP  66           HA       ASP  66   9.467  -4.350   8.109
  520    HB2  ASP  66           HB2      ASP  66   9.812  -6.177   6.569
  521    HB3  ASP  66           HB3      ASP  66  10.959  -5.238   5.629
  522    H    THR  67           H        THR  67  10.121  -1.831   6.223
  523    HA   THR  67           HA       THR  67  12.177  -0.809   7.970
  524    HB   THR  67           HB       THR  67  13.507  -1.925   6.205
  525    HG1  THR  67           HG1      THR  67  14.806  -0.316   6.606
  526   HG21  THR  67          3HG2      THR  67  11.896  -1.757   4.366
  527   HG22  THR  67          1HG2      THR  67  13.466  -1.095   3.905
  528   HG23  THR  67          2HG2      THR  67  12.136  -0.010   4.315
  529    H    LYS  68           H        LYS  68  12.639   1.589   7.236
  530    HA   LYS  68           HA       LYS  68  10.068   2.846   7.076
  531    HB2  LYS  68           HB2      LYS  68  11.226   4.934   7.330
  532    HB3  LYS  68           HB3      LYS  68  11.963   3.762   8.416
  533    HG2  LYS  68           HG2      LYS  68  13.841   3.500   6.984
  534    HG3  LYS  68           HG3      LYS  68  13.067   4.436   5.705
  535    HD2  LYS  68           HD2      LYS  68  13.069   6.400   7.237
  536    HD3  LYS  68           HD3      LYS  68  14.004   5.439   8.385
  537    HE2  LYS  68           HE2      LYS  68  14.849   6.002   5.552
  538    HE3  LYS  68           HE3      LYS  68  15.383   6.935   6.950
  539    HZ1  LYS  68           HZ1      LYS  68  16.458   5.027   7.851
  540    HZ2  LYS  68           HZ2      LYS  68  16.953   5.162   6.229
  541    HZ3  LYS  68           HZ3      LYS  68  15.794   4.007   6.668
  542    H    VAL  69           H        VAL  69  10.027   4.922   5.524
  543    HA   VAL  69           HA       VAL  69  10.680   3.970   2.821
  544    HB   VAL  69           HB       VAL  69   8.460   4.603   2.009
  545   HG11  VAL  69          2HG1      VAL  69   7.150   2.792   3.079
  546   HG12  VAL  69          1HG1      VAL  69   8.414   2.642   4.301
  547   HG13  VAL  69          3HG1      VAL  69   8.774   2.293   2.610
  548   HG21  VAL  69          3HG2      VAL  69   7.905   6.321   3.607
  549   HG22  VAL  69          2HG2      VAL  69   7.839   5.132   4.909
  550   HG23  VAL  69          1HG2      VAL  69   6.650   5.082   3.608
  551    H    ARG  70           H        ARG  70  10.022   5.760   1.188
  552    HA   ARG  70           HA       ARG  70  11.364   8.197   2.067
  553    HB2  ARG  70           HB2      ARG  70  11.381   8.701  -0.412
  554    HB3  ARG  70           HB3      ARG  70  12.278   7.266   0.071
  555    HG2  ARG  70           HG2      ARG  70  10.459   5.842  -0.661
  556    HG3  ARG  70           HG3      ARG  70   9.486   7.255  -1.066
  557    HD2  ARG  70           HD2      ARG  70  12.146   6.622  -2.330
  558    HD3  ARG  70           HD3      ARG  70  10.597   6.128  -3.006
  559    HE   ARG  70           HE       ARG  70  11.397   8.944  -2.630
  560   HH11  ARG  70          2HH1      ARG  70   9.614   6.455  -4.332
  561   HH12  ARG  70          1HH1      ARG  70   9.242   7.480  -5.682
  562   HH21  ARG  70          2HH2      ARG  70  10.884  10.306  -4.412
  563   HH22  ARG  70          1HH2      ARG  70   9.963   9.654  -5.736
  564    H    ASN  71           H        ASN  71   8.364   7.147   0.541
  565    HA   ASN  71           HA       ASN  71   7.458   9.806   0.034
  566    HB2  ASN  71           HB2      ASN  71   6.132   7.123  -0.303
  567    HB3  ASN  71           HB3      ASN  71   5.365   8.648  -0.743
  568   HD21  ASN  71          1HD2      ASN  71   6.247   6.331  -2.345
  569   HD22  ASN  71          2HD2      ASN  71   7.293   6.979  -3.554
  570    H    LYS  72           H        LYS  72   7.462   8.037   2.826
  571    HA   LYS  72           HA       LYS  72   5.037   8.349   4.071
  572    HB2  LYS  72           HB2      LYS  72   7.003   7.311   5.125
  573    HB3  LYS  72           HB3      LYS  72   7.760   8.890   5.277
  574    HG2  LYS  72           HG2      LYS  72   5.962   9.597   6.785
  575    HG3  LYS  72           HG3      LYS  72   5.222   8.002   6.638
  576    HD2  LYS  72           HD2      LYS  72   7.211   6.978   7.608
  577    HD3  LYS  72           HD3      LYS  72   7.984   8.559   7.721
  578    HE2  LYS  72           HE2      LYS  72   5.419   7.802   9.108
  579    HE3  LYS  72           HE3      LYS  72   7.012   7.759   9.859
  580    HZ1  LYS  72           HZ1      LYS  72   5.647  10.177   8.789
  581    HZ2  LYS  72           HZ2      LYS  72   7.213  10.153   9.433
  582    HZ3  LYS  72           HZ3      LYS  72   5.881   9.797  10.423
  583    H    GLU  73           H        GLU  73   7.281  10.804   3.154
  584    HA   GLU  73           HA       GLU  73   6.660  13.030   4.607
  585    HB2  GLU  73           HB2      GLU  73   6.837  12.997   1.591
  586    HB3  GLU  73           HB3      GLU  73   7.202  14.345   2.655
  587    HG2  GLU  73           HG2      GLU  73   9.224  13.463   3.299
  588    HG3  GLU  73           HG3      GLU  73   8.760  11.812   2.895
  589    H    ARG  74           H        ARG  74   4.896  11.848   1.756
  590    HA   ARG  74           HA       ARG  74   2.923  13.950   2.034
  591    HB2  ARG  74           HB2      ARG  74   2.092  13.134  -0.120
  592    HB3  ARG  74           HB3      ARG  74   3.821  13.440  -0.167
  593    HG2  ARG  74           HG2      ARG  74   3.849  10.834   0.468
  594    HG3  ARG  74           HG3      ARG  74   2.331  10.910  -0.429
  595    HD2  ARG  74           HD2      ARG  74   4.069  10.394  -1.983
  596    HD3  ARG  74           HD3      ARG  74   3.568  12.058  -2.258
  597    HE   ARG  74           HE       ARG  74   5.733  12.089  -0.496
  598   HH11  ARG  74          2HH1      ARG  74   5.075  11.255  -3.831
  599   HH12  ARG  74          1HH1      ARG  74   6.670  11.666  -4.385
  600   HH21  ARG  74          2HH2      ARG  74   7.856  12.617  -1.218
  601   HH22  ARG  74          1HH2      ARG  74   8.230  12.452  -2.910
  602    H    PHE  75           H        PHE  75   3.176  10.527   2.673
  603    HA   PHE  75           HA       PHE  75   0.371  10.056   2.875
  604    HB2  PHE  75           HB2      PHE  75   2.670   8.500   4.070
  605    HB3  PHE  75           HB3      PHE  75   1.008   7.945   3.917
  606    HD1  PHE  75           HD1      PHE  75   0.248   8.639   1.242
  607    HD2  PHE  75           HD2      PHE  75   3.988   7.229   2.691
  608    HE1  PHE  75           HE1      PHE  75   0.749   7.697  -0.973
  609    HE2  PHE  75           HE2      PHE  75   4.496   6.289   0.479
  610    HZ   PHE  75           HZ       PHE  75   2.874   6.523  -1.358
  611    H    ASP  76           H        ASP  76   2.713  11.500   4.897
  612    HA   ASP  76           HA       ASP  76   1.591  10.889   7.429
  613    HB2  ASP  76           HB2      ASP  76   3.924  11.944   6.753
  614    HB3  ASP  76           HB3      ASP  76   3.051  13.458   6.970
  615    H    GLY  77           H        GLY  77  -0.322  11.515   8.153
  616    HA2  GLY  77           HA1      GLY  77  -1.819  13.310   8.783
  617    HA3  GLY  77           HA2      GLY  77  -1.396  14.117   7.277
  618    H    LYS  78           H        LYS  78  -1.525  11.219   6.141
  619    HA   LYS  78           HA       LYS  78  -4.380  11.343   5.516
  620    HB2  LYS  78           HB2      LYS  78  -2.049   9.955   4.197
  621    HB3  LYS  78           HB3      LYS  78  -3.716   9.644   3.735
  622    HG2  LYS  78           HG2      LYS  78  -4.008  11.948   3.079
  623    HG3  LYS  78           HG3      LYS  78  -2.389  12.346   3.653
  624    HD2  LYS  78           HD2      LYS  78  -2.509  12.074   1.197
  625    HD3  LYS  78           HD3      LYS  78  -1.392  10.944   1.963
  626    HE2  LYS  78           HE2      LYS  78  -2.744   9.863   0.233
  627    HE3  LYS  78           HE3      LYS  78  -3.047   9.179   1.823
  628    HZ1  LYS  78           HZ1      LYS  78  -4.771  11.255   0.576
  629    HZ2  LYS  78           HZ2      LYS  78  -5.108  10.332   1.961
  630    HZ3  LYS  78           HZ3      LYS  78  -5.064   9.591   0.439
  631    H    VAL  79           H        VAL  79  -5.172   8.937   4.958
  632    HA   VAL  79           HA       VAL  79  -5.079   7.592   7.546
  633    HB   VAL  79           HB       VAL  79  -6.846   7.065   5.149
  634   HG11  VAL  79          2HG1      VAL  79  -6.567   5.086   6.536
  635   HG12  VAL  79          1HG1      VAL  79  -8.199   5.734   6.691
  636   HG13  VAL  79          3HG1      VAL  79  -7.014   6.012   7.969
  637   HG21  VAL  79          3HG2      VAL  79  -8.610   8.145   6.477
  638   HG22  VAL  79          2HG2      VAL  79  -7.284   9.250   6.111
  639   HG23  VAL  79          1HG2      VAL  79  -7.420   8.538   7.718
  640    H    VAL  80           H        VAL  80  -3.458   6.159   7.772
  641    HA   VAL  80           HA       VAL  80  -2.948   4.362   5.494
  642    HB   VAL  80           HB       VAL  80  -0.660   4.406   5.790
  643   HG11  VAL  80          2HG1      VAL  80   0.065   6.735   5.967
  644   HG12  VAL  80          1HG1      VAL  80  -1.519   7.170   6.607
  645   HG13  VAL  80          3HG1      VAL  80  -1.371   6.561   4.958
  646   HG21  VAL  80          3HG2      VAL  80  -1.032   5.534   8.556
  647   HG22  VAL  80          2HG2      VAL  80   0.514   5.179   7.783
  648   HG23  VAL  80          1HG2      VAL  80  -0.609   3.868   8.151
  649    H    LEU  81           H        LEU  81  -2.355   2.227   5.964
  650    HA   LEU  81           HA       LEU  81  -2.864   1.325   8.727
  651    HB2  LEU  81           HB2      LEU  81  -4.523   0.459   7.165
  652    HB3  LEU  81           HB3      LEU  81  -3.251  -0.167   6.133
  653    HG   LEU  81           HG       LEU  81  -2.541  -1.555   8.185
  654   HD11  LEU  81          2HD1      LEU  81  -3.892  -0.397   9.839
  655   HD12  LEU  81          1HD1      LEU  81  -4.345  -2.098   9.737
  656   HD13  LEU  81          3HD1      LEU  81  -5.363  -0.868   8.989
  657   HD21  LEU  81          3HD2      LEU  81  -3.449  -2.546   6.207
  658   HD22  LEU  81          2HD2      LEU  81  -5.089  -2.107   6.687
  659   HD23  LEU  81          1HD2      LEU  81  -4.187  -3.300   7.621
  660    H    GLU  82           H        GLU  82  -1.107   0.564   9.732
  661    HA   GLU  82           HA       GLU  82   1.234  -0.074   8.074
  662    HB2  GLU  82           HB2      GLU  82   1.434   1.807   9.688
  663    HB3  GLU  82           HB3      GLU  82   1.132   0.679  11.001
  664    HG2  GLU  82           HG2      GLU  82   3.169  -0.505  10.511
  665    HG3  GLU  82           HG3      GLU  82   3.456   0.511   9.096
  666    H    VAL  83           H        VAL  83   1.097  -2.194   7.655
  667    HA   VAL  83           HA       VAL  83   1.014  -4.027   9.968
  668    HB   VAL  83           HB       VAL  83   0.035  -5.732   8.434
  669   HG11  VAL  83          2HG1      VAL  83  -1.594  -3.218   8.781
  670   HG12  VAL  83          1HG1      VAL  83  -1.388  -4.500   9.973
  671   HG13  VAL  83          3HG1      VAL  83  -2.243  -4.829   8.466
  672   HG21  VAL  83          3HG2      VAL  83  -1.032  -4.942   6.341
  673   HG22  VAL  83          2HG2      VAL  83   0.727  -4.834   6.301
  674   HG23  VAL  83          1HG2      VAL  83  -0.238  -3.382   6.558
  675    HA   PRO  84           HA       PRO  84   4.833  -5.823   8.586
  676    HB2  PRO  84           HB2      PRO  84   3.627  -8.520   8.674
  677    HB3  PRO  84           HB3      PRO  84   4.992  -7.870   9.586
  678    HG2  PRO  84           HG2      PRO  84   2.633  -8.328  10.757
  679    HG3  PRO  84           HG3      PRO  84   3.635  -6.934  11.208
  680    HD2  PRO  84           HD2      PRO  84   1.208  -7.041   9.459
  681    HD3  PRO  84           HD3      PRO  84   1.666  -5.833  10.678
  682    H    VAL  85           H        VAL  85   5.858  -6.757   6.788
  683    HA   VAL  85           HA       VAL  85   4.524  -6.410   4.341
  684    HB   VAL  85           HB       VAL  85   6.950  -6.114   4.630
  685   HG11  VAL  85          2HG1      VAL  85   7.415  -8.006   6.080
  686   HG12  VAL  85          1HG1      VAL  85   8.449  -8.043   4.653
  687   HG13  VAL  85          3HG1      VAL  85   7.058  -9.122   4.762
  688   HG21  VAL  85          3HG2      VAL  85   7.658  -7.142   2.517
  689   HG22  VAL  85          2HG2      VAL  85   6.075  -6.376   2.390
  690   HG23  VAL  85          1HG2      VAL  85   6.198  -8.131   2.522
  691    H    SER  86           H        SER  86   4.839  -9.166   6.384
  692    HA   SER  86           HA       SER  86   4.335 -11.163   4.419
  693    HB2  SER  86           HB2      SER  86   3.880 -11.372   7.398
  694    HB3  SER  86           HB3      SER  86   4.216 -12.680   6.264
  695    HG   SER  86           HG       SER  86   5.975 -11.437   7.677
  696    H    ALA  87           H        ALA  87   2.326  -8.918   6.044
  697    HA   ALA  87           HA       ALA  87  -0.004 -10.467   6.386
  698    HB1  ALA  87           HB1      ALA  87  -1.166  -8.378   6.747
  699    HB2  ALA  87           HB2      ALA  87   0.388  -8.368   7.579
  700    HB3  ALA  87           HB3      ALA  87   0.192  -7.480   6.067
  701    HA   PRO  88           HA       PRO  88  -1.752  -8.460   2.354
  702    HB2  PRO  88           HB2      PRO  88   0.034  -7.488   0.538
  703    HB3  PRO  88           HB3      PRO  88  -0.736  -6.494   1.779
  704    HG2  PRO  88           HG2      PRO  88   1.978  -7.751   1.770
  705    HG3  PRO  88           HG3      PRO  88   1.499  -6.119   2.276
  706    HD2  PRO  88           HD2      PRO  88   1.945  -8.078   4.061
  707    HD3  PRO  88           HD3      PRO  88   0.689  -6.849   4.314
  708    H    ILE  89           H        ILE  89   1.168 -10.312   2.421
  709    HA   ILE  89           HA       ILE  89   0.998 -11.510  -0.135
  710    HB   ILE  89           HB       ILE  89   2.225 -12.550   2.427
  711   HG12  ILE  89          2HG1      ILE  89   3.452 -11.149   0.040
  712   HG13  ILE  89          3HG1      ILE  89   3.189 -10.438   1.629
  713   HG21  ILE  89          2HG2      ILE  89   3.505 -14.083   1.016
  714   HG22  ILE  89          1HG2      ILE  89   2.615 -13.525  -0.401
  715   HG23  ILE  89          3HG2      ILE  89   1.772 -14.387   0.887
  716   HD11  ILE  89          3HD1      ILE  89   5.502 -11.056   1.352
  717   HD12  ILE  89          2HD1      ILE  89   5.043 -12.715   0.973
  718   HD13  ILE  89          1HD1      ILE  89   4.757 -12.068   2.589
  719    H    LYS  90           H        LYS  90  -0.277 -12.375   3.033
  720    HA   LYS  90           HA       LYS  90  -1.635 -14.707   1.906
  721    HB2  LYS  90           HB2      LYS  90  -1.346 -13.752   4.759
  722    HB3  LYS  90           HB3      LYS  90  -2.188 -15.218   4.276
  723    HG2  LYS  90           HG2      LYS  90   0.736 -14.649   3.849
  724    HG3  LYS  90           HG3      LYS  90   0.051 -15.699   5.092
  725    HD2  LYS  90           HD2      LYS  90  -0.944 -17.091   3.296
  726    HD3  LYS  90           HD3      LYS  90  -0.119 -16.085   2.104
  727    HE2  LYS  90           HE2      LYS  90   2.032 -16.732   3.011
  728    HE3  LYS  90           HE3      LYS  90   1.240 -17.663   4.282
  729    HZ1  LYS  90           HZ1      LYS  90   0.262 -19.069   2.536
  730    HZ2  LYS  90           HZ2      LYS  90   1.957 -19.129   2.542
  731    HZ3  LYS  90           HZ3      LYS  90   1.145 -18.220   1.364
  732    H    ASP  91           H        ASP  91  -2.320 -11.664   3.557
  733    HA   ASP  91           HA       ASP  91  -5.202 -12.193   3.245
  734    HB2  ASP  91           HB2      ASP  91  -3.720 -10.577   5.327
  735    HB3  ASP  91           HB3      ASP  91  -5.472 -10.611   5.175
  736    H    ALA  92           H        ALA  92  -3.850 -11.064   1.073
  737    HA   ALA  92           HA       ALA  92  -3.653  -8.300   0.967
  738    HB1  ALA  92           HB1      ALA  92  -3.960  -8.497  -1.458
  739    HB2  ALA  92           HB2      ALA  92  -2.887  -9.753  -0.838
  740    HB3  ALA  92           HB3      ALA  92  -4.556 -10.145  -1.251
  741    H    GLU  93           H        GLU  93  -6.571 -10.282   0.379
  742    HA   GLU  93           HA       GLU  93  -8.196  -8.031  -0.237
  743    HB2  GLU  93           HB2      GLU  93  -8.957 -10.808   0.682
  744    HB3  GLU  93           HB3      GLU  93 -10.111  -9.593   0.149
  745    HG2  GLU  93           HG2      GLU  93  -8.979  -9.539  -2.047
  746    HG3  GLU  93           HG3      GLU  93  -7.924 -10.841  -1.498
  747    H    LYS  94           H        LYS  94  -7.247  -9.583   2.726
  748    HA   LYS  94           HA       LYS  94  -9.276  -8.366   4.346
  749    HB2  LYS  94           HB2      LYS  94  -6.694  -9.764   5.042
  750    HB3  LYS  94           HB3      LYS  94  -7.744  -9.055   6.257
  751    HG2  LYS  94           HG2      LYS  94  -8.297 -11.313   6.244
  752    HG3  LYS  94           HG3      LYS  94  -9.577 -10.545   5.308
  753    HD2  LYS  94           HD2      LYS  94  -8.650 -11.298   3.259
  754    HD3  LYS  94           HD3      LYS  94  -7.147 -11.792   4.042
  755    HE2  LYS  94           HE2      LYS  94  -9.869 -13.030   4.436
  756    HE3  LYS  94           HE3      LYS  94  -8.516 -13.733   3.551
  757    HZ1  LYS  94           HZ1      LYS  94  -8.698 -13.224   6.469
  758    HZ2  LYS  94           HZ2      LYS  94  -7.246 -13.618   5.691
  759    HZ3  LYS  94           HZ3      LYS  94  -8.538 -14.720   5.684
  760    H    VAL  95           H        VAL  95  -5.903  -7.738   3.591
  761    HA   VAL  95           HA       VAL  95  -5.489  -5.619   5.391
  762    HB   VAL  95           HB       VAL  95  -3.794  -6.997   4.053
  763   HG11  VAL  95          2HG1      VAL  95  -2.946  -6.048   2.005
  764   HG12  VAL  95          1HG1      VAL  95  -4.249  -4.860   2.011
  765   HG13  VAL  95          3HG1      VAL  95  -4.623  -6.578   1.836
  766   HG21  VAL  95          3HG2      VAL  95  -3.090  -5.279   5.567
  767   HG22  VAL  95          2HG2      VAL  95  -3.436  -4.033   4.367
  768   HG23  VAL  95          1HG2      VAL  95  -2.125  -5.181   4.093
  769    H    ILE  96           H        ILE  96  -6.625  -5.743   2.085
  770    HA   ILE  96           HA       ILE  96  -6.832  -2.961   1.640
  771    HB   ILE  96           HB       ILE  96  -8.382  -5.245   0.401
  772   HG12  ILE  96          2HG1      ILE  96  -6.072  -3.577  -0.630
  773   HG13  ILE  96          3HG1      ILE  96  -5.947  -5.224  -0.020
  774   HG21  ILE  96          2HG2      ILE  96  -9.024  -3.637  -1.351
  775   HG22  ILE  96          1HG2      ILE  96  -8.281  -2.337  -0.419
  776   HG23  ILE  96          3HG2      ILE  96  -9.683  -3.193   0.224
  777   HD11  ILE  96          3HD1      ILE  96  -5.928  -5.172  -2.444
  778   HD12  ILE  96          2HD1      ILE  96  -7.491  -4.353  -2.451
  779   HD13  ILE  96          1HD1      ILE  96  -7.364  -6.004  -1.844
  780    H    ASN  97           H        ASN  97  -9.300  -5.332   2.649
  781    HA   ASN  97           HA       ASN  97 -11.379  -3.515   3.101
  782    HB2  ASN  97           HB2      ASN  97 -10.756  -6.191   4.326
  783    HB3  ASN  97           HB3      ASN  97 -12.186  -5.273   4.780
  784   HD21  ASN  97          1HD2      ASN  97 -12.002  -7.865   3.522
  785   HD22  ASN  97          2HD2      ASN  97 -12.839  -7.742   2.012
  786    H    ALA  98           H        ALA  98  -8.802  -4.642   5.217
  787    HA   ALA  98           HA       ALA  98  -9.680  -3.459   7.593
  788    HB1  ALA  98           HB1      ALA  98  -7.928  -5.166   7.505
  789    HB2  ALA  98           HB2      ALA  98  -6.846  -4.013   6.725
  790    HB3  ALA  98           HB3      ALA  98  -7.389  -3.731   8.378
  791    H    ALA  99           H        ALA  99  -7.657  -2.208   4.980
  792    HA   ALA  99           HA       ALA  99  -7.061   0.279   6.191
  793    HB1  ALA  99           HB1      ALA  99  -6.436   1.013   3.942
  794    HB2  ALA  99           HB2      ALA  99  -5.781  -0.586   4.300
  795    HB3  ALA  99           HB3      ALA  99  -7.196  -0.426   3.260
  796    H    LEU 100           H        LEU 100  -9.692  -0.851   4.124
  797    HA   LEU 100           HA       LEU 100 -10.932   1.669   3.761
  798    HB2  LEU 100           HB2      LEU 100 -12.216  -1.062   3.712
  799    HB3  LEU 100           HB3      LEU 100 -12.892   0.407   3.044
  800    HG   LEU 100           HG       LEU 100 -10.358  -0.909   2.059
  801   HD11  LEU 100          2HD1      LEU 100 -12.285  -2.305   1.583
  802   HD12  LEU 100          1HD1      LEU 100 -11.695  -1.544   0.105
  803   HD13  LEU 100          3HD1      LEU 100 -13.141  -0.923   0.901
  804   HD21  LEU 100          3HD2      LEU 100 -10.417   1.512   1.715
  805   HD22  LEU 100          2HD2      LEU 100 -11.992   1.364   0.934
  806   HD23  LEU 100          1HD2      LEU 100 -10.566   0.642   0.187
  807    H    ALA 101           H        ALA 101 -11.122  -0.764   6.274
  808    HA   ALA 101           HA       ALA 101 -13.397   0.256   7.609
  809    HB1  ALA 101           HB1      ALA 101 -12.541  -1.984   8.020
  810    HB2  ALA 101           HB2      ALA 101 -11.070  -1.305   8.721
  811    HB3  ALA 101           HB3      ALA 101 -12.623  -1.058   9.520
  812    H    LEU 102           H        LEU 102 -10.103   1.292   7.486
  813    HA   LEU 102           HA       LEU 102 -10.073   2.794   9.896
  814    HB2  LEU 102           HB2      LEU 102  -8.452   3.172   7.378
  815    HB3  LEU 102           HB3      LEU 102  -8.106   3.906   8.931
  816    HG   LEU 102           HG       LEU 102  -8.042   0.948   8.330
  817   HD11  LEU 102          2HD1      LEU 102  -5.841   2.946   8.815
  818   HD12  LEU 102          1HD1      LEU 102  -6.195   2.114   7.301
  819   HD13  LEU 102          3HD1      LEU 102  -5.623   1.202   8.697
  820   HD21  LEU 102          3HD2      LEU 102  -8.732   1.399  10.629
  821   HD22  LEU 102          2HD2      LEU 102  -7.330   2.447  10.848
  822   HD23  LEU 102          1HD2      LEU 102  -7.104   0.720  10.571
  823    H    ILE 103           H        ILE 103 -11.168   3.444   6.637
  824    HA   ILE 103           HA       ILE 103 -11.982   6.142   7.464
  825    HB   ILE 103           HB       ILE 103 -12.628   6.498   5.099
  826   HG12  ILE 103          2HG1      ILE 103 -11.361   3.787   4.632
  827   HG13  ILE 103          3HG1      ILE 103 -13.083   4.136   4.523
  828   HG21  ILE 103          2HG2      ILE 103 -10.419   7.159   5.903
  829   HG22  ILE 103          1HG2      ILE 103 -10.368   6.668   4.212
  830   HG23  ILE 103          3HG2      ILE 103  -9.781   5.575   5.465
  831   HD11  ILE 103          3HD1      ILE 103 -12.654   5.658   2.665
  832   HD12  ILE 103          2HD1      ILE 103 -12.065   4.031   2.326
  833   HD13  ILE 103          1HD1      ILE 103 -10.930   5.304   2.776
  834    H    ASP 104           H        ASP 104 -13.047   3.198   7.847
  835    HA   ASP 104           HA       ASP 104 -15.018   2.196   8.310
  836    HB2  ASP 104           HB2      ASP 104 -15.219   4.381   9.609
  837    HB3  ASP 104           HB3      ASP 104 -16.269   4.937   8.310
  838    H    GLU 105           H        GLU 105 -14.315   2.303   5.652
  839    HA   GLU 105           HA       GLU 105 -15.064   2.022   3.535
  840    HB2  GLU 105           HB2      GLU 105 -17.625   1.394   5.003
  841    HB3  GLU 105           HB3      GLU 105 -17.379   1.110   3.285
  842    HG2  GLU 105           HG2      GLU 105 -15.525  -0.408   3.823
  843    HG3  GLU 105           HG3      GLU 105 -15.835  -0.150   5.539
  844    H    LYS 106           H        LYS 106 -14.715   4.465   3.640
  845    HA   LYS 106           HA       LYS 106 -17.203   5.924   3.107
  846    HB2  LYS 106           HB2      LYS 106 -15.632   6.907   4.748
  847    HB3  LYS 106           HB3      LYS 106 -14.391   6.973   3.504
  848    HG2  LYS 106           HG2      LYS 106 -16.100   8.394   2.195
  849    HG3  LYS 106           HG3      LYS 106 -16.892   8.590   3.759
  850    HD2  LYS 106           HD2      LYS 106 -15.359  10.437   3.300
  851    HD3  LYS 106           HD3      LYS 106 -14.828   9.498   4.698
  852    HE2  LYS 106           HE2      LYS 106 -12.998  10.130   3.116
  853    HE3  LYS 106           HE3      LYS 106 -13.144   8.397   3.410
  854    HZ1  LYS 106           HZ1      LYS 106 -12.813   8.960   1.045
  855    HZ2  LYS 106           HZ2      LYS 106 -14.286   9.798   1.049
  856    HZ3  LYS 106           HZ3      LYS 106 -14.264   8.124   1.322
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1 -16.851   0.281  -4.759
    2    H2   MET   1           H2       MET   1 -16.911  -0.811  -6.051
    3    H3   MET   1           H3       MET   1 -18.244   0.180  -5.721
    4    HA   MET   1           HA       MET   1 -17.034   0.996  -7.628
    5    HB2  MET   1           HB2      MET   1 -16.946   2.626  -5.099
    6    HB3  MET   1           HB3      MET   1 -16.389   3.294  -6.627
    7    HG2  MET   1           HG2      MET   1 -19.149   2.234  -6.071
    8    HG3  MET   1           HG3      MET   1 -18.683   3.933  -6.147
    9    HE1  MET   1           HE1      MET   1 -21.090   2.854  -7.828
   10    HE2  MET   1           HE2      MET   1 -20.514   4.516  -7.958
   11    HE3  MET   1           HE3      MET   1 -20.776   3.556  -9.416
   12    H    LYS   2           H        LYS   2 -15.065   2.225  -8.315
   13    HA   LYS   2           HA       LYS   2 -12.732   0.703  -7.706
   14    HB2  LYS   2           HB2      LYS   2 -13.039   3.265  -9.289
   15    HB3  LYS   2           HB3      LYS   2 -11.550   2.343  -9.178
   16    HG2  LYS   2           HG2      LYS   2 -12.400   1.655 -11.199
   17    HG3  LYS   2           HG3      LYS   2 -12.984   0.394 -10.114
   18    HD2  LYS   2           HD2      LYS   2 -14.792   1.016 -11.542
   19    HD3  LYS   2           HD3      LYS   2 -15.136   1.662  -9.937
   20    HE2  LYS   2           HE2      LYS   2 -15.656   3.307 -11.651
   21    HE3  LYS   2           HE3      LYS   2 -14.315   3.859 -10.648
   22    HZ1  LYS   2           HZ1      LYS   2 -13.838   2.462 -13.212
   23    HZ2  LYS   2           HZ2      LYS   2 -12.793   3.483 -12.350
   24    HZ3  LYS   2           HZ3      LYS   2 -14.131   4.130 -13.162
   25    H    ARG   3           H        ARG   3 -12.239   0.935  -5.546
   26    HA   ARG   3           HA       ARG   3 -12.118   3.513  -4.305
   27    HB2  ARG   3           HB2      ARG   3 -12.335   0.955  -3.353
   28    HB3  ARG   3           HB3      ARG   3 -10.653   1.324  -2.998
   29    HG2  ARG   3           HG2      ARG   3 -12.123   1.860  -1.123
   30    HG3  ARG   3           HG3      ARG   3 -11.316   3.299  -1.756
   31    HD2  ARG   3           HD2      ARG   3 -13.288   3.965  -2.934
   32    HD3  ARG   3           HD3      ARG   3 -14.093   2.446  -2.552
   33    HE   ARG   3           HE       ARG   3 -13.606   3.458  -0.110
   34   HH11  ARG   3          2HH1      ARG   3 -14.961   4.906  -2.983
   35   HH12  ARG   3          1HH1      ARG   3 -16.099   5.892  -2.116
   36   HH21  ARG   3          2HH2      ARG   3 -15.064   4.759   1.048
   37   HH22  ARG   3          1HH2      ARG   3 -16.116   5.846   0.190
   38    H    LYS   4           H        LYS   4 -10.269   4.618  -3.602
   39    HA   LYS   4           HA       LYS   4  -8.013   4.203  -5.424
   40    HB2  LYS   4           HB2      LYS   4  -8.443   6.581  -3.626
   41    HB3  LYS   4           HB3      LYS   4  -7.477   6.485  -5.090
   42    HG2  LYS   4           HG2      LYS   4 -10.483   6.401  -4.938
   43    HG3  LYS   4           HG3      LYS   4  -9.499   7.767  -5.464
   44    HD2  LYS   4           HD2      LYS   4  -8.645   6.411  -7.324
   45    HD3  LYS   4           HD3      LYS   4  -9.671   5.071  -6.806
   46    HE2  LYS   4           HE2      LYS   4 -10.607   7.793  -7.709
   47    HE3  LYS   4           HE3      LYS   4 -10.699   6.300  -8.640
   48    HZ1  LYS   4           HZ1      LYS   4 -12.819   6.752  -7.653
   49    HZ2  LYS   4           HZ2      LYS   4 -12.140   6.897  -6.110
   50    HZ3  LYS   4           HZ3      LYS   4 -12.157   5.392  -6.887
   51    H    ILE   5           H        ILE   5  -6.253   3.217  -4.662
   52    HA   ILE   5           HA       ILE   5  -5.580   3.534  -1.817
   53    HB   ILE   5           HB       ILE   5  -5.529   0.909  -3.311
   54   HG12  ILE   5          2HG1      ILE   5  -7.305   1.812  -1.030
   55   HG13  ILE   5          3HG1      ILE   5  -7.818   1.610  -2.701
   56   HG21  ILE   5          2HG2      ILE   5  -3.706   1.101  -1.705
   57   HG22  ILE   5          1HG2      ILE   5  -4.899  -0.076  -1.157
   58   HG23  ILE   5          3HG2      ILE   5  -4.853   1.534  -0.438
   59   HD11  ILE   5          3HD1      ILE   5  -8.519  -0.272  -1.362
   60   HD12  ILE   5          2HD1      ILE   5  -6.856  -0.569  -0.857
   61   HD13  ILE   5          1HD1      ILE   5  -7.318  -0.786  -2.545
   62    H    ILE   6           H        ILE   6  -3.449   3.835  -1.420
   63    HA   ILE   6           HA       ILE   6  -1.558   3.115  -3.554
   64    HB   ILE   6           HB       ILE   6  -0.040   4.906  -2.830
   65   HG12  ILE   6          2HG1      ILE   6  -1.034   5.109  -0.495
   66   HG13  ILE   6          3HG1      ILE   6  -0.610   6.613  -1.297
   67   HG21  ILE   6          2HG2      ILE   6  -1.454   5.308  -4.726
   68   HG22  ILE   6          1HG2      ILE   6  -1.292   6.798  -3.797
   69   HG23  ILE   6          3HG2      ILE   6  -2.770   5.842  -3.681
   70   HD11  ILE   6          3HD1      ILE   6  -2.962   6.967  -1.860
   71   HD12  ILE   6          2HD1      ILE   6  -2.712   6.812  -0.121
   72   HD13  ILE   6          1HD1      ILE   6  -3.380   5.462  -1.040
   73    H    ALA   7           H        ALA   7   0.211   1.970  -2.946
   74    HA   ALA   7           HA       ALA   7   0.476   1.355  -0.091
   75    HB1  ALA   7           HB1      ALA   7   0.581  -1.030  -0.538
   76    HB2  ALA   7           HB2      ALA   7  -0.963  -0.372  -1.083
   77    HB3  ALA   7           HB3      ALA   7   0.305  -0.739  -2.256
   78    H    VAL   8           H        VAL   8   2.535   0.858   0.571
   79    HA   VAL   8           HA       VAL   8   4.617   0.866  -1.517
   80    HB   VAL   8           HB       VAL   8   4.855   2.063   1.255
   81   HG11  VAL   8          2HG1      VAL   8   6.949   1.081   0.461
   82   HG12  VAL   8          1HG1      VAL   8   7.047   2.841   0.516
   83   HG13  VAL   8          3HG1      VAL   8   6.827   2.018  -1.028
   84   HG21  VAL   8          3HG2      VAL   8   5.024   4.216   0.099
   85   HG22  VAL   8          2HG2      VAL   8   3.472   3.437  -0.218
   86   HG23  VAL   8          1HG2      VAL   8   4.739   3.411  -1.445
   87    H    THR   9           H        THR   9   6.024  -0.760  -1.454
   88    HA   THR   9           HA       THR   9   5.892  -2.616   0.831
   89    HB   THR   9           HB       THR   9   6.621  -4.358  -0.894
   90    HG1  THR   9           HG1      THR   9   5.872  -2.202  -2.604
   91   HG21  THR   9          3HG2      THR   9   3.905  -3.071  -1.181
   92   HG22  THR   9          1HG2      THR   9   4.361  -4.291   0.010
   93   HG23  THR   9          2HG2      THR   9   4.325  -4.704  -1.705
   94    H    ALA  10           H        ALA  10   7.781  -3.021   1.869
   95    HA   ALA  10           HA       ALA  10  10.323  -2.683   0.550
   96    HB1  ALA  10           HB1      ALA  10  11.145  -0.865   1.937
   97    HB2  ALA  10           HB2      ALA  10   9.727  -0.349   1.025
   98    HB3  ALA  10           HB3      ALA  10   9.578  -0.744   2.737
   99    H    CYS  11           H        CYS  11  10.877  -4.722   1.237
  100    HA   CYS  11           HA       CYS  11  11.153  -5.050   4.150
  101    HB2  CYS  11           HB2      CYS  11   9.551  -6.654   3.242
  102    HB3  CYS  11           HB3      CYS  11  10.728  -7.186   2.048
  103    HG   CYS  11           HG       CYS  11  10.417  -8.035   5.278
  104    H    ALA  12           H        ALA  12  13.150  -5.318   4.915
  105    HA   ALA  12           HA       ALA  12  15.342  -5.491   2.992
  106    HB1  ALA  12           HB1      ALA  12  15.393  -4.878   5.944
  107    HB2  ALA  12           HB2      ALA  12  16.770  -4.794   4.845
  108    HB3  ALA  12           HB3      ALA  12  15.411  -3.689   4.642
  109    H    THR  13           H        THR  13  13.623  -7.450   5.191
  110    HA   THR  13           HA       THR  13  15.689  -9.258   5.922
  111    HB   THR  13           HB       THR  13  12.813 -10.083   5.677
  112    HG1  THR  13           HG1      THR  13  13.949  -8.294   7.586
  113   HG21  THR  13          3HG2      THR  13  13.342 -11.294   7.754
  114   HG22  THR  13          1HG2      THR  13  14.982 -10.651   7.697
  115   HG23  THR  13          2HG2      THR  13  14.420 -11.746   6.433
  116    H    GLY  14           H        GLY  14  13.095  -9.414   3.498
  117    HA2  GLY  14           HA1      GLY  14  14.820 -11.068   1.812
  118    HA3  GLY  14           HA2      GLY  14  13.254 -11.725   2.272
  119    H    VAL  15           H        VAL  15  14.888 -10.007  -0.045
  120    HA   VAL  15           HA       VAL  15  13.057  -8.027  -0.793
  121    HB   VAL  15           HB       VAL  15  14.212  -8.058  -2.988
  122   HG11  VAL  15          2HG1      VAL  15  15.069  -6.702  -1.174
  123   HG12  VAL  15          1HG1      VAL  15  16.407  -7.365  -2.117
  124   HG13  VAL  15          3HG1      VAL  15  15.988  -8.073  -0.555
  125   HG21  VAL  15          3HG2      VAL  15  16.165  -9.508  -3.293
  126   HG22  VAL  15          2HG2      VAL  15  14.675 -10.441  -3.161
  127   HG23  VAL  15          1HG2      VAL  15  15.777 -10.339  -1.787
  128    H    ALA  16           H        ALA  16  13.140 -11.456  -1.440
  129    HA   ALA  16           HA       ALA  16  11.421 -11.552  -3.656
  130    HB1  ALA  16           HB1      ALA  16  11.731 -13.590  -1.455
  131    HB2  ALA  16           HB2      ALA  16  11.033 -13.877  -3.050
  132    HB3  ALA  16           HB3      ALA  16  12.741 -13.468  -2.895
  133    H    HIS  17           H        HIS  17  10.790 -11.281  -0.216
  134    HA   HIS  17           HA       HIS  17   7.973 -11.698  -0.394
  135    HB2  HIS  17           HB2      HIS  17   9.729 -10.474   1.734
  136    HB3  HIS  17           HB3      HIS  17   7.976 -10.538   1.890
  137    HD1  HIS  17           HD1      HIS  17  10.602 -12.209   3.290
  138    HD2  HIS  17           HD2      HIS  17   7.322 -13.552   1.108
  139    HE1  HIS  17           HE1      HIS  17  10.335 -14.636   3.885
  140    HE2  HIS  17           HE2      HIS  17   8.242 -15.378   2.696
  141    H    THR  18           H        THR  18  10.095  -8.937  -0.643
  142    HA   THR  18           HA       THR  18   8.171  -6.900  -0.455
  143    HB   THR  18           HB       THR  18  10.694  -6.812  -2.116
  144    HG1  THR  18           HG1      THR  18  11.809  -6.608  -0.277
  145   HG21  THR  18          3HG2      THR  18   9.130  -4.677  -0.655
  146   HG22  THR  18          1HG2      THR  18   9.242  -4.881  -2.403
  147   HG23  THR  18          2HG2      THR  18  10.672  -4.427  -1.474
  148    H    TYR  19           H        TYR  19   9.428  -8.704  -3.251
  149    HA   TYR  19           HA       TYR  19   7.944  -7.317  -5.217
  150    HB2  TYR  19           HB2      TYR  19   9.131 -10.094  -5.189
  151    HB3  TYR  19           HB3      TYR  19   8.319  -9.416  -6.594
  152    HD1  TYR  19           HD2      TYR  19   9.278  -7.294  -7.622
  153    HD2  TYR  19           HD1      TYR  19  11.396  -9.640  -4.772
  154    HE1  TYR  19           HE2      TYR  19  11.390  -6.265  -8.354
  155    HE2  TYR  19           HE1      TYR  19  13.512  -8.623  -5.497
  156    HH   TYR  19           HH       TYR  19  13.627  -5.879  -7.593
  157    H    MET  20           H        MET  20   7.235 -10.162  -3.242
  158    HA   MET  20           HA       MET  20   4.871 -10.816  -4.713
  159    HB2  MET  20           HB2      MET  20   6.236 -12.497  -3.466
  160    HB3  MET  20           HB3      MET  20   5.633 -11.799  -1.968
  161    HG2  MET  20           HG2      MET  20   3.363 -12.369  -2.566
  162    HG3  MET  20           HG3      MET  20   3.907 -12.983  -4.128
  163    HE1  MET  20           HE1      MET  20   2.078 -14.770  -2.346
  164    HE2  MET  20           HE2      MET  20   2.795 -15.322  -3.862
  165    HE3  MET  20           HE3      MET  20   2.923 -16.317  -2.411
  166    H    ALA  21           H        ALA  21   5.520  -9.090  -1.697
  167    HA   ALA  21           HA       ALA  21   2.870  -8.849  -0.813
  168    HB1  ALA  21           HB1      ALA  21   3.652  -6.948   0.497
  169    HB2  ALA  21           HB2      ALA  21   4.812  -8.275   0.568
  170    HB3  ALA  21           HB3      ALA  21   5.130  -6.881  -0.465
  171    H    ALA  22           H        ALA  22   4.759  -6.930  -3.079
  172    HA   ALA  22           HA       ALA  22   2.891  -4.860  -3.474
  173    HB1  ALA  22           HB1      ALA  22   5.227  -4.658  -4.131
  174    HB2  ALA  22           HB2      ALA  22   5.001  -5.906  -5.357
  175    HB3  ALA  22           HB3      ALA  22   4.161  -4.362  -5.506
  176    H    GLN  23           H        GLN  23   3.476  -7.871  -5.252
  177    HA   GLN  23           HA       GLN  23   1.469  -7.347  -7.212
  178    HB2  GLN  23           HB2      GLN  23   1.923  -9.572  -8.033
  179    HB3  GLN  23           HB3      GLN  23   3.444  -8.785  -7.637
  180    HG2  GLN  23           HG2      GLN  23   3.336  -9.998  -5.427
  181    HG3  GLN  23           HG3      GLN  23   2.019 -10.940  -6.118
  182   HE21  GLN  23          1HE2      GLN  23   4.769  -9.777  -7.926
  183   HE22  GLN  23          2HE2      GLN  23   5.474 -11.328  -8.227
  184    H    ALA  24           H        ALA  24   1.504  -8.968  -4.110
  185    HA   ALA  24           HA       ALA  24  -1.002 -10.304  -4.455
  186    HB1  ALA  24           HB1      ALA  24   0.664 -11.097  -2.844
  187    HB2  ALA  24           HB2      ALA  24   0.459  -9.616  -1.908
  188    HB3  ALA  24           HB3      ALA  24  -0.880 -10.753  -2.065
  189    H    LEU  25           H        LEU  25   0.022  -7.277  -2.920
  190    HA   LEU  25           HA       LEU  25  -2.528  -6.457  -2.048
  191    HB2  LEU  25           HB2      LEU  25  -0.057  -4.927  -2.812
  192    HB3  LEU  25           HB3      LEU  25  -1.527  -4.105  -2.323
  193    HG   LEU  25           HG       LEU  25  -0.020  -6.094  -0.622
  194   HD11  LEU  25          2HD1      LEU  25   0.666  -4.166   0.698
  195   HD12  LEU  25          1HD1      LEU  25  -0.150  -3.086  -0.434
  196   HD13  LEU  25          3HD1      LEU  25   1.247  -4.025  -0.961
  197   HD21  LEU  25          3HD2      LEU  25  -1.494  -5.321   1.167
  198   HD22  LEU  25          2HD2      LEU  25  -2.423  -6.026  -0.157
  199   HD23  LEU  25          1HD2      LEU  25  -2.340  -4.274   0.028
  200    H    LYS  26           H        LYS  26  -0.822  -5.945  -5.105
  201    HA   LYS  26           HA       LYS  26  -2.836  -4.389  -6.339
  202    HB2  LYS  26           HB2      LYS  26  -0.439  -4.634  -7.094
  203    HB3  LYS  26           HB3      LYS  26  -0.863  -6.224  -7.712
  204    HG2  LYS  26           HG2      LYS  26  -2.412  -5.257  -9.277
  205    HG3  LYS  26           HG3      LYS  26  -2.153  -3.650  -8.593
  206    HD2  LYS  26           HD2      LYS  26  -0.037  -5.341  -9.924
  207    HD3  LYS  26           HD3      LYS  26  -0.893  -4.001 -10.686
  208    HE2  LYS  26           HE2      LYS  26   0.036  -2.453  -9.059
  209    HE3  LYS  26           HE3      LYS  26   0.831  -3.781  -8.217
  210    HZ1  LYS  26           HZ1      LYS  26   2.400  -2.645  -9.624
  211    HZ2  LYS  26           HZ2      LYS  26   1.410  -2.859 -10.982
  212    HZ3  LYS  26           HZ3      LYS  26   2.126  -4.203 -10.240
  213    H    LYS  27           H        LYS  27  -2.258  -7.843  -6.092
  214    HA   LYS  27           HA       LYS  27  -4.254  -8.832  -7.752
  215    HB2  LYS  27           HB2      LYS  27  -2.889 -10.499  -6.932
  216    HB3  LYS  27           HB3      LYS  27  -2.855  -9.823  -5.312
  217    HG2  LYS  27           HG2      LYS  27  -5.129 -10.638  -4.920
  218    HG3  LYS  27           HG3      LYS  27  -5.163 -11.320  -6.548
  219    HD2  LYS  27           HD2      LYS  27  -3.458 -12.889  -6.016
  220    HD3  LYS  27           HD3      LYS  27  -3.091 -12.072  -4.496
  221    HE2  LYS  27           HE2      LYS  27  -5.759 -13.346  -5.075
  222    HE3  LYS  27           HE3      LYS  27  -4.426 -14.212  -4.312
  223    HZ1  LYS  27           HZ1      LYS  27  -5.779 -11.774  -3.256
  224    HZ2  LYS  27           HZ2      LYS  27  -4.435 -12.522  -2.550
  225    HZ3  LYS  27           HZ3      LYS  27  -5.905 -13.346  -2.639
  226    H    GLY  28           H        GLY  28  -4.464  -8.127  -4.263
  227    HA2  GLY  28           HA1      GLY  28  -7.184  -8.792  -4.002
  228    HA3  GLY  28           HA2      GLY  28  -6.267  -7.788  -2.890
  229    H    ALA  29           H        ALA  29  -5.605  -5.703  -4.663
  230    HA   ALA  29           HA       ALA  29  -7.924  -4.118  -4.430
  231    HB1  ALA  29           HB1      ALA  29  -5.476  -3.577  -6.105
  232    HB2  ALA  29           HB2      ALA  29  -6.668  -2.393  -5.573
  233    HB3  ALA  29           HB3      ALA  29  -5.642  -3.204  -4.390
  234    H    LYS  30           H        LYS  30  -6.367  -5.570  -7.289
  235    HA   LYS  30           HA       LYS  30  -8.335  -4.566  -9.078
  236    HB2  LYS  30           HB2      LYS  30  -5.998  -6.344  -9.273
  237    HB3  LYS  30           HB3      LYS  30  -7.279  -6.687 -10.429
  238    HG2  LYS  30           HG2      LYS  30  -5.656  -5.176 -11.387
  239    HG3  LYS  30           HG3      LYS  30  -7.211  -4.368 -11.193
  240    HD2  LYS  30           HD2      LYS  30  -6.340  -3.402  -9.052
  241    HD3  LYS  30           HD3      LYS  30  -4.757  -4.064  -9.469
  242    HE2  LYS  30           HE2      LYS  30  -4.816  -1.768 -10.154
  243    HE3  LYS  30           HE3      LYS  30  -4.852  -2.780 -11.598
  244    HZ1  LYS  30           HZ1      LYS  30  -6.437  -1.006 -11.811
  245    HZ2  LYS  30           HZ2      LYS  30  -7.172  -1.415 -10.341
  246    HZ3  LYS  30           HZ3      LYS  30  -7.283  -2.471 -11.661
  247    H    LYS  31           H        LYS  31  -8.125  -7.406  -7.102
  248    HA   LYS  31           HA       LYS  31 -10.117  -8.983  -8.283
  249    HB2  LYS  31           HB2      LYS  31  -8.768  -9.904  -6.539
  250    HB3  LYS  31           HB3      LYS  31  -9.242  -8.640  -5.415
  251    HG2  LYS  31           HG2      LYS  31 -11.508  -9.538  -5.352
  252    HG3  LYS  31           HG3      LYS  31 -11.043 -10.797  -6.498
  253    HD2  LYS  31           HD2      LYS  31  -9.482 -11.729  -4.924
  254    HD3  LYS  31           HD3      LYS  31  -9.749 -10.392  -3.805
  255    HE2  LYS  31           HE2      LYS  31 -11.887 -12.332  -4.672
  256    HE3  LYS  31           HE3      LYS  31 -10.931 -12.506  -3.202
  257    HZ1  LYS  31           HZ1      LYS  31 -13.102 -11.466  -2.819
  258    HZ2  LYS  31           HZ2      LYS  31 -12.663 -10.172  -3.817
  259    HZ3  LYS  31           HZ3      LYS  31 -11.825 -10.452  -2.374
  260    H    MET  32           H        MET  32 -10.270  -6.154  -6.257
  261    HA   MET  32           HA       MET  32 -13.191  -6.321  -6.126
  262    HB2  MET  32           HB2      MET  32 -11.306  -4.410  -4.728
  263    HB3  MET  32           HB3      MET  32 -13.036  -4.556  -4.447
  264    HG2  MET  32           HG2      MET  32 -10.935  -6.627  -3.861
  265    HG3  MET  32           HG3      MET  32 -11.820  -5.655  -2.688
  266    HE1  MET  32           HE1      MET  32 -15.468  -7.068  -3.098
  267    HE2  MET  32           HE2      MET  32 -14.444  -5.912  -2.245
  268    HE3  MET  32           HE3      MET  32 -14.767  -5.703  -3.966
  269    H    GLY  33           H        GLY  33 -11.032  -5.279  -8.252
  270    HA2  GLY  33           HA1      GLY  33 -11.225  -3.913 -10.084
  271    HA3  GLY  33           HA2      GLY  33 -12.855  -3.528  -9.560
  272    H    ASN  34           H        ASN  34 -10.070  -3.009  -7.529
  273    HA   ASN  34           HA       ASN  34 -10.776  -0.196  -7.355
  274    HB2  ASN  34           HB2      ASN  34  -8.809  -1.893  -5.815
  275    HB3  ASN  34           HB3      ASN  34  -9.099  -0.187  -5.499
  276   HD21  ASN  34          1HD2      ASN  34  -9.618  -2.913  -4.147
  277   HD22  ASN  34          2HD2      ASN  34 -11.220  -2.728  -3.524
  278    H    LEU  35           H        LEU  35  -8.934   1.375  -7.129
  279    HA   LEU  35           HA       LEU  35  -6.957   0.919  -9.269
  280    HB2  LEU  35           HB2      LEU  35  -7.984   3.540  -8.171
  281    HB3  LEU  35           HB3      LEU  35  -6.879   3.342  -9.518
  282    HG   LEU  35           HG       LEU  35  -9.755   2.426  -9.487
  283   HD11  LEU  35          2HD1      LEU  35  -8.454   4.764 -10.870
  284   HD12  LEU  35          1HD1      LEU  35  -9.549   4.857  -9.491
  285   HD13  LEU  35          3HD1      LEU  35 -10.136   4.261 -11.044
  286   HD21  LEU  35          3HD2      LEU  35  -9.416   2.056 -11.884
  287   HD22  LEU  35          2HD2      LEU  35  -8.348   1.039 -10.916
  288   HD23  LEU  35          1HD2      LEU  35  -7.714   2.482 -11.709
  289    H    ILE  36           H        ILE  36  -4.903   0.690  -8.585
  290    HA   ILE  36           HA       ILE  36  -4.190   1.845  -5.991
  291    HB   ILE  36           HB       ILE  36  -4.930  -0.476  -5.589
  292   HG12  ILE  36          2HG1      ILE  36  -1.958  -0.076  -5.209
  293   HG13  ILE  36          3HG1      ILE  36  -3.209   0.597  -4.172
  294   HG21  ILE  36          2HG2      ILE  36  -3.580  -2.352  -6.406
  295   HG22  ILE  36          1HG2      ILE  36  -2.626  -1.231  -7.378
  296   HG23  ILE  36          3HG2      ILE  36  -4.340  -1.460  -7.725
  297   HD11  ILE  36          3HD1      ILE  36  -2.203  -1.377  -3.181
  298   HD12  ILE  36          2HD1      ILE  36  -2.656  -2.332  -4.590
  299   HD13  ILE  36          1HD1      ILE  36  -3.905  -1.655  -3.547
  300    H    LYS  37           H        LYS  37  -2.162   2.571  -5.826
  301    HA   LYS  37           HA       LYS  37  -0.270   1.868  -7.972
  302    HB2  LYS  37           HB2      LYS  37  -0.636   4.439  -6.452
  303    HB3  LYS  37           HB3      LYS  37   0.893   4.052  -7.229
  304    HG2  LYS  37           HG2      LYS  37  -1.786   4.407  -8.549
  305    HG3  LYS  37           HG3      LYS  37  -0.362   5.440  -8.704
  306    HD2  LYS  37           HD2      LYS  37   0.832   3.395  -9.631
  307    HD3  LYS  37           HD3      LYS  37  -0.758   2.642  -9.738
  308    HE2  LYS  37           HE2      LYS  37  -0.326   3.553 -11.870
  309    HE3  LYS  37           HE3      LYS  37  -1.475   4.644 -11.098
  310    HZ1  LYS  37           HZ1      LYS  37   0.348   5.804 -12.250
  311    HZ2  LYS  37           HZ2      LYS  37   1.461   5.085 -11.187
  312    HZ3  LYS  37           HZ3      LYS  37   0.296   6.165 -10.592
  313    H    VAL  38           H        VAL  38   1.112   0.423  -7.255
  314    HA   VAL  38           HA       VAL  38   1.798   0.412  -4.407
  315    HB   VAL  38           HB       VAL  38   2.326  -1.775  -6.421
  316   HG11  VAL  38          2HG1      VAL  38   3.771  -1.874  -4.482
  317   HG12  VAL  38          1HG1      VAL  38   2.585  -3.179  -4.410
  318   HG13  VAL  38          3HG1      VAL  38   2.381  -1.742  -3.407
  319   HG21  VAL  38          3HG2      VAL  38   0.388  -2.932  -5.436
  320   HG22  VAL  38          2HG2      VAL  38  -0.068  -1.438  -6.255
  321   HG23  VAL  38          1HG2      VAL  38   0.024  -1.486  -4.494
  322    H    GLU  39           H        GLU  39   3.624   1.316  -3.858
  323    HA   GLU  39           HA       GLU  39   5.845   1.471  -5.746
  324    HB2  GLU  39           HB2      GLU  39   5.220   3.471  -4.462
  325    HB3  GLU  39           HB3      GLU  39   5.504   2.600  -2.962
  326    HG2  GLU  39           HG2      GLU  39   7.881   2.324  -3.659
  327    HG3  GLU  39           HG3      GLU  39   7.541   3.384  -5.027
  328    H    THR  40           H        THR  40   7.929   0.687  -5.208
  329    HA   THR  40           HA       THR  40   8.076  -1.215  -2.983
  330    HB   THR  40           HB       THR  40   9.031  -1.672  -5.817
  331    HG1  THR  40           HG1      THR  40   7.080  -2.931  -4.154
  332   HG21  THR  40          3HG2      THR  40  10.682  -2.497  -4.177
  333   HG22  THR  40          1HG2      THR  40   9.897  -3.812  -5.055
  334   HG23  THR  40          2HG2      THR  40   9.412  -3.441  -3.401
  335    H    GLN  41           H        GLN  41   9.873  -0.984  -1.759
  336    HA   GLN  41           HA       GLN  41  12.094   0.613  -2.854
  337    HB2  GLN  41           HB2      GLN  41  10.625   1.957  -1.343
  338    HB3  GLN  41           HB3      GLN  41  10.987   0.830  -0.044
  339    HG2  GLN  41           HG2      GLN  41  13.368   1.907  -1.329
  340    HG3  GLN  41           HG3      GLN  41  12.341   3.146  -0.610
  341   HE21  GLN  41          1HE2      GLN  41  13.856   3.613   0.972
  342   HE22  GLN  41          2HE2      GLN  41  14.162   2.552   2.302
  343    H    GLY  42           H        GLY  42  14.050  -0.246  -2.567
  344    HA2  GLY  42           HA1      GLY  42  14.222  -2.670  -0.898
  345    HA3  GLY  42           HA2      GLY  42  15.258  -2.308  -2.269
  346    H    ALA  43           H        ALA  43  14.343  -0.933   0.868
  347    HA   ALA  43           HA       ALA  43  15.579  -0.371   2.691
  348    HB1  ALA  43           HB1      ALA  43  17.924  -0.960   2.885
  349    HB2  ALA  43           HB2      ALA  43  16.994  -2.313   2.244
  350    HB3  ALA  43           HB3      ALA  43  17.989  -1.338   1.164
  351    H    THR  44           H        THR  44  17.045   0.589  -0.379
  352    HA   THR  44           HA       THR  44  16.947   3.351   0.509
  353    HB   THR  44           HB       THR  44  19.196   2.557   1.195
  354    HG1  THR  44           HG1      THR  44  20.283   4.221  -0.391
  355   HG21  THR  44          3HG2      THR  44  19.558   0.888  -0.557
  356   HG22  THR  44          1HG2      THR  44  20.878   2.057  -0.511
  357   HG23  THR  44          2HG2      THR  44  19.645   2.168  -1.767
  358    H    GLY  45           H        GLY  45  17.041   0.944  -1.949
  359    HA2  GLY  45           HA1      GLY  45  17.016   2.940  -4.088
  360    HA3  GLY  45           HA2      GLY  45  17.122   1.197  -4.300
  361    H    ILE  46           H        ILE  46  15.128   3.844  -4.487
  362    HA   ILE  46           HA       ILE  46  12.673   2.378  -3.929
  363    HB   ILE  46           HB       ILE  46  12.962   5.234  -4.887
  364   HG12  ILE  46          2HG1      ILE  46  12.645   4.194  -2.060
  365   HG13  ILE  46          3HG1      ILE  46  14.126   4.871  -2.729
  366   HG21  ILE  46          2HG2      ILE  46  10.761   4.314  -5.272
  367   HG22  ILE  46          1HG2      ILE  46  10.692   5.468  -3.940
  368   HG23  ILE  46          3HG2      ILE  46  10.679   3.737  -3.607
  369   HD11  ILE  46          3HD1      ILE  46  13.022   7.021  -3.016
  370   HD12  ILE  46          2HD1      ILE  46  12.941   6.480  -1.338
  371   HD13  ILE  46          1HD1      ILE  46  11.524   6.345  -2.380
  372    H    GLU  47           H        GLU  47  11.485   1.434  -5.470
  373    HA   GLU  47           HA       GLU  47  12.415   1.352  -8.173
  374    HB2  GLU  47           HB2      GLU  47  10.019   0.208  -6.758
  375    HB3  GLU  47           HB3      GLU  47  10.256   0.010  -8.487
  376    HG2  GLU  47           HG2      GLU  47  12.451  -0.765  -6.638
  377    HG3  GLU  47           HG3      GLU  47  11.042  -1.814  -6.786
  378    H    ASN  48           H        ASN  48   9.265   2.325  -6.830
  379    HA   ASN  48           HA       ASN  48   8.609   3.593  -9.349
  380    HB2  ASN  48           HB2      ASN  48   6.917   2.213  -8.235
  381    HB3  ASN  48           HB3      ASN  48   6.961   3.278  -6.832
  382   HD21  ASN  48          1HD2      ASN  48   4.817   3.860  -6.985
  383   HD22  ASN  48          2HD2      ASN  48   4.211   4.878  -8.246
  384    H    GLU  49           H        GLU  49   8.845   4.566  -5.939
  385    HA   GLU  49           HA       GLU  49   8.891   6.572  -4.901
  386    HB2  GLU  49           HB2      GLU  49  10.843   6.880  -6.567
  387    HB3  GLU  49           HB3      GLU  49   9.727   7.870  -7.493
  388    HG2  GLU  49           HG2      GLU  49  10.225   8.444  -4.603
  389    HG3  GLU  49           HG3      GLU  49  11.359   8.989  -5.834
  390    H    LEU  50           H        LEU  50   6.712   6.505  -4.604
  391    HA   LEU  50           HA       LEU  50   4.783   7.051  -6.562
  392    HB2  LEU  50           HB2      LEU  50   4.705   5.731  -4.345
  393    HB3  LEU  50           HB3      LEU  50   4.384   7.283  -3.598
  394    HG   LEU  50           HG       LEU  50   2.339   7.512  -4.809
  395   HD11  LEU  50          2HD1      LEU  50   3.033   6.521  -6.927
  396   HD12  LEU  50          1HD1      LEU  50   1.536   5.789  -6.346
  397   HD13  LEU  50          3HD1      LEU  50   3.066   4.926  -6.173
  398   HD21  LEU  50          3HD2      LEU  50   1.101   5.590  -3.931
  399   HD22  LEU  50          2HD2      LEU  50   2.275   6.189  -2.760
  400   HD23  LEU  50          1HD2      LEU  50   2.621   4.724  -3.687
  401    H    THR  51           H        THR  51   4.470   8.951  -7.474
  402    HA   THR  51           HA       THR  51   5.447  11.380  -6.400
  403    HB   THR  51           HB       THR  51   4.539  12.468  -8.332
  404    HG1  THR  51           HG1      THR  51   3.083  10.073  -8.915
  405   HG21  THR  51          3HG2      THR  51   5.429   9.686  -9.097
  406   HG22  THR  51          1HG2      THR  51   6.487  11.054  -8.759
  407   HG23  THR  51          2HG2      THR  51   5.416  11.093 -10.160
  408    H    GLU  52           H        GLU  52   4.060  13.354  -6.134
  409    HA   GLU  52           HA       GLU  52   2.187  12.903  -4.079
  410    HB2  GLU  52           HB2      GLU  52   2.611  15.393  -5.737
  411    HB3  GLU  52           HB3      GLU  52   1.715  15.316  -4.227
  412    HG2  GLU  52           HG2      GLU  52   3.797  14.564  -3.102
  413    HG3  GLU  52           HG3      GLU  52   4.658  14.833  -4.617
  414    H    LYS  53           H        LYS  53   1.849  13.460  -7.526
  415    HA   LYS  53           HA       LYS  53  -0.936  13.890  -7.561
  416    HB2  LYS  53           HB2      LYS  53   0.943  12.833  -9.673
  417    HB3  LYS  53           HB3      LYS  53  -0.752  13.201  -9.977
  418    HG2  LYS  53           HG2      LYS  53  -0.390  15.520  -9.388
  419    HG3  LYS  53           HG3      LYS  53   1.289  15.180  -8.975
  420    HD2  LYS  53           HD2      LYS  53   1.756  14.582 -11.285
  421    HD3  LYS  53           HD3      LYS  53   0.064  14.845 -11.712
  422    HE2  LYS  53           HE2      LYS  53   1.871  16.970 -10.571
  423    HE3  LYS  53           HE3      LYS  53   1.587  16.737 -12.295
  424    HZ1  LYS  53           HZ1      LYS  53  -0.615  17.211 -10.367
  425    HZ2  LYS  53           HZ2      LYS  53  -0.662  17.317 -12.059
  426    HZ3  LYS  53           HZ3      LYS  53   0.186  18.476 -11.163
  427    H    ASP  54           H        ASP  54   0.980  10.910  -7.872
  428    HA   ASP  54           HA       ASP  54  -1.238   9.166  -8.178
  429    HB2  ASP  54           HB2      ASP  54   1.532   8.650  -7.082
  430    HB3  ASP  54           HB3      ASP  54   0.338   7.387  -7.346
  431    H    VAL  55           H        VAL  55   0.654  10.189  -5.407
  432    HA   VAL  55           HA       VAL  55  -0.583   8.715  -3.411
  433    HB   VAL  55           HB       VAL  55   0.793  11.390  -3.386
  434   HG11  VAL  55          2HG1      VAL  55   0.851  11.180  -0.914
  435   HG12  VAL  55          1HG1      VAL  55  -0.321   9.865  -1.043
  436   HG13  VAL  55          3HG1      VAL  55  -0.756  11.493  -1.570
  437   HG21  VAL  55          3HG2      VAL  55   2.547  10.133  -2.242
  438   HG22  VAL  55          2HG2      VAL  55   2.178   9.441  -3.821
  439   HG23  VAL  55          1HG2      VAL  55   1.570   8.670  -2.355
  440    H    ASN  56           H        ASN  56  -1.412  11.939  -4.651
  441    HA   ASN  56           HA       ASN  56  -3.468  12.368  -2.723
  442    HB2  ASN  56           HB2      ASN  56  -2.650  13.808  -5.231
  443    HB3  ASN  56           HB3      ASN  56  -4.074  14.296  -4.314
  444   HD21  ASN  56          1HD2      ASN  56  -1.402  15.562  -4.831
  445   HD22  ASN  56          2HD2      ASN  56  -0.822  15.993  -3.257
  446    H    ILE  57           H        ILE  57  -3.403  10.496  -5.530
  447    HA   ILE  57           HA       ILE  57  -6.248  10.656  -6.016
  448    HB   ILE  57           HB       ILE  57  -4.177   8.682  -6.997
  449   HG12  ILE  57          2HG1      ILE  57  -5.642  10.918  -8.417
  450   HG13  ILE  57          3HG1      ILE  57  -3.969  10.982  -7.877
  451   HG21  ILE  57          2HG2      ILE  57  -5.889   7.862  -8.533
  452   HG22  ILE  57          1HG2      ILE  57  -7.074   8.943  -7.801
  453   HG23  ILE  57          3HG2      ILE  57  -6.381   7.626  -6.855
  454   HD11  ILE  57          3HD1      ILE  57  -5.095   9.131  -9.961
  455   HD12  ILE  57          2HD1      ILE  57  -3.420   9.148  -9.407
  456   HD13  ILE  57          1HD1      ILE  57  -4.086  10.548 -10.246
  457    H    GLY  58           H        GLY  58  -3.987   8.330  -4.566
  458    HA2  GLY  58           HA1      GLY  58  -5.946   6.461  -3.730
  459    HA3  GLY  58           HA2      GLY  58  -4.306   6.585  -3.110
  460    H    GLU  59           H        GLU  59  -7.064   6.205  -1.906
  461    HA   GLU  59           HA       GLU  59  -7.322   8.520  -0.166
  462    HB2  GLU  59           HB2      GLU  59  -8.906   5.939  -0.209
  463    HB3  GLU  59           HB3      GLU  59  -9.345   7.426   0.625
  464    HG2  GLU  59           HG2      GLU  59  -9.724   8.566  -1.414
  465    HG3  GLU  59           HG3      GLU  59  -8.992   7.267  -2.353
  466    H    VAL  60           H        VAL  60  -7.155   4.997   0.370
  467    HA   VAL  60           HA       VAL  60  -5.892   5.487   2.960
  468    HB   VAL  60           HB       VAL  60  -6.165   2.978   3.253
  469   HG11  VAL  60          2HG1      VAL  60  -8.631   4.671   2.893
  470   HG12  VAL  60          1HG1      VAL  60  -7.618   4.590   4.335
  471   HG13  VAL  60          3HG1      VAL  60  -8.539   3.176   3.823
  472   HG21  VAL  60          3HG2      VAL  60  -7.900   3.331   0.807
  473   HG22  VAL  60          2HG2      VAL  60  -7.883   1.904   1.845
  474   HG23  VAL  60          1HG2      VAL  60  -6.442   2.346   0.928
  475    H    VAL  61           H        VAL  61  -3.967   4.545   3.566
  476    HA   VAL  61           HA       VAL  61  -2.238   3.738   1.319
  477    HB   VAL  61           HB       VAL  61  -1.343   5.046   3.885
  478   HG11  VAL  61          2HG1      VAL  61   0.713   5.496   2.607
  479   HG12  VAL  61          1HG1      VAL  61   0.047   4.584   1.252
  480   HG13  VAL  61          3HG1      VAL  61   0.382   3.773   2.782
  481   HG21  VAL  61          3HG2      VAL  61  -1.091   7.115   2.545
  482   HG22  VAL  61          2HG2      VAL  61  -2.767   6.619   2.762
  483   HG23  VAL  61          1HG2      VAL  61  -1.953   6.325   1.227
  484    H    ILE  62           H        ILE  62  -1.297   1.800   1.459
  485    HA   ILE  62           HA       ILE  62  -1.330   0.432   4.073
  486    HB   ILE  62           HB       ILE  62  -1.432  -0.825   1.321
  487   HG12  ILE  62          2HG1      ILE  62  -3.562  -0.674   3.468
  488   HG13  ILE  62          3HG1      ILE  62  -3.541   0.296   1.998
  489   HG21  ILE  62          2HG2      ILE  62  -1.789  -2.931   2.540
  490   HG22  ILE  62          1HG2      ILE  62  -1.545  -2.076   4.064
  491   HG23  ILE  62          3HG2      ILE  62  -0.221  -2.211   2.907
  492   HD11  ILE  62          3HD1      ILE  62  -3.749  -2.703   2.124
  493   HD12  ILE  62          2HD1      ILE  62  -3.742  -1.726   0.656
  494   HD13  ILE  62          1HD1      ILE  62  -5.071  -1.579   1.806
  495    H    PHE  63           H        PHE  63   0.609   0.036   4.924
  496    HA   PHE  63           HA       PHE  63   2.922  -0.008   3.109
  497    HB2  PHE  63           HB2      PHE  63   2.700   0.736   6.016
  498    HB3  PHE  63           HB3      PHE  63   4.244   0.270   5.307
  499    HD1  PHE  63           HD1      PHE  63   4.985   1.555   3.216
  500    HD2  PHE  63           HD2      PHE  63   2.022   2.939   5.926
  501    HE1  PHE  63           HE1      PHE  63   5.360   3.860   2.445
  502    HE2  PHE  63           HE2      PHE  63   2.383   5.244   5.158
  503    HZ   PHE  63           HZ       PHE  63   4.057   5.705   3.412
  504    H    ALA  64           H        ALA  64   3.248  -2.058   2.532
  505    HA   ALA  64           HA       ALA  64   3.449  -4.080   4.645
  506    HB1  ALA  64           HB1      ALA  64   3.733  -4.343   1.646
  507    HB2  ALA  64           HB2      ALA  64   3.819  -5.671   2.804
  508    HB3  ALA  64           HB3      ALA  64   2.312  -4.780   2.597
  509    H    VAL  65           H        VAL  65   5.279  -3.444   5.736
  510    HA   VAL  65           HA       VAL  65   7.739  -3.242   4.161
  511    HB   VAL  65           HB       VAL  65   8.407  -1.209   5.461
  512   HG11  VAL  65          2HG1      VAL  65   7.099   0.366   4.115
  513   HG12  VAL  65          1HG1      VAL  65   5.971  -0.929   3.709
  514   HG13  VAL  65          3HG1      VAL  65   7.646  -1.017   3.164
  515   HG21  VAL  65          3HG2      VAL  65   5.483  -1.148   6.205
  516   HG22  VAL  65          2HG2      VAL  65   6.660   0.126   6.526
  517   HG23  VAL  65          1HG2      VAL  65   6.826  -1.445   7.309
  518    H    ASP  66           H        ASP  66   9.618  -3.530   5.233
  519    HA   ASP  66           HA       ASP  66   9.496  -4.485   8.018
  520    HB2  ASP  66           HB2      ASP  66  10.304  -6.226   6.555
  521    HB3  ASP  66           HB3      ASP  66  11.410  -5.115   5.758
  522    H    THR  67           H        THR  67  10.798  -2.271   5.737
  523    HA   THR  67           HA       THR  67  12.384  -0.960   7.836
  524    HB   THR  67           HB       THR  67  13.798  -1.973   6.067
  525    HG1  THR  67           HG1      THR  67  14.808  -0.255   6.896
  526   HG21  THR  67          3HG2      THR  67  13.791  -1.004   3.806
  527   HG22  THR  67          1HG2      THR  67  12.363  -0.058   4.225
  528   HG23  THR  67          2HG2      THR  67  12.273  -1.819   4.182
  529    H    LYS  68           H        LYS  68  12.778   1.476   7.060
  530    HA   LYS  68           HA       LYS  68  10.090   2.558   6.849
  531    HB2  LYS  68           HB2      LYS  68  10.892   4.509   7.803
  532    HB3  LYS  68           HB3      LYS  68  11.948   3.302   8.518
  533    HG2  LYS  68           HG2      LYS  68  12.638   5.067   6.174
  534    HG3  LYS  68           HG3      LYS  68  13.159   5.314   7.839
  535    HD2  LYS  68           HD2      LYS  68  14.446   3.291   7.801
  536    HD3  LYS  68           HD3      LYS  68  13.800   2.854   6.216
  537    HE2  LYS  68           HE2      LYS  68  14.823   4.983   5.341
  538    HE3  LYS  68           HE3      LYS  68  15.639   5.141   6.896
  539    HZ1  LYS  68           HZ1      LYS  68  17.054   4.098   5.230
  540    HZ2  LYS  68           HZ2      LYS  68  15.925   2.847   5.029
  541    HZ3  LYS  68           HZ3      LYS  68  16.733   3.028   6.512
  542    H    VAL  69           H        VAL  69   9.833   4.626   5.524
  543    HA   VAL  69           HA       VAL  69  11.250   4.415   2.954
  544    HB   VAL  69           HB       VAL  69   9.219   4.703   1.701
  545   HG11  VAL  69          2HG1      VAL  69   8.835   2.517   3.740
  546   HG12  VAL  69          1HG1      VAL  69   9.780   2.406   2.254
  547   HG13  VAL  69          3HG1      VAL  69   8.031   2.622   2.175
  548   HG21  VAL  69          3HG2      VAL  69   7.013   4.764   2.744
  549   HG22  VAL  69          2HG2      VAL  69   8.010   6.131   3.238
  550   HG23  VAL  69          1HG2      VAL  69   7.767   4.774   4.339
  551    H    ARG  70           H        ARG  70  10.803   6.431   1.578
  552    HA   ARG  70           HA       ARG  70  11.083   8.763   3.309
  553    HB2  ARG  70           HB2      ARG  70  12.783   8.603   1.648
  554    HB3  ARG  70           HB3      ARG  70  11.606   8.325   0.371
  555    HG2  ARG  70           HG2      ARG  70  10.780  10.603   0.614
  556    HG3  ARG  70           HG3      ARG  70  11.924  10.887   1.926
  557    HD2  ARG  70           HD2      ARG  70  12.701  10.145  -0.888
  558    HD3  ARG  70           HD3      ARG  70  12.656  11.794  -0.266
  559    HE   ARG  70           HE       ARG  70  14.245  10.364   1.483
  560   HH11  ARG  70          2HH1      ARG  70  14.285  11.139  -1.942
  561   HH12  ARG  70          1HH1      ARG  70  16.024  11.177  -2.036
  562   HH21  ARG  70          2HH2      ARG  70  16.519  10.394   1.349
  563   HH22  ARG  70          1HH2      ARG  70  17.298  10.731  -0.167
  564    H    ASN  71           H        ASN  71   9.096   7.640   0.621
  565    HA   ASN  71           HA       ASN  71   7.720  10.067   0.228
  566    HB2  ASN  71           HB2      ASN  71   6.908   7.284  -0.622
  567    HB3  ASN  71           HB3      ASN  71   6.284   8.796  -1.283
  568   HD21  ASN  71          1HD2      ASN  71   7.713   6.641  -2.642
  569   HD22  ASN  71          2HD2      ASN  71   9.117   7.387  -3.328
  570    H    LYS  72           H        LYS  72   7.483   7.891   2.684
  571    HA   LYS  72           HA       LYS  72   4.903   7.717   3.552
  572    HB2  LYS  72           HB2      LYS  72   6.942   6.867   4.703
  573    HB3  LYS  72           HB3      LYS  72   7.292   8.501   5.231
  574    HG2  LYS  72           HG2      LYS  72   5.162   8.491   6.504
  575    HG3  LYS  72           HG3      LYS  72   4.946   6.797   6.045
  576    HD2  LYS  72           HD2      LYS  72   7.116   6.267   7.097
  577    HD3  LYS  72           HD3      LYS  72   7.259   7.948   7.606
  578    HE2  LYS  72           HE2      LYS  72   6.473   6.716   9.470
  579    HE3  LYS  72           HE3      LYS  72   5.109   7.648   8.857
  580    HZ1  LYS  72           HZ1      LYS  72   4.618   5.292   9.449
  581    HZ2  LYS  72           HZ2      LYS  72   5.586   4.810   8.145
  582    HZ3  LYS  72           HZ3      LYS  72   4.187   5.725   7.874
  583    H    GLU  73           H        GLU  73   6.885  10.568   3.336
  584    HA   GLU  73           HA       GLU  73   5.740  12.447   4.969
  585    HB2  GLU  73           HB2      GLU  73   6.382  12.958   2.063
  586    HB3  GLU  73           HB3      GLU  73   6.420  14.119   3.378
  587    HG2  GLU  73           HG2      GLU  73   8.421  13.290   4.216
  588    HG3  GLU  73           HG3      GLU  73   8.244  11.748   3.384
  589    H    ARG  74           H        ARG  74   4.699  11.574   1.715
  590    HA   ARG  74           HA       ARG  74   2.610  13.377   1.411
  591    HB2  ARG  74           HB2      ARG  74   3.299  10.732   0.184
  592    HB3  ARG  74           HB3      ARG  74   1.845  11.597  -0.292
  593    HG2  ARG  74           HG2      ARG  74   2.970  13.002  -1.541
  594    HG3  ARG  74           HG3      ARG  74   4.181  13.303  -0.303
  595    HD2  ARG  74           HD2      ARG  74   4.400  10.661  -1.518
  596    HD3  ARG  74           HD3      ARG  74   4.595  11.976  -2.674
  597    HE   ARG  74           HE       ARG  74   6.144  12.265  -0.254
  598   HH11  ARG  74          2HH1      ARG  74   6.082  10.863  -3.458
  599   HH12  ARG  74          1HH1      ARG  74   7.806  10.948  -3.674
  600   HH21  ARG  74          2HH2      ARG  74   8.413  12.423  -0.529
  601   HH22  ARG  74          1HH2      ARG  74   9.129  11.849  -2.015
  602    H    PHE  75           H        PHE  75   2.656  10.240   2.970
  603    HA   PHE  75           HA       PHE  75  -0.201   9.921   2.762
  604    HB2  PHE  75           HB2      PHE  75   1.783   8.220   4.266
  605    HB3  PHE  75           HB3      PHE  75   0.162   7.767   3.741
  606    HD1  PHE  75           HD2      PHE  75  -0.093   8.405   1.029
  607    HD2  PHE  75           HD1      PHE  75   3.415   7.160   3.081
  608    HE1  PHE  75           HE2      PHE  75   0.852   7.582  -1.089
  609    HE2  PHE  75           HE1      PHE  75   4.369   6.346   0.967
  610    HZ   PHE  75           HZ       PHE  75   3.086   6.551  -1.122
  611    H    ASP  76           H        ASP  76   1.848  11.522   4.866
  612    HA   ASP  76           HA       ASP  76   0.688  10.975   7.377
  613    HB2  ASP  76           HB2      ASP  76   2.858  12.133   7.099
  614    HB3  ASP  76           HB3      ASP  76   2.015  13.531   6.439
  615    H    GLY  77           H        GLY  77  -0.240  13.053   4.746
  616    HA2  GLY  77           HA1      GLY  77  -2.185  14.534   6.269
  617    HA3  GLY  77           HA2      GLY  77  -1.943  14.602   4.531
  618    H    LYS  78           H        LYS  78  -2.188  11.429   5.017
  619    HA   LYS  78           HA       LYS  78  -5.121  11.454   4.797
  620    HB2  LYS  78           HB2      LYS  78  -3.107   9.947   3.138
  621    HB3  LYS  78           HB3      LYS  78  -4.788   9.444   3.236
  622    HG2  LYS  78           HG2      LYS  78  -4.948  10.749   1.409
  623    HG3  LYS  78           HG3      LYS  78  -5.185  11.994   2.632
  624    HD2  LYS  78           HD2      LYS  78  -3.601  12.987   1.302
  625    HD3  LYS  78           HD3      LYS  78  -2.575  12.190   2.497
  626    HE2  LYS  78           HE2      LYS  78  -1.906  11.919   0.065
  627    HE3  LYS  78           HE3      LYS  78  -2.028  10.437   1.006
  628    HZ1  LYS  78           HZ1      LYS  78  -4.144  11.509  -0.788
  629    HZ2  LYS  78           HZ2      LYS  78  -4.220  10.053   0.065
  630    HZ3  LYS  78           HZ3      LYS  78  -3.093  10.242  -1.183
  631    H    VAL  79           H        VAL  79  -5.110   8.506   4.499
  632    HA   VAL  79           HA       VAL  79  -4.772   7.915   7.363
  633    HB   VAL  79           HB       VAL  79  -6.728   6.640   5.441
  634   HG11  VAL  79          2HG1      VAL  79  -6.411   6.399   8.429
  635   HG12  VAL  79          1HG1      VAL  79  -6.077   5.147   7.231
  636   HG13  VAL  79          3HG1      VAL  79  -7.731   5.706   7.486
  637   HG21  VAL  79          3HG2      VAL  79  -7.220   8.694   7.592
  638   HG22  VAL  79          2HG2      VAL  79  -8.461   7.883   6.638
  639   HG23  VAL  79          1HG2      VAL  79  -7.316   8.970   5.854
  640    H    VAL  80           H        VAL  80  -3.456   6.289   7.902
  641    HA   VAL  80           HA       VAL  80  -2.425   4.604   5.721
  642    HB   VAL  80           HB       VAL  80  -0.903   5.631   8.126
  643   HG11  VAL  80          2HG1      VAL  80  -0.119   3.449   7.420
  644   HG12  VAL  80          1HG1      VAL  80   1.063   4.690   7.003
  645   HG13  VAL  80          3HG1      VAL  80   0.016   4.013   5.755
  646   HG21  VAL  80          3HG2      VAL  80  -1.358   7.409   6.522
  647   HG22  VAL  80          2HG2      VAL  80  -0.697   6.420   5.221
  648   HG23  VAL  80          1HG2      VAL  80   0.354   6.984   6.521
  649    H    LEU  81           H        LEU  81  -2.323   2.457   6.047
  650    HA   LEU  81           HA       LEU  81  -2.668   1.427   8.783
  651    HB2  LEU  81           HB2      LEU  81  -4.704   1.245   7.171
  652    HB3  LEU  81           HB3      LEU  81  -3.770   0.002   6.368
  653    HG   LEU  81           HG       LEU  81  -5.455  -0.876   7.969
  654   HD11  LEU  81          2HD1      LEU  81  -3.977  -2.468   9.104
  655   HD12  LEU  81          1HD1      LEU  81  -2.586  -1.477   8.661
  656   HD13  LEU  81          3HD1      LEU  81  -3.551  -2.254   7.406
  657   HD21  LEU  81          3HD2      LEU  81  -5.040  -0.682  10.366
  658   HD22  LEU  81          2HD2      LEU  81  -5.333   0.895   9.633
  659   HD23  LEU  81          1HD2      LEU  81  -3.689   0.406  10.046
  660    H    GLU  82           H        GLU  82  -0.623   0.803   9.202
  661    HA   GLU  82           HA       GLU  82   0.998  -0.436   7.133
  662    HB2  GLU  82           HB2      GLU  82   1.674   0.367   9.967
  663    HB3  GLU  82           HB3      GLU  82   2.817  -0.224   8.776
  664    HG2  GLU  82           HG2      GLU  82   2.379   1.714   7.372
  665    HG3  GLU  82           HG3      GLU  82   1.210   2.304   8.553
  666    H    VAL  83           H        VAL  83   1.773  -2.495   7.203
  667    HA   VAL  83           HA       VAL  83   1.012  -4.222   9.447
  668    HB   VAL  83           HB       VAL  83   0.311  -6.008   7.830
  669   HG11  VAL  83          2HG1      VAL  83  -1.356  -3.498   7.788
  670   HG12  VAL  83          1HG1      VAL  83  -1.352  -4.721   9.058
  671   HG13  VAL  83          3HG1      VAL  83  -1.935  -5.127   7.442
  672   HG21  VAL  83          3HG2      VAL  83   1.374  -5.137   5.824
  673   HG22  VAL  83          2HG2      VAL  83   0.305  -3.734   5.848
  674   HG23  VAL  83          1HG2      VAL  83  -0.358  -5.343   5.568
  675    HA   PRO  84           HA       PRO  84   4.980  -6.251   8.721
  676    HB2  PRO  84           HB2      PRO  84   3.498  -8.823   8.782
  677    HB3  PRO  84           HB3      PRO  84   4.877  -8.299   9.755
  678    HG2  PRO  84           HG2      PRO  84   2.432  -8.443  10.813
  679    HG3  PRO  84           HG3      PRO  84   3.549  -7.140  11.256
  680    HD2  PRO  84           HD2      PRO  84   1.192  -7.074   9.417
  681    HD3  PRO  84           HD3      PRO  84   1.759  -5.849  10.572
  682    H    VAL  85           H        VAL  85   6.072  -7.209   6.952
  683    HA   VAL  85           HA       VAL  85   4.817  -6.701   4.481
  684    HB   VAL  85           HB       VAL  85   7.256  -6.471   4.892
  685   HG11  VAL  85          2HG1      VAL  85   7.652  -8.513   6.132
  686   HG12  VAL  85          1HG1      VAL  85   8.698  -8.445   4.714
  687   HG13  VAL  85          3HG1      VAL  85   7.270  -9.479   4.708
  688   HG21  VAL  85          3HG2      VAL  85   7.966  -7.398   2.671
  689   HG22  VAL  85          2HG2      VAL  85   6.515  -6.396   2.630
  690   HG23  VAL  85          1HG2      VAL  85   6.379  -8.154   2.552
  691    H    SER  86           H        SER  86   5.157  -9.649   6.323
  692    HA   SER  86           HA       SER  86   4.559 -11.415   4.156
  693    HB2  SER  86           HB2      SER  86   4.218 -13.083   6.045
  694    HB3  SER  86           HB3      SER  86   5.810 -12.335   5.950
  695    HG   SER  86           HG       SER  86   4.262 -12.408   8.028
  696    H    ALA  87           H        ALA  87   2.660  -9.480   6.261
  697    HA   ALA  87           HA       ALA  87   0.377 -11.086   6.538
  698    HB1  ALA  87           HB1      ALA  87   0.867  -9.151   7.967
  699    HB2  ALA  87           HB2      ALA  87   0.499  -8.081   6.615
  700    HB3  ALA  87           HB3      ALA  87  -0.764  -9.103   7.298
  701    HA   PRO  88           HA       PRO  88  -1.666  -8.585   2.915
  702    HB2  PRO  88           HB2      PRO  88   0.002  -7.492   1.061
  703    HB3  PRO  88           HB3      PRO  88  -0.616  -6.605   2.459
  704    HG2  PRO  88           HG2      PRO  88   2.026  -7.963   2.095
  705    HG3  PRO  88           HG3      PRO  88   1.676  -6.365   2.783
  706    HD2  PRO  88           HD2      PRO  88   2.169  -8.488   4.342
  707    HD3  PRO  88           HD3      PRO  88   0.986  -7.248   4.807
  708    H    ILE  89           H        ILE  89   0.918 -10.757   2.762
  709    HA   ILE  89           HA       ILE  89   0.472 -11.608   0.043
  710    HB   ILE  89           HB       ILE  89   2.050 -12.873   2.291
  711   HG12  ILE  89          2HG1      ILE  89   2.910 -11.307  -0.154
  712   HG13  ILE  89          3HG1      ILE  89   2.943 -10.728   1.507
  713   HG21  ILE  89          2HG2      ILE  89   3.046 -14.306   0.566
  714   HG22  ILE  89          1HG2      ILE  89   1.929 -13.638  -0.625
  715   HG23  ILE  89          3HG2      ILE  89   1.312 -14.584   0.729
  716   HD11  ILE  89          3HD1      ILE  89   4.606 -12.432   2.061
  717   HD12  ILE  89          2HD1      ILE  89   5.155 -11.370   0.762
  718   HD13  ILE  89          1HD1      ILE  89   4.576 -12.995   0.390
  719    H    LYS  90           H        LYS  90  -0.385 -12.704   3.288
  720    HA   LYS  90           HA       LYS  90  -1.935 -14.930   2.182
  721    HB2  LYS  90           HB2      LYS  90  -1.254 -14.182   5.030
  722    HB3  LYS  90           HB3      LYS  90  -2.202 -15.589   4.569
  723    HG2  LYS  90           HG2      LYS  90   0.640 -15.090   3.721
  724    HG3  LYS  90           HG3      LYS  90   0.155 -16.094   5.089
  725    HD2  LYS  90           HD2      LYS  90  -1.256 -17.401   3.416
  726    HD3  LYS  90           HD3      LYS  90  -0.349 -16.550   2.163
  727    HE2  LYS  90           HE2      LYS  90   0.653 -18.719   2.634
  728    HE3  LYS  90           HE3      LYS  90   1.741 -17.408   3.091
  729    HZ1  LYS  90           HZ1      LYS  90   1.654 -19.161   4.771
  730    HZ2  LYS  90           HZ2      LYS  90  -0.013 -18.903   4.969
  731    HZ3  LYS  90           HZ3      LYS  90   1.089 -17.684   5.389
  732    H    ASP  91           H        ASP  91  -2.364 -11.775   3.482
  733    HA   ASP  91           HA       ASP  91  -5.224 -12.315   3.983
  734    HB2  ASP  91           HB2      ASP  91  -3.632 -12.017   5.993
  735    HB3  ASP  91           HB3      ASP  91  -3.578 -10.323   5.532
  736    H    ALA  92           H        ALA  92  -3.931 -11.219   1.576
  737    HA   ALA  92           HA       ALA  92  -3.739  -8.463   1.449
  738    HB1  ALA  92           HB1      ALA  92  -4.683 -10.267  -0.775
  739    HB2  ALA  92           HB2      ALA  92  -3.956  -8.670  -0.948
  740    HB3  ALA  92           HB3      ALA  92  -2.997 -10.012  -0.321
  741    H    GLU  93           H        GLU  93  -6.592 -10.426   0.582
  742    HA   GLU  93           HA       GLU  93  -8.213  -8.230  -0.087
  743    HB2  GLU  93           HB2      GLU  93  -8.893 -11.042   0.749
  744    HB3  GLU  93           HB3      GLU  93 -10.118  -9.870   0.292
  745    HG2  GLU  93           HG2      GLU  93  -9.676 -11.228  -1.598
  746    HG3  GLU  93           HG3      GLU  93  -8.983  -9.641  -1.909
  747    H    LYS  94           H        LYS  94  -7.623  -9.852   2.974
  748    HA   LYS  94           HA       LYS  94  -9.855  -8.645   4.305
  749    HB2  LYS  94           HB2      LYS  94  -8.990 -10.802   5.022
  750    HB3  LYS  94           HB3      LYS  94  -7.423 -10.090   5.370
  751    HG2  LYS  94           HG2      LYS  94  -8.672 -10.493   7.402
  752    HG3  LYS  94           HG3      LYS  94  -8.415  -8.766   7.159
  753    HD2  LYS  94           HD2      LYS  94 -10.680  -8.501   6.367
  754    HD3  LYS  94           HD3      LYS  94 -10.945 -10.245   6.446
  755    HE2  LYS  94           HE2      LYS  94 -11.932  -9.102   8.371
  756    HE3  LYS  94           HE3      LYS  94 -10.644 -10.200   8.861
  757    HZ1  LYS  94           HZ1      LYS  94  -9.148  -8.221   8.902
  758    HZ2  LYS  94           HZ2      LYS  94 -10.377  -8.194  10.066
  759    HZ3  LYS  94           HZ3      LYS  94 -10.511  -7.239   8.669
  760    H    VAL  95           H        VAL  95  -6.389  -8.030   4.091
  761    HA   VAL  95           HA       VAL  95  -6.241  -5.886   5.900
  762    HB   VAL  95           HB       VAL  95  -4.590  -6.388   3.412
  763   HG11  VAL  95          2HG1      VAL  95  -2.902  -4.956   4.443
  764   HG12  VAL  95          1HG1      VAL  95  -3.999  -4.616   5.781
  765   HG13  VAL  95          3HG1      VAL  95  -4.396  -4.068   4.153
  766   HG21  VAL  95          3HG2      VAL  95  -4.112  -7.119   6.298
  767   HG22  VAL  95          2HG2      VAL  95  -2.960  -7.350   4.981
  768   HG23  VAL  95          1HG2      VAL  95  -4.490  -8.232   4.980
  769    H    ILE  96           H        ILE  96  -6.941  -5.974   2.430
  770    HA   ILE  96           HA       ILE  96  -7.068  -3.185   2.042
  771    HB   ILE  96           HB       ILE  96  -8.321  -5.460   0.501
  772   HG12  ILE  96          2HG1      ILE  96  -5.919  -3.698  -0.038
  773   HG13  ILE  96          3HG1      ILE  96  -5.854  -5.351   0.560
  774   HG21  ILE  96          2HG2      ILE  96  -8.147  -2.546  -0.277
  775   HG22  ILE  96          1HG2      ILE  96  -9.623  -3.418   0.135
  776   HG23  ILE  96          3HG2      ILE  96  -8.712  -3.861  -1.309
  777   HD11  ILE  96          3HD1      ILE  96  -6.802  -6.165  -1.506
  778   HD12  ILE  96          2HD1      ILE  96  -5.369  -5.191  -1.830
  779   HD13  ILE  96          1HD1      ILE  96  -6.975  -4.514  -2.102
  780    H    ASN  97           H        ASN  97  -9.596  -5.572   2.808
  781    HA   ASN  97           HA       ASN  97 -11.718  -3.685   2.844
  782    HB2  ASN  97           HB2      ASN  97 -11.390  -6.462   3.930
  783    HB3  ASN  97           HB3      ASN  97 -12.806  -5.510   4.361
  784   HD21  ASN  97          1HD2      ASN  97 -11.169  -7.243   1.863
  785   HD22  ASN  97          2HD2      ASN  97 -12.451  -7.182   0.702
  786    H    ALA  98           H        ALA  98  -9.352  -4.692   5.197
  787    HA   ALA  98           HA       ALA  98 -10.566  -3.476   7.462
  788    HB1  ALA  98           HB1      ALA  98  -7.650  -4.077   6.976
  789    HB2  ALA  98           HB2      ALA  98  -8.404  -3.743   8.536
  790    HB3  ALA  98           HB3      ALA  98  -8.830  -5.204   7.644
  791    H    ALA  99           H        ALA  99  -8.113  -2.410   5.126
  792    HA   ALA  99           HA       ALA  99  -7.606   0.128   6.193
  793    HB1  ALA  99           HB1      ALA  99  -6.813   0.727   3.956
  794    HB2  ALA  99           HB2      ALA  99  -6.235  -0.871   4.430
  795    HB3  ALA  99           HB3      ALA  99  -7.576  -0.717   3.293
  796    H    LEU 100           H        LEU 100 -10.140  -1.026   4.032
  797    HA   LEU 100           HA       LEU 100 -11.288   1.450   3.372
  798    HB2  LEU 100           HB2      LEU 100 -12.601  -1.256   3.628
  799    HB3  LEU 100           HB3      LEU 100 -13.328   0.143   2.863
  800    HG   LEU 100           HG       LEU 100 -10.849  -1.298   1.918
  801   HD11  LEU 100          2HD1      LEU 100 -12.863  -2.590   1.536
  802   HD12  LEU 100          1HD1      LEU 100 -12.257  -1.943   0.012
  803   HD13  LEU 100          3HD1      LEU 100 -13.646  -1.194   0.799
  804   HD21  LEU 100          3HD2      LEU 100 -10.744   1.092   1.441
  805   HD22  LEU 100          2HD2      LEU 100 -12.342   1.022   0.699
  806   HD23  LEU 100          1HD2      LEU 100 -10.990   0.161  -0.037
  807    H    ALA 101           H        ALA 101 -11.512  -0.509   6.240
  808    HA   ALA 101           HA       ALA 101 -13.906   0.582   7.286
  809    HB1  ALA 101           HB1      ALA 101 -12.990  -1.534   8.077
  810    HB2  ALA 101           HB2      ALA 101 -11.598  -0.688   8.755
  811    HB3  ALA 101           HB3      ALA 101 -13.211  -0.401   9.409
  812    H    LEU 102           H        LEU 102 -10.780   1.887   6.961
  813    HA   LEU 102           HA       LEU 102 -11.005   3.701   9.198
  814    HB2  LEU 102           HB2      LEU 102  -8.988   3.318   7.016
  815    HB3  LEU 102           HB3      LEU 102  -8.952   4.753   8.019
  816    HG   LEU 102           HG       LEU 102  -7.375   3.159   8.880
  817   HD11  LEU 102          2HD1      LEU 102  -8.167   2.915  11.165
  818   HD12  LEU 102          1HD1      LEU 102  -9.817   3.249  10.639
  819   HD13  LEU 102          3HD1      LEU 102  -8.582   4.501  10.513
  820   HD21  LEU 102          3HD2      LEU 102  -8.065   0.952   9.700
  821   HD22  LEU 102          2HD2      LEU 102  -8.306   1.116   7.961
  822   HD23  LEU 102          1HD2      LEU 102  -9.684   1.228   9.054
  823    H    ILE 103           H        ILE 103 -11.701   3.767   5.766
  824    HA   ILE 103           HA       ILE 103 -12.276   6.648   5.969
  825    HB   ILE 103           HB       ILE 103 -12.346   6.613   3.461
  826   HG12  ILE 103          2HG1      ILE 103 -11.022   3.911   3.786
  827   HG13  ILE 103          3HG1      ILE 103 -12.690   4.136   3.274
  828   HG21  ILE 103          2HG2      ILE 103  -9.762   5.843   4.806
  829   HG22  ILE 103          1HG2      ILE 103 -10.435   7.469   4.672
  830   HG23  ILE 103          3HG2      ILE 103  -9.899   6.613   3.225
  831   HD11  ILE 103          3HD1      ILE 103 -11.939   5.321   1.296
  832   HD12  ILE 103          2HD1      ILE 103 -11.204   3.721   1.391
  833   HD13  ILE 103          1HD1      ILE 103 -10.263   5.151   1.816
  834    H    ASP 104           H        ASP 104 -13.638   3.578   4.877
  835    HA   ASP 104           HA       ASP 104 -16.215   4.767   4.322
  836    HB2  ASP 104           HB2      ASP 104 -15.109   1.974   4.224
  837    HB3  ASP 104           HB3      ASP 104 -16.846   2.246   4.145
  838    H    GLU 105           H        GLU 105 -14.613   3.021   6.856
  839    HA   GLU 105           HA       GLU 105 -15.127   2.539   9.005
  840    HB2  GLU 105           HB2      GLU 105 -17.325   4.565   8.550
  841    HB3  GLU 105           HB3      GLU 105 -16.923   3.879  10.118
  842    HG2  GLU 105           HG2      GLU 105 -14.686   4.832   9.978
  843    HG3  GLU 105           HG3      GLU 105 -15.065   5.494   8.389
  844    H    LYS 106           H        LYS 106 -16.565   1.295   6.592
  845    HA   LYS 106           HA       LYS 106 -18.809   0.072   8.036
  846    HB2  LYS 106           HB2      LYS 106 -18.252   0.242   5.069
  847    HB3  LYS 106           HB3      LYS 106 -19.610  -0.617   5.783
  848    HG2  LYS 106           HG2      LYS 106 -20.584   1.394   6.569
  849    HG3  LYS 106           HG3      LYS 106 -19.127   2.319   6.199
  850    HD2  LYS 106           HD2      LYS 106 -20.934   0.979   4.183
  851    HD3  LYS 106           HD3      LYS 106 -20.875   2.709   4.532
  852    HE2  LYS 106           HE2      LYS 106 -18.456   2.662   3.882
  853    HE3  LYS 106           HE3      LYS 106 -18.695   1.001   3.347
  854    HZ1  LYS 106           HZ1      LYS 106 -18.859   2.544   1.508
  855    HZ2  LYS 106           HZ2      LYS 106 -20.105   3.388   2.286
  856    HZ3  LYS 106           HZ3      LYS 106 -20.356   1.792   1.775
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1 -13.404  -1.244  -6.569
    2    H2   MET   1           H2       MET   1 -14.678  -1.282  -7.688
    3    H3   MET   1           H3       MET   1 -14.904  -1.892  -6.126
    4    HA   MET   1           HA       MET   1 -15.947   0.257  -6.336
    5    HB2  MET   1           HB2      MET   1 -14.934  -0.459  -4.178
    6    HB3  MET   1           HB3      MET   1 -13.446   0.358  -4.634
    7    HG2  MET   1           HG2      MET   1 -14.710   2.488  -4.733
    8    HG3  MET   1           HG3      MET   1 -16.122   1.630  -4.120
    9    HE1  MET   1           HE1      MET   1 -14.730  -0.413  -2.056
   10    HE2  MET   1           HE2      MET   1 -14.879   0.510  -0.562
   11    HE3  MET   1           HE3      MET   1 -16.214   0.477  -1.718
   12    H    LYS   2           H        LYS   2 -12.790   0.050  -7.674
   13    HA   LYS   2           HA       LYS   2 -11.498   1.424  -8.915
   14    HB2  LYS   2           HB2      LYS   2 -14.187   2.703  -9.361
   15    HB3  LYS   2           HB3      LYS   2 -12.732   3.265 -10.173
   16    HG2  LYS   2           HG2      LYS   2 -13.885   0.490 -10.347
   17    HG3  LYS   2           HG3      LYS   2 -14.006   1.746 -11.581
   18    HD2  LYS   2           HD2      LYS   2 -11.554   1.768 -11.774
   19    HD3  LYS   2           HD3      LYS   2 -11.458   0.483 -10.570
   20    HE2  LYS   2           HE2      LYS   2 -11.256  -0.398 -12.842
   21    HE3  LYS   2           HE3      LYS   2 -12.703  -1.006 -12.038
   22    HZ1  LYS   2           HZ1      LYS   2 -12.672   1.282 -13.935
   23    HZ2  LYS   2           HZ2      LYS   2 -14.041   0.549 -13.251
   24    HZ3  LYS   2           HZ3      LYS   2 -13.087  -0.309 -14.358
   25    H    ARG   3           H        ARG   3 -11.640   1.948  -6.121
   26    HA   ARG   3           HA       ARG   3 -11.374   4.851  -5.933
   27    HB2  ARG   3           HB2      ARG   3 -12.537   3.249  -4.199
   28    HB3  ARG   3           HB3      ARG   3 -10.889   2.955  -3.659
   29    HG2  ARG   3           HG2      ARG   3 -11.857   4.661  -2.294
   30    HG3  ARG   3           HG3      ARG   3 -10.616   5.391  -3.314
   31    HD2  ARG   3           HD2      ARG   3 -12.293   6.257  -4.815
   32    HD3  ARG   3           HD3      ARG   3 -13.569   5.417  -3.935
   33    HE   ARG   3           HE       ARG   3 -12.121   7.177  -2.228
   34   HH11  ARG   3          2HH1      ARG   3 -14.537   7.179  -4.758
   35   HH12  ARG   3          1HH1      ARG   3 -15.329   8.606  -4.170
   36   HH21  ARG   3          2HH2      ARG   3 -13.121   9.066  -1.473
   37   HH22  ARG   3          1HH2      ARG   3 -14.523   9.692  -2.306
   38    H    LYS   4           H        LYS   4  -9.387   5.838  -5.362
   39    HA   LYS   4           HA       LYS   4  -7.078   4.354  -6.276
   40    HB2  LYS   4           HB2      LYS   4  -7.367   7.209  -5.335
   41    HB3  LYS   4           HB3      LYS   4  -5.877   6.509  -5.954
   42    HG2  LYS   4           HG2      LYS   4  -8.454   6.812  -7.479
   43    HG3  LYS   4           HG3      LYS   4  -7.014   7.815  -7.659
   44    HD2  LYS   4           HD2      LYS   4  -7.116   4.842  -8.159
   45    HD3  LYS   4           HD3      LYS   4  -7.232   6.078  -9.412
   46    HE2  LYS   4           HE2      LYS   4  -4.897   5.773  -7.528
   47    HE3  LYS   4           HE3      LYS   4  -4.958   5.091  -9.153
   48    HZ1  LYS   4           HZ1      LYS   4  -3.778   7.171  -9.180
   49    HZ2  LYS   4           HZ2      LYS   4  -5.087   7.973  -8.461
   50    HZ3  LYS   4           HZ3      LYS   4  -5.241   7.344 -10.025
   51    H    ILE   5           H        ILE   5  -5.764   3.256  -5.037
   52    HA   ILE   5           HA       ILE   5  -5.523   4.019  -2.196
   53    HB   ILE   5           HB       ILE   5  -5.329   1.233  -3.373
   54   HG12  ILE   5          2HG1      ILE   5  -7.368   2.438  -1.491
   55   HG13  ILE   5          3HG1      ILE   5  -7.643   2.045  -3.185
   56   HG21  ILE   5          2HG2      ILE   5  -5.047   2.132  -0.507
   57   HG22  ILE   5          1HG2      ILE   5  -3.740   1.563  -1.544
   58   HG23  ILE   5          3HG2      ILE   5  -5.036   0.463  -1.074
   59   HD11  ILE   5          3HD1      ILE   5  -7.266  -0.326  -2.675
   60   HD12  ILE   5          2HD1      ILE   5  -8.601   0.355  -1.745
   61   HD13  ILE   5          1HD1      ILE   5  -7.037   0.087  -0.975
   62    H    ILE   6           H        ILE   6  -3.498   4.480  -1.522
   63    HA   ILE   6           HA       ILE   6  -1.288   3.742  -3.307
   64    HB   ILE   6           HB       ILE   6   0.098   5.408  -2.104
   65   HG12  ILE   6          2HG1      ILE   6  -1.383   5.460  -0.018
   66   HG13  ILE   6          3HG1      ILE   6  -0.764   7.007  -0.586
   67   HG21  ILE   6          2HG2      ILE   6  -0.895   7.384  -3.172
   68   HG22  ILE   6          1HG2      ILE   6  -2.383   6.474  -3.431
   69   HG23  ILE   6          3HG2      ILE   6  -0.890   5.968  -4.222
   70   HD11  ILE   6          3HD1      ILE   6  -2.937   7.450  -1.653
   71   HD12  ILE   6          2HD1      ILE   6  -3.072   7.215   0.091
   72   HD13  ILE   6          1HD1      ILE   6  -3.543   5.922  -1.013
   73    H    ALA   7           H        ALA   7   0.136   2.274  -2.685
   74    HA   ALA   7           HA       ALA   7   0.263   1.558   0.157
   75    HB1  ALA   7           HB1      ALA   7   0.138  -0.808  -0.381
   76    HB2  ALA   7           HB2      ALA   7  -1.316   0.025  -0.931
   77    HB3  ALA   7           HB3      ALA   7  -0.066  -0.427  -2.090
   78    H    VAL   8           H        VAL   8   2.259   0.904   0.853
   79    HA   VAL   8           HA       VAL   8   4.375   0.766  -1.195
   80    HB   VAL   8           HB       VAL   8   4.666   2.015   1.545
   81   HG11  VAL   8          2HG1      VAL   8   6.618   1.830  -0.747
   82   HG12  VAL   8          1HG1      VAL   8   6.707   0.925   0.764
   83   HG13  VAL   8          3HG1      VAL   8   6.887   2.680   0.775
   84   HG21  VAL   8          3HG2      VAL   8   4.924   4.138   0.370
   85   HG22  VAL   8          2HG2      VAL   8   3.343   3.426   0.048
   86   HG23  VAL   8          1HG2      VAL   8   4.617   3.333  -1.168
   87    H    THR   9           H        THR   9   5.421  -1.071  -1.200
   88    HA   THR   9           HA       THR   9   5.553  -2.681   1.261
   89    HB   THR   9           HB       THR   9   6.239  -4.538  -0.308
   90    HG1  THR   9           HG1      THR   9   6.751  -2.903  -2.022
   91   HG21  THR   9          3HG2      THR   9   3.536  -3.294  -0.830
   92   HG22  THR   9          1HG2      THR   9   3.938  -4.337   0.534
   93   HG23  THR   9          2HG2      THR   9   3.974  -4.980  -1.109
   94    H    ALA  10           H        ALA  10   7.419  -2.441   2.329
   95    HA   ALA  10           HA       ALA  10   9.864  -1.933   0.772
   96    HB1  ALA  10           HB1      ALA  10   9.026   0.210   1.626
   97    HB2  ALA  10           HB2      ALA  10   9.093  -0.429   3.268
   98    HB3  ALA  10           HB3      ALA  10  10.577  -0.229   2.340
   99    H    CYS  11           H        CYS  11  10.782  -3.890   1.098
  100    HA   CYS  11           HA       CYS  11  11.212  -4.720   3.887
  101    HB2  CYS  11           HB2      CYS  11   9.904  -6.329   2.546
  102    HB3  CYS  11           HB3      CYS  11  11.214  -6.413   1.376
  103    HG   CYS  11           HG       CYS  11  12.340  -8.406   2.484
  104    H    ALA  12           H        ALA  12  13.263  -4.821   4.616
  105    HA   ALA  12           HA       ALA  12  15.359  -3.973   2.766
  106    HB1  ALA  12           HB1      ALA  12  15.423  -4.232   5.770
  107    HB2  ALA  12           HB2      ALA  12  16.687  -3.532   4.758
  108    HB3  ALA  12           HB3      ALA  12  15.111  -2.748   4.870
  109    H    THR  13           H        THR  13  14.977  -6.400   5.354
  110    HA   THR  13           HA       THR  13  16.990  -8.038   4.001
  111    HB   THR  13           HB       THR  13  16.746  -9.467   6.119
  112    HG1  THR  13           HG1      THR  13  14.811  -8.494   6.898
  113   HG21  THR  13          3HG2      THR  13  18.671  -8.012   5.654
  114   HG22  THR  13          1HG2      THR  13  18.272  -8.032   7.373
  115   HG23  THR  13          2HG2      THR  13  17.812  -6.651   6.375
  116    H    GLY  14           H        GLY  14  16.147  -9.276   2.470
  117    HA2  GLY  14           HA1      GLY  14  14.899 -11.339   2.056
  118    HA3  GLY  14           HA2      GLY  14  13.611 -10.670   3.049
  119    H    VAL  15           H        VAL  15  15.493  -9.993   0.136
  120    HA   VAL  15           HA       VAL  15  13.787  -8.022  -0.897
  121    HB   VAL  15           HB       VAL  15  14.951  -8.386  -3.040
  122   HG11  VAL  15          2HG1      VAL  15  15.936  -6.926  -1.391
  123   HG12  VAL  15          1HG1      VAL  15  17.204  -7.828  -2.222
  124   HG13  VAL  15          3HG1      VAL  15  16.707  -8.301  -0.598
  125   HG21  VAL  15          3HG2      VAL  15  16.294 -10.658  -1.586
  126   HG22  VAL  15          2HG2      VAL  15  16.770 -10.025  -3.163
  127   HG23  VAL  15          1HG2      VAL  15  15.199 -10.801  -2.963
  128    H    ALA  16           H        ALA  16  13.421 -11.448  -0.871
  129    HA   ALA  16           HA       ALA  16  11.736 -11.637  -3.171
  130    HB1  ALA  16           HB1      ALA  16  12.899 -13.589  -2.238
  131    HB2  ALA  16           HB2      ALA  16  11.893 -13.487  -0.793
  132    HB3  ALA  16           HB3      ALA  16  11.158 -13.850  -2.355
  133    H    HIS  17           H        HIS  17  11.238 -10.987   0.237
  134    HA   HIS  17           HA       HIS  17   8.412 -11.166   0.251
  135    HB2  HIS  17           HB2      HIS  17  10.290  -9.556   1.993
  136    HB3  HIS  17           HB3      HIS  17   8.559  -9.666   2.271
  137    HD1  HIS  17           HD1      HIS  17   7.661 -12.142   2.862
  138    HD2  HIS  17           HD2      HIS  17  11.764 -11.548   3.091
  139    HE1  HIS  17           HE1      HIS  17   8.537 -14.038   4.261
  140    HE2  HIS  17           HE2      HIS  17  10.986 -13.517   4.567
  141    H    THR  18           H        THR  18  10.671  -8.582  -0.477
  142    HA   THR  18           HA       THR  18   8.979  -6.389  -0.487
  143    HB   THR  18           HB       THR  18  11.181  -6.685  -2.513
  144    HG1  THR  18           HG1      THR  18  12.585  -6.048  -0.695
  145   HG21  THR  18          3HG2      THR  18   9.975  -4.577  -2.494
  146   HG22  THR  18          1HG2      THR  18  11.605  -4.331  -1.869
  147   HG23  THR  18          2HG2      THR  18  10.236  -4.413  -0.760
  148    H    TYR  19           H        TYR  19   9.832  -8.538  -3.197
  149    HA   TYR  19           HA       TYR  19   8.094  -7.107  -4.985
  150    HB2  TYR  19           HB2      TYR  19   9.922  -9.458  -5.266
  151    HB3  TYR  19           HB3      TYR  19   8.734  -9.120  -6.521
  152    HD1  TYR  19           HD2      TYR  19  11.717  -7.809  -4.781
  153    HD2  TYR  19           HD1      TYR  19   8.993  -7.278  -8.009
  154    HE1  TYR  19           HE2      TYR  19  13.218  -6.123  -5.766
  155    HE2  TYR  19           HE1      TYR  19  10.480  -5.594  -9.000
  156    HH   TYR  19           HH       TYR  19  12.242  -4.088  -8.356
  157    H    MET  20           H        MET  20   7.916 -10.145  -3.184
  158    HA   MET  20           HA       MET  20   5.679 -11.148  -4.620
  159    HB2  MET  20           HB2      MET  20   7.118 -12.624  -3.291
  160    HB3  MET  20           HB3      MET  20   6.585 -11.821  -1.818
  161    HG2  MET  20           HG2      MET  20   5.438 -13.945  -2.156
  162    HG3  MET  20           HG3      MET  20   4.315 -12.584  -2.189
  163    HE1  MET  20           HE1      MET  20   2.656 -15.027  -4.739
  164    HE2  MET  20           HE2      MET  20   3.479 -15.448  -3.236
  165    HE3  MET  20           HE3      MET  20   2.423 -14.037  -3.297
  166    H    ALA  21           H        ALA  21   5.985  -9.274  -1.633
  167    HA   ALA  21           HA       ALA  21   3.287  -9.327  -0.865
  168    HB1  ALA  21           HB1      ALA  21   5.123  -8.569   0.594
  169    HB2  ALA  21           HB2      ALA  21   5.286  -7.117  -0.392
  170    HB3  ALA  21           HB3      ALA  21   3.802  -7.404   0.517
  171    H    ALA  22           H        ALA  22   5.080  -7.078  -2.918
  172    HA   ALA  22           HA       ALA  22   3.016  -5.225  -3.356
  173    HB1  ALA  22           HB1      ALA  22   5.321  -5.965  -5.162
  174    HB2  ALA  22           HB2      ALA  22   4.331  -4.511  -5.297
  175    HB3  ALA  22           HB3      ALA  22   5.352  -4.754  -3.880
  176    H    GLN  23           H        GLN  23   3.934  -8.158  -5.117
  177    HA   GLN  23           HA       GLN  23   2.116  -7.818  -7.258
  178    HB2  GLN  23           HB2      GLN  23   3.443 -10.297  -6.161
  179    HB3  GLN  23           HB3      GLN  23   2.494 -10.266  -7.641
  180    HG2  GLN  23           HG2      GLN  23   4.046  -8.761  -8.673
  181    HG3  GLN  23           HG3      GLN  23   4.948  -8.591  -7.166
  182   HE21  GLN  23          1HE2      GLN  23   6.250 -10.275  -6.469
  183   HE22  GLN  23          2HE2      GLN  23   6.729 -11.574  -7.513
  184    H    ALA  24           H        ALA  24   1.917  -9.751  -4.270
  185    HA   ALA  24           HA       ALA  24  -0.631 -10.850  -4.833
  186    HB1  ALA  24           HB1      ALA  24   0.691 -10.460  -2.151
  187    HB2  ALA  24           HB2      ALA  24  -0.651 -11.546  -2.506
  188    HB3  ALA  24           HB3      ALA  24   0.933 -11.840  -3.222
  189    H    LEU  25           H        LEU  25   0.399  -8.045  -2.949
  190    HA   LEU  25           HA       LEU  25  -2.116  -7.260  -1.973
  191    HB2  LEU  25           HB2      LEU  25  -0.030  -6.386  -1.103
  192    HB3  LEU  25           HB3      LEU  25   0.343  -5.648  -2.646
  193    HG   LEU  25           HG       LEU  25  -1.602  -4.132  -2.348
  194   HD11  LEU  25          2HD1      LEU  25  -1.714  -5.347   0.412
  195   HD12  LEU  25          1HD1      LEU  25  -2.935  -5.527  -0.846
  196   HD13  LEU  25          3HD1      LEU  25  -2.626  -3.941  -0.139
  197   HD21  LEU  25          3HD2      LEU  25   0.394  -4.072  -0.090
  198   HD22  LEU  25          2HD2      LEU  25  -0.506  -2.701  -0.741
  199   HD23  LEU  25          1HD2      LEU  25   0.708  -3.515  -1.735
  200    H    LYS  26           H        LYS  26  -0.368  -6.302  -4.903
  201    HA   LYS  26           HA       LYS  26  -2.270  -4.441  -5.836
  202    HB2  LYS  26           HB2      LYS  26   0.085  -4.554  -6.570
  203    HB3  LYS  26           HB3      LYS  26  -0.253  -6.064  -7.394
  204    HG2  LYS  26           HG2      LYS  26  -1.647  -4.976  -8.983
  205    HG3  LYS  26           HG3      LYS  26  -1.610  -3.465  -8.064
  206    HD2  LYS  26           HD2      LYS  26   0.768  -3.236  -8.476
  207    HD3  LYS  26           HD3      LYS  26   0.800  -4.790  -9.311
  208    HE2  LYS  26           HE2      LYS  26  -0.795  -2.390 -10.199
  209    HE3  LYS  26           HE3      LYS  26   0.788  -2.835 -10.837
  210    HZ1  LYS  26           HZ1      LYS  26  -1.809  -4.136 -11.233
  211    HZ2  LYS  26           HZ2      LYS  26  -0.413  -5.096 -11.263
  212    HZ3  LYS  26           HZ3      LYS  26  -0.579  -3.810 -12.353
  213    H    LYS  27           H        LYS  27  -1.806  -7.889  -6.452
  214    HA   LYS  27           HA       LYS  27  -3.871  -8.151  -8.365
  215    HB2  LYS  27           HB2      LYS  27  -2.097  -9.909  -6.872
  216    HB3  LYS  27           HB3      LYS  27  -3.686 -10.615  -7.129
  217    HG2  LYS  27           HG2      LYS  27  -1.971  -9.474  -9.324
  218    HG3  LYS  27           HG3      LYS  27  -2.019 -11.181  -8.879
  219    HD2  LYS  27           HD2      LYS  27  -4.463 -11.172  -9.325
  220    HD3  LYS  27           HD3      LYS  27  -4.315  -9.508  -9.891
  221    HE2  LYS  27           HE2      LYS  27  -2.908 -10.171 -11.699
  222    HE3  LYS  27           HE3      LYS  27  -2.766 -11.809 -11.061
  223    HZ1  LYS  27           HZ1      LYS  27  -4.321 -11.791 -12.863
  224    HZ2  LYS  27           HZ2      LYS  27  -5.223 -10.542 -12.153
  225    HZ3  LYS  27           HZ3      LYS  27  -5.169 -12.072 -11.422
  226    H    GLY  28           H        GLY  28  -3.799  -8.402  -4.850
  227    HA2  GLY  28           HA1      GLY  28  -6.414  -9.426  -4.512
  228    HA3  GLY  28           HA2      GLY  28  -5.482  -8.563  -3.298
  229    H    ALA  29           H        ALA  29  -5.159  -6.138  -4.728
  230    HA   ALA  29           HA       ALA  29  -7.629  -4.875  -4.078
  231    HB1  ALA  29           HB1      ALA  29  -5.236  -3.768  -5.538
  232    HB2  ALA  29           HB2      ALA  29  -6.563  -2.824  -4.861
  233    HB3  ALA  29           HB3      ALA  29  -5.494  -3.737  -3.795
  234    H    LYS  30           H        LYS  30  -6.053  -5.785  -7.093
  235    HA   LYS  30           HA       LYS  30  -7.950  -4.505  -8.778
  236    HB2  LYS  30           HB2      LYS  30  -5.621  -5.183  -9.445
  237    HB3  LYS  30           HB3      LYS  30  -6.182  -6.849  -9.485
  238    HG2  LYS  30           HG2      LYS  30  -7.646  -6.417 -11.283
  239    HG3  LYS  30           HG3      LYS  30  -7.458  -4.671 -11.107
  240    HD2  LYS  30           HD2      LYS  30  -5.038  -4.962 -11.680
  241    HD3  LYS  30           HD3      LYS  30  -5.390  -6.651 -12.047
  242    HE2  LYS  30           HE2      LYS  30  -6.861  -6.047 -13.810
  243    HE3  LYS  30           HE3      LYS  30  -6.839  -4.351 -13.333
  244    HZ1  LYS  30           HZ1      LYS  30  -4.598  -5.907 -14.518
  245    HZ2  LYS  30           HZ2      LYS  30  -4.440  -4.340 -13.899
  246    HZ3  LYS  30           HZ3      LYS  30  -5.450  -4.621 -15.228
  247    H    LYS  31           H        LYS  31  -7.839  -7.558  -7.138
  248    HA   LYS  31           HA       LYS  31  -9.807  -8.971  -8.549
  249    HB2  LYS  31           HB2      LYS  31  -8.388  -9.980  -6.801
  250    HB3  LYS  31           HB3      LYS  31  -9.216  -9.022  -5.581
  251    HG2  LYS  31           HG2      LYS  31 -11.344 -10.164  -6.299
  252    HG3  LYS  31           HG3      LYS  31 -10.336 -11.253  -7.251
  253    HD2  LYS  31           HD2      LYS  31 -10.191 -10.840  -4.265
  254    HD3  LYS  31           HD3      LYS  31 -10.881 -12.240  -5.089
  255    HE2  LYS  31           HE2      LYS  31  -8.619 -12.619  -6.115
  256    HE3  LYS  31           HE3      LYS  31  -7.997 -11.364  -5.043
  257    HZ1  LYS  31           HZ1      LYS  31  -7.624 -13.478  -4.037
  258    HZ2  LYS  31           HZ2      LYS  31  -9.239 -13.939  -4.247
  259    HZ3  LYS  31           HZ3      LYS  31  -8.846 -12.705  -3.151
  260    H    MET  32           H        MET  32 -10.007  -6.327  -6.321
  261    HA   MET  32           HA       MET  32 -12.916  -6.612  -6.121
  262    HB2  MET  32           HB2      MET  32 -10.982  -4.827  -4.631
  263    HB3  MET  32           HB3      MET  32 -12.727  -4.830  -4.389
  264    HG2  MET  32           HG2      MET  32 -10.855  -7.131  -3.897
  265    HG3  MET  32           HG3      MET  32 -11.614  -6.118  -2.672
  266    HE1  MET  32           HE1      MET  32 -12.536  -8.289  -1.426
  267    HE2  MET  32           HE2      MET  32 -13.429  -9.569  -2.248
  268    HE3  MET  32           HE3      MET  32 -11.735  -9.283  -2.644
  269    H    GLY  33           H        GLY  33 -11.053  -5.503  -8.364
  270    HA2  GLY  33           HA1      GLY  33 -11.263  -3.947 -10.029
  271    HA3  GLY  33           HA2      GLY  33 -12.907  -3.705  -9.460
  272    H    ASN  34           H        ASN  34  -9.664  -3.019  -8.165
  273    HA   ASN  34           HA       ASN  34 -10.550  -0.241  -7.741
  274    HB2  ASN  34           HB2      ASN  34  -8.778  -1.936  -5.973
  275    HB3  ASN  34           HB3      ASN  34  -9.065  -0.215  -5.741
  276   HD21  ASN  34          1HD2      ASN  34  -9.695  -2.703  -4.180
  277   HD22  ASN  34          2HD2      ASN  34 -11.372  -2.545  -3.791
  278    H    LEU  35           H        LEU  35  -8.661   1.268  -7.483
  279    HA   LEU  35           HA       LEU  35  -6.577   0.536  -9.425
  280    HB2  LEU  35           HB2      LEU  35  -7.678   3.275  -8.778
  281    HB3  LEU  35           HB3      LEU  35  -6.388   2.943  -9.916
  282    HG   LEU  35           HG       LEU  35  -9.244   2.003 -10.199
  283   HD11  LEU  35          2HD1      LEU  35  -9.062   4.402 -10.493
  284   HD12  LEU  35          1HD1      LEU  35  -9.339   3.616 -12.047
  285   HD13  LEU  35          3HD1      LEU  35  -7.725   4.183 -11.623
  286   HD21  LEU  35          3HD2      LEU  35  -7.663   0.456 -11.214
  287   HD22  LEU  35          2HD2      LEU  35  -6.892   1.786 -12.076
  288   HD23  LEU  35          1HD2      LEU  35  -8.554   1.336 -12.454
  289    H    ILE  36           H        ILE  36  -5.036  -0.212  -8.061
  290    HA   ILE  36           HA       ILE  36  -4.296   1.478  -5.780
  291    HB   ILE  36           HB       ILE  36  -4.942  -0.855  -5.259
  292   HG12  ILE  36          2HG1      ILE  36  -2.025  -0.242  -4.742
  293   HG13  ILE  36          3HG1      ILE  36  -3.378   0.395  -3.814
  294   HG21  ILE  36          2HG2      ILE  36  -4.189  -1.962  -7.268
  295   HG22  ILE  36          1HG2      ILE  36  -3.420  -2.693  -5.861
  296   HG23  ILE  36          3HG2      ILE  36  -2.511  -1.581  -6.884
  297   HD11  ILE  36          3HD1      ILE  36  -2.339  -1.433  -2.634
  298   HD12  ILE  36          2HD1      ILE  36  -2.562  -2.494  -4.027
  299   HD13  ILE  36          1HD1      ILE  36  -3.964  -1.893  -3.142
  300    H    LYS  37           H        LYS  37  -2.256   2.200  -5.517
  301    HA   LYS  37           HA       LYS  37  -0.308   1.611  -7.648
  302    HB2  LYS  37           HB2      LYS  37  -0.876   4.114  -6.085
  303    HB3  LYS  37           HB3      LYS  37   0.719   3.841  -6.771
  304    HG2  LYS  37           HG2      LYS  37  -1.811   3.791  -8.397
  305    HG3  LYS  37           HG3      LYS  37  -0.826   5.238  -8.158
  306    HD2  LYS  37           HD2      LYS  37   1.109   4.046  -9.122
  307    HD3  LYS  37           HD3      LYS  37   0.074   2.645  -9.415
  308    HE2  LYS  37           HE2      LYS  37  -1.299   3.920 -10.935
  309    HE3  LYS  37           HE3      LYS  37  -0.404   5.393 -10.561
  310    HZ1  LYS  37           HZ1      LYS  37   1.560   4.449 -11.555
  311    HZ2  LYS  37           HZ2      LYS  37   0.280   4.380 -12.668
  312    HZ3  LYS  37           HZ3      LYS  37   0.763   2.978 -11.842
  313    H    VAL  38           H        VAL  38   0.977   0.083  -6.857
  314    HA   VAL  38           HA       VAL  38   1.709   0.156  -4.026
  315    HB   VAL  38           HB       VAL  38   2.281  -2.014  -6.052
  316   HG11  VAL  38          2HG1      VAL  38   2.404  -2.048  -3.038
  317   HG12  VAL  38          1HG1      VAL  38   3.794  -1.996  -4.122
  318   HG13  VAL  38          3HG1      VAL  38   2.737  -3.408  -4.110
  319   HG21  VAL  38          3HG2      VAL  38   0.066  -1.824  -4.013
  320   HG22  VAL  38          2HG2      VAL  38   0.429  -3.236  -5.005
  321   HG23  VAL  38          1HG2      VAL  38  -0.121  -1.742  -5.766
  322    H    GLU  39           H        GLU  39   3.534   1.055  -3.446
  323    HA   GLU  39           HA       GLU  39   5.696   1.412  -5.385
  324    HB2  GLU  39           HB2      GLU  39   4.918   3.341  -4.020
  325    HB3  GLU  39           HB3      GLU  39   5.388   2.474  -2.566
  326    HG2  GLU  39           HG2      GLU  39   7.697   2.557  -3.190
  327    HG3  GLU  39           HG3      GLU  39   7.290   3.248  -4.762
  328    H    THR  40           H        THR  40   7.623   0.360  -5.212
  329    HA   THR  40           HA       THR  40   7.773  -1.672  -3.092
  330    HB   THR  40           HB       THR  40   9.051  -1.821  -5.825
  331    HG1  THR  40           HG1      THR  40   6.535  -2.786  -4.894
  332   HG21  THR  40          3HG2      THR  40   8.511  -3.923  -3.723
  333   HG22  THR  40          1HG2      THR  40  10.086  -3.257  -4.152
  334   HG23  THR  40          2HG2      THR  40   9.191  -4.228  -5.321
  335    H    GLN  41           H        GLN  41   9.001  -0.539  -1.598
  336    HA   GLN  41           HA       GLN  41  11.427   0.797  -2.512
  337    HB2  GLN  41           HB2      GLN  41  10.014   1.971  -0.898
  338    HB3  GLN  41           HB3      GLN  41  10.179   0.638   0.238
  339    HG2  GLN  41           HG2      GLN  41  12.586   1.067   0.382
  340    HG3  GLN  41           HG3      GLN  41  12.406   2.418  -0.737
  341   HE21  GLN  41          1HE2      GLN  41  13.361   2.345   2.028
  342   HE22  GLN  41          2HE2      GLN  41  12.343   3.427   2.917
  343    H    GLY  42           H        GLY  42  13.049  -0.522  -2.899
  344    HA2  GLY  42           HA1      GLY  42  13.558  -2.881  -1.319
  345    HA3  GLY  42           HA2      GLY  42  14.544  -2.268  -2.640
  346    H    ALA  43           H        ALA  43  13.560  -1.428   0.638
  347    HA   ALA  43           HA       ALA  43  14.707  -0.773   2.480
  348    HB1  ALA  43           HB1      ALA  43  17.131  -1.061   2.623
  349    HB2  ALA  43           HB2      ALA  43  16.343  -2.505   1.983
  350    HB3  ALA  43           HB3      ALA  43  17.191  -1.407   0.894
  351    H    THR  44           H        THR  44  17.034   0.371   0.042
  352    HA   THR  44           HA       THR  44  16.451   3.112   0.941
  353    HB   THR  44           HB       THR  44  18.876   2.190  -0.609
  354    HG1  THR  44           HG1      THR  44  18.945   1.148   1.376
  355   HG21  THR  44          3HG2      THR  44  19.851   4.282   0.239
  356   HG22  THR  44          1HG2      THR  44  18.322   4.669   1.026
  357   HG23  THR  44          2HG2      THR  44  18.411   4.584  -0.734
  358    H    GLY  45           H        GLY  45  16.453   0.978  -1.797
  359    HA2  GLY  45           HA1      GLY  45  16.169   3.136  -3.730
  360    HA3  GLY  45           HA2      GLY  45  16.225   1.413  -4.084
  361    H    ILE  46           H        ILE  46  14.339   3.154  -5.234
  362    HA   ILE  46           HA       ILE  46  11.874   2.149  -3.981
  363    HB   ILE  46           HB       ILE  46  12.298   4.940  -5.075
  364   HG12  ILE  46          2HG1      ILE  46  11.620   3.994  -2.280
  365   HG13  ILE  46          3HG1      ILE  46  13.201   4.570  -2.802
  366   HG21  ILE  46          2HG2      ILE  46   9.794   3.640  -4.016
  367   HG22  ILE  46          1HG2      ILE  46  10.099   4.128  -5.683
  368   HG23  ILE  46          3HG2      ILE  46   9.965   5.349  -4.417
  369   HD11  ILE  46          3HD1      ILE  46  11.999   6.287  -1.586
  370   HD12  ILE  46          2HD1      ILE  46  10.661   6.185  -2.732
  371   HD13  ILE  46          1HD1      ILE  46  12.238   6.767  -3.267
  372    H    GLU  47           H        GLU  47  10.988   0.790  -5.375
  373    HA   GLU  47           HA       GLU  47  11.183   1.170  -8.241
  374    HB2  GLU  47           HB2      GLU  47   9.701  -0.863  -6.560
  375    HB3  GLU  47           HB3      GLU  47   9.683  -0.844  -8.317
  376    HG2  GLU  47           HG2      GLU  47  12.153  -1.156  -6.626
  377    HG3  GLU  47           HG3      GLU  47  11.256  -2.481  -7.369
  378    H    ASN  48           H        ASN  48   9.602   1.891  -9.558
  379    HA   ASN  48           HA       ASN  48   7.596   2.639 -10.328
  380    HB2  ASN  48           HB2      ASN  48   6.449   0.895  -9.081
  381    HB3  ASN  48           HB3      ASN  48   6.546   1.844  -7.605
  382   HD21  ASN  48          1HD2      ASN  48   4.332   1.812  -7.332
  383   HD22  ASN  48          2HD2      ASN  48   3.266   2.753  -8.316
  384    H    GLU  49           H        GLU  49   7.797   3.571  -6.899
  385    HA   GLU  49           HA       GLU  49   7.761   5.566  -5.838
  386    HB2  GLU  49           HB2      GLU  49   9.644   6.144  -7.317
  387    HB3  GLU  49           HB3      GLU  49   8.509   6.731  -8.525
  388    HG2  GLU  49           HG2      GLU  49   7.719   8.414  -6.886
  389    HG3  GLU  49           HG3      GLU  49   8.984   7.874  -5.784
  390    H    LEU  50           H        LEU  50   5.859   6.155  -5.143
  391    HA   LEU  50           HA       LEU  50   3.559   6.289  -6.781
  392    HB2  LEU  50           HB2      LEU  50   3.973   7.343  -3.983
  393    HB3  LEU  50           HB3      LEU  50   2.421   7.112  -4.766
  394    HG   LEU  50           HG       LEU  50   4.383   4.959  -3.982
  395   HD11  LEU  50          2HD1      LEU  50   3.103   5.833  -2.122
  396   HD12  LEU  50          1HD1      LEU  50   2.552   4.209  -2.533
  397   HD13  LEU  50          3HD1      LEU  50   1.603   5.611  -3.024
  398   HD21  LEU  50          3HD2      LEU  50   1.748   4.703  -5.426
  399   HD22  LEU  50          2HD2      LEU  50   2.735   3.367  -4.829
  400   HD23  LEU  50          1HD2      LEU  50   3.344   4.408  -6.117
  401    H    THR  51           H        THR  51   2.915   7.818  -8.082
  402    HA   THR  51           HA       THR  51   4.210  10.327  -8.283
  403    HB   THR  51           HB       THR  51   1.808  10.454  -9.718
  404    HG1  THR  51           HG1      THR  51   1.213   8.430  -9.955
  405   HG21  THR  51          3HG2      THR  51   4.513   9.434 -10.600
  406   HG22  THR  51          1HG2      THR  51   4.043  11.131 -10.494
  407   HG23  THR  51          2HG2      THR  51   3.247  10.068 -11.653
  408    H    GLU  52           H        GLU  52   3.356  12.404  -7.930
  409    HA   GLU  52           HA       GLU  52   2.069  12.802  -5.490
  410    HB2  GLU  52           HB2      GLU  52   2.413  14.665  -7.841
  411    HB3  GLU  52           HB3      GLU  52   1.859  15.176  -6.252
  412    HG2  GLU  52           HG2      GLU  52   3.930  14.760  -5.268
  413    HG3  GLU  52           HG3      GLU  52   4.463  13.747  -6.606
  414    H    LYS  53           H        LYS  53   0.783  12.888  -8.779
  415    HA   LYS  53           HA       LYS  53  -1.786  13.826  -8.173
  416    HB2  LYS  53           HB2      LYS  53  -0.685  13.511 -10.466
  417    HB3  LYS  53           HB3      LYS  53  -1.189  11.831 -10.351
  418    HG2  LYS  53           HG2      LYS  53  -2.814  12.976 -11.640
  419    HG3  LYS  53           HG3      LYS  53  -3.536  12.644 -10.065
  420    HD2  LYS  53           HD2      LYS  53  -2.988  14.939  -9.354
  421    HD3  LYS  53           HD3      LYS  53  -2.332  15.264 -10.960
  422    HE2  LYS  53           HE2      LYS  53  -4.574  16.142 -10.818
  423    HE3  LYS  53           HE3      LYS  53  -4.554  14.771 -11.927
  424    HZ1  LYS  53           HZ1      LYS  53  -5.392  14.625  -9.081
  425    HZ2  LYS  53           HZ2      LYS  53  -5.492  13.380 -10.234
  426    HZ3  LYS  53           HZ3      LYS  53  -6.462  14.760 -10.389
  427    H    ASP  54           H        ASP  54  -0.446  10.558  -8.235
  428    HA   ASP  54           HA       ASP  54  -2.919   9.259  -7.677
  429    HB2  ASP  54           HB2      ASP  54  -0.056   8.321  -7.523
  430    HB3  ASP  54           HB3      ASP  54  -1.424   7.280  -7.140
  431    H    VAL  55           H        VAL  55  -0.223  10.376  -5.720
  432    HA   VAL  55           HA       VAL  55  -0.994   9.203  -3.291
  433    HB   VAL  55           HB       VAL  55   0.580  11.715  -3.854
  434   HG11  VAL  55          2HG1      VAL  55  -0.376  11.921  -1.643
  435   HG12  VAL  55          1HG1      VAL  55   1.349  11.570  -1.518
  436   HG13  VAL  55          3HG1      VAL  55   0.166  10.295  -1.229
  437   HG21  VAL  55          3HG2      VAL  55   2.495  10.313  -3.248
  438   HG22  VAL  55          2HG2      VAL  55   1.614   9.653  -4.625
  439   HG23  VAL  55          1HG2      VAL  55   1.414   8.939  -3.025
  440    H    ASN  56           H        ASN  56  -1.839  12.346  -4.705
  441    HA   ASN  56           HA       ASN  56  -3.236  13.210  -2.359
  442    HB2  ASN  56           HB2      ASN  56  -2.953  14.331  -5.135
  443    HB3  ASN  56           HB3      ASN  56  -4.057  15.053  -3.969
  444   HD21  ASN  56          1HD2      ASN  56  -0.722  14.456  -4.774
  445   HD22  ASN  56          2HD2      ASN  56  -0.046  15.575  -3.631
  446    H    ILE  57           H        ILE  57  -4.157  11.538  -5.284
  447    HA   ILE  57           HA       ILE  57  -6.989  11.907  -4.747
  448    HB   ILE  57           HB       ILE  57  -5.618  10.238  -6.869
  449   HG12  ILE  57          2HG1      ILE  57  -5.247  12.646  -7.146
  450   HG13  ILE  57          3HG1      ILE  57  -6.318  12.032  -8.402
  451   HG21  ILE  57          2HG2      ILE  57  -7.831   9.363  -6.351
  452   HG22  ILE  57          1HG2      ILE  57  -7.819  10.128  -7.940
  453   HG23  ILE  57          3HG2      ILE  57  -8.528  10.967  -6.562
  454   HD11  ILE  57          3HD1      ILE  57  -7.185  13.524  -5.933
  455   HD12  ILE  57          2HD1      ILE  57  -8.244  12.935  -7.217
  456   HD13  ILE  57          1HD1      ILE  57  -7.056  14.194  -7.559
  457    H    GLY  58           H        GLY  58  -4.506   9.494  -4.303
  458    HA2  GLY  58           HA1      GLY  58  -6.041   7.262  -3.661
  459    HA3  GLY  58           HA2      GLY  58  -4.446   7.608  -3.010
  460    H    GLU  59           H        GLU  59  -7.265   6.688  -2.018
  461    HA   GLU  59           HA       GLU  59  -7.894   8.653  -0.003
  462    HB2  GLU  59           HB2      GLU  59  -8.971   5.866  -0.466
  463    HB3  GLU  59           HB3      GLU  59  -9.634   7.034   0.668
  464    HG2  GLU  59           HG2      GLU  59  -9.410   7.554  -2.277
  465    HG3  GLU  59           HG3      GLU  59 -10.828   6.822  -1.527
  466    H    VAL  60           H        VAL  60  -7.306   5.166   0.312
  467    HA   VAL  60           HA       VAL  60  -6.266   5.662   2.992
  468    HB   VAL  60           HB       VAL  60  -6.466   3.190   3.281
  469   HG11  VAL  60          2HG1      VAL  60  -8.905   3.158   3.411
  470   HG12  VAL  60          1HG1      VAL  60  -8.985   4.589   2.383
  471   HG13  VAL  60          3HG1      VAL  60  -8.260   4.696   3.987
  472   HG21  VAL  60          3HG2      VAL  60  -7.749   3.317   0.550
  473   HG22  VAL  60          2HG2      VAL  60  -7.751   1.915   1.621
  474   HG23  VAL  60          1HG2      VAL  60  -6.232   2.513   0.954
  475    H    VAL  61           H        VAL  61  -4.271   4.971   3.675
  476    HA   VAL  61           HA       VAL  61  -2.388   4.320   1.508
  477    HB   VAL  61           HB       VAL  61  -1.660   5.487   4.192
  478   HG11  VAL  61          2HG1      VAL  61   0.386   6.162   2.996
  479   HG12  VAL  61          1HG1      VAL  61  -0.209   5.344   1.552
  480   HG13  VAL  61          3HG1      VAL  61   0.154   4.415   3.007
  481   HG21  VAL  61          3HG2      VAL  61  -2.243   6.978   1.635
  482   HG22  VAL  61          2HG2      VAL  61  -1.540   7.681   3.091
  483   HG23  VAL  61          1HG2      VAL  61  -3.183   7.046   3.126
  484    H    ILE  62           H        ILE  62  -1.647   2.319   1.522
  485    HA   ILE  62           HA       ILE  62  -1.762   0.783   4.035
  486    HB   ILE  62           HB       ILE  62  -1.802  -0.177   1.167
  487   HG12  ILE  62          2HG1      ILE  62  -3.905  -0.294   3.344
  488   HG13  ILE  62          3HG1      ILE  62  -3.918   0.803   1.968
  489   HG21  ILE  62          2HG2      ILE  62  -1.858  -1.780   3.719
  490   HG22  ILE  62          1HG2      ILE  62  -0.546  -1.733   2.543
  491   HG23  ILE  62          3HG2      ILE  62  -2.104  -2.428   2.097
  492   HD11  ILE  62          3HD1      ILE  62  -4.104  -2.197   1.839
  493   HD12  ILE  62          2HD1      ILE  62  -4.101  -1.103   0.454
  494   HD13  ILE  62          1HD1      ILE  62  -5.429  -1.054   1.615
  495    H    PHE  63           H        PHE  63   0.072  -0.022   4.882
  496    HA   PHE  63           HA       PHE  63   2.481   0.028   3.190
  497    HB2  PHE  63           HB2      PHE  63   2.247   0.716   6.119
  498    HB3  PHE  63           HB3      PHE  63   3.780   0.408   5.315
  499    HD1  PHE  63           HD2      PHE  63   4.366   1.876   3.309
  500    HD2  PHE  63           HD1      PHE  63   1.325   2.829   6.118
  501    HE1  PHE  63           HE2      PHE  63   4.480   4.236   2.622
  502    HE2  PHE  63           HE1      PHE  63   1.430   5.190   5.440
  503    HZ   PHE  63           HZ       PHE  63   3.010   5.896   3.686
  504    H    ALA  64           H        ALA  64   3.584  -1.776   3.042
  505    HA   ALA  64           HA       ALA  64   3.306  -3.821   5.144
  506    HB1  ALA  64           HB1      ALA  64   3.453  -5.574   3.451
  507    HB2  ALA  64           HB2      ALA  64   2.052  -4.547   3.152
  508    HB3  ALA  64           HB3      ALA  64   3.506  -4.358   2.176
  509    H    VAL  65           H        VAL  65   5.236  -3.353   6.152
  510    HA   VAL  65           HA       VAL  65   7.592  -3.189   4.410
  511    HB   VAL  65           HB       VAL  65   8.438  -1.290   5.750
  512   HG11  VAL  65          2HG1      VAL  65   6.986   0.400   4.713
  513   HG12  VAL  65          1HG1      VAL  65   5.786  -0.849   4.378
  514   HG13  VAL  65          3HG1      VAL  65   7.366  -0.912   3.596
  515   HG21  VAL  65          3HG2      VAL  65   7.126  -1.640   7.783
  516   HG22  VAL  65          2HG2      VAL  65   5.646  -1.262   6.903
  517   HG23  VAL  65          1HG2      VAL  65   6.871  -0.016   7.143
  518    H    ASP  66           H        ASP  66   9.528  -3.696   5.219
  519    HA   ASP  66           HA       ASP  66   9.647  -5.065   7.818
  520    HB2  ASP  66           HB2      ASP  66  10.339  -6.534   6.069
  521    HB3  ASP  66           HB3      ASP  66  11.278  -5.273   5.281
  522    H    THR  67           H        THR  67  10.925  -2.521   5.828
  523    HA   THR  67           HA       THR  67  12.547  -1.533   8.079
  524    HB   THR  67           HB       THR  67  13.893  -2.197   6.090
  525    HG1  THR  67           HG1      THR  67  15.094  -0.663   6.899
  526   HG21  THR  67          3HG2      THR  67  12.336  -0.017   4.701
  527   HG22  THR  67          1HG2      THR  67  12.308  -1.738   4.316
  528   HG23  THR  67          2HG2      THR  67  13.777  -0.798   4.053
  529    H    LYS  68           H        LYS  68  12.927   1.072   7.299
  530    HA   LYS  68           HA       LYS  68  10.289   2.176   7.696
  531    HB2  LYS  68           HB2      LYS  68  11.352   4.289   7.983
  532    HB3  LYS  68           HB3      LYS  68  12.377   3.098   8.773
  533    HG2  LYS  68           HG2      LYS  68  13.944   3.149   6.979
  534    HG3  LYS  68           HG3      LYS  68  12.862   4.135   5.994
  535    HD2  LYS  68           HD2      LYS  68  13.026   5.903   7.773
  536    HD3  LYS  68           HD3      LYS  68  14.298   4.932   8.518
  537    HE2  LYS  68           HE2      LYS  68  14.350   5.942   5.683
  538    HE3  LYS  68           HE3      LYS  68  15.151   6.738   7.039
  539    HZ1  LYS  68           HZ1      LYS  68  16.633   5.286   5.717
  540    HZ2  LYS  68           HZ2      LYS  68  15.704   3.947   6.180
  541    HZ3  LYS  68           HZ3      LYS  68  16.548   4.842   7.350
  542    H    VAL  69           H        VAL  69   9.641   4.150   6.330
  543    HA   VAL  69           HA       VAL  69  10.014   3.419   3.500
  544    HB   VAL  69           HB       VAL  69   7.602   4.823   4.649
  545   HG11  VAL  69          2HG1      VAL  69   7.969   5.195   2.282
  546   HG12  VAL  69          1HG1      VAL  69   6.549   4.181   2.536
  547   HG13  VAL  69          3HG1      VAL  69   8.068   3.458   2.006
  548   HG21  VAL  69          3HG2      VAL  69   7.723   2.619   5.646
  549   HG22  VAL  69          2HG2      VAL  69   7.944   1.888   4.056
  550   HG23  VAL  69          1HG2      VAL  69   6.419   2.678   4.460
  551    H    ARG  70           H        ARG  70  10.478   5.017   2.046
  552    HA   ARG  70           HA       ARG  70  11.480   7.487   3.160
  553    HB2  ARG  70           HB2      ARG  70  11.441   6.426   0.333
  554    HB3  ARG  70           HB3      ARG  70  12.178   7.953   0.801
  555    HG2  ARG  70           HG2      ARG  70  13.691   6.730   2.312
  556    HG3  ARG  70           HG3      ARG  70  12.983   5.214   1.753
  557    HD2  ARG  70           HD2      ARG  70  15.077   5.690   0.595
  558    HD3  ARG  70           HD3      ARG  70  13.715   5.699  -0.521
  559    HE   ARG  70           HE       ARG  70  14.032   8.319   0.255
  560   HH11  ARG  70          2HH1      ARG  70  16.033   5.904  -1.331
  561   HH12  ARG  70          1HH1      ARG  70  16.954   7.082  -2.213
  562   HH21  ARG  70          2HH2      ARG  70  15.244   9.845  -0.916
  563   HH22  ARG  70          1HH2      ARG  70  16.508   9.311  -1.986
  564    H    ASN  71           H        ASN  71   9.108   6.691   0.600
  565    HA   ASN  71           HA       ASN  71   8.279   9.416   0.392
  566    HB2  ASN  71           HB2      ASN  71   7.274   6.868  -0.847
  567    HB3  ASN  71           HB3      ASN  71   6.433   8.401  -1.076
  568   HD21  ASN  71          1HD2      ASN  71   7.773   6.737  -3.053
  569   HD22  ASN  71          2HD2      ASN  71   8.995   7.747  -3.758
  570    H    LYS  72           H        LYS  72   7.575   7.098   2.648
  571    HA   LYS  72           HA       LYS  72   4.857   7.260   3.146
  572    HB2  LYS  72           HB2      LYS  72   6.338   5.727   4.330
  573    HB3  LYS  72           HB3      LYS  72   7.133   7.074   5.126
  574    HG2  LYS  72           HG2      LYS  72   5.180   7.567   6.404
  575    HG3  LYS  72           HG3      LYS  72   4.220   6.406   5.485
  576    HD2  LYS  72           HD2      LYS  72   5.540   4.572   6.366
  577    HD3  LYS  72           HD3      LYS  72   6.601   5.705   7.204
  578    HE2  LYS  72           HE2      LYS  72   4.761   6.437   8.602
  579    HE3  LYS  72           HE3      LYS  72   3.645   5.393   7.726
  580    HZ1  LYS  72           HZ1      LYS  72   4.502   4.540   9.918
  581    HZ2  LYS  72           HZ2      LYS  72   6.006   4.327   9.163
  582    HZ3  LYS  72           HZ3      LYS  72   4.649   3.474   8.609
  583    H    GLU  73           H        GLU  73   7.323   9.608   3.672
  584    HA   GLU  73           HA       GLU  73   6.313  11.229   5.639
  585    HB2  GLU  73           HB2      GLU  73   7.550  13.076   4.415
  586    HB3  GLU  73           HB3      GLU  73   8.484  11.650   4.840
  587    HG2  GLU  73           HG2      GLU  73   8.236  10.814   2.546
  588    HG3  GLU  73           HG3      GLU  73   7.330  12.266   2.128
  589    H    ARG  74           H        ARG  74   5.229  11.095   2.257
  590    HA   ARG  74           HA       ARG  74   3.809  13.588   2.503
  591    HB2  ARG  74           HB2      ARG  74   3.024  13.115   0.220
  592    HB3  ARG  74           HB3      ARG  74   4.772  13.018   0.378
  593    HG2  ARG  74           HG2      ARG  74   4.180  10.443   0.766
  594    HG3  ARG  74           HG3      ARG  74   2.796  10.907  -0.234
  595    HD2  ARG  74           HD2      ARG  74   4.643  10.116  -1.621
  596    HD3  ARG  74           HD3      ARG  74   4.324  11.824  -1.896
  597    HE   ARG  74           HE       ARG  74   6.401  11.223   0.028
  598   HH11  ARG  74          2HH1      ARG  74   5.636  12.011  -3.291
  599   HH12  ARG  74          1HH1      ARG  74   7.205  12.684  -3.627
  600   HH21  ARG  74          2HH2      ARG  74   8.480  12.103  -0.413
  601   HH22  ARG  74          1HH2      ARG  74   8.833  12.709  -2.004
  602    H    PHE  75           H        PHE  75   3.074  10.445   3.473
  603    HA   PHE  75           HA       PHE  75   0.199  10.851   3.199
  604    HB2  PHE  75           HB2      PHE  75   1.648   8.492   4.399
  605    HB3  PHE  75           HB3      PHE  75  -0.014   8.560   3.830
  606    HD1  PHE  75           HD1      PHE  75  -0.241   9.271   1.271
  607    HD2  PHE  75           HD2      PHE  75   3.199   7.510   3.045
  608    HE1  PHE  75           HE1      PHE  75   0.498   8.490  -0.940
  609    HE2  PHE  75           HE2      PHE  75   3.947   6.732   0.836
  610    HZ   PHE  75           HZ       PHE  75   2.593   7.221  -1.161
  611    H    ASP  76           H        ASP  76   2.045  12.362   5.035
  612    HA   ASP  76           HA       ASP  76   1.888  11.537   7.677
  613    HB2  ASP  76           HB2      ASP  76   2.437  13.817   8.279
  614    HB3  ASP  76           HB3      ASP  76   3.357  13.344   6.858
  615    H    GLY  77           H        GLY  77  -0.421  13.524   5.848
  616    HA2  GLY  77           HA1      GLY  77  -2.144  13.592   8.239
  617    HA3  GLY  77           HA2      GLY  77  -2.261  14.691   6.872
  618    H    LYS  78           H        LYS  78  -1.716  11.431   6.093
  619    HA   LYS  78           HA       LYS  78  -4.501  11.223   5.163
  620    HB2  LYS  78           HB2      LYS  78  -1.997   9.900   4.096
  621    HB3  LYS  78           HB3      LYS  78  -3.619   9.675   3.450
  622    HG2  LYS  78           HG2      LYS  78  -3.737  11.992   2.809
  623    HG3  LYS  78           HG3      LYS  78  -2.186  12.320   3.575
  624    HD2  LYS  78           HD2      LYS  78  -1.931  12.134   1.164
  625    HD3  LYS  78           HD3      LYS  78  -1.082  10.823   1.983
  626    HE2  LYS  78           HE2      LYS  78  -2.317  10.087  -0.028
  627    HE3  LYS  78           HE3      LYS  78  -2.841   9.281   1.446
  628    HZ1  LYS  78           HZ1      LYS  78  -4.231  11.630   0.267
  629    HZ2  LYS  78           HZ2      LYS  78  -4.785  10.638   1.527
  630    HZ3  LYS  78           HZ3      LYS  78  -4.674  10.023  -0.046
  631    H    VAL  79           H        VAL  79  -5.337   8.939   5.057
  632    HA   VAL  79           HA       VAL  79  -5.084   7.861   7.696
  633    HB   VAL  79           HB       VAL  79  -7.282   7.895   6.781
  634   HG11  VAL  79          2HG1      VAL  79  -7.916   6.644   4.776
  635   HG12  VAL  79          1HG1      VAL  79  -6.228   6.203   4.527
  636   HG13  VAL  79          3HG1      VAL  79  -6.719   7.892   4.422
  637   HG21  VAL  79          3HG2      VAL  79  -7.963   5.548   6.971
  638   HG22  VAL  79          2HG2      VAL  79  -6.802   5.996   8.221
  639   HG23  VAL  79          1HG2      VAL  79  -6.277   5.053   6.826
  640    H    VAL  80           H        VAL  80  -3.686   6.412   8.346
  641    HA   VAL  80           HA       VAL  80  -2.201   4.916   6.293
  642    HB   VAL  80           HB       VAL  80  -1.305   5.808   9.040
  643   HG11  VAL  80          2HG1      VAL  80   0.904   4.966   8.400
  644   HG12  VAL  80          1HG1      VAL  80   0.223   4.332   6.900
  645   HG13  VAL  80          3HG1      VAL  80  -0.296   3.674   8.452
  646   HG21  VAL  80          3HG2      VAL  80  -0.444   6.723   6.295
  647   HG22  VAL  80          2HG2      VAL  80   0.222   7.279   7.830
  648   HG23  VAL  80          1HG2      VAL  80  -1.456   7.632   7.417
  649    H    LEU  81           H        LEU  81  -2.561   2.831   6.202
  650    HA   LEU  81           HA       LEU  81  -3.044   1.355   8.708
  651    HB2  LEU  81           HB2      LEU  81  -4.947   1.393   7.024
  652    HB3  LEU  81           HB3      LEU  81  -3.902   0.508   5.936
  653    HG   LEU  81           HG       LEU  81  -5.641  -0.830   7.227
  654   HD11  LEU  81          2HD1      LEU  81  -4.154  -2.729   7.579
  655   HD12  LEU  81          1HD1      LEU  81  -2.754  -1.662   7.472
  656   HD13  LEU  81          3HD1      LEU  81  -3.791  -1.900   6.066
  657   HD21  LEU  81          3HD2      LEU  81  -5.040  -1.491   9.503
  658   HD22  LEU  81          2HD2      LEU  81  -5.354   0.241   9.388
  659   HD23  LEU  81          1HD2      LEU  81  -3.695  -0.350   9.478
  660    H    GLU  82           H        GLU  82  -1.209   0.378   9.275
  661    HA   GLU  82           HA       GLU  82   0.612  -0.501   7.137
  662    HB2  GLU  82           HB2      GLU  82   1.405   1.416   8.530
  663    HB3  GLU  82           HB3      GLU  82   1.358   0.361   9.935
  664    HG2  GLU  82           HG2      GLU  82   3.023  -1.090   8.910
  665    HG3  GLU  82           HG3      GLU  82   3.065  -0.045   7.489
  666    H    VAL  83           H        VAL  83   1.225  -2.544   7.083
  667    HA   VAL  83           HA       VAL  83   0.892  -4.243   9.459
  668    HB   VAL  83           HB       VAL  83   0.089  -6.097   7.994
  669   HG11  VAL  83          2HG1      VAL  83  -1.679  -3.657   7.988
  670   HG12  VAL  83          1HG1      VAL  83  -1.504  -4.805   9.315
  671   HG13  VAL  83          3HG1      VAL  83  -2.216  -5.325   7.787
  672   HG21  VAL  83          3HG2      VAL  83  -0.169  -3.921   5.920
  673   HG22  VAL  83          2HG2      VAL  83  -0.829  -5.550   5.775
  674   HG23  VAL  83          1HG2      VAL  83   0.917  -5.310   5.855
  675    HA   PRO  84           HA       PRO  84   4.865  -6.010   8.356
  676    HB2  PRO  84           HB2      PRO  84   3.654  -8.717   8.363
  677    HB3  PRO  84           HB3      PRO  84   5.001  -8.086   9.316
  678    HG2  PRO  84           HG2      PRO  84   2.622  -8.533  10.431
  679    HG3  PRO  84           HG3      PRO  84   3.608  -7.135  10.901
  680    HD2  PRO  84           HD2      PRO  84   1.216  -7.253   9.105
  681    HD3  PRO  84           HD3      PRO  84   1.653  -6.033  10.321
  682    H    VAL  85           H        VAL  85   5.995  -6.970   6.601
  683    HA   VAL  85           HA       VAL  85   4.716  -6.485   4.113
  684    HB   VAL  85           HB       VAL  85   7.153  -6.136   4.606
  685   HG11  VAL  85          2HG1      VAL  85   7.302  -9.122   4.236
  686   HG12  VAL  85          1HG1      VAL  85   7.651  -8.227   5.716
  687   HG13  VAL  85          3HG1      VAL  85   8.683  -8.026   4.300
  688   HG21  VAL  85          3HG2      VAL  85   6.394  -5.967   2.347
  689   HG22  VAL  85          2HG2      VAL  85   6.395  -7.723   2.161
  690   HG23  VAL  85          1HG2      VAL  85   7.917  -6.856   2.351
  691    H    SER  86           H        SER  86   5.130  -9.329   6.024
  692    HA   SER  86           HA       SER  86   4.703 -11.233   3.935
  693    HB2  SER  86           HB2      SER  86   4.185 -12.669   6.099
  694    HB3  SER  86           HB3      SER  86   5.834 -12.166   5.712
  695    HG   SER  86           HG       SER  86   4.374 -11.575   7.874
  696    H    ALA  87           H        ALA  87   2.624  -9.216   5.781
  697    HA   ALA  87           HA       ALA  87   0.429 -10.963   6.099
  698    HB1  ALA  87           HB1      ALA  87  -0.825  -9.026   6.791
  699    HB2  ALA  87           HB2      ALA  87   0.793  -8.984   7.493
  700    HB3  ALA  87           HB3      ALA  87   0.404  -7.957   6.114
  701    HA   PRO  88           HA       PRO  88  -1.698  -8.638   2.458
  702    HB2  PRO  88           HB2      PRO  88  -0.172  -7.395   0.601
  703    HB3  PRO  88           HB3      PRO  88  -0.741  -6.585   2.067
  704    HG2  PRO  88           HG2      PRO  88   1.921  -7.843   1.511
  705    HG3  PRO  88           HG3      PRO  88   1.563  -6.273   2.257
  706    HD2  PRO  88           HD2      PRO  88   2.192  -8.440   3.728
  707    HD3  PRO  88           HD3      PRO  88   1.034  -7.223   4.300
  708    H    ILE  89           H        ILE  89   0.959 -10.713   2.246
  709    HA   ILE  89           HA       ILE  89   0.658 -11.508  -0.482
  710    HB   ILE  89           HB       ILE  89   1.860 -13.040   1.839
  711   HG12  ILE  89          2HG1      ILE  89   3.170 -11.311  -0.278
  712   HG13  ILE  89          3HG1      ILE  89   2.969 -10.875   1.415
  713   HG21  ILE  89          2HG2      ILE  89   3.007 -14.347   0.109
  714   HG22  ILE  89          1HG2      ILE  89   2.124 -13.466  -1.137
  715   HG23  ILE  89          3HG2      ILE  89   1.255 -14.504  -0.008
  716   HD11  ILE  89          3HD1      ILE  89   5.233 -11.603   0.965
  717   HD12  ILE  89          2HD1      ILE  89   4.636 -13.146   0.355
  718   HD13  ILE  89          1HD1      ILE  89   4.426 -12.730   2.057
  719    H    LYS  90           H        LYS  90  -0.513 -12.727   2.625
  720    HA   LYS  90           HA       LYS  90  -2.316 -14.564   1.239
  721    HB2  LYS  90           HB2      LYS  90  -1.625 -14.248   4.160
  722    HB3  LYS  90           HB3      LYS  90  -2.830 -15.375   3.558
  723    HG2  LYS  90           HG2      LYS  90   0.105 -15.391   2.886
  724    HG3  LYS  90           HG3      LYS  90  -0.725 -16.499   3.983
  725    HD2  LYS  90           HD2      LYS  90  -2.178 -17.160   2.032
  726    HD3  LYS  90           HD3      LYS  90  -1.085 -16.231   1.004
  727    HE2  LYS  90           HE2      LYS  90   0.774 -17.635   1.660
  728    HE3  LYS  90           HE3      LYS  90  -0.263 -18.529   2.774
  729    HZ1  LYS  90           HZ1      LYS  90  -0.173 -19.851   0.876
  730    HZ2  LYS  90           HZ2      LYS  90  -0.300 -18.532  -0.182
  731    HZ3  LYS  90           HZ3      LYS  90  -1.652 -19.035   0.710
  732    H    ASP  91           H        ASP  91  -2.392 -11.904   3.583
  733    HA   ASP  91           HA       ASP  91  -5.316 -11.966   3.569
  734    HB2  ASP  91           HB2      ASP  91  -3.270 -10.705   5.378
  735    HB3  ASP  91           HB3      ASP  91  -4.967 -10.239   5.450
  736    H    ALA  92           H        ALA  92  -4.035 -10.956   1.233
  737    HA   ALA  92           HA       ALA  92  -3.688  -8.209   1.094
  738    HB1  ALA  92           HB1      ALA  92  -4.901  -9.979  -1.029
  739    HB2  ALA  92           HB2      ALA  92  -4.166  -8.396  -1.282
  740    HB3  ALA  92           HB3      ALA  92  -3.174  -9.752  -0.747
  741    H    GLU  93           H        GLU  93  -6.700 -10.056   0.640
  742    HA   GLU  93           HA       GLU  93  -8.330  -7.804   0.119
  743    HB2  GLU  93           HB2      GLU  93  -9.000 -10.572   1.122
  744    HB3  GLU  93           HB3      GLU  93 -10.215  -9.370   0.707
  745    HG2  GLU  93           HG2      GLU  93  -9.559  -9.366  -1.570
  746    HG3  GLU  93           HG3      GLU  93  -8.118 -10.320  -1.218
  747    H    LYS  94           H        LYS  94  -7.369  -9.438   3.070
  748    HA   LYS  94           HA       LYS  94  -9.252  -8.207   4.791
  749    HB2  LYS  94           HB2      LYS  94  -8.120 -10.218   5.497
  750    HB3  LYS  94           HB3      LYS  94  -6.549  -9.450   5.335
  751    HG2  LYS  94           HG2      LYS  94  -7.132  -9.610   7.659
  752    HG3  LYS  94           HG3      LYS  94  -7.132  -7.914   7.171
  753    HD2  LYS  94           HD2      LYS  94  -9.047  -8.300   8.557
  754    HD3  LYS  94           HD3      LYS  94  -9.605  -8.061   6.900
  755    HE2  LYS  94           HE2      LYS  94  -9.780 -10.501   6.626
  756    HE3  LYS  94           HE3      LYS  94  -9.257 -10.717   8.297
  757    HZ1  LYS  94           HZ1      LYS  94 -11.722  -9.304   7.417
  758    HZ2  LYS  94           HZ2      LYS  94 -11.217  -9.486   9.021
  759    HZ3  LYS  94           HZ3      LYS  94 -11.659 -10.850   8.115
  760    H    VAL  95           H        VAL  95  -5.921  -7.455   3.905
  761    HA   VAL  95           HA       VAL  95  -5.550  -5.228   5.571
  762    HB   VAL  95           HB       VAL  95  -4.309  -5.793   2.871
  763   HG11  VAL  95          2HG1      VAL  95  -2.476  -4.381   3.612
  764   HG12  VAL  95          1HG1      VAL  95  -3.331  -4.039   5.117
  765   HG13  VAL  95          3HG1      VAL  95  -3.990  -3.477   3.580
  766   HG21  VAL  95          3HG2      VAL  95  -3.997  -7.639   4.417
  767   HG22  VAL  95          2HG2      VAL  95  -3.386  -6.528   5.646
  768   HG23  VAL  95          1HG2      VAL  95  -2.474  -6.783   4.158
  769    H    ILE  96           H        ILE  96  -6.701  -5.464   2.225
  770    HA   ILE  96           HA       ILE  96  -7.018  -2.698   1.759
  771    HB   ILE  96           HB       ILE  96  -8.489  -5.026   0.513
  772   HG12  ILE  96          2HG1      ILE  96  -6.097  -3.502  -0.524
  773   HG13  ILE  96          3HG1      ILE  96  -5.970  -5.015   0.367
  774   HG21  ILE  96          2HG2      ILE  96  -8.892  -3.477  -1.364
  775   HG22  ILE  96          1HG2      ILE  96  -8.187  -2.170  -0.413
  776   HG23  ILE  96          3HG2      ILE  96  -9.677  -2.946   0.123
  777   HD11  ILE  96          3HD1      ILE  96  -7.235  -6.151  -1.364
  778   HD12  ILE  96          2HD1      ILE  96  -5.812  -5.355  -2.032
  779   HD13  ILE  96          1HD1      ILE  96  -7.406  -4.632  -2.245
  780    H    ASN  97           H        ASN  97  -9.371  -5.197   2.721
  781    HA   ASN  97           HA       ASN  97 -11.595  -3.516   2.954
  782    HB2  ASN  97           HB2      ASN  97 -10.910  -6.139   4.272
  783    HB3  ASN  97           HB3      ASN  97 -12.437  -5.315   4.572
  784   HD21  ASN  97          1HD2      ASN  97 -11.869  -7.905   3.303
  785   HD22  ASN  97          2HD2      ASN  97 -12.584  -7.825   1.733
  786    H    ALA  98           H        ALA  98  -9.133  -4.420   5.329
  787    HA   ALA  98           HA       ALA  98 -10.297  -3.199   7.567
  788    HB1  ALA  98           HB1      ALA  98  -7.367  -3.595   6.967
  789    HB2  ALA  98           HB2      ALA  98  -8.063  -3.247   8.551
  790    HB3  ALA  98           HB3      ALA  98  -8.438  -4.766   7.736
  791    H    ALA  99           H        ALA  99  -8.178  -1.906   5.056
  792    HA   ALA  99           HA       ALA  99  -7.701   0.609   6.214
  793    HB1  ALA  99           HB1      ALA  99  -6.393  -0.247   4.338
  794    HB2  ALA  99           HB2      ALA  99  -7.805  -0.120   3.290
  795    HB3  ALA  99           HB3      ALA  99  -7.078   1.335   3.968
  796    H    LEU 100           H        LEU 100 -10.172  -0.410   3.840
  797    HA   LEU 100           HA       LEU 100 -11.504   2.085   3.770
  798    HB2  LEU 100           HB2      LEU 100 -12.253  -0.710   2.990
  799    HB3  LEU 100           HB3      LEU 100 -13.451   0.567   2.949
  800    HG   LEU 100           HG       LEU 100 -12.504   0.196   0.748
  801   HD11  LEU 100          2HD1      LEU 100 -13.231   2.437   1.297
  802   HD12  LEU 100          1HD1      LEU 100 -11.821   2.499   0.237
  803   HD13  LEU 100          3HD1      LEU 100 -11.641   2.811   1.965
  804   HD21  LEU 100          3HD2      LEU 100 -10.175   0.672   0.243
  805   HD22  LEU 100          2HD2      LEU 100 -10.314  -0.654   1.397
  806   HD23  LEU 100          1HD2      LEU 100  -9.854   0.955   1.953
  807    H    ALA 101           H        ALA 101 -11.735  -0.702   5.851
  808    HA   ALA 101           HA       ALA 101 -14.207  -0.086   7.069
  809    HB1  ALA 101           HB1      ALA 101 -13.173  -2.302   7.193
  810    HB2  ALA 101           HB2      ALA 101 -11.892  -1.643   8.209
  811    HB3  ALA 101           HB3      ALA 101 -13.555  -1.668   8.793
  812    H    LEU 102           H        LEU 102 -11.119   1.342   7.384
  813    HA   LEU 102           HA       LEU 102 -11.501   2.331  10.059
  814    HB2  LEU 102           HB2      LEU 102  -9.512   3.106   7.927
  815    HB3  LEU 102           HB3      LEU 102  -9.477   3.678   9.584
  816    HG   LEU 102           HG       LEU 102  -9.097   0.828   8.668
  817   HD11  LEU 102          2HD1      LEU 102  -6.823   1.124   9.511
  818   HD12  LEU 102          1HD1      LEU 102  -7.183   2.808   9.896
  819   HD13  LEU 102          3HD1      LEU 102  -7.186   2.267   8.218
  820   HD21  LEU 102          3HD2      LEU 102  -9.025   1.982  11.454
  821   HD22  LEU 102          2HD2      LEU 102  -8.639   0.320  11.007
  822   HD23  LEU 102          1HD2      LEU 102 -10.282   0.928  10.805
  823    H    ILE 103           H        ILE 103 -12.496   3.316   6.931
  824    HA   ILE 103           HA       ILE 103 -13.117   6.001   7.975
  825    HB   ILE 103           HB       ILE 103 -13.160   6.771   5.600
  826   HG12  ILE 103          2HG1      ILE 103 -11.822   4.111   5.054
  827   HG13  ILE 103          3HG1      ILE 103 -13.454   4.544   4.555
  828   HG21  ILE 103          2HG2      ILE 103 -10.729   6.935   5.388
  829   HG22  ILE 103          1HG2      ILE 103 -10.539   5.661   6.591
  830   HG23  ILE 103          3HG2      ILE 103 -11.254   7.206   7.049
  831   HD11  ILE 103          3HD1      ILE 103 -11.908   4.744   2.711
  832   HD12  ILE 103          2HD1      ILE 103 -10.909   5.862   3.641
  833   HD13  ILE 103          1HD1      ILE 103 -12.540   6.330   3.157
  834    H    ASP 104           H        ASP 104 -14.334   3.326   5.996
  835    HA   ASP 104           HA       ASP 104 -17.013   4.551   6.162
  836    HB2  ASP 104           HB2      ASP 104 -16.064   4.480   3.867
  837    HB3  ASP 104           HB3      ASP 104 -15.953   2.731   3.993
  838    H    GLU 105           H        GLU 105 -15.086   1.805   6.788
  839    HA   GLU 105           HA       GLU 105 -15.457  -0.200   7.759
  840    HB2  GLU 105           HB2      GLU 105 -18.098   1.073   8.419
  841    HB3  GLU 105           HB3      GLU 105 -17.756  -0.601   8.828
  842    HG2  GLU 105           HG2      GLU 105 -15.770   0.198  10.100
  843    HG3  GLU 105           HG3      GLU 105 -16.318   1.848   9.805
  844    H    LYS 106           H        LYS 106 -15.226  -1.205   5.743
  845    HA   LYS 106           HA       LYS 106 -17.746  -2.401   4.839
  846    HB2  LYS 106           HB2      LYS 106 -16.759  -1.166   3.001
  847    HB3  LYS 106           HB3      LYS 106 -15.211  -1.964   3.250
  848    HG2  LYS 106           HG2      LYS 106 -16.513  -2.865   1.340
  849    HG3  LYS 106           HG3      LYS 106 -16.110  -4.073   2.561
  850    HD2  LYS 106           HD2      LYS 106 -18.494  -3.281   3.501
  851    HD3  LYS 106           HD3      LYS 106 -18.741  -2.957   1.783
  852    HE2  LYS 106           HE2      LYS 106 -19.476  -5.220   2.439
  853    HE3  LYS 106           HE3      LYS 106 -18.190  -5.246   1.233
  854    HZ1  LYS 106           HZ1      LYS 106 -17.631  -5.510   4.134
  855    HZ2  LYS 106           HZ2      LYS 106 -16.617  -5.892   2.827
  856    HZ3  LYS 106           HZ3      LYS 106 -17.970  -6.853   3.155
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1 -16.543  -0.574  -8.267
    2    H2   MET   1           H2       MET   1 -17.494   0.747  -8.734
    3    H3   MET   1           H3       MET   1 -18.039  -0.302  -7.523
    4    HA   MET   1           HA       MET   1 -17.223   1.771  -6.599
    5    HB2  MET   1           HB2      MET   1 -17.038  -0.324  -5.295
    6    HB3  MET   1           HB3      MET   1 -15.450  -0.609  -5.993
    7    HG2  MET   1           HG2      MET   1 -14.767   1.614  -4.991
    8    HG3  MET   1           HG3      MET   1 -16.280   1.553  -4.088
    9    HE1  MET   1           HE1      MET   1 -16.868  -0.397  -2.325
   10    HE2  MET   1           HE2      MET   1 -16.536  -1.602  -3.570
   11    HE3  MET   1           HE3      MET   1 -15.783  -1.742  -1.979
   12    H    LYS   2           H        LYS   2 -14.401  -0.138  -7.571
   13    HA   LYS   2           HA       LYS   2 -12.282   0.448  -8.084
   14    HB2  LYS   2           HB2      LYS   2 -13.754   2.498  -9.740
   15    HB3  LYS   2           HB3      LYS   2 -12.039   2.137  -9.903
   16    HG2  LYS   2           HG2      LYS   2 -12.627  -0.209 -10.428
   17    HG3  LYS   2           HG3      LYS   2 -14.330   0.241 -10.378
   18    HD2  LYS   2           HD2      LYS   2 -13.576   0.208 -12.666
   19    HD3  LYS   2           HD3      LYS   2 -13.911   1.873 -12.188
   20    HE2  LYS   2           HE2      LYS   2 -11.524   2.246 -11.818
   21    HE3  LYS   2           HE3      LYS   2 -11.190   0.578 -12.284
   22    HZ1  LYS   2           HZ1      LYS   2 -12.001   1.035 -14.487
   23    HZ2  LYS   2           HZ2      LYS   2 -10.804   2.165 -14.091
   24    HZ3  LYS   2           HZ3      LYS   2 -12.438   2.614 -14.049
   25    H    ARG   3           H        ARG   3 -11.876   1.053  -5.904
   26    HA   ARG   3           HA       ARG   3 -11.927   3.884  -5.256
   27    HB2  ARG   3           HB2      ARG   3 -12.403   1.788  -3.690
   28    HB3  ARG   3           HB3      ARG   3 -10.660   1.857  -3.466
   29    HG2  ARG   3           HG2      ARG   3 -11.776   3.078  -1.708
   30    HG3  ARG   3           HG3      ARG   3 -10.860   4.193  -2.728
   31    HD2  ARG   3           HD2      ARG   3 -12.921   4.749  -3.940
   32    HD3  ARG   3           HD3      ARG   3 -13.823   3.656  -2.896
   33    HE   ARG   3           HE       ARG   3 -12.531   5.480  -1.248
   34   HH11  ARG   3          2HH1      ARG   3 -14.919   5.565  -3.798
   35   HH12  ARG   3          1HH1      ARG   3 -15.800   6.891  -3.111
   36   HH21  ARG   3          2HH2      ARG   3 -13.661   7.265  -0.356
   37   HH22  ARG   3          1HH2      ARG   3 -15.080   7.868  -1.162
   38    H    LYS   4           H        LYS   4  -9.857   4.735  -4.157
   39    HA   LYS   4           HA       LYS   4  -7.573   4.032  -5.882
   40    HB2  LYS   4           HB2      LYS   4  -7.824   6.631  -4.409
   41    HB3  LYS   4           HB3      LYS   4  -6.915   6.270  -5.870
   42    HG2  LYS   4           HG2      LYS   4  -9.916   6.358  -5.709
   43    HG3  LYS   4           HG3      LYS   4  -8.900   7.695  -6.244
   44    HD2  LYS   4           HD2      LYS   4  -8.094   6.392  -8.110
   45    HD3  LYS   4           HD3      LYS   4  -8.974   4.972  -7.534
   46    HE2  LYS   4           HE2      LYS   4 -10.182   6.066  -9.347
   47    HE3  LYS   4           HE3      LYS   4 -11.090   6.146  -7.840
   48    HZ1  LYS   4           HZ1      LYS   4 -10.129   8.436  -7.560
   49    HZ2  LYS   4           HZ2      LYS   4 -11.231   8.260  -8.833
   50    HZ3  LYS   4           HZ3      LYS   4  -9.570   8.325  -9.161
   51    H    ILE   5           H        ILE   5  -5.818   3.189  -4.885
   52    HA   ILE   5           HA       ILE   5  -5.437   3.765  -2.025
   53    HB   ILE   5           HB       ILE   5  -5.282   0.996  -3.233
   54   HG12  ILE   5          2HG1      ILE   5  -7.235   2.130  -1.216
   55   HG13  ILE   5          3HG1      ILE   5  -7.601   1.809  -2.907
   56   HG21  ILE   5          2HG2      ILE   5  -3.609   1.302  -1.512
   57   HG22  ILE   5          1HG2      ILE   5  -4.896   0.255  -0.913
   58   HG23  ILE   5          3HG2      ILE   5  -4.824   1.943  -0.406
   59   HD11  ILE   5          3HD1      ILE   5  -7.239  -0.564  -2.554
   60   HD12  ILE   5          2HD1      ILE   5  -8.452   0.062  -1.436
   61   HD13  ILE   5          1HD1      ILE   5  -6.813  -0.259  -0.870
   62    H    ILE   6           H        ILE   6  -3.378   4.292  -1.547
   63    HA   ILE   6           HA       ILE   6  -1.283   3.367  -3.394
   64    HB   ILE   6           HB       ILE   6   0.185   5.137  -2.489
   65   HG12  ILE   6          2HG1      ILE   6  -1.148   5.424  -0.318
   66   HG13  ILE   6          3HG1      ILE   6  -0.537   6.889  -1.079
   67   HG21  ILE   6          2HG2      ILE   6  -0.991   5.476  -4.573
   68   HG22  ILE   6          1HG2      ILE   6  -0.838   6.998  -3.693
   69   HG23  ILE   6          3HG2      ILE   6  -2.377   6.137  -3.706
   70   HD11  ILE   6          3HD1      ILE   6  -2.791   7.210  -0.266
   71   HD12  ILE   6          2HD1      ILE   6  -3.361   5.846  -1.228
   72   HD13  ILE   6          1HD1      ILE   6  -2.762   7.300  -2.027
   73    H    ALA   7           H        ALA   7   0.271   2.038  -2.620
   74    HA   ALA   7           HA       ALA   7   0.408   1.597   0.271
   75    HB1  ALA   7           HB1      ALA   7  -0.165  -0.609  -1.706
   76    HB2  ALA   7           HB2      ALA   7   0.117  -0.811   0.023
   77    HB3  ALA   7           HB3      ALA   7  -1.308   0.059  -0.540
   78    H    VAL   8           H        VAL   8   2.450   1.409   0.895
   79    HA   VAL   8           HA       VAL   8   4.495   0.865  -1.125
   80    HB   VAL   8           HB       VAL   8   4.898   1.727   1.745
   81   HG11  VAL   8          2HG1      VAL   8   6.768   1.711  -0.621
   82   HG12  VAL   8          1HG1      VAL   8   6.833   0.624   0.767
   83   HG13  VAL   8          3HG1      VAL   8   7.142   2.348   0.981
   84   HG21  VAL   8          3HG2      VAL   8   5.303   3.976   0.835
   85   HG22  VAL   8          2HG2      VAL   8   3.648   3.436   0.551
   86   HG23  VAL   8          1HG2      VAL   8   4.824   3.404  -0.763
   87    H    THR   9           H        THR   9   5.176  -1.142  -1.359
   88    HA   THR   9           HA       THR   9   5.194  -2.919   0.992
   89    HB   THR   9           HB       THR   9   5.114  -4.783  -0.743
   90    HG1  THR   9           HG1      THR   9   5.587  -3.133  -2.478
   91   HG21  THR   9          3HG2      THR   9   2.736  -2.928  -0.545
   92   HG22  THR   9          1HG2      THR   9   3.171  -4.180   0.618
   93   HG23  THR   9          2HG2      THR   9   2.678  -4.628  -1.015
   94    H    ALA  10           H        ALA  10   7.210  -3.235   1.710
   95    HA   ALA  10           HA       ALA  10   9.360  -3.866  -0.098
   96    HB1  ALA  10           HB1      ALA  10  10.804  -1.998   0.519
   97    HB2  ALA  10           HB2      ALA  10   9.337  -1.426  -0.277
   98    HB3  ALA  10           HB3      ALA  10   9.497  -1.297   1.474
   99    H    CYS  11           H        CYS  11  11.340  -4.419   1.046
  100    HA   CYS  11           HA       CYS  11  11.285  -4.543   3.918
  101    HB2  CYS  11           HB2      CYS  11  11.522  -7.011   4.023
  102    HB3  CYS  11           HB3      CYS  11   9.941  -6.503   3.445
  103    HG   CYS  11           HG       CYS  11  11.272  -6.795   0.692
  104    H    ALA  12           H        ALA  12  13.311  -4.799   4.787
  105    HA   ALA  12           HA       ALA  12  15.507  -4.583   2.879
  106    HB1  ALA  12           HB1      ALA  12  15.397  -2.945   4.693
  107    HB2  ALA  12           HB2      ALA  12  15.492  -4.244   5.882
  108    HB3  ALA  12           HB3      ALA  12  16.858  -3.924   4.813
  109    H    THR  13           H        THR  13  14.247  -6.668   5.374
  110    HA   THR  13           HA       THR  13  16.291  -8.666   4.670
  111    HB   THR  13           HB       THR  13  15.542  -9.814   6.814
  112    HG1  THR  13           HG1      THR  13  14.106  -7.383   6.986
  113   HG21  THR  13          3HG2      THR  13  16.915  -8.372   8.248
  114   HG22  THR  13          1HG2      THR  13  16.819  -7.085   7.046
  115   HG23  THR  13          2HG2      THR  13  17.653  -8.591   6.661
  116    H    GLY  14           H        GLY  14  15.669 -10.571   3.795
  117    HA2  GLY  14           HA1      GLY  14  14.282 -12.162   2.857
  118    HA3  GLY  14           HA2      GLY  14  12.974 -11.543   3.858
  119    H    VAL  15           H        VAL  15  14.963 -10.471   1.115
  120    HA   VAL  15           HA       VAL  15  13.287  -8.375   0.365
  121    HB   VAL  15           HB       VAL  15  14.595  -8.286  -1.705
  122   HG11  VAL  15          2HG1      VAL  15  15.461  -7.277   0.341
  123   HG12  VAL  15          1HG1      VAL  15  16.769  -7.903  -0.662
  124   HG13  VAL  15          3HG1      VAL  15  16.245  -8.800   0.762
  125   HG21  VAL  15          3HG2      VAL  15  14.819 -10.675  -2.141
  126   HG22  VAL  15          2HG2      VAL  15  15.846 -10.847  -0.716
  127   HG23  VAL  15          1HG2      VAL  15  16.400  -9.895  -2.092
  128    H    ALA  16           H        ALA  16  12.932 -11.733  -0.306
  129    HA   ALA  16           HA       ALA  16  11.514 -11.642  -2.723
  130    HB1  ALA  16           HB1      ALA  16  12.301 -13.725  -1.684
  131    HB2  ALA  16           HB2      ALA  16  11.086 -13.540  -0.420
  132    HB3  ALA  16           HB3      ALA  16  10.587 -13.794  -2.092
  133    H    HIS  17           H        HIS  17  10.613 -10.742   0.494
  134    HA   HIS  17           HA       HIS  17   7.805 -10.913   0.233
  135    HB2  HIS  17           HB2      HIS  17   9.534  -9.205   2.025
  136    HB3  HIS  17           HB3      HIS  17   7.780  -9.253   2.135
  137    HD1  HIS  17           HD1      HIS  17  10.586 -10.622   3.738
  138    HD2  HIS  17           HD2      HIS  17   6.971 -12.207   2.435
  139    HE1  HIS  17           HE1      HIS  17  10.248 -12.722   5.076
  140    HE2  HIS  17           HE2      HIS  17   8.143 -13.749   4.156
  141    H    THR  18           H        THR  18  10.130  -8.398  -0.596
  142    HA   THR  18           HA       THR  18   8.389  -6.244  -0.921
  143    HB   THR  18           HB       THR  18  10.857  -6.796  -2.588
  144    HG1  THR  18           HG1      THR  18  11.982  -5.720  -0.934
  145   HG21  THR  18          3HG2      THR  18   9.487  -4.933  -3.398
  146   HG22  THR  18          1HG2      THR  18  11.017  -4.358  -2.734
  147   HG23  THR  18          2HG2      THR  18   9.532  -4.198  -1.796
  148    H    TYR  19           H        TYR  19   9.158  -8.901  -3.093
  149    HA   TYR  19           HA       TYR  19   7.742  -7.611  -5.284
  150    HB2  TYR  19           HB2      TYR  19   9.187 -10.268  -5.229
  151    HB3  TYR  19           HB3      TYR  19   8.587  -9.436  -6.664
  152    HD1  TYR  19           HD1      TYR  19   9.559  -7.080  -7.124
  153    HD2  TYR  19           HD2      TYR  19  11.373  -9.897  -4.504
  154    HE1  TYR  19           HE1      TYR  19  11.694  -5.879  -7.319
  155    HE2  TYR  19           HE2      TYR  19  13.513  -8.701  -4.693
  156    HH   TYR  19           HH       TYR  19  14.607  -7.153  -6.454
  157    H    MET  20           H        MET  20   7.530 -10.517  -3.275
  158    HA   MET  20           HA       MET  20   5.287 -11.621  -4.578
  159    HB2  MET  20           HB2      MET  20   6.716 -12.973  -3.140
  160    HB3  MET  20           HB3      MET  20   6.255 -12.010  -1.742
  161    HG2  MET  20           HG2      MET  20   5.066 -14.110  -1.743
  162    HG3  MET  20           HG3      MET  20   3.947 -12.769  -1.980
  163    HE1  MET  20           HE1      MET  20   2.198 -15.514  -4.087
  164    HE2  MET  20           HE2      MET  20   3.018 -15.709  -2.538
  165    HE3  MET  20           HE3      MET  20   2.017 -14.287  -2.833
  166    H    ALA  21           H        ALA  21   5.569  -9.433  -1.800
  167    HA   ALA  21           HA       ALA  21   2.853  -9.514  -1.041
  168    HB1  ALA  21           HB1      ALA  21   4.632  -8.661   0.421
  169    HB2  ALA  21           HB2      ALA  21   4.824  -7.266  -0.639
  170    HB3  ALA  21           HB3      ALA  21   3.315  -7.502   0.241
  171    H    ALA  22           H        ALA  22   4.625  -7.270  -3.141
  172    HA   ALA  22           HA       ALA  22   2.515  -5.498  -3.636
  173    HB1  ALA  22           HB1      ALA  22   3.819  -4.721  -5.529
  174    HB2  ALA  22           HB2      ALA  22   4.872  -5.012  -4.146
  175    HB3  ALA  22           HB3      ALA  22   4.815  -6.175  -5.471
  176    H    GLN  23           H        GLN  23   3.499  -8.450  -5.336
  177    HA   GLN  23           HA       GLN  23   1.616  -8.140  -7.463
  178    HB2  GLN  23           HB2      GLN  23   3.086 -10.591  -6.475
  179    HB3  GLN  23           HB3      GLN  23   2.157 -10.517  -7.964
  180    HG2  GLN  23           HG2      GLN  23   3.676  -8.858  -8.864
  181    HG3  GLN  23           HG3      GLN  23   4.574  -8.833  -7.347
  182   HE21  GLN  23          1HE2      GLN  23   4.324 -11.709  -6.967
  183   HE22  GLN  23          2HE2      GLN  23   5.420 -12.449  -8.083
  184    H    ALA  24           H        ALA  24   1.612  -9.994  -4.433
  185    HA   ALA  24           HA       ALA  24  -0.882 -11.275  -4.902
  186    HB1  ALA  24           HB1      ALA  24   0.756 -12.135  -3.297
  187    HB2  ALA  24           HB2      ALA  24   0.506 -10.715  -2.282
  188    HB3  ALA  24           HB3      ALA  24  -0.810 -11.861  -2.536
  189    H    LEU  25           H        LEU  25   0.080  -8.326  -3.225
  190    HA   LEU  25           HA       LEU  25  -2.477  -7.553  -2.330
  191    HB2  LEU  25           HB2      LEU  25  -0.369  -6.572  -1.529
  192    HB3  LEU  25           HB3      LEU  25  -0.096  -5.858  -3.104
  193    HG   LEU  25           HG       LEU  25  -2.104  -4.451  -2.795
  194   HD11  LEU  25          2HD1      LEU  25  -3.139  -4.299  -0.587
  195   HD12  LEU  25          1HD1      LEU  25  -2.145  -5.643  -0.025
  196   HD13  LEU  25          3HD1      LEU  25  -3.352  -5.905  -1.284
  197   HD21  LEU  25          3HD2      LEU  25   0.172  -3.694  -2.172
  198   HD22  LEU  25          2HD2      LEU  25  -0.137  -4.235  -0.522
  199   HD23  LEU  25          1HD2      LEU  25  -1.102  -2.931  -1.216
  200    H    LYS  26           H        LYS  26  -0.698  -6.959  -5.314
  201    HA   LYS  26           HA       LYS  26  -2.513  -5.300  -6.641
  202    HB2  LYS  26           HB2      LYS  26  -0.179  -5.906  -7.389
  203    HB3  LYS  26           HB3      LYS  26  -0.815  -7.460  -7.907
  204    HG2  LYS  26           HG2      LYS  26  -0.820  -6.260  -9.865
  205    HG3  LYS  26           HG3      LYS  26  -2.475  -6.029  -9.295
  206    HD2  LYS  26           HD2      LYS  26  -1.749  -3.891  -9.951
  207    HD3  LYS  26           HD3      LYS  26  -1.632  -3.903  -8.191
  208    HE2  LYS  26           HE2      LYS  26   0.338  -2.869  -9.166
  209    HE3  LYS  26           HE3      LYS  26   0.766  -4.376  -8.355
  210    HZ1  LYS  26           HZ1      LYS  26   0.832  -5.488 -10.481
  211    HZ2  LYS  26           HZ2      LYS  26   1.858  -4.142 -10.518
  212    HZ3  LYS  26           HZ3      LYS  26   0.344  -4.078 -11.280
  213    H    LYS  27           H        LYS  27  -2.274  -8.819  -6.467
  214    HA   LYS  27           HA       LYS  27  -4.342  -9.512  -8.211
  215    HB2  LYS  27           HB2      LYS  27  -2.638 -11.057  -7.299
  216    HB3  LYS  27           HB3      LYS  27  -3.395 -10.939  -5.719
  217    HG2  LYS  27           HG2      LYS  27  -5.438 -11.942  -6.654
  218    HG3  LYS  27           HG3      LYS  27  -4.608 -12.119  -8.205
  219    HD2  LYS  27           HD2      LYS  27  -2.858 -13.444  -7.036
  220    HD3  LYS  27           HD3      LYS  27  -3.847 -13.382  -5.578
  221    HE2  LYS  27           HE2      LYS  27  -5.680 -14.481  -6.819
  222    HE3  LYS  27           HE3      LYS  27  -4.618 -14.612  -8.220
  223    HZ1  LYS  27           HZ1      LYS  27  -4.211 -15.882  -5.566
  224    HZ2  LYS  27           HZ2      LYS  27  -3.088 -15.928  -6.833
  225    HZ3  LYS  27           HZ3      LYS  27  -4.597 -16.669  -7.019
  226    H    GLY  28           H        GLY  28  -4.381  -9.002  -4.686
  227    HA2  GLY  28           HA1      GLY  28  -7.130  -9.501  -4.303
  228    HA3  GLY  28           HA2      GLY  28  -6.107  -8.545  -3.237
  229    H    ALA  29           H        ALA  29  -5.367  -6.492  -4.926
  230    HA   ALA  29           HA       ALA  29  -7.592  -4.769  -4.805
  231    HB1  ALA  29           HB1      ALA  29  -5.053  -4.434  -6.396
  232    HB2  ALA  29           HB2      ALA  29  -6.190  -3.158  -5.967
  233    HB3  ALA  29           HB3      ALA  29  -5.272  -3.982  -4.706
  234    H    LYS  30           H        LYS  30  -6.170  -6.621  -7.443
  235    HA   LYS  30           HA       LYS  30  -7.795  -5.600  -9.519
  236    HB2  LYS  30           HB2      LYS  30  -5.712  -6.883  -9.899
  237    HB3  LYS  30           HB3      LYS  30  -6.502  -8.327  -9.280
  238    HG2  LYS  30           HG2      LYS  30  -6.537  -8.480 -11.638
  239    HG3  LYS  30           HG3      LYS  30  -8.179  -8.081 -11.131
  240    HD2  LYS  30           HD2      LYS  30  -7.650  -6.727 -13.026
  241    HD3  LYS  30           HD3      LYS  30  -7.660  -5.684 -11.603
  242    HE2  LYS  30           HE2      LYS  30  -5.763  -5.143 -13.004
  243    HE3  LYS  30           HE3      LYS  30  -5.206  -5.856 -11.490
  244    HZ1  LYS  30           HZ1      LYS  30  -5.518  -7.358 -14.032
  245    HZ2  LYS  30           HZ2      LYS  30  -4.818  -7.930 -12.596
  246    HZ3  LYS  30           HZ3      LYS  30  -4.052  -6.707 -13.489
  247    H    LYS  31           H        LYS  31  -8.163  -8.260  -7.245
  248    HA   LYS  31           HA       LYS  31 -10.480  -9.401  -8.384
  249    HB2  LYS  31           HB2      LYS  31  -9.003 -10.512  -6.704
  250    HB3  LYS  31           HB3      LYS  31  -9.651  -9.427  -5.478
  251    HG2  LYS  31           HG2      LYS  31 -11.916 -10.331  -5.964
  252    HG3  LYS  31           HG3      LYS  31 -11.167 -11.501  -7.050
  253    HD2  LYS  31           HD2      LYS  31 -10.640 -11.223  -4.094
  254    HD3  LYS  31           HD3      LYS  31 -11.603 -12.485  -4.864
  255    HE2  LYS  31           HE2      LYS  31  -9.584 -13.188  -6.119
  256    HE3  LYS  31           HE3      LYS  31  -8.651 -11.990  -5.220
  257    HZ1  LYS  31           HZ1      LYS  31  -8.419 -14.149  -4.211
  258    HZ2  LYS  31           HZ2      LYS  31 -10.099 -14.309  -4.066
  259    HZ3  LYS  31           HZ3      LYS  31  -9.282 -13.129  -3.160
  260    H    MET  32           H        MET  32 -10.067  -7.108  -5.694
  261    HA   MET  32           HA       MET  32 -12.862  -6.771  -5.259
  262    HB2  MET  32           HB2      MET  32 -10.512  -5.060  -4.423
  263    HB3  MET  32           HB3      MET  32 -12.163  -4.822  -3.864
  264    HG2  MET  32           HG2      MET  32 -12.130  -7.076  -2.882
  265    HG3  MET  32           HG3      MET  32 -10.457  -7.260  -3.403
  266    HE1  MET  32           HE1      MET  32 -11.841  -4.156  -0.272
  267    HE2  MET  32           HE2      MET  32 -12.186  -4.004  -1.995
  268    HE3  MET  32           HE3      MET  32 -12.929  -5.300  -1.057
  269    H    GLY  33           H        GLY  33 -10.562  -5.332  -7.402
  270    HA2  GLY  33           HA1      GLY  33 -11.085  -4.198  -9.364
  271    HA3  GLY  33           HA2      GLY  33 -12.745  -4.056  -8.809
  272    H    ASN  34           H        ASN  34  -9.528  -2.910  -7.775
  273    HA   ASN  34           HA       ASN  34 -10.607  -0.187  -7.814
  274    HB2  ASN  34           HB2      ASN  34  -9.532   0.372  -5.714
  275    HB3  ASN  34           HB3      ASN  34 -10.616  -0.987  -5.477
  276   HD21  ASN  34          1HD2      ASN  34  -9.782  -3.001  -4.985
  277   HD22  ASN  34          2HD2      ASN  34  -8.145  -3.216  -4.480
  278    H    LEU  35           H        LEU  35  -8.632   1.363  -7.362
  279    HA   LEU  35           HA       LEU  35  -6.530   0.560  -9.267
  280    HB2  LEU  35           HB2      LEU  35  -7.494   3.323  -8.500
  281    HB3  LEU  35           HB3      LEU  35  -6.130   3.007  -9.549
  282    HG   LEU  35           HG       LEU  35  -7.877   3.564 -10.992
  283   HD11  LEU  35          2HD1      LEU  35  -6.679   1.599 -11.735
  284   HD12  LEU  35          1HD1      LEU  35  -8.368   1.524 -12.239
  285   HD13  LEU  35          3HD1      LEU  35  -7.811   0.558 -10.873
  286   HD21  LEU  35          3HD2      LEU  35  -9.709   3.456  -9.403
  287   HD22  LEU  35          2HD2      LEU  35  -9.669   1.694  -9.453
  288   HD23  LEU  35          1HD2      LEU  35 -10.121   2.608 -10.892
  289    H    ILE  36           H        ILE  36  -4.738  -0.045  -8.242
  290    HA   ILE  36           HA       ILE  36  -4.105   1.309  -5.714
  291    HB   ILE  36           HB       ILE  36  -4.714  -1.083  -5.469
  292   HG12  ILE  36          2HG1      ILE  36  -1.819  -0.490  -4.832
  293   HG13  ILE  36          3HG1      ILE  36  -3.189   0.081  -3.889
  294   HG21  ILE  36          2HG2      ILE  36  -3.859  -1.919  -7.591
  295   HG22  ILE  36          1HG2      ILE  36  -3.159  -2.808  -6.238
  296   HG23  ILE  36          3HG2      ILE  36  -2.208  -1.579  -7.070
  297   HD11  ILE  36          3HD1      ILE  36  -2.462  -2.803  -4.336
  298   HD12  ILE  36          2HD1      ILE  36  -3.793  -2.204  -3.347
  299   HD13  ILE  36          1HD1      ILE  36  -2.126  -1.868  -2.879
  300    H    LYS  37           H        LYS  37  -2.128   2.077  -5.370
  301    HA   LYS  37           HA       LYS  37  -0.120   1.785  -7.508
  302    HB2  LYS  37           HB2      LYS  37  -1.131   4.110  -6.061
  303    HB3  LYS  37           HB3      LYS  37   0.618   3.976  -5.961
  304    HG2  LYS  37           HG2      LYS  37  -0.969   3.999  -8.521
  305    HG3  LYS  37           HG3      LYS  37  -0.133   5.389  -7.827
  306    HD2  LYS  37           HD2      LYS  37   1.968   3.936  -7.894
  307    HD3  LYS  37           HD3      LYS  37   1.047   2.860  -8.945
  308    HE2  LYS  37           HE2      LYS  37   1.629   5.777  -9.449
  309    HE3  LYS  37           HE3      LYS  37   2.406   4.412 -10.249
  310    HZ1  LYS  37           HZ1      LYS  37   0.655   5.413 -11.598
  311    HZ2  LYS  37           HZ2      LYS  37  -0.491   5.065 -10.402
  312    HZ3  LYS  37           HZ3      LYS  37   0.298   3.799 -11.218
  313    H    VAL  38           H        VAL  38   1.150   0.163  -6.789
  314    HA   VAL  38           HA       VAL  38   1.887   0.079  -3.968
  315    HB   VAL  38           HB       VAL  38   2.984  -2.098  -4.574
  316   HG11  VAL  38          2HG1      VAL  38   0.041  -1.821  -5.147
  317   HG12  VAL  38          1HG1      VAL  38   0.789  -2.040  -3.564
  318   HG13  VAL  38          3HG1      VAL  38   0.867  -3.331  -4.763
  319   HG21  VAL  38          3HG2      VAL  38   1.557  -1.693  -7.201
  320   HG22  VAL  38          2HG2      VAL  38   2.385  -3.163  -6.685
  321   HG23  VAL  38          1HG2      VAL  38   3.305  -1.685  -6.966
  322    H    GLU  39           H        GLU  39   3.764   0.748  -3.236
  323    HA   GLU  39           HA       GLU  39   5.774   1.661  -5.157
  324    HB2  GLU  39           HB2      GLU  39   4.998   3.245  -3.437
  325    HB3  GLU  39           HB3      GLU  39   5.536   2.144  -2.176
  326    HG2  GLU  39           HG2      GLU  39   7.803   2.487  -2.706
  327    HG3  GLU  39           HG3      GLU  39   7.405   3.281  -4.228
  328    H    THR  40           H        THR  40   7.954   1.043  -4.995
  329    HA   THR  40           HA       THR  40   8.397  -1.474  -3.538
  330    HB   THR  40           HB       THR  40   9.364  -0.888  -6.341
  331    HG1  THR  40           HG1      THR  40   6.973  -1.891  -5.393
  332   HG21  THR  40          3HG2      THR  40  10.765  -2.463  -5.086
  333   HG22  THR  40          1HG2      THR  40   9.904  -3.272  -6.397
  334   HG23  THR  40          2HG2      THR  40   9.343  -3.446  -4.735
  335    H    GLN  41           H        GLN  41  10.040  -1.255  -2.178
  336    HA   GLN  41           HA       GLN  41  12.340   0.405  -2.987
  337    HB2  GLN  41           HB2      GLN  41  10.990   1.402  -1.113
  338    HB3  GLN  41           HB3      GLN  41  11.364  -0.023  -0.154
  339    HG2  GLN  41           HG2      GLN  41  13.811   0.557  -0.551
  340    HG3  GLN  41           HG3      GLN  41  13.227   2.119  -1.117
  341   HE21  GLN  41          1HE2      GLN  41  12.195   3.504   0.359
  342   HE22  GLN  41          2HE2      GLN  41  12.399   3.316   2.067
  343    H    GLY  42           H        GLY  42  14.318  -0.570  -2.818
  344    HA2  GLY  42           HA1      GLY  42  14.354  -3.398  -2.170
  345    HA3  GLY  42           HA2      GLY  42  15.694  -2.452  -2.805
  346    H    ALA  43           H        ALA  43  16.339  -0.643  -1.155
  347    HA   ALA  43           HA       ALA  43  16.274  -1.618   1.601
  348    HB1  ALA  43           HB1      ALA  43  18.695  -1.409   1.847
  349    HB2  ALA  43           HB2      ALA  43  18.284  -2.615   0.628
  350    HB3  ALA  43           HB3      ALA  43  18.844  -1.017   0.134
  351    H    THR  44           H        THR  44  17.267   0.906  -0.669
  352    HA   THR  44           HA       THR  44  16.110   2.874   1.128
  353    HB   THR  44           HB       THR  44  18.478   2.870   1.782
  354    HG1  THR  44           HG1      THR  44  17.441   5.120   0.397
  355   HG21  THR  44          3HG2      THR  44  19.483   2.090  -0.300
  356   HG22  THR  44          1HG2      THR  44  20.211   3.612   0.212
  357   HG23  THR  44          2HG2      THR  44  19.029   3.597  -1.098
  358    H    GLY  45           H        GLY  45  16.996   1.756  -1.979
  359    HA2  GLY  45           HA1      GLY  45  16.228   4.233  -3.302
  360    HA3  GLY  45           HA2      GLY  45  16.843   2.781  -4.079
  361    H    ILE  46           H        ILE  46  14.305   4.633  -4.119
  362    HA   ILE  46           HA       ILE  46  12.272   2.517  -3.999
  363    HB   ILE  46           HB       ILE  46  11.940   5.506  -4.324
  364   HG12  ILE  46          2HG1      ILE  46  11.460   3.738  -1.912
  365   HG13  ILE  46          3HG1      ILE  46  12.824   4.833  -2.111
  366   HG21  ILE  46          2HG2      ILE  46   9.565   5.078  -3.880
  367   HG22  ILE  46          1HG2      ILE  46   9.887   3.344  -3.870
  368   HG23  ILE  46          3HG2      ILE  46  10.116   4.275  -5.350
  369   HD11  ILE  46          3HD1      ILE  46  11.302   6.732  -2.147
  370   HD12  ILE  46          2HD1      ILE  46  11.116   5.785  -0.671
  371   HD13  ILE  46          1HD1      ILE  46   9.928   5.639  -1.967
  372    H    GLU  47           H        GLU  47  11.464   1.645  -5.814
  373    HA   GLU  47           HA       GLU  47  12.494   2.669  -8.349
  374    HB2  GLU  47           HB2      GLU  47  12.702   0.238  -7.726
  375    HB3  GLU  47           HB3      GLU  47  10.955   0.113  -7.878
  376    HG2  GLU  47           HG2      GLU  47  11.062   0.670 -10.210
  377    HG3  GLU  47           HG3      GLU  47  12.791   0.994 -10.091
  378    H    ASN  48           H        ASN  48   9.366   1.584  -7.026
  379    HA   ASN  48           HA       ASN  48   8.003   3.083  -9.135
  380    HB2  ASN  48           HB2      ASN  48   7.323   0.689  -8.539
  381    HB3  ASN  48           HB3      ASN  48   6.692   1.348  -7.034
  382   HD21  ASN  48          1HD2      ASN  48   4.923   2.790  -7.114
  383   HD22  ASN  48          2HD2      ASN  48   3.870   2.829  -8.486
  384    H    GLU  49           H        GLU  49   8.747   5.057  -8.165
  385    HA   GLU  49           HA       GLU  49   8.130   5.857  -5.531
  386    HB2  GLU  49           HB2      GLU  49   8.569   7.655  -7.919
  387    HB3  GLU  49           HB3      GLU  49   8.823   8.056  -6.225
  388    HG2  GLU  49           HG2      GLU  49  10.679   6.546  -6.085
  389    HG3  GLU  49           HG3      GLU  49  10.370   5.951  -7.715
  390    H    LEU  50           H        LEU  50   6.220   6.410  -4.663
  391    HA   LEU  50           HA       LEU  50   3.940   7.030  -6.333
  392    HB2  LEU  50           HB2      LEU  50   4.237   7.207  -3.330
  393    HB3  LEU  50           HB3      LEU  50   2.728   7.264  -4.220
  394    HG   LEU  50           HG       LEU  50   4.577   4.889  -3.989
  395   HD11  LEU  50          2HD1      LEU  50   1.802   5.374  -2.924
  396   HD12  LEU  50          1HD1      LEU  50   3.286   5.335  -1.974
  397   HD13  LEU  50          3HD1      LEU  50   2.717   3.873  -2.781
  398   HD21  LEU  50          3HD2      LEU  50   2.835   3.672  -5.220
  399   HD22  LEU  50          2HD2      LEU  50   3.572   4.946  -6.192
  400   HD23  LEU  50          1HD2      LEU  50   1.976   5.190  -5.481
  401    H    THR  51           H        THR  51   3.699   8.973  -7.223
  402    HA   THR  51           HA       THR  51   5.179  11.223  -6.102
  403    HB   THR  51           HB       THR  51   4.623  12.382  -8.209
  404    HG1  THR  51           HG1      THR  51   3.142   9.989  -8.656
  405   HG21  THR  51          3HG2      THR  51   5.782   9.619  -8.580
  406   HG22  THR  51          1HG2      THR  51   6.665  11.052  -8.053
  407   HG23  THR  51          2HG2      THR  51   5.991  10.981  -9.681
  408    H    GLU  52           H        GLU  52   4.023  13.429  -6.455
  409    HA   GLU  52           HA       GLU  52   2.100  13.777  -4.526
  410    HB2  GLU  52           HB2      GLU  52   3.487  15.549  -5.655
  411    HB3  GLU  52           HB3      GLU  52   2.381  15.471  -7.017
  412    HG2  GLU  52           HG2      GLU  52   1.759  17.341  -5.715
  413    HG3  GLU  52           HG3      GLU  52   0.541  16.096  -5.440
  414    H    LYS  53           H        LYS  53   1.611  13.399  -8.003
  415    HA   LYS  53           HA       LYS  53  -1.145  13.771  -8.110
  416    HB2  LYS  53           HB2      LYS  53   0.394  13.709 -10.058
  417    HB3  LYS  53           HB3      LYS  53   0.571  11.976  -9.850
  418    HG2  LYS  53           HG2      LYS  53  -2.162  13.088 -10.226
  419    HG3  LYS  53           HG3      LYS  53  -1.083  12.999 -11.616
  420    HD2  LYS  53           HD2      LYS  53  -1.865  10.692  -9.834
  421    HD3  LYS  53           HD3      LYS  53  -2.501  11.012 -11.449
  422    HE2  LYS  53           HE2      LYS  53   0.380  10.426 -10.766
  423    HE3  LYS  53           HE3      LYS  53  -0.759   9.287 -11.478
  424    HZ1  LYS  53           HZ1      LYS  53   0.659  10.234 -13.161
  425    HZ2  LYS  53           HZ2      LYS  53   0.207  11.807 -12.727
  426    HZ3  LYS  53           HZ3      LYS  53  -0.936  10.754 -13.410
  427    H    ASP  54           H        ASP  54   0.692  10.738  -7.750
  428    HA   ASP  54           HA       ASP  54  -1.557   9.034  -7.719
  429    HB2  ASP  54           HB2      ASP  54   1.067   8.491  -6.325
  430    HB3  ASP  54           HB3      ASP  54  -0.082   7.309  -6.935
  431    H    VAL  55           H        VAL  55   0.294  10.571  -5.188
  432    HA   VAL  55           HA       VAL  55  -0.826   9.253  -2.993
  433    HB   VAL  55           HB       VAL  55   0.417  12.000  -3.162
  434   HG11  VAL  55          2HG1      VAL  55  -0.063  10.236  -0.768
  435   HG12  VAL  55          1HG1      VAL  55  -0.896  11.747  -1.125
  436   HG13  VAL  55          3HG1      VAL  55   0.830  11.757  -0.765
  437   HG21  VAL  55          3HG2      VAL  55   2.451  10.878  -2.430
  438   HG22  VAL  55          2HG2      VAL  55   1.869  10.191  -3.945
  439   HG23  VAL  55          1HG2      VAL  55   1.609   9.328  -2.429
  440    H    ASN  56           H        ASN  56  -1.790  12.258  -4.614
  441    HA   ASN  56           HA       ASN  56  -3.750  12.865  -2.599
  442    HB2  ASN  56           HB2      ASN  56  -3.027  14.123  -5.231
  443    HB3  ASN  56           HB3      ASN  56  -4.450  14.639  -4.324
  444   HD21  ASN  56          1HD2      ASN  56  -0.998  14.519  -4.413
  445   HD22  ASN  56          2HD2      ASN  56  -0.712  15.645  -3.124
  446    H    ILE  57           H        ILE  57  -3.723  11.032  -5.503
  447    HA   ILE  57           HA       ILE  57  -6.583  11.107  -5.848
  448    HB   ILE  57           HB       ILE  57  -4.493   9.295  -7.071
  449   HG12  ILE  57          2HG1      ILE  57  -4.247  11.591  -7.796
  450   HG13  ILE  57          3HG1      ILE  57  -4.932  10.645  -9.112
  451   HG21  ILE  57          2HG2      ILE  57  -6.251   8.672  -8.694
  452   HG22  ILE  57          1HG2      ILE  57  -7.429   9.544  -7.712
  453   HG23  ILE  57          3HG2      ILE  57  -6.604   8.132  -7.053
  454   HD11  ILE  57          3HD1      ILE  57  -6.438  12.492  -7.280
  455   HD12  ILE  57          2HD1      ILE  57  -7.156  11.511  -8.557
  456   HD13  ILE  57          1HD1      ILE  57  -6.015  12.793  -8.964
  457    H    GLY  58           H        GLY  58  -4.186   8.875  -4.518
  458    HA2  GLY  58           HA1      GLY  58  -5.930   6.770  -3.872
  459    HA3  GLY  58           HA2      GLY  58  -4.369   7.075  -3.127
  460    H    GLU  59           H        GLU  59  -7.219   6.341  -2.212
  461    HA   GLU  59           HA       GLU  59  -7.990   8.458  -0.432
  462    HB2  GLU  59           HB2      GLU  59  -8.825   5.550  -0.428
  463    HB3  GLU  59           HB3      GLU  59  -9.657   6.872   0.374
  464    HG2  GLU  59           HG2      GLU  59  -9.293   6.688  -2.605
  465    HG3  GLU  59           HG3      GLU  59 -10.706   6.078  -1.746
  466    H    VAL  60           H        VAL  60  -6.944   5.114   0.153
  467    HA   VAL  60           HA       VAL  60  -5.917   5.955   2.772
  468    HB   VAL  60           HB       VAL  60  -6.051   3.531   3.378
  469   HG11  VAL  60          2HG1      VAL  60  -8.627   4.837   2.521
  470   HG12  VAL  60          1HG1      VAL  60  -7.792   5.073   4.058
  471   HG13  VAL  60          3HG1      VAL  60  -8.486   3.500   3.661
  472   HG21  VAL  60          3HG2      VAL  60  -7.428   2.052   1.986
  473   HG22  VAL  60          2HG2      VAL  60  -5.973   2.578   1.139
  474   HG23  VAL  60          1HG2      VAL  60  -7.531   3.313   0.757
  475    H    VAL  61           H        VAL  61  -3.931   5.144   3.507
  476    HA   VAL  61           HA       VAL  61  -2.125   4.254   1.348
  477    HB   VAL  61           HB       VAL  61  -1.241   5.644   3.870
  478   HG11  VAL  61          2HG1      VAL  61   0.757   6.144   2.490
  479   HG12  VAL  61          1HG1      VAL  61   0.058   5.181   1.188
  480   HG13  VAL  61          3HG1      VAL  61   0.479   4.417   2.720
  481   HG21  VAL  61          3HG2      VAL  61  -2.761   7.164   2.750
  482   HG22  VAL  61          2HG2      VAL  61  -1.912   6.924   1.222
  483   HG23  VAL  61          1HG2      VAL  61  -1.099   7.725   2.566
  484    H    ILE  62           H        ILE  62  -1.617   2.166   1.573
  485    HA   ILE  62           HA       ILE  62  -1.594   1.035   4.285
  486    HB   ILE  62           HB       ILE  62  -1.576  -0.395   1.612
  487   HG12  ILE  62          2HG1      ILE  62  -3.798  -0.093   3.649
  488   HG13  ILE  62          3HG1      ILE  62  -3.709   0.770   2.117
  489   HG21  ILE  62          2HG2      ILE  62  -2.011  -2.420   2.934
  490   HG22  ILE  62          1HG2      ILE  62  -1.820  -1.482   4.415
  491   HG23  ILE  62          3HG2      ILE  62  -0.451  -1.695   3.323
  492   HD11  ILE  62          3HD1      ILE  62  -3.892  -1.331   0.909
  493   HD12  ILE  62          2HD1      ILE  62  -5.248  -1.120   2.018
  494   HD13  ILE  62          1HD1      ILE  62  -3.928  -2.216   2.435
  495    H    PHE  63           H        PHE  63   0.258   0.399   5.223
  496    HA   PHE  63           HA       PHE  63   2.686   0.430   3.556
  497    HB2  PHE  63           HB2      PHE  63   2.329   1.160   6.462
  498    HB3  PHE  63           HB3      PHE  63   3.905   0.883   5.730
  499    HD1  PHE  63           HD2      PHE  63   4.519   2.325   3.709
  500    HD2  PHE  63           HD1      PHE  63   1.354   3.261   6.395
  501    HE1  PHE  63           HE2      PHE  63   4.602   4.675   2.985
  502    HE2  PHE  63           HE1      PHE  63   1.432   5.609   5.677
  503    HZ   PHE  63           HZ       PHE  63   3.057   6.318   3.968
  504    H    ALA  64           H        ALA  64   3.229  -1.596   3.112
  505    HA   ALA  64           HA       ALA  64   3.378  -3.462   5.389
  506    HB1  ALA  64           HB1      ALA  64   3.225  -5.296   3.770
  507    HB2  ALA  64           HB2      ALA  64   1.807  -4.252   3.681
  508    HB3  ALA  64           HB3      ALA  64   3.072  -4.129   2.459
  509    H    VAL  65           H        VAL  65   5.425  -2.909   6.039
  510    HA   VAL  65           HA       VAL  65   7.575  -3.281   4.101
  511    HB   VAL  65           HB       VAL  65   8.659  -1.151   4.915
  512   HG11  VAL  65          2HG1      VAL  65   7.357   0.298   3.408
  513   HG12  VAL  65          1HG1      VAL  65   6.088  -0.926   3.357
  514   HG13  VAL  65          3HG1      VAL  65   7.686  -1.284   2.703
  515   HG21  VAL  65          3HG2      VAL  65   7.332  -0.770   6.906
  516   HG22  VAL  65          2HG2      VAL  65   5.872  -0.606   5.928
  517   HG23  VAL  65          1HG2      VAL  65   7.160   0.591   5.797
  518    H    ASP  66           H        ASP  66   9.396  -4.066   4.883
  519    HA   ASP  66           HA       ASP  66   9.722  -4.412   7.775
  520    HB2  ASP  66           HB2      ASP  66  10.135  -6.432   6.572
  521    HB3  ASP  66           HB3      ASP  66  11.106  -5.597   5.366
  522    H    THR  67           H        THR  67  10.729  -2.539   5.126
  523    HA   THR  67           HA       THR  67  12.897  -1.307   6.689
  524    HB   THR  67           HB       THR  67  13.761  -2.164   4.610
  525    HG1  THR  67           HG1      THR  67  13.705   0.329   3.600
  526   HG21  THR  67          3HG2      THR  67  12.861  -1.471   2.427
  527   HG22  THR  67          1HG2      THR  67  11.546  -0.629   3.250
  528   HG23  THR  67          2HG2      THR  67  11.683  -2.383   3.370
  529    H    LYS  68           H        LYS  68  13.007   1.064   6.590
  530    HA   LYS  68           HA       LYS  68  10.361   2.154   6.878
  531    HB2  LYS  68           HB2      LYS  68  11.373   4.077   7.806
  532    HB3  LYS  68           HB3      LYS  68  12.336   2.720   8.370
  533    HG2  LYS  68           HG2      LYS  68  14.070   3.206   6.800
  534    HG3  LYS  68           HG3      LYS  68  13.073   4.429   6.006
  535    HD2  LYS  68           HD2      LYS  68  13.048   5.709   8.134
  536    HD3  LYS  68           HD3      LYS  68  14.172   4.529   8.811
  537    HE2  LYS  68           HE2      LYS  68  15.815   5.089   7.102
  538    HE3  LYS  68           HE3      LYS  68  14.686   6.232   6.373
  539    HZ1  LYS  68           HZ1      LYS  68  14.721   7.506   8.434
  540    HZ2  LYS  68           HZ2      LYS  68  16.271   7.370   7.768
  541    HZ3  LYS  68           HZ3      LYS  68  15.841   6.419   9.103
  542    H    VAL  69           H        VAL  69   9.741   4.219   5.877
  543    HA   VAL  69           HA       VAL  69  10.688   4.360   3.093
  544    HB   VAL  69           HB       VAL  69   8.453   5.009   2.400
  545   HG11  VAL  69          2HG1      VAL  69   7.251   2.921   2.816
  546   HG12  VAL  69          1HG1      VAL  69   8.386   2.526   4.106
  547   HG13  VAL  69          3HG1      VAL  69   8.948   2.626   2.438
  548   HG21  VAL  69          3HG2      VAL  69   7.777   6.182   4.435
  549   HG22  VAL  69          2HG2      VAL  69   7.643   4.642   5.283
  550   HG23  VAL  69          1HG2      VAL  69   6.562   5.004   3.938
  551    H    ARG  70           H        ARG  70  10.765   6.432   2.122
  552    HA   ARG  70           HA       ARG  70  10.999   8.641   4.002
  553    HB2  ARG  70           HB2      ARG  70  12.768   8.548   2.383
  554    HB3  ARG  70           HB3      ARG  70  11.617   8.406   1.055
  555    HG2  ARG  70           HG2      ARG  70  10.752  10.701   1.859
  556    HG3  ARG  70           HG3      ARG  70  12.294  10.807   2.709
  557    HD2  ARG  70           HD2      ARG  70  13.495  10.993   0.778
  558    HD3  ARG  70           HD3      ARG  70  12.340  10.046  -0.160
  559    HE   ARG  70           HE       ARG  70  11.101  12.440   0.611
  560   HH11  ARG  70          2HH1      ARG  70  13.772  11.410  -1.427
  561   HH12  ARG  70          1HH1      ARG  70  13.490  12.639  -2.623
  562   HH21  ARG  70          2HH2      ARG  70  10.760  14.074  -0.960
  563   HH22  ARG  70          1HH2      ARG  70  11.790  14.142  -2.360
  564    H    ASN  71           H        ASN  71   9.078   7.651   1.209
  565    HA   ASN  71           HA       ASN  71   7.869  10.115   0.691
  566    HB2  ASN  71           HB2      ASN  71   7.048   7.309  -0.019
  567    HB3  ASN  71           HB3      ASN  71   6.141   8.725  -0.554
  568   HD21  ASN  71          1HD2      ASN  71   7.530   6.799  -2.205
  569   HD22  ASN  71          2HD2      ASN  71   8.735   7.695  -3.069
  570    H    LYS  72           H        LYS  72   7.346   8.130   3.322
  571    HA   LYS  72           HA       LYS  72   4.670   8.372   3.947
  572    HB2  LYS  72           HB2      LYS  72   6.426   7.187   5.300
  573    HB3  LYS  72           HB3      LYS  72   6.940   8.753   5.910
  574    HG2  LYS  72           HG2      LYS  72   4.754   9.090   6.922
  575    HG3  LYS  72           HG3      LYS  72   4.202   7.547   6.268
  576    HD2  LYS  72           HD2      LYS  72   4.820   7.318   8.614
  577    HD3  LYS  72           HD3      LYS  72   5.904   6.381   7.585
  578    HE2  LYS  72           HE2      LYS  72   7.227   7.488   9.239
  579    HE3  LYS  72           HE3      LYS  72   7.526   8.270   7.687
  580    HZ1  LYS  72           HZ1      LYS  72   7.272  10.004   9.203
  581    HZ2  LYS  72           HZ2      LYS  72   5.957   9.284   9.984
  582    HZ3  LYS  72           HZ3      LYS  72   5.763   9.936   8.427
  583    H    GLU  73           H        GLU  73   7.105  10.827   3.780
  584    HA   GLU  73           HA       GLU  73   6.295  12.964   5.226
  585    HB2  GLU  73           HB2      GLU  73   6.864  13.116   2.259
  586    HB3  GLU  73           HB3      GLU  73   7.050  14.412   3.428
  587    HG2  GLU  73           HG2      GLU  73   8.995  13.556   4.272
  588    HG3  GLU  73           HG3      GLU  73   8.608  11.903   3.794
  589    H    ARG  74           H        ARG  74   4.793  11.887   2.205
  590    HA   ARG  74           HA       ARG  74   2.896  14.078   2.282
  591    HB2  ARG  74           HB2      ARG  74   2.207  13.246   0.073
  592    HB3  ARG  74           HB3      ARG  74   3.938  13.526   0.163
  593    HG2  ARG  74           HG2      ARG  74   3.770  10.900   0.856
  594    HG3  ARG  74           HG3      ARG  74   2.444  11.056  -0.301
  595    HD2  ARG  74           HD2      ARG  74   4.394  10.458  -1.539
  596    HD3  ARG  74           HD3      ARG  74   4.078  12.161  -1.863
  597    HE   ARG  74           HE       ARG  74   6.011  11.518   0.232
  598   HH11  ARG  74          2HH1      ARG  74   5.403  12.603  -3.027
  599   HH12  ARG  74          1HH1      ARG  74   7.008  13.233  -3.266
  600   HH21  ARG  74          2HH2      ARG  74   8.146  12.388  -0.054
  601   HH22  ARG  74          1HH2      ARG  74   8.541  13.126  -1.578
  602    H    PHE  75           H        PHE  75   2.966  10.662   2.979
  603    HA   PHE  75           HA       PHE  75   0.097  10.416   3.069
  604    HB2  PHE  75           HB2      PHE  75   2.146   8.495   4.175
  605    HB3  PHE  75           HB3      PHE  75   0.487   8.153   3.712
  606    HD1  PHE  75           HD1      PHE  75   0.036   8.950   1.120
  607    HD2  PHE  75           HD2      PHE  75   3.717   7.628   2.784
  608    HE1  PHE  75           HE1      PHE  75   0.800   8.269  -1.116
  609    HE2  PHE  75           HE2      PHE  75   4.492   6.950   0.552
  610    HZ   PHE  75           HZ       PHE  75   3.031   7.270  -1.402
  611    H    ASP  76           H        ASP  76   2.449  11.674   5.087
  612    HA   ASP  76           HA       ASP  76   1.758  10.763   7.636
  613    HB2  ASP  76           HB2      ASP  76   3.436  12.802   6.508
  614    HB3  ASP  76           HB3      ASP  76   2.566  13.460   7.890
  615    H    GLY  77           H        GLY  77   0.244  13.142   5.601
  616    HA2  GLY  77           HA1      GLY  77  -1.583  13.857   7.801
  617    HA3  GLY  77           HA2      GLY  77  -1.343  14.805   6.339
  618    H    LYS  78           H        LYS  78  -1.599  11.378   6.078
  619    HA   LYS  78           HA       LYS  78  -4.347  11.660   5.049
  620    HB2  LYS  78           HB2      LYS  78  -2.077  10.011   3.919
  621    HB3  LYS  78           HB3      LYS  78  -3.747   9.893   3.381
  622    HG2  LYS  78           HG2      LYS  78  -3.714  12.145   2.574
  623    HG3  LYS  78           HG3      LYS  78  -2.119  12.422   3.273
  624    HD2  LYS  78           HD2      LYS  78  -1.966  12.045   0.870
  625    HD3  LYS  78           HD3      LYS  78  -1.167  10.751   1.762
  626    HE2  LYS  78           HE2      LYS  78  -2.438   9.824  -0.070
  627    HE3  LYS  78           HE3      LYS  78  -3.156   9.342   1.457
  628    HZ1  LYS  78           HZ1      LYS  78  -4.132  11.629  -0.170
  629    HZ2  LYS  78           HZ2      LYS  78  -4.897  10.932   1.172
  630    HZ3  LYS  78           HZ3      LYS  78  -4.771  10.064  -0.280
  631    H    VAL  79           H        VAL  79  -5.212   9.234   4.718
  632    HA   VAL  79           HA       VAL  79  -5.106   8.092   7.403
  633    HB   VAL  79           HB       VAL  79  -6.893   7.317   5.087
  634   HG11  VAL  79          2HG1      VAL  79  -8.273   6.261   6.810
  635   HG12  VAL  79          1HG1      VAL  79  -7.076   6.697   8.032
  636   HG13  VAL  79          3HG1      VAL  79  -6.656   5.562   6.748
  637   HG21  VAL  79          3HG2      VAL  79  -7.289   9.633   5.713
  638   HG22  VAL  79          2HG2      VAL  79  -7.451   9.164   7.407
  639   HG23  VAL  79          1HG2      VAL  79  -8.640   8.619   6.222
  640    H    VAL  80           H        VAL  80  -3.604   6.574   7.765
  641    HA   VAL  80           HA       VAL  80  -2.922   4.777   5.536
  642    HB   VAL  80           HB       VAL  80  -0.681   4.696   6.160
  643   HG11  VAL  80          2HG1      VAL  80  -1.213   6.818   5.108
  644   HG12  VAL  80          1HG1      VAL  80   0.099   7.013   6.271
  645   HG13  VAL  80          3HG1      VAL  80  -1.532   7.540   6.686
  646   HG21  VAL  80          3HG2      VAL  80  -1.449   5.943   8.790
  647   HG22  VAL  80          2HG2      VAL  80   0.209   5.634   8.270
  648   HG23  VAL  80          1HG2      VAL  80  -0.906   4.288   8.505
  649    H    LEU  81           H        LEU  81  -2.170   2.658   6.141
  650    HA   LEU  81           HA       LEU  81  -2.859   1.724   8.819
  651    HB2  LEU  81           HB2      LEU  81  -4.843   1.434   7.252
  652    HB3  LEU  81           HB3      LEU  81  -3.861   0.313   6.337
  653    HG   LEU  81           HG       LEU  81  -5.546  -0.674   7.978
  654   HD11  LEU  81          2HD1      LEU  81  -3.783  -2.008   6.976
  655   HD12  LEU  81          1HD1      LEU  81  -4.039  -2.475   8.657
  656   HD13  LEU  81          3HD1      LEU  81  -2.652  -1.478   8.219
  657   HD21  LEU  81          3HD2      LEU  81  -5.108   0.834   9.841
  658   HD22  LEU  81          2HD2      LEU  81  -3.459   0.221   9.963
  659   HD23  LEU  81          1HD2      LEU  81  -4.824  -0.842  10.305
  660    H    GLU  82           H        GLU  82  -1.080   0.732   9.525
  661    HA   GLU  82           HA       GLU  82   0.853  -0.256   7.579
  662    HB2  GLU  82           HB2      GLU  82   1.148   0.245  10.546
  663    HB3  GLU  82           HB3      GLU  82   2.439  -0.179   9.439
  664    HG2  GLU  82           HG2      GLU  82   2.068   1.920   8.218
  665    HG3  GLU  82           HG3      GLU  82   0.812   2.348   9.379
  666    H    VAL  83           H        VAL  83   1.382  -2.327   7.368
  667    HA   VAL  83           HA       VAL  83   0.638  -4.262   9.438
  668    HB   VAL  83           HB       VAL  83  -0.088  -5.870   7.631
  669   HG11  VAL  83          2HG1      VAL  83  -1.719  -4.822   9.072
  670   HG12  VAL  83          1HG1      VAL  83  -2.356  -4.963   7.432
  671   HG13  VAL  83          3HG1      VAL  83  -1.773  -3.406   8.021
  672   HG21  VAL  83          3HG2      VAL  83  -0.200  -3.362   5.961
  673   HG22  VAL  83          2HG2      VAL  83  -0.874  -4.927   5.507
  674   HG23  VAL  83          1HG2      VAL  83   0.868  -4.742   5.709
  675    HA   PRO  84           HA       PRO  84   4.573  -6.194   8.468
  676    HB2  PRO  84           HB2      PRO  84   3.145  -8.782   8.249
  677    HB3  PRO  84           HB3      PRO  84   4.485  -8.325   9.307
  678    HG2  PRO  84           HG2      PRO  84   2.016  -8.628  10.272
  679    HG3  PRO  84           HG3      PRO  84   3.089  -7.353  10.878
  680    HD2  PRO  84           HD2      PRO  84   0.791  -7.152   8.970
  681    HD3  PRO  84           HD3      PRO  84   1.276  -6.047  10.274
  682    H    VAL  85           H        VAL  85   5.711  -6.861   6.643
  683    HA   VAL  85           HA       VAL  85   4.482  -6.352   4.165
  684    HB   VAL  85           HB       VAL  85   6.868  -5.949   4.577
  685   HG11  VAL  85          2HG1      VAL  85   7.130  -8.949   4.545
  686   HG12  VAL  85          1HG1      VAL  85   7.413  -7.880   5.918
  687   HG13  VAL  85          3HG1      VAL  85   8.473  -7.807   4.510
  688   HG21  VAL  85          3HG2      VAL  85   7.731  -6.819   2.431
  689   HG22  VAL  85          2HG2      VAL  85   6.129  -6.090   2.288
  690   HG23  VAL  85          1HG2      VAL  85   6.301  -7.845   2.305
  691    H    SER  86           H        SER  86   4.940  -9.291   5.947
  692    HA   SER  86           HA       SER  86   4.494 -11.076   3.770
  693    HB2  SER  86           HB2      SER  86   4.141 -11.625   6.719
  694    HB3  SER  86           HB3      SER  86   4.472 -12.797   5.440
  695    HG   SER  86           HG       SER  86   6.442 -12.416   6.278
  696    H    ALA  87           H        ALA  87   2.411  -9.140   5.672
  697    HA   ALA  87           HA       ALA  87   0.182 -10.845   5.904
  698    HB1  ALA  87           HB1      ALA  87   0.169  -7.832   5.863
  699    HB2  ALA  87           HB2      ALA  87  -1.079  -8.889   6.525
  700    HB3  ALA  87           HB3      ALA  87   0.516  -8.829   7.275
  701    HA   PRO  88           HA       PRO  88  -1.713  -8.641   2.032
  702    HB2  PRO  88           HB2      PRO  88   0.008  -7.465   0.278
  703    HB3  PRO  88           HB3      PRO  88  -0.800  -6.591   1.585
  704    HG2  PRO  88           HG2      PRO  88   1.975  -7.710   1.484
  705    HG3  PRO  88           HG3      PRO  88   1.426  -6.138   2.098
  706    HD2  PRO  88           HD2      PRO  88   1.981  -8.196   3.741
  707    HD3  PRO  88           HD3      PRO  88   0.681  -7.039   4.094
  708    H    ILE  89           H        ILE  89   1.054 -10.582   2.178
  709    HA   ILE  89           HA       ILE  89   1.040 -11.565  -0.498
  710    HB   ILE  89           HB       ILE  89   2.145 -12.764   2.046
  711   HG12  ILE  89          2HG1      ILE  89   3.488 -11.356  -0.271
  712   HG13  ILE  89          3HG1      ILE  89   3.213 -10.669   1.325
  713   HG21  ILE  89          2HG2      ILE  89   3.415 -14.284   0.573
  714   HG22  ILE  89          1HG2      ILE  89   2.493 -13.682  -0.806
  715   HG23  ILE  89          3HG2      ILE  89   1.674 -14.552   0.492
  716   HD11  ILE  89          3HD1      ILE  89   4.700 -12.337   2.299
  717   HD12  ILE  89          2HD1      ILE  89   5.513 -11.393   1.050
  718   HD13  ILE  89          1HD1      ILE  89   4.967 -13.033   0.700
  719    H    LYS  90           H        LYS  90  -0.270 -12.765   2.579
  720    HA   LYS  90           HA       LYS  90  -1.721 -14.850   1.135
  721    HB2  LYS  90           HB2      LYS  90  -1.355 -14.376   4.095
  722    HB3  LYS  90           HB3      LYS  90  -2.264 -15.710   3.402
  723    HG2  LYS  90           HG2      LYS  90   0.677 -15.199   3.007
  724    HG3  LYS  90           HG3      LYS  90  -0.029 -16.387   4.104
  725    HD2  LYS  90           HD2      LYS  90  -1.137 -17.428   2.106
  726    HD3  LYS  90           HD3      LYS  90  -0.178 -16.346   1.095
  727    HE2  LYS  90           HE2      LYS  90   0.876 -18.536   1.278
  728    HE3  LYS  90           HE3      LYS  90   1.874 -17.290   2.031
  729    HZ1  LYS  90           HZ1      LYS  90   1.129 -17.978   4.184
  730    HZ2  LYS  90           HZ2      LYS  90   1.682 -19.349   3.357
  731    HZ3  LYS  90           HZ3      LYS  90   0.016 -19.069   3.515
  732    H    ASP  91           H        ASP  91  -2.289 -11.964   3.076
  733    HA   ASP  91           HA       ASP  91  -5.194 -12.474   2.902
  734    HB2  ASP  91           HB2      ASP  91  -4.074 -12.894   5.147
  735    HB3  ASP  91           HB3      ASP  91  -3.785 -11.163   5.226
  736    H    ALA  92           H        ALA  92  -3.830 -10.946   1.039
  737    HA   ALA  92           HA       ALA  92  -3.531  -8.233   1.503
  738    HB1  ALA  92           HB1      ALA  92  -4.484  -9.515  -1.052
  739    HB2  ALA  92           HB2      ALA  92  -3.727  -7.930  -0.888
  740    HB3  ALA  92           HB3      ALA  92  -2.801  -9.390  -0.539
  741    H    GLU  93           H        GLU  93  -6.458 -10.020   0.677
  742    HA   GLU  93           HA       GLU  93  -8.027  -7.780   0.005
  743    HB2  GLU  93           HB2      GLU  93  -8.845 -10.535   0.942
  744    HB3  GLU  93           HB3      GLU  93  -9.958  -9.331   0.303
  745    HG2  GLU  93           HG2      GLU  93  -8.756  -9.338  -1.820
  746    HG3  GLU  93           HG3      GLU  93  -7.635 -10.540  -1.182
  747    H    LYS  94           H        LYS  94  -7.575  -9.486   3.091
  748    HA   LYS  94           HA       LYS  94  -9.613  -8.022   4.438
  749    HB2  LYS  94           HB2      LYS  94  -8.679 -10.229   5.193
  750    HB3  LYS  94           HB3      LYS  94  -7.222  -9.380   5.687
  751    HG2  LYS  94           HG2      LYS  94  -8.628  -7.983   7.194
  752    HG3  LYS  94           HG3      LYS  94  -9.998  -9.016   6.786
  753    HD2  LYS  94           HD2      LYS  94  -7.423  -9.888   8.092
  754    HD3  LYS  94           HD3      LYS  94  -8.994  -9.725   8.879
  755    HE2  LYS  94           HE2      LYS  94  -9.906 -11.510   7.556
  756    HE3  LYS  94           HE3      LYS  94  -8.440 -11.596   6.581
  757    HZ1  LYS  94           HZ1      LYS  94  -8.725 -12.291   9.453
  758    HZ2  LYS  94           HZ2      LYS  94  -7.241 -12.199   8.647
  759    HZ3  LYS  94           HZ3      LYS  94  -8.386 -13.351   8.170
  760    H    VAL  95           H        VAL  95  -6.163  -7.596   3.967
  761    HA   VAL  95           HA       VAL  95  -5.753  -5.437   5.714
  762    HB   VAL  95           HB       VAL  95  -4.361  -5.985   3.083
  763   HG11  VAL  95          2HG1      VAL  95  -2.499  -4.708   4.043
  764   HG12  VAL  95          1HG1      VAL  95  -3.489  -4.339   5.456
  765   HG13  VAL  95          3HG1      VAL  95  -3.949  -3.721   3.869
  766   HG21  VAL  95          3HG2      VAL  95  -2.648  -7.089   4.479
  767   HG22  VAL  95          2HG2      VAL  95  -4.210  -7.910   4.538
  768   HG23  VAL  95          1HG2      VAL  95  -3.698  -6.888   5.881
  769    H    ILE  96           H        ILE  96  -6.729  -5.535   2.308
  770    HA   ILE  96           HA       ILE  96  -6.881  -2.761   1.883
  771    HB   ILE  96           HB       ILE  96  -8.418  -5.007   0.559
  772   HG12  ILE  96          2HG1      ILE  96  -5.965  -3.474  -0.336
  773   HG13  ILE  96          3HG1      ILE  96  -5.950  -5.100   0.340
  774   HG21  ILE  96          2HG2      ILE  96  -8.858  -3.415  -1.254
  775   HG22  ILE  96          1HG2      ILE  96  -8.091  -2.134  -0.317
  776   HG23  ILE  96          3HG2      ILE  96  -9.582  -2.876   0.262
  777   HD11  ILE  96          3HD1      ILE  96  -5.757  -5.136  -2.080
  778   HD12  ILE  96          2HD1      ILE  96  -7.285  -4.268  -2.227
  779   HD13  ILE  96          1HD1      ILE  96  -7.258  -5.897  -1.555
  780    H    ASN  97           H        ASN  97  -9.373  -5.101   2.866
  781    HA   ASN  97           HA       ASN  97 -11.504  -3.278   3.068
  782    HB2  ASN  97           HB2      ASN  97 -10.964  -5.967   4.291
  783    HB3  ASN  97           HB3      ASN  97 -12.372  -5.037   4.790
  784   HD21  ASN  97          1HD2      ASN  97 -10.844  -6.743   2.159
  785   HD22  ASN  97          2HD2      ASN  97 -12.254  -6.854   1.165
  786    H    ALA  98           H        ALA  98  -9.048  -4.265   5.404
  787    HA   ALA  98           HA       ALA  98 -10.087  -3.025   7.682
  788    HB1  ALA  98           HB1      ALA  98  -7.186  -3.409   6.939
  789    HB2  ALA  98           HB2      ALA  98  -7.808  -3.087   8.557
  790    HB3  ALA  98           HB3      ALA  98  -8.213  -4.596   7.741
  791    H    ALA  99           H        ALA  99  -8.077  -1.738   5.080
  792    HA   ALA  99           HA       ALA  99  -7.649   0.814   6.250
  793    HB1  ALA  99           HB1      ALA  99  -6.866   1.478   4.036
  794    HB2  ALA  99           HB2      ALA  99  -6.197  -0.088   4.498
  795    HB3  ALA  99           HB3      ALA  99  -7.530  -0.003   3.347
  796    H    LEU 100           H        LEU 100 -10.058  -0.494   4.027
  797    HA   LEU 100           HA       LEU 100 -11.349   1.962   3.446
  798    HB2  LEU 100           HB2      LEU 100 -12.453  -0.848   3.395
  799    HB3  LEU 100           HB3      LEU 100 -13.223   0.553   2.677
  800    HG   LEU 100           HG       LEU 100 -10.565  -0.606   1.833
  801   HD11  LEU 100          2HD1      LEU 100 -11.762  -1.279  -0.194
  802   HD12  LEU 100          1HD1      LEU 100 -13.271  -0.697   0.509
  803   HD13  LEU 100          3HD1      LEU 100 -12.422  -2.056   1.245
  804   HD21  LEU 100          3HD2      LEU 100 -10.673   1.811   1.503
  805   HD22  LEU 100          2HD2      LEU 100 -12.201   1.632   0.638
  806   HD23  LEU 100          1HD2      LEU 100 -10.718   0.958  -0.040
  807    H    ALA 101           H        ALA 101 -11.658  -0.366   6.023
  808    HA   ALA 101           HA       ALA 101 -14.097   0.593   7.099
  809    HB1  ALA 101           HB1      ALA 101 -13.206  -1.635   7.600
  810    HB2  ALA 101           HB2      ALA 101 -11.874  -0.897   8.491
  811    HB3  ALA 101           HB3      ALA 101 -13.530  -0.715   9.070
  812    H    LEU 102           H        LEU 102 -10.914   1.847   7.165
  813    HA   LEU 102           HA       LEU 102 -11.255   3.327   9.622
  814    HB2  LEU 102           HB2      LEU 102  -9.133   3.528   7.486
  815    HB3  LEU 102           HB3      LEU 102  -9.094   4.365   9.024
  816    HG   LEU 102           HG       LEU 102  -8.979   1.375   8.629
  817   HD11  LEU 102          2HD1      LEU 102  -6.704   1.601   9.486
  818   HD12  LEU 102          1HD1      LEU 102  -6.897   3.353   9.546
  819   HD13  LEU 102          3HD1      LEU 102  -6.924   2.514   7.995
  820   HD21  LEU 102          3HD2      LEU 102  -8.829   3.004  11.163
  821   HD22  LEU 102          2HD2      LEU 102  -8.602   1.259  11.034
  822   HD23  LEU 102          1HD2      LEU 102 -10.176   1.973  10.678
  823    H    ILE 103           H        ILE 103 -11.856   3.833   6.245
  824    HA   ILE 103           HA       ILE 103 -12.147   6.715   6.695
  825    HB   ILE 103           HB       ILE 103 -12.355   6.876   4.200
  826   HG12  ILE 103          2HG1      ILE 103 -11.367   4.014   4.262
  827   HG13  ILE 103          3HG1      ILE 103 -13.006   4.494   3.834
  828   HG21  ILE 103          2HG2      ILE 103  -9.947   6.602   3.809
  829   HG22  ILE 103          1HG2      ILE 103  -9.815   5.710   5.324
  830   HG23  ILE 103          3HG2      ILE 103 -10.291   7.407   5.340
  831   HD11  ILE 103          3HD1      ILE 103 -11.669   4.049   1.860
  832   HD12  ILE 103          2HD1      ILE 103 -10.499   5.266   2.363
  833   HD13  ILE 103          1HD1      ILE 103 -12.140   5.747   1.931
  834    H    ASP 104           H        ASP 104 -13.963   3.943   5.403
  835    HA   ASP 104           HA       ASP 104 -16.386   5.632   5.491
  836    HB2  ASP 104           HB2      ASP 104 -15.653   4.939   3.206
  837    HB3  ASP 104           HB3      ASP 104 -15.858   3.261   3.690
  838    H    GLU 105           H        GLU 105 -14.833   2.904   6.708
  839    HA   GLU 105           HA       GLU 105 -15.410   1.174   8.034
  840    HB2  GLU 105           HB2      GLU 105 -17.917   2.809   8.413
  841    HB3  GLU 105           HB3      GLU 105 -17.632   1.286   9.244
  842    HG2  GLU 105           HG2      GLU 105 -15.496   2.330  10.115
  843    HG3  GLU 105           HG3      GLU 105 -16.131   3.865   9.521
  844    H    LYS 106           H        LYS 106 -15.548   0.588   5.466
  845    HA   LYS 106           HA       LYS 106 -18.037  -0.895   5.093
  846    HB2  LYS 106           HB2      LYS 106 -15.714  -0.273   3.284
  847    HB3  LYS 106           HB3      LYS 106 -16.822  -1.584   2.902
  848    HG2  LYS 106           HG2      LYS 106 -18.694   0.036   2.964
  849    HG3  LYS 106           HG3      LYS 106 -17.519   1.330   3.210
  850    HD2  LYS 106           HD2      LYS 106 -16.533   0.951   1.077
  851    HD3  LYS 106           HD3      LYS 106 -17.418  -0.559   0.866
  852    HE2  LYS 106           HE2      LYS 106 -18.453   1.119  -0.496
  853    HE3  LYS 106           HE3      LYS 106 -19.532   0.746   0.846
  854    HZ1  LYS 106           HZ1      LYS 106 -18.746   2.750   1.972
  855    HZ2  LYS 106           HZ2      LYS 106 -19.418   3.114   0.455
  856    HZ3  LYS 106           HZ3      LYS 106 -17.739   3.108   0.653
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1 -16.294   2.902  -6.276
    2    H2   MET   1           H2       MET   1 -17.672   2.214  -6.981
    3    H3   MET   1           H3       MET   1 -16.284   2.479  -7.918
    4    HA   MET   1           HA       MET   1 -16.548   0.578  -5.661
    5    HB2  MET   1           HB2      MET   1 -16.295   0.187  -8.642
    6    HB3  MET   1           HB3      MET   1 -15.993  -1.099  -7.483
    7    HG2  MET   1           HG2      MET   1 -18.322  -0.768  -6.647
    8    HG3  MET   1           HG3      MET   1 -18.580   0.337  -7.997
    9    HE1  MET   1           HE1      MET   1 -17.502  -4.116  -8.532
   10    HE2  MET   1           HE2      MET   1 -16.346  -2.882  -8.029
   11    HE3  MET   1           HE3      MET   1 -17.671  -3.338  -6.958
   12    H    LYS   2           H        LYS   2 -14.465   1.796  -8.260
   13    HA   LYS   2           HA       LYS   2 -12.137   0.482  -7.280
   14    HB2  LYS   2           HB2      LYS   2 -12.265   2.894  -9.097
   15    HB3  LYS   2           HB3      LYS   2 -10.910   1.792  -8.907
   16    HG2  LYS   2           HG2      LYS   2 -12.308  -0.018  -9.846
   17    HG3  LYS   2           HG3      LYS   2 -13.585   1.166 -10.131
   18    HD2  LYS   2           HD2      LYS   2 -11.956   2.469 -11.508
   19    HD3  LYS   2           HD3      LYS   2 -10.822   1.129 -11.334
   20    HE2  LYS   2           HE2      LYS   2 -11.953   0.906 -13.436
   21    HE3  LYS   2           HE3      LYS   2 -12.520  -0.365 -12.355
   22    HZ1  LYS   2           HZ1      LYS   2 -13.949   2.178 -12.918
   23    HZ2  LYS   2           HZ2      LYS   2 -14.503   0.930 -11.912
   24    HZ3  LYS   2           HZ3      LYS   2 -14.339   0.666 -13.575
   25    H    ARG   3           H        ARG   3 -11.692   0.996  -5.177
   26    HA   ARG   3           HA       ARG   3 -11.598   3.727  -4.299
   27    HB2  ARG   3           HB2      ARG   3 -11.838   1.411  -2.943
   28    HB3  ARG   3           HB3      ARG   3 -10.101   1.655  -2.791
   29    HG2  ARG   3           HG2      ARG   3 -11.043   2.669  -0.899
   30    HG3  ARG   3           HG3      ARG   3 -10.649   4.001  -1.994
   31    HD2  ARG   3           HD2      ARG   3 -13.109   3.582  -2.836
   32    HD3  ARG   3           HD3      ARG   3 -13.306   2.885  -1.230
   33    HE   ARG   3           HE       ARG   3 -12.181   5.574  -1.451
   34   HH11  ARG   3          2HH1      ARG   3 -14.869   3.507  -0.566
   35   HH12  ARG   3          1HH1      ARG   3 -15.741   4.769   0.241
   36   HH21  ARG   3          2HH2      ARG   3 -13.313   7.229  -0.414
   37   HH22  ARG   3          1HH2      ARG   3 -14.855   6.897   0.340
   38    H    LYS   4           H        LYS   4  -9.729   4.933  -3.833
   39    HA   LYS   4           HA       LYS   4  -7.464   4.253  -5.545
   40    HB2  LYS   4           HB2      LYS   4  -7.840   6.775  -3.935
   41    HB3  LYS   4           HB3      LYS   4  -6.816   6.535  -5.346
   42    HG2  LYS   4           HG2      LYS   4  -9.823   6.469  -5.349
   43    HG3  LYS   4           HG3      LYS   4  -8.826   7.834  -5.855
   44    HD2  LYS   4           HD2      LYS   4  -8.067   6.734  -7.755
   45    HD3  LYS   4           HD3      LYS   4  -8.459   5.140  -7.105
   46    HE2  LYS   4           HE2      LYS   4  -9.983   5.958  -8.925
   47    HE3  LYS   4           HE3      LYS   4 -10.784   5.482  -7.429
   48    HZ1  LYS   4           HZ1      LYS   4 -10.128   8.279  -8.201
   49    HZ2  LYS   4           HZ2      LYS   4 -10.966   7.792  -6.806
   50    HZ3  LYS   4           HZ3      LYS   4 -11.659   7.559  -8.335
   51    H    ILE   5           H        ILE   5  -5.753   3.260  -4.713
   52    HA   ILE   5           HA       ILE   5  -5.215   3.595  -1.832
   53    HB   ILE   5           HB       ILE   5  -4.878   1.042  -3.408
   54   HG12  ILE   5          2HG1      ILE   5  -6.975   1.759  -1.347
   55   HG13  ILE   5          3HG1      ILE   5  -7.260   1.618  -3.077
   56   HG21  ILE   5          2HG2      ILE   5  -4.603   1.614  -0.458
   57   HG22  ILE   5          1HG2      ILE   5  -3.287   1.269  -1.582
   58   HG23  ILE   5          3HG2      ILE   5  -4.478   0.022  -1.209
   59   HD11  ILE   5          3HD1      ILE   5  -6.382  -0.613  -1.260
   60   HD12  ILE   5          2HD1      ILE   5  -6.703  -0.747  -2.989
   61   HD13  ILE   5          1HD1      ILE   5  -8.014  -0.357  -1.876
   62    H    ILE   6           H        ILE   6  -3.218   4.342  -1.432
   63    HA   ILE   6           HA       ILE   6  -1.117   3.746  -3.399
   64    HB   ILE   6           HB       ILE   6   0.254   5.501  -2.336
   65   HG12  ILE   6          2HG1      ILE   6  -1.033   5.396  -0.106
   66   HG13  ILE   6          3HG1      ILE   6  -0.512   6.977  -0.672
   67   HG21  ILE   6          2HG2      ILE   6  -1.016   6.017  -4.313
   68   HG22  ILE   6          1HG2      ILE   6  -0.987   7.417  -3.240
   69   HG23  ILE   6          3HG2      ILE   6  -2.434   6.411  -3.338
   70   HD11  ILE   6          3HD1      ILE   6  -2.775   7.416  -1.495
   71   HD12  ILE   6          2HD1      ILE   6  -2.756   7.062   0.233
   72   HD13  ILE   6          1HD1      ILE   6  -3.287   5.831  -0.913
   73    H    ALA   7           H        ALA   7   0.373   2.303  -2.900
   74    HA   ALA   7           HA       ALA   7   0.635   1.511  -0.081
   75    HB1  ALA   7           HB1      ALA   7   0.583  -0.830  -0.695
   76    HB2  ALA   7           HB2      ALA   7  -0.898  -0.036  -1.226
   77    HB3  ALA   7           HB3      ALA   7   0.371  -0.408  -2.393
   78    H    VAL   8           H        VAL   8   2.649   1.041   0.580
   79    HA   VAL   8           HA       VAL   8   4.760   0.943  -1.474
   80    HB   VAL   8           HB       VAL   8   4.961   2.106   1.315
   81   HG11  VAL   8          2HG1      VAL   8   7.051   1.927  -0.856
   82   HG12  VAL   8          1HG1      VAL   8   7.022   0.969   0.624
   83   HG13  VAL   8          3HG1      VAL   8   7.242   2.717   0.709
   84   HG21  VAL   8          3HG2      VAL   8   5.048   3.418  -1.402
   85   HG22  VAL   8          2HG2      VAL   8   5.380   4.227   0.131
   86   HG23  VAL   8          1HG2      VAL   8   3.771   3.581  -0.194
   87    H    THR   9           H        THR   9   5.672  -0.979  -1.584
   88    HA   THR   9           HA       THR   9   5.672  -2.696   0.793
   89    HB   THR   9           HB       THR   9   6.358  -4.495  -0.884
   90    HG1  THR   9           HG1      THR   9   6.507  -2.418  -2.498
   91   HG21  THR   9          3HG2      THR   9   4.060  -4.834  -1.664
   92   HG22  THR   9          1HG2      THR   9   3.664  -3.167  -1.244
   93   HG23  THR   9          2HG2      THR   9   4.086  -4.322   0.022
   94    H    ALA  10           H        ALA  10   7.505  -2.910   1.908
   95    HA   ALA  10           HA       ALA  10  10.064  -2.461   0.541
   96    HB1  ALA  10           HB1      ALA  10  10.860  -1.009   2.329
   97    HB2  ALA  10           HB2      ALA  10   9.438  -0.317   1.547
   98    HB3  ALA  10           HB3      ALA  10   9.287  -1.101   3.119
   99    H    CYS  11           H        CYS  11  11.922  -3.210   1.822
  100    HA   CYS  11           HA       CYS  11  11.374  -4.950   4.062
  101    HB2  CYS  11           HB2      CYS  11  10.843  -6.366   2.097
  102    HB3  CYS  11           HB3      CYS  11  12.466  -6.095   1.478
  103    HG   CYS  11           HG       CYS  11  12.940  -8.484   2.414
  104    H    ALA  12           H        ALA  12  13.289  -5.584   5.178
  105    HA   ALA  12           HA       ALA  12  15.680  -4.064   4.349
  106    HB1  ALA  12           HB1      ALA  12  16.327  -4.147   6.747
  107    HB2  ALA  12           HB2      ALA  12  14.826  -3.271   6.450
  108    HB3  ALA  12           HB3      ALA  12  14.776  -4.910   7.098
  109    H    THR  13           H        THR  13  14.398  -7.164   4.825
  110    HA   THR  13           HA       THR  13  17.032  -8.375   5.203
  111    HB   THR  13           HB       THR  13  15.599 -10.502   5.500
  112    HG1  THR  13           HG1      THR  13  13.579  -8.524   5.958
  113   HG21  THR  13          3HG2      THR  13  16.731  -9.366   7.343
  114   HG22  THR  13          1HG2      THR  13  15.143  -9.943   7.848
  115   HG23  THR  13          2HG2      THR  13  15.386  -8.234   7.485
  116    H    GLY  14           H        GLY  14  14.304  -9.910   3.619
  117    HA2  GLY  14           HA1      GLY  14  15.994 -10.419   1.278
  118    HA3  GLY  14           HA2      GLY  14  14.485 -11.237   1.667
  119    H    VAL  15           H        VAL  15  15.903  -9.021  -0.340
  120    HA   VAL  15           HA       VAL  15  14.047  -6.941  -0.540
  121    HB   VAL  15           HB       VAL  15  15.754  -8.084  -2.760
  122   HG11  VAL  15          2HG1      VAL  15  14.547  -5.335  -2.438
  123   HG12  VAL  15          1HG1      VAL  15  14.004  -6.572  -3.572
  124   HG13  VAL  15          3HG1      VAL  15  15.605  -5.857  -3.751
  125   HG21  VAL  15          3HG2      VAL  15  17.401  -6.398  -2.110
  126   HG22  VAL  15          2HG2      VAL  15  17.080  -7.517  -0.786
  127   HG23  VAL  15          1HG2      VAL  15  16.370  -5.902  -0.769
  128    H    ALA  16           H        ALA  16  14.040 -10.148  -1.943
  129    HA   ALA  16           HA       ALA  16  12.176  -9.809  -3.983
  130    HB1  ALA  16           HB1      ALA  16  13.578 -11.784  -3.753
  131    HB2  ALA  16           HB2      ALA  16  12.674 -12.266  -2.316
  132    HB3  ALA  16           HB3      ALA  16  11.873 -12.222  -3.888
  133    H    HIS  17           H        HIS  17  11.651  -9.875  -0.567
  134    HA   HIS  17           HA       HIS  17   9.001 -10.855  -0.547
  135    HB2  HIS  17           HB2      HIS  17  10.450  -9.056   1.396
  136    HB3  HIS  17           HB3      HIS  17   8.802  -9.616   1.656
  137    HD1  HIS  17           HD1      HIS  17   8.531 -12.305   1.869
  138    HD2  HIS  17           HD2      HIS  17  12.399 -10.792   2.178
  139    HE1  HIS  17           HE1      HIS  17   9.895 -14.120   2.952
  140    HE2  HIS  17           HE2      HIS  17  12.176 -13.111   3.297
  141    H    THR  18           H        THR  18  10.331  -7.726  -1.297
  142    HA   THR  18           HA       THR  18   8.021  -6.157  -0.938
  143    HB   THR  18           HB       THR  18   9.087  -4.556  -2.501
  144    HG1  THR  18           HG1      THR  18  11.302  -6.302  -2.700
  145   HG21  THR  18          3HG2      THR  18  11.106  -4.151  -1.179
  146   HG22  THR  18          1HG2      THR  18  10.989  -5.774  -0.498
  147   HG23  THR  18          2HG2      THR  18   9.743  -4.576  -0.143
  148    H    TYR  19           H        TYR  19   9.339  -7.660  -3.877
  149    HA   TYR  19           HA       TYR  19   7.272  -6.947  -5.611
  150    HB2  TYR  19           HB2      TYR  19   9.132  -9.327  -5.679
  151    HB3  TYR  19           HB3      TYR  19   8.073  -8.867  -7.005
  152    HD1  TYR  19           HD2      TYR  19   8.486  -6.775  -8.249
  153    HD2  TYR  19           HD1      TYR  19  11.174  -8.151  -5.255
  154    HE1  TYR  19           HE2      TYR  19  10.223  -5.271  -9.125
  155    HE2  TYR  19           HE1      TYR  19  12.918  -6.653  -6.127
  156    HH   TYR  19           HH       TYR  19  12.258  -4.170  -8.394
  157    H    MET  20           H        MET  20   7.718  -9.880  -3.657
  158    HA   MET  20           HA       MET  20   5.459 -11.261  -4.550
  159    HB2  MET  20           HB2      MET  20   7.215 -12.296  -3.186
  160    HB3  MET  20           HB3      MET  20   6.725 -11.318  -1.809
  161    HG2  MET  20           HG2      MET  20   4.524 -12.405  -1.826
  162    HG3  MET  20           HG3      MET  20   5.046 -13.406  -3.184
  163    HE1  MET  20           HE1      MET  20   5.002 -16.048  -0.335
  164    HE2  MET  20           HE2      MET  20   3.861 -14.724  -0.559
  165    HE3  MET  20           HE3      MET  20   4.450 -15.626  -1.956
  166    H    ALA  21           H        ALA  21   5.831  -9.043  -1.803
  167    HA   ALA  21           HA       ALA  21   3.187  -9.199  -0.872
  168    HB1  ALA  21           HB1      ALA  21   5.121  -6.891  -0.672
  169    HB2  ALA  21           HB2      ALA  21   3.658  -7.098   0.290
  170    HB3  ALA  21           HB3      ALA  21   4.992  -8.237   0.459
  171    H    ALA  22           H        ALA  22   4.739  -6.941  -3.127
  172    HA   ALA  22           HA       ALA  22   2.530  -5.300  -3.631
  173    HB1  ALA  22           HB1      ALA  22   4.815  -4.741  -4.311
  174    HB2  ALA  22           HB2      ALA  22   4.777  -6.033  -5.511
  175    HB3  ALA  22           HB3      ALA  22   3.699  -4.647  -5.673
  176    H    GLN  23           H        GLN  23   3.619  -8.240  -5.302
  177    HA   GLN  23           HA       GLN  23   1.671  -8.194  -7.336
  178    HB2  GLN  23           HB2      GLN  23   3.239 -10.482  -6.146
  179    HB3  GLN  23           HB3      GLN  23   2.207 -10.642  -7.560
  180    HG2  GLN  23           HG2      GLN  23   3.575  -9.105  -8.799
  181    HG3  GLN  23           HG3      GLN  23   4.546  -8.762  -7.367
  182   HE21  GLN  23          1HE2      GLN  23   6.434  -9.411  -8.386
  183   HE22  GLN  23          2HE2      GLN  23   6.791 -11.073  -8.693
  184    H    ALA  24           H        ALA  24   1.724  -9.903  -4.210
  185    HA   ALA  24           HA       ALA  24  -0.772 -11.197  -4.618
  186    HB1  ALA  24           HB1      ALA  24   0.946 -12.023  -3.060
  187    HB2  ALA  24           HB2      ALA  24   0.634 -10.641  -2.011
  188    HB3  ALA  24           HB3      ALA  24  -0.631 -11.837  -2.293
  189    H    LEU  25           H        LEU  25   0.199  -8.231  -2.994
  190    HA   LEU  25           HA       LEU  25  -2.326  -7.530  -1.947
  191    HB2  LEU  25           HB2      LEU  25  -0.260  -6.481  -1.221
  192    HB3  LEU  25           HB3      LEU  25  -0.010  -5.804  -2.816
  193    HG   LEU  25           HG       LEU  25  -2.030  -4.409  -2.515
  194   HD11  LEU  25          2HD1      LEU  25  -2.006  -5.522   0.288
  195   HD12  LEU  25          1HD1      LEU  25  -3.233  -5.832  -0.941
  196   HD13  LEU  25          3HD1      LEU  25  -3.024  -4.205  -0.294
  197   HD21  LEU  25          3HD2      LEU  25   0.236  -3.597  -1.974
  198   HD22  LEU  25          2HD2      LEU  25   0.000  -4.121  -0.305
  199   HD23  LEU  25          1HD2      LEU  25  -1.013  -2.842  -0.979
  200    H    LYS  26           H        LYS  26  -0.736  -6.671  -5.004
  201    HA   LYS  26           HA       LYS  26  -2.835  -5.058  -6.004
  202    HB2  LYS  26           HB2      LYS  26  -0.407  -5.144  -6.761
  203    HB3  LYS  26           HB3      LYS  26  -0.830  -6.598  -7.648
  204    HG2  LYS  26           HG2      LYS  26  -2.315  -5.396  -9.067
  205    HG3  LYS  26           HG3      LYS  26  -2.182  -3.944  -8.069
  206    HD2  LYS  26           HD2      LYS  26   0.259  -3.896  -8.603
  207    HD3  LYS  26           HD3      LYS  26  -0.013  -5.225  -9.728
  208    HE2  LYS  26           HE2      LYS  26  -1.422  -2.569  -9.892
  209    HE3  LYS  26           HE3      LYS  26   0.060  -2.946 -10.766
  210    HZ1  LYS  26           HZ1      LYS  26  -2.592  -4.239 -11.082
  211    HZ2  LYS  26           HZ2      LYS  26  -1.168  -4.841 -11.780
  212    HZ3  LYS  26           HZ3      LYS  26  -1.749  -3.311 -12.221
  213    H    LYS  27           H        LYS  27  -2.212  -8.477  -6.042
  214    HA   LYS  27           HA       LYS  27  -4.023  -9.369  -7.959
  215    HB2  LYS  27           HB2      LYS  27  -2.416 -10.838  -6.857
  216    HB3  LYS  27           HB3      LYS  27  -3.228 -10.611  -5.317
  217    HG2  LYS  27           HG2      LYS  27  -3.865 -12.733  -6.131
  218    HG3  LYS  27           HG3      LYS  27  -5.258 -11.670  -6.341
  219    HD2  LYS  27           HD2      LYS  27  -4.662 -11.365  -8.694
  220    HD3  LYS  27           HD3      LYS  27  -3.275 -12.437  -8.481
  221    HE2  LYS  27           HE2      LYS  27  -4.871 -14.225  -7.770
  222    HE3  LYS  27           HE3      LYS  27  -6.191 -13.145  -8.222
  223    HZ1  LYS  27           HZ1      LYS  27  -5.671 -14.708  -9.987
  224    HZ2  LYS  27           HZ2      LYS  27  -4.072 -14.145 -10.046
  225    HZ3  LYS  27           HZ3      LYS  27  -5.347 -13.116 -10.483
  226    H    GLY  28           H        GLY  28  -4.520  -8.784  -4.485
  227    HA2  GLY  28           HA1      GLY  28  -7.259  -9.498  -4.458
  228    HA3  GLY  28           HA2      GLY  28  -6.432  -8.551  -3.232
  229    H    ALA  29           H        ALA  29  -5.600  -6.441  -4.948
  230    HA   ALA  29           HA       ALA  29  -7.859  -4.767  -4.839
  231    HB1  ALA  29           HB1      ALA  29  -6.485  -3.120  -5.990
  232    HB2  ALA  29           HB2      ALA  29  -5.558  -3.926  -4.726
  233    HB3  ALA  29           HB3      ALA  29  -5.317  -4.370  -6.415
  234    H    LYS  30           H        LYS  30  -6.299  -6.421  -7.577
  235    HA   LYS  30           HA       LYS  30  -8.145  -5.436  -9.512
  236    HB2  LYS  30           HB2      LYS  30  -5.923  -6.270 -10.144
  237    HB3  LYS  30           HB3      LYS  30  -6.367  -7.884  -9.604
  238    HG2  LYS  30           HG2      LYS  30  -8.100  -7.982 -11.327
  239    HG3  LYS  30           HG3      LYS  30  -7.644  -6.367 -11.873
  240    HD2  LYS  30           HD2      LYS  30  -5.804  -8.758 -11.834
  241    HD3  LYS  30           HD3      LYS  30  -6.676  -8.181 -13.256
  242    HE2  LYS  30           HE2      LYS  30  -5.508  -6.060 -13.146
  243    HE3  LYS  30           HE3      LYS  30  -4.690  -6.560 -11.666
  244    HZ1  LYS  30           HZ1      LYS  30  -3.317  -6.787 -13.685
  245    HZ2  LYS  30           HZ2      LYS  30  -4.409  -7.945 -14.277
  246    HZ3  LYS  30           HZ3      LYS  30  -3.531  -8.254 -12.860
  247    H    LYS  31           H        LYS  31  -8.026  -8.236  -7.426
  248    HA   LYS  31           HA       LYS  31 -10.041  -9.798  -8.572
  249    HB2  LYS  31           HB2      LYS  31  -8.530 -10.683  -6.914
  250    HB3  LYS  31           HB3      LYS  31  -9.090  -9.522  -5.718
  251    HG2  LYS  31           HG2      LYS  31 -11.227 -10.607  -5.585
  252    HG3  LYS  31           HG3      LYS  31 -10.796 -11.697  -6.909
  253    HD2  LYS  31           HD2      LYS  31  -9.095 -12.735  -5.594
  254    HD3  LYS  31           HD3      LYS  31  -9.271 -11.528  -4.320
  255    HE2  LYS  31           HE2      LYS  31 -11.401 -13.490  -5.152
  256    HE3  LYS  31           HE3      LYS  31 -10.330 -13.685  -3.766
  257    HZ1  LYS  31           HZ1      LYS  31 -12.273 -12.785  -2.894
  258    HZ2  LYS  31           HZ2      LYS  31 -12.467 -11.682  -4.164
  259    HZ3  LYS  31           HZ3      LYS  31 -11.236 -11.445  -3.017
  260    H    MET  32           H        MET  32 -10.183  -7.124  -6.291
  261    HA   MET  32           HA       MET  32 -13.085  -7.404  -6.120
  262    HB2  MET  32           HB2      MET  32 -11.125  -5.709  -4.576
  263    HB3  MET  32           HB3      MET  32 -12.873  -5.618  -4.360
  264    HG2  MET  32           HG2      MET  32 -12.865  -8.044  -3.811
  265    HG3  MET  32           HG3      MET  32 -11.106  -8.006  -3.876
  266    HE1  MET  32           HE1      MET  32  -9.566  -6.964  -2.055
  267    HE2  MET  32           HE2      MET  32 -10.201  -5.417  -2.612
  268    HE3  MET  32           HE3      MET  32 -10.134  -5.767  -0.887
  269    H    GLY  33           H        GLY  33 -10.745  -5.597  -7.811
  270    HA2  GLY  33           HA1      GLY  33 -11.241  -4.269  -9.674
  271    HA3  GLY  33           HA2      GLY  33 -12.894  -4.120  -9.101
  272    H    ASN  34           H        ASN  34  -9.715  -3.311  -7.713
  273    HA   ASN  34           HA       ASN  34 -10.703  -0.562  -7.308
  274    HB2  ASN  34           HB2      ASN  34  -8.896  -2.213  -5.533
  275    HB3  ASN  34           HB3      ASN  34  -9.128  -0.478  -5.341
  276   HD21  ASN  34          1HD2      ASN  34 -10.525  -3.615  -4.954
  277   HD22  ASN  34          2HD2      ASN  34 -11.910  -3.115  -4.050
  278    H    LEU  35           H        LEU  35  -8.774   0.990  -6.939
  279    HA   LEU  35           HA       LEU  35  -6.737   0.400  -8.986
  280    HB2  LEU  35           HB2      LEU  35  -7.861   3.060  -8.102
  281    HB3  LEU  35           HB3      LEU  35  -6.525   2.869  -9.219
  282    HG   LEU  35           HG       LEU  35  -9.360   1.947  -9.688
  283   HD11  LEU  35          2HD1      LEU  35  -7.768   4.207 -10.884
  284   HD12  LEU  35          1HD1      LEU  35  -9.130   4.362  -9.776
  285   HD13  LEU  35          3HD1      LEU  35  -9.379   3.705 -11.393
  286   HD21  LEU  35          3HD2      LEU  35  -8.590   1.443 -11.956
  287   HD22  LEU  35          2HD2      LEU  35  -7.737   0.471 -10.756
  288   HD23  LEU  35          1HD2      LEU  35  -6.942   1.863 -11.491
  289    H    ILE  36           H        ILE  36  -4.790   0.030  -8.151
  290    HA   ILE  36           HA       ILE  36  -4.097   1.366  -5.630
  291    HB   ILE  36           HB       ILE  36  -4.748  -0.995  -5.233
  292   HG12  ILE  36          2HG1      ILE  36  -1.811  -0.432  -4.768
  293   HG13  ILE  36          3HG1      ILE  36  -3.129   0.174  -3.772
  294   HG21  ILE  36          2HG2      ILE  36  -2.355  -1.631  -6.955
  295   HG22  ILE  36          1HG2      ILE  36  -4.043  -1.966  -7.343
  296   HG23  ILE  36          3HG2      ILE  36  -3.265  -2.797  -5.995
  297   HD11  ILE  36          3HD1      ILE  36  -2.076  -1.728  -2.720
  298   HD12  ILE  36          2HD1      ILE  36  -2.370  -2.713  -4.155
  299   HD13  ILE  36          1HD1      ILE  36  -3.728  -2.132  -3.190
  300    H    LYS  37           H        LYS  37  -2.095   2.167  -5.470
  301    HA   LYS  37           HA       LYS  37  -0.224   1.634  -7.680
  302    HB2  LYS  37           HB2      LYS  37  -0.954   4.118  -6.241
  303    HB3  LYS  37           HB3      LYS  37   0.754   3.906  -6.601
  304    HG2  LYS  37           HG2      LYS  37  -1.494   3.858  -8.602
  305    HG3  LYS  37           HG3      LYS  37  -0.357   5.183  -8.338
  306    HD2  LYS  37           HD2      LYS  37   1.491   3.568  -8.894
  307    HD3  LYS  37           HD3      LYS  37   0.244   2.415  -9.373
  308    HE2  LYS  37           HE2      LYS  37   1.060   3.553 -11.328
  309    HE3  LYS  37           HE3      LYS  37  -0.596   4.068 -11.010
  310    HZ1  LYS  37           HZ1      LYS  37   0.240   6.094 -10.022
  311    HZ2  LYS  37           HZ2      LYS  37   0.862   5.921 -11.590
  312    HZ3  LYS  37           HZ3      LYS  37   1.842   5.587 -10.250
  313    H    VAL  38           H        VAL  38   1.072   0.088  -6.936
  314    HA   VAL  38           HA       VAL  38   2.030   0.250  -4.175
  315    HB   VAL  38           HB       VAL  38   2.448  -2.040  -6.096
  316   HG11  VAL  38          2HG1      VAL  38   3.966  -1.987  -4.202
  317   HG12  VAL  38          1HG1      VAL  38   2.824  -3.322  -4.035
  318   HG13  VAL  38          3HG1      VAL  38   2.603  -1.849  -3.090
  319   HG21  VAL  38          3HG2      VAL  38   0.562  -3.158  -4.997
  320   HG22  VAL  38          2HG2      VAL  38   0.048  -1.687  -5.825
  321   HG23  VAL  38          1HG2      VAL  38   0.235  -1.692  -4.070
  322    H    GLU  39           H        GLU  39   3.973   1.022  -3.785
  323    HA   GLU  39           HA       GLU  39   5.913   1.224  -5.963
  324    HB2  GLU  39           HB2      GLU  39   5.536   3.229  -4.611
  325    HB3  GLU  39           HB3      GLU  39   5.969   2.339  -3.156
  326    HG2  GLU  39           HG2      GLU  39   8.215   1.923  -4.259
  327    HG3  GLU  39           HG3      GLU  39   7.739   3.148  -5.435
  328    H    THR  40           H        THR  40   7.876   0.195  -5.942
  329    HA   THR  40           HA       THR  40   8.163  -1.967  -4.001
  330    HB   THR  40           HB       THR  40  10.041  -1.585  -6.301
  331    HG1  THR  40           HG1      THR  40   8.585  -2.143  -7.770
  332   HG21  THR  40          3HG2      THR  40   8.771  -4.031  -5.058
  333   HG22  THR  40          1HG2      THR  40  10.379  -3.409  -4.685
  334   HG23  THR  40          2HG2      THR  40  10.026  -4.027  -6.298
  335    H    GLN  41           H        GLN  41   9.046  -0.998  -2.184
  336    HA   GLN  41           HA       GLN  41  11.420   0.662  -2.590
  337    HB2  GLN  41           HB2      GLN  41   9.581   1.389  -1.036
  338    HB3  GLN  41           HB3      GLN  41   9.999   0.033  -0.001
  339    HG2  GLN  41           HG2      GLN  41  11.935   0.993   0.716
  340    HG3  GLN  41           HG3      GLN  41  12.146   1.936  -0.760
  341   HE21  GLN  41          1HE2      GLN  41   9.434   2.941  -0.762
  342   HE22  GLN  41          2HE2      GLN  41   9.352   4.115   0.497
  343    H    GLY  42           H        GLY  42  12.975  -0.722  -3.155
  344    HA2  GLY  42           HA1      GLY  42  13.053  -3.433  -2.479
  345    HA3  GLY  42           HA2      GLY  42  14.394  -2.523  -3.154
  346    H    ALA  43           H        ALA  43  15.580  -1.139  -1.539
  347    HA   ALA  43           HA       ALA  43  15.664  -2.452   1.098
  348    HB1  ALA  43           HB1      ALA  43  18.115  -2.303   1.075
  349    HB2  ALA  43           HB2      ALA  43  17.515  -3.325  -0.232
  350    HB3  ALA  43           HB3      ALA  43  18.058  -1.682  -0.574
  351    H    THR  44           H        THR  44  14.256  -0.549   1.471
  352    HA   THR  44           HA       THR  44  13.837   1.544   2.256
  353    HB   THR  44           HB       THR  44  16.799   1.957   2.665
  354    HG1  THR  44           HG1      THR  44  15.901  -0.186   3.419
  355   HG21  THR  44          3HG2      THR  44  16.048   3.163   4.659
  356   HG22  THR  44          1HG2      THR  44  14.374   2.761   4.281
  357   HG23  THR  44          2HG2      THR  44  15.289   3.821   3.209
  358    H    GLY  45           H        GLY  45  14.779   0.923  -0.559
  359    HA2  GLY  45           HA1      GLY  45  15.337   3.695  -1.393
  360    HA3  GLY  45           HA2      GLY  45  16.118   2.316  -2.158
  361    H    ILE  46           H        ILE  46  14.557   4.233  -3.529
  362    HA   ILE  46           HA       ILE  46  11.866   3.135  -3.768
  363    HB   ILE  46           HB       ILE  46  13.054   5.571  -5.102
  364   HG12  ILE  46          2HG1      ILE  46  13.203   5.666  -2.624
  365   HG13  ILE  46          3HG1      ILE  46  12.140   6.897  -3.301
  366   HG21  ILE  46          2HG2      ILE  46  10.718   6.292  -5.311
  367   HG22  ILE  46          1HG2      ILE  46  10.194   4.759  -4.615
  368   HG23  ILE  46          3HG2      ILE  46  11.028   4.783  -6.168
  369   HD11  ILE  46          3HD1      ILE  46  11.296   4.329  -1.980
  370   HD12  ILE  46          2HD1      ILE  46  10.206   5.520  -2.689
  371   HD13  ILE  46          1HD1      ILE  46  11.195   5.952  -1.292
  372    H    GLU  47           H        GLU  47  11.066   2.114  -5.569
  373    HA   GLU  47           HA       GLU  47  12.796   2.038  -7.958
  374    HB2  GLU  47           HB2      GLU  47  12.519  -0.182  -6.986
  375    HB3  GLU  47           HB3      GLU  47  10.770   0.002  -7.008
  376    HG2  GLU  47           HG2      GLU  47  11.071   0.325  -9.552
  377    HG3  GLU  47           HG3      GLU  47  12.654  -0.406  -9.291
  378    H    ASN  48           H        ASN  48   9.367   1.666  -7.065
  379    HA   ASN  48           HA       ASN  48   8.473   2.417  -9.674
  380    HB2  ASN  48           HB2      ASN  48   7.242   0.807  -8.268
  381    HB3  ASN  48           HB3      ASN  48   6.903   2.083  -7.107
  382   HD21  ASN  48          1HD2      ASN  48   5.367   3.655  -7.612
  383   HD22  ASN  48          2HD2      ASN  48   4.254   3.461  -8.918
  384    H    GLU  49           H        GLU  49   8.298   3.937  -6.486
  385    HA   GLU  49           HA       GLU  49   8.147   6.065  -5.779
  386    HB2  GLU  49           HB2      GLU  49   9.842   6.634  -7.462
  387    HB3  GLU  49           HB3      GLU  49   8.574   6.857  -8.661
  388    HG2  GLU  49           HG2      GLU  49   7.661   8.711  -7.414
  389    HG3  GLU  49           HG3      GLU  49   8.829   8.453  -6.118
  390    H    LEU  50           H        LEU  50   6.340   6.842  -5.061
  391    HA   LEU  50           HA       LEU  50   4.005   6.990  -6.815
  392    HB2  LEU  50           HB2      LEU  50   4.227   7.477  -3.839
  393    HB3  LEU  50           HB3      LEU  50   2.739   7.402  -4.761
  394    HG   LEU  50           HG       LEU  50   4.648   5.102  -4.316
  395   HD11  LEU  50          2HD1      LEU  50   3.426   5.691  -2.300
  396   HD12  LEU  50          1HD1      LEU  50   2.846   4.163  -2.961
  397   HD13  LEU  50          3HD1      LEU  50   1.904   5.637  -3.189
  398   HD21  LEU  50          3HD2      LEU  50   2.908   3.737  -5.372
  399   HD22  LEU  50          2HD2      LEU  50   3.550   4.947  -6.483
  400   HD23  LEU  50          1HD2      LEU  50   1.979   5.196  -5.721
  401    H    THR  51           H        THR  51   3.591   8.835  -7.838
  402    HA   THR  51           HA       THR  51   5.149  11.175  -7.238
  403    HB   THR  51           HB       THR  51   4.029  12.199  -9.172
  404    HG1  THR  51           HG1      THR  51   2.517   9.765  -9.189
  405   HG21  THR  51          3HG2      THR  51   4.849  10.656 -10.890
  406   HG22  THR  51          1HG2      THR  51   4.943   9.366  -9.688
  407   HG23  THR  51          2HG2      THR  51   5.985  10.783  -9.546
  408    H    GLU  52           H        GLU  52   3.951  13.369  -7.318
  409    HA   GLU  52           HA       GLU  52   2.496  13.632  -4.961
  410    HB2  GLU  52           HB2      GLU  52   2.044  15.915  -5.642
  411    HB3  GLU  52           HB3      GLU  52   3.721  15.503  -5.930
  412    HG2  GLU  52           HG2      GLU  52   1.516  15.776  -7.962
  413    HG3  GLU  52           HG3      GLU  52   2.869  16.872  -7.711
  414    H    LYS  53           H        LYS  53   1.352  13.638  -8.297
  415    HA   LYS  53           HA       LYS  53  -1.364  13.893  -7.895
  416    HB2  LYS  53           HB2      LYS  53  -0.098  12.001  -9.890
  417    HB3  LYS  53           HB3      LYS  53  -1.711  12.689  -9.980
  418    HG2  LYS  53           HG2      LYS  53   0.923  14.074 -10.356
  419    HG3  LYS  53           HG3      LYS  53  -0.397  13.889 -11.510
  420    HD2  LYS  53           HD2      LYS  53  -1.807  15.315 -10.061
  421    HD3  LYS  53           HD3      LYS  53  -0.422  15.550  -8.994
  422    HE2  LYS  53           HE2      LYS  53  -0.801  16.503 -11.816
  423    HE3  LYS  53           HE3      LYS  53  -0.442  17.446 -10.370
  424    HZ1  LYS  53           HZ1      LYS  53   1.728  16.089 -10.349
  425    HZ2  LYS  53           HZ2      LYS  53   1.577  17.360 -11.459
  426    HZ3  LYS  53           HZ3      LYS  53   1.366  15.754 -11.973
  427    H    ASP  54           H        ASP  54   0.513  10.862  -7.954
  428    HA   ASP  54           HA       ASP  54  -1.557   9.076  -7.474
  429    HB2  ASP  54           HB2      ASP  54   1.323   8.904  -6.569
  430    HB3  ASP  54           HB3      ASP  54   0.182   7.570  -6.477
  431    H    VAL  55           H        VAL  55   0.491  10.754  -5.164
  432    HA   VAL  55           HA       VAL  55  -0.493   9.573  -2.834
  433    HB   VAL  55           HB       VAL  55   0.652  12.344  -3.195
  434   HG11  VAL  55          2HG1      VAL  55  -0.525  12.153  -1.088
  435   HG12  VAL  55          1HG1      VAL  55   1.217  12.188  -0.811
  436   HG13  VAL  55          3HG1      VAL  55   0.336  10.662  -0.716
  437   HG21  VAL  55          3HG2      VAL  55   2.139  10.583  -3.996
  438   HG22  VAL  55          2HG2      VAL  55   1.978   9.736  -2.457
  439   HG23  VAL  55          1HG2      VAL  55   2.767  11.313  -2.517
  440    H    ASN  56           H        ASN  56  -1.579  12.499  -4.536
  441    HA   ASN  56           HA       ASN  56  -3.500  13.063  -2.449
  442    HB2  ASN  56           HB2      ASN  56  -2.865  14.455  -5.048
  443    HB3  ASN  56           HB3      ASN  56  -4.154  14.976  -3.967
  444   HD21  ASN  56          1HD2      ASN  56  -0.718  14.719  -4.416
  445   HD22  ASN  56          2HD2      ASN  56  -0.268  15.750  -3.095
  446    H    ILE  57           H        ILE  57  -3.473  11.254  -5.337
  447    HA   ILE  57           HA       ILE  57  -6.349  11.315  -5.672
  448    HB   ILE  57           HB       ILE  57  -4.239   9.558  -6.942
  449   HG12  ILE  57          2HG1      ILE  57  -5.919  11.792  -8.107
  450   HG13  ILE  57          3HG1      ILE  57  -4.239  11.958  -7.602
  451   HG21  ILE  57          2HG2      ILE  57  -7.201   9.696  -7.494
  452   HG22  ILE  57          1HG2      ILE  57  -6.314   8.322  -6.834
  453   HG23  ILE  57          3HG2      ILE  57  -6.024   8.845  -8.492
  454   HD11  ILE  57          3HD1      ILE  57  -5.243  10.140  -9.781
  455   HD12  ILE  57          2HD1      ILE  57  -3.562  10.347  -9.292
  456   HD13  ILE  57          1HD1      ILE  57  -4.440  11.693 -10.014
  457    H    GLY  58           H        GLY  58  -3.901   9.007  -4.528
  458    HA2  GLY  58           HA1      GLY  58  -5.622   6.921  -3.774
  459    HA3  GLY  58           HA2      GLY  58  -4.030   7.232  -3.092
  460    H    GLU  59           H        GLU  59  -6.884   6.553  -2.102
  461    HA   GLU  59           HA       GLU  59  -7.357   8.756  -0.261
  462    HB2  GLU  59           HB2      GLU  59  -8.887   6.187  -0.722
  463    HB3  GLU  59           HB3      GLU  59  -9.393   7.491   0.344
  464    HG2  GLU  59           HG2      GLU  59  -9.605   8.995  -1.536
  465    HG3  GLU  59           HG3      GLU  59  -8.993   7.754  -2.628
  466    H    VAL  60           H        VAL  60  -6.927   5.223  -0.062
  467    HA   VAL  60           HA       VAL  60  -6.101   5.550   2.734
  468    HB   VAL  60           HB       VAL  60  -6.371   3.077   2.904
  469   HG11  VAL  60          2HG1      VAL  60  -8.822   3.093   2.892
  470   HG12  VAL  60          1HG1      VAL  60  -8.802   4.594   1.964
  471   HG13  VAL  60          3HG1      VAL  60  -8.158   4.563   3.606
  472   HG21  VAL  60          3HG2      VAL  60  -7.475   3.351   0.110
  473   HG22  VAL  60          2HG2      VAL  60  -7.622   1.912   1.121
  474   HG23  VAL  60          1HG2      VAL  60  -6.033   2.459   0.590
  475    H    VAL  61           H        VAL  61  -4.164   4.780   3.487
  476    HA   VAL  61           HA       VAL  61  -2.159   4.160   1.418
  477    HB   VAL  61           HB       VAL  61  -1.670   5.214   4.211
  478   HG11  VAL  61          2HG1      VAL  61   0.585   5.695   3.372
  479   HG12  VAL  61          1HG1      VAL  61   0.159   4.965   1.826
  480   HG13  VAL  61          3HG1      VAL  61   0.208   3.975   3.284
  481   HG21  VAL  61          3HG2      VAL  61  -2.859   6.901   2.960
  482   HG22  VAL  61          2HG2      VAL  61  -1.756   6.710   1.597
  483   HG23  VAL  61          1HG2      VAL  61  -1.165   7.372   3.122
  484    H    ILE  62           H        ILE  62  -1.326   2.168   1.420
  485    HA   ILE  62           HA       ILE  62  -1.570   0.574   3.892
  486    HB   ILE  62           HB       ILE  62  -1.626  -0.405   1.030
  487   HG12  ILE  62          2HG1      ILE  62  -3.730  -0.450   3.207
  488   HG13  ILE  62          3HG1      ILE  62  -3.734   0.611   1.802
  489   HG21  ILE  62          2HG2      ILE  62  -1.997  -2.635   2.017
  490   HG22  ILE  62          1HG2      ILE  62  -1.697  -1.954   3.616
  491   HG23  ILE  62          3HG2      ILE  62  -0.409  -1.976   2.411
  492   HD11  ILE  62          3HD1      ILE  62  -5.269  -1.254   1.525
  493   HD12  ILE  62          2HD1      ILE  62  -3.939  -2.393   1.743
  494   HD13  ILE  62          1HD1      ILE  62  -3.965  -1.325   0.339
  495    H    PHE  63           H        PHE  63   0.309   0.177   4.831
  496    HA   PHE  63           HA       PHE  63   2.724   0.146   3.154
  497    HB2  PHE  63           HB2      PHE  63   2.314   0.789   6.059
  498    HB3  PHE  63           HB3      PHE  63   3.900   0.330   5.447
  499    HD1  PHE  63           HD2      PHE  63   3.874   1.660   2.810
  500    HD2  PHE  63           HD1      PHE  63   2.563   3.025   6.618
  501    HE1  PHE  63           HE2      PHE  63   4.280   3.982   2.112
  502    HE2  PHE  63           HE1      PHE  63   2.968   5.351   5.927
  503    HZ   PHE  63           HZ       PHE  63   3.828   5.831   3.671
  504    H    ALA  64           H        ALA  64   3.176  -1.839   2.538
  505    HA   ALA  64           HA       ALA  64   3.150  -3.979   4.562
  506    HB1  ALA  64           HB1      ALA  64   3.400  -4.211   1.559
  507    HB2  ALA  64           HB2      ALA  64   3.296  -5.547   2.706
  508    HB3  ALA  64           HB3      ALA  64   1.917  -4.470   2.480
  509    H    VAL  65           H        VAL  65   5.081  -3.583   5.623
  510    HA   VAL  65           HA       VAL  65   7.471  -3.473   3.931
  511    HB   VAL  65           HB       VAL  65   8.367  -1.629   5.364
  512   HG11  VAL  65          2HG1      VAL  65   5.861  -1.012   3.798
  513   HG12  VAL  65          1HG1      VAL  65   7.481  -1.206   3.123
  514   HG13  VAL  65          3HG1      VAL  65   7.131   0.139   4.211
  515   HG21  VAL  65          3HG2      VAL  65   6.810  -0.280   6.655
  516   HG22  VAL  65          2HG2      VAL  65   6.841  -1.932   7.271
  517   HG23  VAL  65          1HG2      VAL  65   5.494  -1.389   6.268
  518    H    ASP  66           H        ASP  66   9.411  -3.952   4.895
  519    HA   ASP  66           HA       ASP  66   9.299  -5.403   7.459
  520    HB2  ASP  66           HB2      ASP  66   9.879  -6.777   5.479
  521    HB3  ASP  66           HB3      ASP  66  11.214  -5.695   5.117
  522    H    THR  67           H        THR  67   9.755  -2.484   6.597
  523    HA   THR  67           HA       THR  67  11.616  -1.766   8.581
  524    HB   THR  67           HB       THR  67  13.227  -2.602   6.874
  525    HG1  THR  67           HG1      THR  67  14.573  -0.749   6.962
  526   HG21  THR  67          3HG2      THR  67  12.196  -0.313   5.196
  527   HG22  THR  67          1HG2      THR  67  11.974  -2.029   4.852
  528   HG23  THR  67          2HG2      THR  67  13.591  -1.323   4.821
  529    H    LYS  68           H        LYS  68  12.406   0.734   7.571
  530    HA   LYS  68           HA       LYS  68   9.970   2.214   7.858
  531    HB2  LYS  68           HB2      LYS  68  11.429   4.189   7.673
  532    HB3  LYS  68           HB3      LYS  68  12.063   3.017   8.823
  533    HG2  LYS  68           HG2      LYS  68  13.702   2.262   7.256
  534    HG3  LYS  68           HG3      LYS  68  12.984   3.234   5.971
  535    HD2  LYS  68           HD2      LYS  68  14.183   4.369   8.493
  536    HD3  LYS  68           HD3      LYS  68  15.049   4.216   6.964
  537    HE2  LYS  68           HE2      LYS  68  13.350   5.637   5.888
  538    HE3  LYS  68           HE3      LYS  68  12.543   5.823   7.447
  539    HZ1  LYS  68           HZ1      LYS  68  15.328   6.671   6.844
  540    HZ2  LYS  68           HZ2      LYS  68  14.509   6.894   8.316
  541    HZ3  LYS  68           HZ3      LYS  68  13.983   7.703   6.923
  542    H    VAL  69           H        VAL  69   9.790   4.252   6.319
  543    HA   VAL  69           HA       VAL  69  10.090   3.407   3.520
  544    HB   VAL  69           HB       VAL  69   7.853   4.187   2.948
  545   HG11  VAL  69          2HG1      VAL  69   7.784   2.188   5.199
  546   HG12  VAL  69          1HG1      VAL  69   8.114   1.832   3.503
  547   HG13  VAL  69          3HG1      VAL  69   6.524   2.424   3.989
  548   HG21  VAL  69          3HG2      VAL  69   6.212   4.763   4.660
  549   HG22  VAL  69          2HG2      VAL  69   7.580   5.876   4.682
  550   HG23  VAL  69          1HG2      VAL  69   7.453   4.613   5.905
  551    H    ARG  70           H        ARG  70  10.147   5.104   2.006
  552    HA   ARG  70           HA       ARG  70  11.064   7.652   3.054
  553    HB2  ARG  70           HB2      ARG  70  10.878   6.623   0.214
  554    HB3  ARG  70           HB3      ARG  70  11.614   8.143   0.690
  555    HG2  ARG  70           HG2      ARG  70  12.578   5.449   1.626
  556    HG3  ARG  70           HG3      ARG  70  13.224   6.305   0.225
  557    HD2  ARG  70           HD2      ARG  70  13.687   8.238   1.770
  558    HD3  ARG  70           HD3      ARG  70  13.298   7.161   3.110
  559    HE   ARG  70           HE       ARG  70  15.166   5.719   2.031
  560   HH11  ARG  70          2HH1      ARG  70  15.101   9.219   2.209
  561   HH12  ARG  70          1HH1      ARG  70  16.835   9.374   2.210
  562   HH21  ARG  70          2HH2      ARG  70  17.449   5.928   2.048
  563   HH22  ARG  70          1HH2      ARG  70  18.163   7.515   2.100
  564    H    ASN  71           H        ASN  71   8.202   6.284   1.764
  565    HA   ASN  71           HA       ASN  71   7.202   8.728   0.598
  566    HB2  ASN  71           HB2      ASN  71   6.172   5.940   0.822
  567    HB3  ASN  71           HB3      ASN  71   5.048   7.238   0.449
  568   HD21  ASN  71          1HD2      ASN  71   7.726   5.363  -0.670
  569   HD22  ASN  71          2HD2      ASN  71   7.660   5.868  -2.324
  570    H    LYS  72           H        LYS  72   7.323   7.587   3.732
  571    HA   LYS  72           HA       LYS  72   4.740   8.112   4.702
  572    HB2  LYS  72           HB2      LYS  72   6.478   6.887   5.965
  573    HB3  LYS  72           HB3      LYS  72   7.367   8.387   6.175
  574    HG2  LYS  72           HG2      LYS  72   6.141   7.826   8.175
  575    HG3  LYS  72           HG3      LYS  72   5.502   9.305   7.458
  576    HD2  LYS  72           HD2      LYS  72   3.650   8.067   6.494
  577    HD3  LYS  72           HD3      LYS  72   4.316   6.552   7.107
  578    HE2  LYS  72           HE2      LYS  72   2.561   7.242   8.577
  579    HE3  LYS  72           HE3      LYS  72   4.097   7.461   9.413
  580    HZ1  LYS  72           HZ1      LYS  72   3.917   9.868   8.555
  581    HZ2  LYS  72           HZ2      LYS  72   2.954   9.396   9.868
  582    HZ3  LYS  72           HZ3      LYS  72   2.272   9.505   8.323
  583    H    GLU  73           H        GLU  73   7.335  10.173   3.803
  584    HA   GLU  73           HA       GLU  73   6.816  12.522   5.170
  585    HB2  GLU  73           HB2      GLU  73   7.599  12.358   2.261
  586    HB3  GLU  73           HB3      GLU  73   7.938  13.670   3.377
  587    HG2  GLU  73           HG2      GLU  73   9.455  12.263   4.622
  588    HG3  GLU  73           HG3      GLU  73   9.059  10.886   3.594
  589    H    ARG  74           H        ARG  74   5.211  11.238   2.281
  590    HA   ARG  74           HA       ARG  74   3.830  13.770   1.886
  591    HB2  ARG  74           HB2      ARG  74   3.138  12.808  -0.263
  592    HB3  ARG  74           HB3      ARG  74   4.880  12.755  -0.038
  593    HG2  ARG  74           HG2      ARG  74   4.177  10.324   0.921
  594    HG3  ARG  74           HG3      ARG  74   2.939  10.568  -0.312
  595    HD2  ARG  74           HD2      ARG  74   4.801   9.457  -1.326
  596    HD3  ARG  74           HD3      ARG  74   4.748  11.113  -1.920
  597    HE   ARG  74           HE       ARG  74   6.465  10.960   0.310
  598   HH11  ARG  74          2HH1      ARG  74   6.306  10.025  -3.054
  599   HH12  ARG  74          1HH1      ARG  74   8.020  10.093  -3.289
  600   HH21  ARG  74          2HH2      ARG  74   8.746  11.050   0.010
  601   HH22  ARG  74          1HH2      ARG  74   9.407  10.684  -1.549
  602    H    PHE  75           H        PHE  75   3.128  10.679   3.246
  603    HA   PHE  75           HA       PHE  75   0.258  11.032   2.934
  604    HB2  PHE  75           HB2      PHE  75   1.740   8.886   4.462
  605    HB3  PHE  75           HB3      PHE  75   0.063   8.857   3.941
  606    HD1  PHE  75           HD2      PHE  75   0.076   9.577   1.190
  607    HD2  PHE  75           HD1      PHE  75   2.941   7.301   3.359
  608    HE1  PHE  75           HE2      PHE  75   0.764   8.457  -0.892
  609    HE2  PHE  75           HE1      PHE  75   3.638   6.182   1.289
  610    HZ   PHE  75           HZ       PHE  75   2.546   6.760  -0.844
  611    H    ASP  76           H        ASP  76   1.276  13.143   4.307
  612    HA   ASP  76           HA       ASP  76   1.525  12.842   7.085
  613    HB2  ASP  76           HB2      ASP  76   1.006  15.336   7.127
  614    HB3  ASP  76           HB3      ASP  76   2.379  14.836   6.150
  615    H    GLY  77           H        GLY  77  -1.187  14.716   5.737
  616    HA2  GLY  77           HA1      GLY  77  -2.871  13.787   7.917
  617    HA3  GLY  77           HA2      GLY  77  -3.278  15.018   6.727
  618    H    LYS  78           H        LYS  78  -2.263  11.640   6.407
  619    HA   LYS  78           HA       LYS  78  -4.776  11.095   4.980
  620    HB2  LYS  78           HB2      LYS  78  -2.022  10.102   4.209
  621    HB3  LYS  78           HB3      LYS  78  -3.527   9.668   3.410
  622    HG2  LYS  78           HG2      LYS  78  -3.855  11.951   2.693
  623    HG3  LYS  78           HG3      LYS  78  -2.421  12.464   3.582
  624    HD2  LYS  78           HD2      LYS  78  -1.899  12.255   1.228
  625    HD3  LYS  78           HD3      LYS  78  -1.044  11.011   2.139
  626    HE2  LYS  78           HE2      LYS  78  -1.979  10.103   0.084
  627    HE3  LYS  78           HE3      LYS  78  -2.731   9.374   1.496
  628    HZ1  LYS  78           HZ1      LYS  78  -3.928  11.645   0.008
  629    HZ2  LYS  78           HZ2      LYS  78  -4.672  10.674   1.184
  630    HZ3  LYS  78           HZ3      LYS  78  -4.285  10.023  -0.333
  631    H    VAL  79           H        VAL  79  -5.316   8.770   4.924
  632    HA   VAL  79           HA       VAL  79  -4.940   7.704   7.580
  633    HB   VAL  79           HB       VAL  79  -7.185   7.656   6.756
  634   HG11  VAL  79          2HG1      VAL  79  -7.837   6.342   4.787
  635   HG12  VAL  79          1HG1      VAL  79  -6.133   6.023   4.456
  636   HG13  VAL  79          3HG1      VAL  79  -6.752   7.673   4.380
  637   HG21  VAL  79          3HG2      VAL  79  -7.718   5.251   6.949
  638   HG22  VAL  79          2HG2      VAL  79  -6.590   5.806   8.187
  639   HG23  VAL  79          1HG2      VAL  79  -6.000   4.884   6.803
  640    H    VAL  80           H        VAL  80  -3.392   6.346   8.089
  641    HA   VAL  80           HA       VAL  80  -2.127   4.800   5.928
  642    HB   VAL  80           HB       VAL  80  -0.918   5.787   8.518
  643   HG11  VAL  80          2HG1      VAL  80   1.198   4.921   7.632
  644   HG12  VAL  80          1HG1      VAL  80   0.336   4.239   6.254
  645   HG13  VAL  80          3HG1      VAL  80   0.017   3.635   7.880
  646   HG21  VAL  80          3HG2      VAL  80   0.477   7.186   7.045
  647   HG22  VAL  80          2HG2      VAL  80  -1.237   7.580   6.915
  648   HG23  VAL  80          1HG2      VAL  80  -0.455   6.624   5.656
  649    H    LEU  81           H        LEU  81  -2.556   2.727   5.963
  650    HA   LEU  81           HA       LEU  81  -2.934   1.377   8.553
  651    HB2  LEU  81           HB2      LEU  81  -4.805   1.277   6.865
  652    HB3  LEU  81           HB3      LEU  81  -3.726   0.407   5.798
  653    HG   LEU  81           HG       LEU  81  -5.443  -0.943   7.145
  654   HD11  LEU  81          2HD1      LEU  81  -2.531  -1.704   7.255
  655   HD12  LEU  81          1HD1      LEU  81  -3.649  -2.008   5.924
  656   HD13  LEU  81          3HD1      LEU  81  -3.886  -2.808   7.478
  657   HD21  LEU  81          3HD2      LEU  81  -4.722  -1.606   9.391
  658   HD22  LEU  81          2HD2      LEU  81  -5.106   0.113   9.299
  659   HD23  LEU  81          1HD2      LEU  81  -3.423  -0.415   9.318
  660    H    GLU  82           H        GLU  82  -1.053   0.557   9.209
  661    HA   GLU  82           HA       GLU  82   0.856  -0.387   7.189
  662    HB2  GLU  82           HB2      GLU  82   1.573   1.380   8.807
  663    HB3  GLU  82           HB3      GLU  82   1.358   0.216  10.107
  664    HG2  GLU  82           HG2      GLU  82   3.068  -1.209   9.141
  665    HG3  GLU  82           HG3      GLU  82   3.260  -0.089   7.795
  666    H    VAL  83           H        VAL  83   1.513  -2.435   7.082
  667    HA   VAL  83           HA       VAL  83   0.896  -4.295   9.260
  668    HB   VAL  83           HB       VAL  83   0.183  -6.017   7.584
  669   HG11  VAL  83          2HG1      VAL  83  -1.539  -3.547   7.721
  670   HG12  VAL  83          1HG1      VAL  83  -1.501  -4.868   8.890
  671   HG13  VAL  83          3HG1      VAL  83  -2.095  -5.155   7.254
  672   HG21  VAL  83          3HG2      VAL  83  -0.565  -5.279   5.367
  673   HG22  VAL  83          2HG2      VAL  83   1.167  -5.031   5.588
  674   HG23  VAL  83          1HG2      VAL  83   0.058  -3.664   5.700
  675    HA   PRO  84           HA       PRO  84   4.942  -5.966   8.263
  676    HB2  PRO  84           HB2      PRO  84   4.385  -8.671   8.430
  677    HB3  PRO  84           HB3      PRO  84   4.785  -7.642   9.809
  678    HG2  PRO  84           HG2      PRO  84   2.114  -8.559   8.839
  679    HG3  PRO  84           HG3      PRO  84   2.703  -8.372  10.501
  680    HD2  PRO  84           HD2      PRO  84   1.063  -6.568   9.368
  681    HD3  PRO  84           HD3      PRO  84   2.338  -6.086  10.506
  682    H    VAL  85           H        VAL  85   6.001  -6.890   6.480
  683    HA   VAL  85           HA       VAL  85   4.747  -6.478   4.039
  684    HB   VAL  85           HB       VAL  85   7.194  -6.386   4.435
  685   HG11  VAL  85          2HG1      VAL  85   7.032  -9.390   4.334
  686   HG12  VAL  85          1HG1      VAL  85   7.521  -8.403   5.712
  687   HG13  VAL  85          3HG1      VAL  85   8.520  -8.446   4.259
  688   HG21  VAL  85          3HG2      VAL  85   6.310  -8.120   2.135
  689   HG22  VAL  85          2HG2      VAL  85   7.855  -7.275   2.239
  690   HG23  VAL  85          1HG2      VAL  85   6.351  -6.356   2.174
  691    H    SER  86           H        SER  86   4.977  -9.426   5.912
  692    HA   SER  86           HA       SER  86   4.251 -11.181   3.777
  693    HB2  SER  86           HB2      SER  86   5.571 -11.943   5.717
  694    HB3  SER  86           HB3      SER  86   4.183 -11.655   6.765
  695    HG   SER  86           HG       SER  86   3.048 -13.175   5.327
  696    H    ALA  87           H        ALA  87   2.438  -9.088   5.798
  697    HA   ALA  87           HA       ALA  87   0.180 -10.715   6.276
  698    HB1  ALA  87           HB1      ALA  87   0.742  -8.731   7.613
  699    HB2  ALA  87           HB2      ALA  87   0.280  -7.706   6.254
  700    HB3  ALA  87           HB3      ALA  87  -0.926  -8.725   7.043
  701    HA   PRO  88           HA       PRO  88  -2.092  -8.414   2.711
  702    HB2  PRO  88           HB2      PRO  88  -0.662  -7.108   0.832
  703    HB3  PRO  88           HB3      PRO  88  -1.180  -6.334   2.335
  704    HG2  PRO  88           HG2      PRO  88   1.475  -7.544   1.649
  705    HG3  PRO  88           HG3      PRO  88   1.124  -5.989   2.428
  706    HD2  PRO  88           HD2      PRO  88   1.845  -8.171   3.840
  707    HD3  PRO  88           HD3      PRO  88   0.705  -6.968   4.478
  708    H    ILE  89           H        ILE  89   0.626 -10.360   2.442
  709    HA   ILE  89           HA       ILE  89   0.206 -11.230  -0.270
  710    HB   ILE  89           HB       ILE  89   1.771 -12.574   1.943
  711   HG12  ILE  89          2HG1      ILE  89   2.734 -10.704  -0.236
  712   HG13  ILE  89          3HG1      ILE  89   2.555 -10.272   1.462
  713   HG21  ILE  89          2HG2      ILE  89   1.198 -14.072   0.099
  714   HG22  ILE  89          1HG2      ILE  89   2.928 -13.733   0.135
  715   HG23  ILE  89          3HG2      ILE  89   1.898 -12.930  -1.048
  716   HD11  ILE  89          3HD1      ILE  89   4.260 -11.889   2.069
  717   HD12  ILE  89          2HD1      ILE  89   4.872 -10.744   0.875
  718   HD13  ILE  89          1HD1      ILE  89   4.417 -12.374   0.382
  719    H    LYS  90           H        LYS  90  -0.670 -12.258   2.960
  720    HA   LYS  90           HA       LYS  90  -2.080 -14.599   1.925
  721    HB2  LYS  90           HB2      LYS  90  -0.512 -14.540   4.006
  722    HB3  LYS  90           HB3      LYS  90  -1.885 -13.806   4.819
  723    HG2  LYS  90           HG2      LYS  90  -2.028 -16.459   3.413
  724    HG3  LYS  90           HG3      LYS  90  -1.631 -16.282   5.121
  725    HD2  LYS  90           HD2      LYS  90  -3.784 -15.229   5.532
  726    HD3  LYS  90           HD3      LYS  90  -4.176 -15.321   3.813
  727    HE2  LYS  90           HE2      LYS  90  -3.683 -17.666   5.645
  728    HE3  LYS  90           HE3      LYS  90  -5.258 -17.110   5.083
  729    HZ1  LYS  90           HZ1      LYS  90  -4.596 -17.605   2.817
  730    HZ2  LYS  90           HZ2      LYS  90  -4.450 -18.989   3.788
  731    HZ3  LYS  90           HZ3      LYS  90  -3.066 -18.118   3.343
  732    H    ASP  91           H        ASP  91  -2.647 -11.672   3.852
  733    HA   ASP  91           HA       ASP  91  -5.544 -12.154   3.681
  734    HB2  ASP  91           HB2      ASP  91  -3.950 -10.413   5.576
  735    HB3  ASP  91           HB3      ASP  91  -5.705 -10.520   5.558
  736    H    ALA  92           H        ALA  92  -4.383 -11.133   1.374
  737    HA   ALA  92           HA       ALA  92  -4.037  -8.392   1.155
  738    HB1  ALA  92           HB1      ALA  92  -3.521 -10.011  -0.625
  739    HB2  ALA  92           HB2      ALA  92  -5.249 -10.214  -0.921
  740    HB3  ALA  92           HB3      ALA  92  -4.482  -8.652  -1.213
  741    H    GLU  93           H        GLU  93  -7.041 -10.240   0.681
  742    HA   GLU  93           HA       GLU  93  -8.737  -8.081   0.117
  743    HB2  GLU  93           HB2      GLU  93  -9.592 -10.500   1.711
  744    HB3  GLU  93           HB3      GLU  93 -10.544  -9.558   0.576
  745    HG2  GLU  93           HG2      GLU  93  -8.197 -11.269  -0.209
  746    HG3  GLU  93           HG3      GLU  93  -9.874 -11.810  -0.237
  747    H    LYS  94           H        LYS  94  -7.718  -9.507   3.172
  748    HA   LYS  94           HA       LYS  94  -9.639  -8.129   4.763
  749    HB2  LYS  94           HB2      LYS  94  -8.580 -10.320   5.348
  750    HB3  LYS  94           HB3      LYS  94  -7.073  -9.465   5.633
  751    HG2  LYS  94           HG2      LYS  94  -8.111  -8.203   7.432
  752    HG3  LYS  94           HG3      LYS  94  -9.645  -9.022   7.132
  753    HD2  LYS  94           HD2      LYS  94  -8.579 -11.177   7.648
  754    HD3  LYS  94           HD3      LYS  94  -7.064 -10.338   7.983
  755    HE2  LYS  94           HE2      LYS  94  -9.664  -9.957   9.461
  756    HE3  LYS  94           HE3      LYS  94  -8.273 -10.873  10.040
  757    HZ1  LYS  94           HZ1      LYS  94  -6.979  -8.768   9.868
  758    HZ2  LYS  94           HZ2      LYS  94  -8.205  -8.740  11.036
  759    HZ3  LYS  94           HZ3      LYS  94  -8.431  -7.947   9.554
  760    H    VAL  95           H        VAL  95  -6.252  -7.636   3.954
  761    HA   VAL  95           HA       VAL  95  -5.752  -5.442   5.653
  762    HB   VAL  95           HB       VAL  95  -4.498  -6.102   2.979
  763   HG11  VAL  95          2HG1      VAL  95  -3.472  -4.334   5.195
  764   HG12  VAL  95          1HG1      VAL  95  -4.100  -3.780   3.642
  765   HG13  VAL  95          3HG1      VAL  95  -2.620  -4.739   3.706
  766   HG21  VAL  95          3HG2      VAL  95  -3.607  -6.792   5.778
  767   HG22  VAL  95          2HG2      VAL  95  -2.735  -7.162   4.290
  768   HG23  VAL  95          1HG2      VAL  95  -4.300  -7.916   4.606
  769    H    ILE  96           H        ILE  96  -6.868  -5.642   2.297
  770    HA   ILE  96           HA       ILE  96  -7.026  -2.868   1.825
  771    HB   ILE  96           HB       ILE  96  -8.501  -5.183   0.543
  772   HG12  ILE  96          2HG1      ILE  96  -6.142  -3.515  -0.381
  773   HG13  ILE  96          3HG1      ILE  96  -6.045  -5.146   0.274
  774   HG21  ILE  96          2HG2      ILE  96  -9.085  -3.636  -1.265
  775   HG22  ILE  96          1HG2      ILE  96  -8.357  -2.302  -0.373
  776   HG23  ILE  96          3HG2      ILE  96  -9.788  -3.111   0.265
  777   HD11  ILE  96          3HD1      ILE  96  -7.422  -4.337  -2.276
  778   HD12  ILE  96          2HD1      ILE  96  -7.354  -5.972  -1.620
  779   HD13  ILE  96          1HD1      ILE  96  -5.871  -5.168  -2.138
  780    H    ASN  97           H        ASN  97  -9.439  -5.224   2.933
  781    HA   ASN  97           HA       ASN  97 -11.602  -3.443   3.128
  782    HB2  ASN  97           HB2      ASN  97 -10.989  -6.040   4.527
  783    HB3  ASN  97           HB3      ASN  97 -12.478  -5.151   4.825
  784   HD21  ASN  97          1HD2      ASN  97 -12.078  -7.802   3.657
  785   HD22  ASN  97          2HD2      ASN  97 -12.813  -7.738   2.092
  786    H    ALA  98           H        ALA  98  -9.111  -4.346   5.472
  787    HA   ALA  98           HA       ALA  98 -10.155  -3.035   7.711
  788    HB1  ALA  98           HB1      ALA  98  -7.251  -3.465   7.015
  789    HB2  ALA  98           HB2      ALA  98  -7.901  -3.118   8.618
  790    HB3  ALA  98           HB3      ALA  98  -8.302  -4.636   7.815
  791    H    ALA  99           H        ALA  99  -8.008  -1.864   5.151
  792    HA   ALA  99           HA       ALA  99  -7.498   0.684   6.196
  793    HB1  ALA  99           HB1      ALA  99  -6.243  -0.263   4.325
  794    HB2  ALA  99           HB2      ALA  99  -7.674  -0.147   3.302
  795    HB3  ALA  99           HB3      ALA  99  -6.904   1.318   3.912
  796    H    LEU 100           H        LEU 100 -10.126  -0.503   4.150
  797    HA   LEU 100           HA       LEU 100 -11.347   2.033   3.761
  798    HB2  LEU 100           HB2      LEU 100 -12.568  -0.724   3.592
  799    HB3  LEU 100           HB3      LEU 100 -13.270   0.748   2.950
  800    HG   LEU 100           HG       LEU 100 -10.721  -0.563   2.007
  801   HD11  LEU 100          2HD1      LEU 100 -13.417  -0.274   0.692
  802   HD12  LEU 100          1HD1      LEU 100 -12.718  -1.765   1.322
  803   HD13  LEU 100          3HD1      LEU 100 -11.972  -0.958  -0.056
  804   HD21  LEU 100          3HD2      LEU 100 -12.115   1.913   0.996
  805   HD22  LEU 100          2HD2      LEU 100 -10.715   1.137   0.256
  806   HD23  LEU 100          1HD2      LEU 100 -10.575   1.866   1.857
  807    H    ALA 101           H        ALA 101 -11.662  -0.504   6.150
  808    HA   ALA 101           HA       ALA 101 -14.032   0.443   7.367
  809    HB1  ALA 101           HB1      ALA 101 -11.857  -1.254   8.577
  810    HB2  ALA 101           HB2      ALA 101 -13.509  -1.078   9.173
  811    HB3  ALA 101           HB3      ALA 101 -13.211  -1.855   7.618
  812    H    LEU 102           H        LEU 102 -10.783   1.540   7.520
  813    HA   LEU 102           HA       LEU 102 -10.972   2.725  10.122
  814    HB2  LEU 102           HB2      LEU 102  -9.034   3.236   7.870
  815    HB3  LEU 102           HB3      LEU 102  -8.880   3.893   9.488
  816    HG   LEU 102           HG       LEU 102  -8.743   0.981   8.710
  817   HD11  LEU 102          2HD1      LEU 102  -6.662   2.861   9.814
  818   HD12  LEU 102          1HD1      LEU 102  -6.753   2.278   8.152
  819   HD13  LEU 102          3HD1      LEU 102  -6.434   1.147   9.467
  820   HD21  LEU 102          3HD2      LEU 102  -8.537   2.258  11.436
  821   HD22  LEU 102          2HD2      LEU 102  -8.241   0.558  11.068
  822   HD23  LEU 102          1HD2      LEU 102  -9.856   1.239  10.862
  823    H    ILE 103           H        ILE 103 -11.662   3.774   6.853
  824    HA   ILE 103           HA       ILE 103 -12.126   6.498   7.850
  825    HB   ILE 103           HB       ILE 103 -12.189   7.165   5.443
  826   HG12  ILE 103          2HG1      ILE 103 -11.033   4.419   4.935
  827   HG13  ILE 103          3HG1      ILE 103 -12.713   4.836   4.617
  828   HG21  ILE 103          2HG2      ILE 103  -9.663   5.861   6.442
  829   HG22  ILE 103          1HG2      ILE 103 -10.203   7.504   6.784
  830   HG23  ILE 103          3HG2      ILE 103  -9.752   7.047   5.140
  831   HD11  ILE 103          3HD1      ILE 103 -11.372   4.921   2.600
  832   HD12  ILE 103          2HD1      ILE 103 -10.313   6.120   3.340
  833   HD13  ILE 103          1HD1      ILE 103 -12.001   6.515   3.012
  834    H    ASP 104           H        ASP 104 -13.669   3.903   6.005
  835    HA   ASP 104           HA       ASP 104 -16.142   5.488   5.943
  836    HB2  ASP 104           HB2      ASP 104 -15.177   4.567   3.799
  837    HB3  ASP 104           HB3      ASP 104 -15.536   2.957   4.414
  838    H    GLU 105           H        GLU 105 -14.661   2.685   7.239
  839    HA   GLU 105           HA       GLU 105 -15.276   1.183   8.813
  840    HB2  GLU 105           HB2      GLU 105 -16.000   3.220  10.019
  841    HB3  GLU 105           HB3      GLU 105 -17.598   3.053   9.309
  842    HG2  GLU 105           HG2      GLU 105 -17.565   2.236  11.585
  843    HG3  GLU 105           HG3      GLU 105 -17.894   0.923  10.456
  844    H    LYS 106           H        LYS 106 -15.659  -0.382   7.217
  845    HA   LYS 106           HA       LYS 106 -18.477  -1.171   7.094
  846    HB2  LYS 106           HB2      LYS 106 -16.510  -1.167   4.800
  847    HB3  LYS 106           HB3      LYS 106 -18.016  -2.075   4.775
  848    HG2  LYS 106           HG2      LYS 106 -17.798   0.911   5.106
  849    HG3  LYS 106           HG3      LYS 106 -18.200   0.073   3.605
  850    HD2  LYS 106           HD2      LYS 106 -20.202  -0.842   4.617
  851    HD3  LYS 106           HD3      LYS 106 -19.779  -0.119   6.169
  852    HE2  LYS 106           HE2      LYS 106 -20.366   1.403   3.633
  853    HE3  LYS 106           HE3      LYS 106 -21.501   1.161   4.957
  854    HZ1  LYS 106           HZ1      LYS 106 -19.900   2.333   6.415
  855    HZ2  LYS 106           HZ2      LYS 106 -20.507   3.305   5.170
  856    HZ3  LYS 106           HZ3      LYS 106 -18.941   2.666   5.054
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1 -17.227   0.246  -5.144
    2    H2   MET   1           H2       MET   1 -16.807   1.886  -5.220
    3    H3   MET   1           H3       MET   1 -15.653   0.734  -4.775
    4    HA   MET   1           HA       MET   1 -15.801  -0.284  -6.974
    5    HB2  MET   1           HB2      MET   1 -17.538   2.127  -7.547
    6    HB3  MET   1           HB3      MET   1 -16.918   1.017  -8.761
    7    HG2  MET   1           HG2      MET   1 -18.205  -0.798  -7.752
    8    HG3  MET   1           HG3      MET   1 -18.832   0.326  -6.544
    9    HE1  MET   1           HE1      MET   1 -20.693  -1.490  -8.400
   10    HE2  MET   1           HE2      MET   1 -21.313  -0.370  -7.186
   11    HE3  MET   1           HE3      MET   1 -21.948  -0.327  -8.832
   12    H    LYS   2           H        LYS   2 -13.933   0.107  -8.023
   13    HA   LYS   2           HA       LYS   2 -12.078   1.163  -8.818
   14    HB2  LYS   2           HB2      LYS   2 -13.913   3.564  -8.952
   15    HB3  LYS   2           HB3      LYS   2 -12.397   3.370  -9.820
   16    HG2  LYS   2           HG2      LYS   2 -13.321   1.569 -11.126
   17    HG3  LYS   2           HG3      LYS   2 -14.818   1.618 -10.191
   18    HD2  LYS   2           HD2      LYS   2 -15.158   3.956 -10.960
   19    HD3  LYS   2           HD3      LYS   2 -13.729   3.788 -11.983
   20    HE2  LYS   2           HE2      LYS   2 -14.795   1.981 -13.209
   21    HE3  LYS   2           HE3      LYS   2 -16.202   2.068 -12.149
   22    HZ1  LYS   2           HZ1      LYS   2 -16.563   3.218 -14.257
   23    HZ2  LYS   2           HZ2      LYS   2 -15.265   4.257 -13.925
   24    HZ3  LYS   2           HZ3      LYS   2 -16.648   4.289 -12.944
   25    H    ARG   3           H        ARG   3 -12.264   1.027  -6.023
   26    HA   ARG   3           HA       ARG   3 -11.981   3.513  -4.728
   27    HB2  ARG   3           HB2      ARG   3 -12.432   1.063  -3.828
   28    HB3  ARG   3           HB3      ARG   3 -10.687   1.070  -3.615
   29    HG2  ARG   3           HG2      ARG   3 -11.786   1.723  -1.573
   30    HG3  ARG   3           HG3      ARG   3 -10.873   3.083  -2.233
   31    HD2  ARG   3           HD2      ARG   3 -12.863   4.110  -3.068
   32    HD3  ARG   3           HD3      ARG   3 -13.824   2.677  -2.704
   33    HE   ARG   3           HE       ARG   3 -13.479   3.159  -0.337
   34   HH11  ARG   3          2HH1      ARG   3 -13.013   5.733  -2.663
   35   HH12  ARG   3          1HH1      ARG   3 -13.109   7.007  -1.488
   36   HH21  ARG   3          2HH2      ARG   3 -13.693   4.841   1.211
   37   HH22  ARG   3          1HH2      ARG   3 -13.540   6.495   0.714
   38    H    LYS   4           H        LYS   4 -10.306   4.829  -4.513
   39    HA   LYS   4           HA       LYS   4  -7.870   4.269  -5.960
   40    HB2  LYS   4           HB2      LYS   4  -8.434   6.705  -4.279
   41    HB3  LYS   4           HB3      LYS   4  -7.376   6.567  -5.676
   42    HG2  LYS   4           HG2      LYS   4 -10.365   6.277  -5.806
   43    HG3  LYS   4           HG3      LYS   4  -9.507   7.792  -6.081
   44    HD2  LYS   4           HD2      LYS   4  -8.412   6.915  -8.005
   45    HD3  LYS   4           HD3      LYS   4  -8.961   5.277  -7.647
   46    HE2  LYS   4           HE2      LYS   4 -10.211   6.460  -9.478
   47    HE3  LYS   4           HE3      LYS   4 -11.206   5.817  -8.174
   48    HZ1  LYS   4           HZ1      LYS   4 -11.439   7.988  -7.253
   49    HZ2  LYS   4           HZ2      LYS   4 -11.812   8.095  -8.905
   50    HZ3  LYS   4           HZ3      LYS   4 -10.314   8.647  -8.335
   51    H    ILE   5           H        ILE   5  -6.121   3.358  -5.052
   52    HA   ILE   5           HA       ILE   5  -5.652   3.763  -2.181
   53    HB   ILE   5           HB       ILE   5  -5.676   1.069  -3.550
   54   HG12  ILE   5          2HG1      ILE   5  -7.398   2.144  -1.306
   55   HG13  ILE   5          3HG1      ILE   5  -7.917   1.940  -2.976
   56   HG21  ILE   5          2HG2      ILE   5  -3.846   1.227  -1.946
   57   HG22  ILE   5          1HG2      ILE   5  -5.102   0.132  -1.368
   58   HG23  ILE   5          3HG2      ILE   5  -4.977   1.759  -0.700
   59   HD11  ILE   5          3HD1      ILE   5  -7.084  -0.255  -1.094
   60   HD12  ILE   5          2HD1      ILE   5  -7.574  -0.474  -2.774
   61   HD13  ILE   5          1HD1      ILE   5  -8.731   0.134  -1.590
   62    H    ILE   6           H        ILE   6  -3.566   4.142  -1.702
   63    HA   ILE   6           HA       ILE   6  -1.534   3.183  -3.602
   64    HB   ILE   6           HB       ILE   6   0.017   4.890  -2.768
   65   HG12  ILE   6          2HG1      ILE   6  -1.159   5.187  -0.523
   66   HG13  ILE   6          3HG1      ILE   6  -0.563   6.650  -1.293
   67   HG21  ILE   6          2HG2      ILE   6  -2.563   6.021  -3.826
   68   HG22  ILE   6          1HG2      ILE   6  -1.246   5.334  -4.777
   69   HG23  ILE   6          3HG2      ILE   6  -0.994   6.826  -3.870
   70   HD11  ILE   6          3HD1      ILE   6  -2.761   6.965  -0.294
   71   HD12  ILE   6          2HD1      ILE   6  -3.419   5.689  -1.319
   72   HD13  ILE   6          1HD1      ILE   6  -2.815   7.180  -2.043
   73    H    ALA   7           H        ALA   7   0.087   1.912  -2.816
   74    HA   ALA   7           HA       ALA   7   0.085   1.373   0.071
   75    HB1  ALA   7           HB1      ALA   7  -0.056  -0.764  -2.056
   76    HB2  ALA   7           HB2      ALA   7   0.098  -1.035  -0.319
   77    HB3  ALA   7           HB3      ALA   7  -1.367  -0.301  -0.971
   78    H    VAL   8           H        VAL   8   2.068   1.198   0.900
   79    HA   VAL   8           HA       VAL   8   4.306   1.050  -1.002
   80    HB   VAL   8           HB       VAL   8   4.315   2.157   1.811
   81   HG11  VAL   8          2HG1      VAL   8   6.474   1.239   1.160
   82   HG12  VAL   8          1HG1      VAL   8   6.543   3.000   1.231
   83   HG13  VAL   8          3HG1      VAL   8   6.442   2.184  -0.329
   84   HG21  VAL   8          3HG2      VAL   8   4.383   3.594  -0.842
   85   HG22  VAL   8          2HG2      VAL   8   4.522   4.347   0.747
   86   HG23  VAL   8          1HG2      VAL   8   3.020   3.552   0.276
   87    H    THR   9           H        THR   9   5.130  -0.889  -1.135
   88    HA   THR   9           HA       THR   9   5.320  -2.583   1.256
   89    HB   THR   9           HB       THR   9   5.983  -4.366  -0.427
   90    HG1  THR   9           HG1      THR   9   5.894  -2.220  -2.068
   91   HG21  THR   9          3HG2      THR   9   3.682  -4.742  -1.201
   92   HG22  THR   9          1HG2      THR   9   3.263  -3.091  -0.744
   93   HG23  THR   9          2HG2      THR   9   3.727  -4.258   0.495
   94    H    ALA  10           H        ALA  10   7.213  -2.596   2.296
   95    HA   ALA  10           HA       ALA  10   9.666  -2.151   0.757
   96    HB1  ALA  10           HB1      ALA  10   8.955  -0.584   3.231
   97    HB2  ALA  10           HB2      ALA  10  10.487  -0.509   2.360
   98    HB3  ALA  10           HB3      ALA  10   9.003   0.046   1.584
   99    H    CYS  11           H        CYS  11  11.193  -3.538   1.298
  100    HA   CYS  11           HA       CYS  11  11.585  -4.373   4.018
  101    HB2  CYS  11           HB2      CYS  11   9.786  -5.922   3.219
  102    HB3  CYS  11           HB3      CYS  11  10.879  -6.479   1.958
  103    HG   CYS  11           HG       CYS  11  12.121  -8.238   3.361
  104    H    ALA  12           H        ALA  12  13.699  -4.714   4.337
  105    HA   ALA  12           HA       ALA  12  15.470  -4.388   2.086
  106    HB1  ALA  12           HB1      ALA  12  16.122  -4.851   4.995
  107    HB2  ALA  12           HB2      ALA  12  17.245  -4.328   3.741
  108    HB3  ALA  12           HB3      ALA  12  15.917  -3.275   4.229
  109    H    THR  13           H        THR  13  14.508  -6.944   4.281
  110    HA   THR  13           HA       THR  13  16.441  -8.776   3.089
  111    HB   THR  13           HB       THR  13  15.633 -10.341   4.884
  112    HG1  THR  13           HG1      THR  13  14.613  -8.489   6.532
  113   HG21  THR  13          3HG2      THR  13  16.802  -9.155   6.701
  114   HG22  THR  13          1HG2      THR  13  16.725  -7.664   5.762
  115   HG23  THR  13          2HG2      THR  13  17.668  -9.032   5.169
  116    H    GLY  14           H        GLY  14  15.875 -10.172   1.556
  117    HA2  GLY  14           HA1      GLY  14  14.585 -11.630   0.319
  118    HA3  GLY  14           HA2      GLY  14  13.300 -11.432   1.503
  119    H    VAL  15           H        VAL  15  14.902  -9.801  -1.190
  120    HA   VAL  15           HA       VAL  15  13.051  -7.769  -1.635
  121    HB   VAL  15           HB       VAL  15  14.686  -9.202  -3.744
  122   HG11  VAL  15          2HG1      VAL  15  14.557  -7.081  -4.967
  123   HG12  VAL  15          1HG1      VAL  15  13.502  -6.426  -3.715
  124   HG13  VAL  15          3HG1      VAL  15  12.959  -7.779  -4.706
  125   HG21  VAL  15          3HG2      VAL  15  16.097  -8.442  -1.913
  126   HG22  VAL  15          2HG2      VAL  15  15.400  -6.826  -2.025
  127   HG23  VAL  15          1HG2      VAL  15  16.370  -7.462  -3.354
  128    H    ALA  16           H        ALA  16  13.017 -11.134  -2.665
  129    HA   ALA  16           HA       ALA  16  10.876 -10.930  -4.501
  130    HB1  ALA  16           HB1      ALA  16  12.383 -12.849  -4.470
  131    HB2  ALA  16           HB2      ALA  16  11.763 -13.319  -2.886
  132    HB3  ALA  16           HB3      ALA  16  10.703 -13.357  -4.295
  133    H    HIS  17           H        HIS  17  11.019 -11.175  -1.030
  134    HA   HIS  17           HA       HIS  17   8.248 -11.844  -0.670
  135    HB2  HIS  17           HB2      HIS  17  10.308 -10.708   1.238
  136    HB3  HIS  17           HB3      HIS  17   8.662 -11.104   1.712
  137    HD1  HIS  17           HD1      HIS  17  10.106 -12.708   3.416
  138    HD2  HIS  17           HD2      HIS  17   9.970 -13.805  -0.600
  139    HE1  HIS  17           HE1      HIS  17  10.788 -15.125   3.343
  140    HE2  HIS  17           HE2      HIS  17  10.766 -15.755   0.902
  141    H    THR  18           H        THR  18  10.189  -8.905  -0.616
  142    HA   THR  18           HA       THR  18   8.240  -7.032   0.024
  143    HB   THR  18           HB       THR  18  10.419  -6.554  -2.010
  144    HG1  THR  18           HG1      THR  18  11.715  -6.094  -0.067
  145   HG21  THR  18          3HG2      THR  18   9.160  -4.814   0.115
  146   HG22  THR  18          1HG2      THR  18   8.905  -4.685  -1.626
  147   HG23  THR  18          2HG2      THR  18  10.490  -4.331  -0.938
  148    H    TYR  19           H        TYR  19   9.267  -8.211  -3.171
  149    HA   TYR  19           HA       TYR  19   7.348  -6.701  -4.610
  150    HB2  TYR  19           HB2      TYR  19   9.410  -7.528  -5.661
  151    HB3  TYR  19           HB3      TYR  19   8.850  -9.186  -5.463
  152    HD1  TYR  19           HD2      TYR  19   8.042  -5.970  -7.137
  153    HD2  TYR  19           HD1      TYR  19   7.487 -10.189  -7.095
  154    HE1  TYR  19           HE2      TYR  19   6.899  -5.836  -9.308
  155    HE2  TYR  19           HE1      TYR  19   6.340 -10.065  -9.267
  156    HH   TYR  19           HH       TYR  19   6.405  -7.286 -11.221
  157    H    MET  20           H        MET  20   7.299  -9.895  -3.159
  158    HA   MET  20           HA       MET  20   5.031 -10.881  -4.495
  159    HB2  MET  20           HB2      MET  20   6.548 -12.285  -3.127
  160    HB3  MET  20           HB3      MET  20   5.894 -11.528  -1.679
  161    HG2  MET  20           HG2      MET  20   3.675 -12.378  -2.213
  162    HG3  MET  20           HG3      MET  20   4.315 -13.120  -3.684
  163    HE1  MET  20           HE1      MET  20   3.527 -15.523  -3.189
  164    HE2  MET  20           HE2      MET  20   3.725 -16.340  -1.638
  165    HE3  MET  20           HE3      MET  20   2.685 -14.920  -1.760
  166    H    ALA  21           H        ALA  21   5.352  -9.126  -1.423
  167    HA   ALA  21           HA       ALA  21   2.622  -9.021  -0.793
  168    HB1  ALA  21           HB1      ALA  21   3.219  -7.092   0.613
  169    HB2  ALA  21           HB2      ALA  21   4.348  -8.433   0.816
  170    HB3  ALA  21           HB3      ALA  21   4.804  -7.037  -0.157
  171    H    ALA  22           H        ALA  22   4.658  -7.012  -2.821
  172    HA   ALA  22           HA       ALA  22   2.823  -4.941  -3.304
  173    HB1  ALA  22           HB1      ALA  22   4.263  -4.343  -5.177
  174    HB2  ALA  22           HB2      ALA  22   5.216  -4.730  -3.744
  175    HB3  ALA  22           HB3      ALA  22   5.080  -5.901  -5.056
  176    H    GLN  23           H        GLN  23   3.587  -7.860  -5.208
  177    HA   GLN  23           HA       GLN  23   1.633  -7.236  -7.196
  178    HB2  GLN  23           HB2      GLN  23   2.119  -9.420  -8.143
  179    HB3  GLN  23           HB3      GLN  23   3.607  -8.581  -7.737
  180    HG2  GLN  23           HG2      GLN  23   3.904  -9.937  -5.783
  181    HG3  GLN  23           HG3      GLN  23   2.336 -10.704  -6.028
  182   HE21  GLN  23          1HE2      GLN  23   4.999 -11.877  -5.871
  183   HE22  GLN  23          2HE2      GLN  23   5.233 -12.753  -7.344
  184    H    ALA  24           H        ALA  24   1.607  -9.079  -4.226
  185    HA   ALA  24           HA       ALA  24  -0.852 -10.425  -4.681
  186    HB1  ALA  24           HB1      ALA  24   0.442  -9.629  -2.068
  187    HB2  ALA  24           HB2      ALA  24  -0.892 -10.769  -2.250
  188    HB3  ALA  24           HB3      ALA  24   0.690 -11.148  -2.931
  189    H    LEU  25           H        LEU  25  -0.025  -7.414  -2.997
  190    HA   LEU  25           HA       LEU  25  -2.664  -6.608  -2.429
  191    HB2  LEU  25           HB2      LEU  25  -0.143  -5.034  -2.885
  192    HB3  LEU  25           HB3      LEU  25  -1.663  -4.256  -2.490
  193    HG   LEU  25           HG       LEU  25  -0.272  -6.298  -0.759
  194   HD11  LEU  25          2HD1      LEU  25   0.987  -4.219  -0.861
  195   HD12  LEU  25          1HD1      LEU  25   0.214  -4.401   0.714
  196   HD13  LEU  25          3HD1      LEU  25  -0.471  -3.302  -0.482
  197   HD21  LEU  25          3HD2      LEU  25  -1.907  -5.634   0.930
  198   HD22  LEU  25          2HD2      LEU  25  -2.696  -6.309  -0.496
  199   HD23  LEU  25          1HD2      LEU  25  -2.682  -4.564  -0.239
  200    H    LYS  26           H        LYS  26  -0.627  -5.954  -5.258
  201    HA   LYS  26           HA       LYS  26  -2.410  -4.360  -6.710
  202    HB2  LYS  26           HB2      LYS  26  -0.023  -4.747  -7.291
  203    HB3  LYS  26           HB3      LYS  26  -0.428  -6.384  -7.783
  204    HG2  LYS  26           HG2      LYS  26  -2.019  -5.327  -9.456
  205    HG3  LYS  26           HG3      LYS  26  -1.218  -3.799  -9.086
  206    HD2  LYS  26           HD2      LYS  26   0.180  -6.293 -10.051
  207    HD3  LYS  26           HD3      LYS  26  -0.280  -4.935 -11.077
  208    HE2  LYS  26           HE2      LYS  26   1.478  -4.586  -8.666
  209    HE3  LYS  26           HE3      LYS  26   2.135  -5.026 -10.242
  210    HZ1  LYS  26           HZ1      LYS  26   2.238  -2.657  -9.925
  211    HZ2  LYS  26           HZ2      LYS  26   0.574  -2.570  -9.620
  212    HZ3  LYS  26           HZ3      LYS  26   1.133  -3.006 -11.159
  213    H    LYS  27           H        LYS  27  -2.101  -7.841  -6.430
  214    HA   LYS  27           HA       LYS  27  -4.023  -8.603  -8.341
  215    HB2  LYS  27           HB2      LYS  27  -2.282 -10.073  -7.440
  216    HB3  LYS  27           HB3      LYS  27  -3.013  -9.979  -5.849
  217    HG2  LYS  27           HG2      LYS  27  -4.983 -11.142  -6.672
  218    HG3  LYS  27           HG3      LYS  27  -4.265 -11.220  -8.286
  219    HD2  LYS  27           HD2      LYS  27  -3.895 -13.319  -7.130
  220    HD3  LYS  27           HD3      LYS  27  -2.365 -12.466  -7.351
  221    HE2  LYS  27           HE2      LYS  27  -2.391 -13.354  -5.135
  222    HE3  LYS  27           HE3      LYS  27  -2.575 -11.606  -5.026
  223    HZ1  LYS  27           HZ1      LYS  27  -5.024 -12.021  -4.841
  224    HZ2  LYS  27           HZ2      LYS  27  -4.106 -12.577  -3.528
  225    HZ3  LYS  27           HZ3      LYS  27  -4.672 -13.674  -4.686
  226    H    GLY  28           H        GLY  28  -4.211  -8.305  -4.795
  227    HA2  GLY  28           HA1      GLY  28  -6.868  -9.111  -4.495
  228    HA3  GLY  28           HA2      GLY  28  -5.987  -8.100  -3.363
  229    H    ALA  29           H        ALA  29  -5.589  -5.795  -4.746
  230    HA   ALA  29           HA       ALA  29  -8.096  -4.527  -4.555
  231    HB1  ALA  29           HB1      ALA  29  -6.986  -2.544  -5.392
  232    HB2  ALA  29           HB2      ALA  29  -5.964  -3.367  -4.213
  233    HB3  ALA  29           HB3      ALA  29  -5.618  -3.515  -5.936
  234    H    LYS  30           H        LYS  30  -6.356  -5.872  -7.284
  235    HA   LYS  30           HA       LYS  30  -8.025  -4.773  -9.303
  236    HB2  LYS  30           HB2      LYS  30  -5.791  -5.646  -9.804
  237    HB3  LYS  30           HB3      LYS  30  -6.304  -7.260  -9.334
  238    HG2  LYS  30           HG2      LYS  30  -7.898  -7.298 -11.182
  239    HG3  LYS  30           HG3      LYS  30  -7.391  -5.677 -11.652
  240    HD2  LYS  30           HD2      LYS  30  -5.463  -7.978 -11.476
  241    HD3  LYS  30           HD3      LYS  30  -6.379  -7.627 -12.941
  242    HE2  LYS  30           HE2      LYS  30  -4.286  -6.576 -13.222
  243    HE3  LYS  30           HE3      LYS  30  -5.421  -5.289 -12.824
  244    HZ1  LYS  30           HZ1      LYS  30  -3.326  -5.062 -11.637
  245    HZ2  LYS  30           HZ2      LYS  30  -3.541  -6.582 -10.915
  246    HZ3  LYS  30           HZ3      LYS  30  -4.607  -5.311 -10.555
  247    H    LYS  31           H        LYS  31  -8.074  -7.737  -7.411
  248    HA   LYS  31           HA       LYS  31 -10.176  -9.060  -8.707
  249    HB2  LYS  31           HB2      LYS  31  -8.731 -10.115  -7.009
  250    HB3  LYS  31           HB3      LYS  31  -9.443  -9.089  -5.770
  251    HG2  LYS  31           HG2      LYS  31 -10.440 -11.257  -5.634
  252    HG3  LYS  31           HG3      LYS  31 -11.645 -10.124  -6.249
  253    HD2  LYS  31           HD2      LYS  31 -11.823 -12.095  -7.560
  254    HD3  LYS  31           HD3      LYS  31 -11.023 -10.884  -8.564
  255    HE2  LYS  31           HE2      LYS  31  -9.869 -12.954  -8.852
  256    HE3  LYS  31           HE3      LYS  31  -8.837 -11.887  -7.902
  257    HZ1  LYS  31           HZ1      LYS  31 -10.576 -14.007  -6.765
  258    HZ2  LYS  31           HZ2      LYS  31  -9.475 -13.045  -5.906
  259    HZ3  LYS  31           HZ3      LYS  31  -8.914 -14.173  -7.045
  260    H    MET  32           H        MET  32 -10.166  -6.656  -6.127
  261    HA   MET  32           HA       MET  32 -12.997  -6.723  -5.717
  262    HB2  MET  32           HB2      MET  32 -10.922  -4.685  -4.895
  263    HB3  MET  32           HB3      MET  32 -12.593  -4.692  -4.348
  264    HG2  MET  32           HG2      MET  32 -12.268  -6.793  -3.225
  265    HG3  MET  32           HG3      MET  32 -10.632  -6.923  -3.872
  266    HE1  MET  32           HE1      MET  32 -12.352  -3.625  -2.551
  267    HE2  MET  32           HE2      MET  32 -13.022  -4.886  -1.513
  268    HE3  MET  32           HE3      MET  32 -11.920  -3.684  -0.841
  269    H    GLY  33           H        GLY  33 -10.879  -5.049  -7.875
  270    HA2  GLY  33           HA1      GLY  33 -11.573  -3.957  -9.835
  271    HA3  GLY  33           HA2      GLY  33 -13.183  -3.782  -9.149
  272    H    ASN  34           H        ASN  34  -9.867  -2.789  -8.349
  273    HA   ASN  34           HA       ASN  34 -10.900  -0.101  -7.733
  274    HB2  ASN  34           HB2      ASN  34  -8.923  -1.746  -6.137
  275    HB3  ASN  34           HB3      ASN  34  -9.288  -0.053  -5.829
  276   HD21  ASN  34          1HD2      ASN  34  -9.717  -2.768  -4.455
  277   HD22  ASN  34          2HD2      ASN  34 -11.342  -2.651  -3.876
  278    H    LEU  35           H        LEU  35  -8.904   1.401  -7.330
  279    HA   LEU  35           HA       LEU  35  -6.925   0.918  -9.463
  280    HB2  LEU  35           HB2      LEU  35  -8.169   3.474  -8.460
  281    HB3  LEU  35           HB3      LEU  35  -6.649   3.482  -9.328
  282    HG   LEU  35           HG       LEU  35  -7.856   2.352 -11.238
  283   HD11  LEU  35          2HD1      LEU  35  -9.781   1.526  -9.972
  284   HD12  LEU  35          1HD1      LEU  35 -10.273   2.542 -11.326
  285   HD13  LEU  35          3HD1      LEU  35 -10.298   3.188  -9.685
  286   HD21  LEU  35          3HD2      LEU  35  -8.794   5.092 -10.403
  287   HD22  LEU  35          2HD2      LEU  35  -8.824   4.440 -12.041
  288   HD23  LEU  35          1HD2      LEU  35  -7.282   4.722 -11.234
  289    H    ILE  36           H        ILE  36  -5.052   0.282  -8.552
  290    HA   ILE  36           HA       ILE  36  -4.318   1.511  -5.987
  291    HB   ILE  36           HB       ILE  36  -5.179  -0.772  -5.617
  292   HG12  ILE  36          2HG1      ILE  36  -2.204  -0.487  -5.147
  293   HG13  ILE  36          3HG1      ILE  36  -3.465   0.211  -4.139
  294   HG21  ILE  36          2HG2      ILE  36  -4.545  -1.768  -7.757
  295   HG22  ILE  36          1HG2      ILE  36  -3.923  -2.712  -6.405
  296   HG23  ILE  36          3HG2      ILE  36  -2.842  -1.654  -7.312
  297   HD11  ILE  36          3HD1      ILE  36  -4.245  -2.032  -3.568
  298   HD12  ILE  36          2HD1      ILE  36  -2.551  -1.795  -3.136
  299   HD13  ILE  36          1HD1      ILE  36  -2.973  -2.725  -4.574
  300    H    LYS  37           H        LYS  37  -2.329   2.255  -5.836
  301    HA   LYS  37           HA       LYS  37  -0.359   1.407  -7.855
  302    HB2  LYS  37           HB2      LYS  37  -0.810   4.071  -6.561
  303    HB3  LYS  37           HB3      LYS  37   0.761   3.640  -7.227
  304    HG2  LYS  37           HG2      LYS  37  -0.861   2.973  -9.287
  305    HG3  LYS  37           HG3      LYS  37  -1.733   4.345  -8.591
  306    HD2  LYS  37           HD2      LYS  37   0.239   5.719  -8.737
  307    HD3  LYS  37           HD3      LYS  37   1.189   4.337  -9.285
  308    HE2  LYS  37           HE2      LYS  37  -0.033   4.236 -11.344
  309    HE3  LYS  37           HE3      LYS  37  -1.170   5.464 -10.783
  310    HZ1  LYS  37           HZ1      LYS  37   0.515   7.109 -10.838
  311    HZ2  LYS  37           HZ2      LYS  37   0.591   6.290 -12.327
  312    HZ3  LYS  37           HZ3      LYS  37   1.735   5.964 -11.116
  313    H    VAL  38           H        VAL  38   0.816  -0.104  -6.917
  314    HA   VAL  38           HA       VAL  38   1.519   0.152  -4.094
  315    HB   VAL  38           HB       VAL  38   2.182  -2.148  -5.927
  316   HG11  VAL  38          2HG1      VAL  38   2.342  -3.399  -3.822
  317   HG12  VAL  38          1HG1      VAL  38   2.025  -1.915  -2.925
  318   HG13  VAL  38          3HG1      VAL  38   3.494  -2.067  -3.892
  319   HG21  VAL  38          3HG2      VAL  38   0.212  -3.282  -5.015
  320   HG22  VAL  38          2HG2      VAL  38  -0.232  -1.834  -5.918
  321   HG23  VAL  38          1HG2      VAL  38  -0.235  -1.809  -4.154
  322    H    GLU  39           H        GLU  39   3.397   0.887  -3.457
  323    HA   GLU  39           HA       GLU  39   5.575   1.232  -5.386
  324    HB2  GLU  39           HB2      GLU  39   4.965   3.209  -4.107
  325    HB3  GLU  39           HB3      GLU  39   5.121   2.327  -2.596
  326    HG2  GLU  39           HG2      GLU  39   7.490   2.159  -2.863
  327    HG3  GLU  39           HG3      GLU  39   7.398   2.837  -4.489
  328    H    THR  40           H        THR  40   7.393   0.031  -5.296
  329    HA   THR  40           HA       THR  40   7.677  -1.827  -3.039
  330    HB   THR  40           HB       THR  40   9.009  -2.051  -5.740
  331    HG1  THR  40           HG1      THR  40   6.527  -3.083  -4.808
  332   HG21  THR  40          3HG2      THR  40  10.072  -3.309  -3.923
  333   HG22  THR  40          1HG2      THR  40   9.320  -4.392  -5.095
  334   HG23  THR  40          2HG2      THR  40   8.528  -4.077  -3.551
  335    H    GLN  41           H        GLN  41   8.936  -0.817  -1.569
  336    HA   GLN  41           HA       GLN  41  11.324   0.599  -2.541
  337    HB2  GLN  41           HB2      GLN  41   9.603   1.767  -1.067
  338    HB3  GLN  41           HB3      GLN  41  10.140   0.713   0.232
  339    HG2  GLN  41           HG2      GLN  41  12.205   1.724   0.384
  340    HG3  GLN  41           HG3      GLN  41  12.121   2.377  -1.251
  341   HE21  GLN  41          1HE2      GLN  41   9.346   3.299  -0.827
  342   HE22  GLN  41          2HE2      GLN  41   9.476   4.714   0.145
  343    H    GLY  42           H        GLY  42  13.097  -0.608  -2.540
  344    HA2  GLY  42           HA1      GLY  42  13.202  -2.895  -0.693
  345    HA3  GLY  42           HA2      GLY  42  14.082  -2.769  -2.208
  346    H    ALA  43           H        ALA  43  16.135  -2.179  -2.128
  347    HA   ALA  43           HA       ALA  43  17.236  -1.594   0.508
  348    HB1  ALA  43           HB1      ALA  43  18.642  -2.309  -2.063
  349    HB2  ALA  43           HB2      ALA  43  19.401  -2.138  -0.481
  350    HB3  ALA  43           HB3      ALA  43  18.227  -3.424  -0.762
  351    H    THR  44           H        THR  44  16.493   0.562   0.608
  352    HA   THR  44           HA       THR  44  16.511   2.807   0.352
  353    HB   THR  44           HB       THR  44  18.749   3.871  -0.062
  354    HG1  THR  44           HG1      THR  44  19.352   1.507  -1.063
  355   HG21  THR  44          3HG2      THR  44  17.990   3.376   2.182
  356   HG22  THR  44          1HG2      THR  44  19.721   3.070   2.053
  357   HG23  THR  44          2HG2      THR  44  18.584   1.721   2.045
  358    H    GLY  45           H        GLY  45  15.937   1.120  -2.024
  359    HA2  GLY  45           HA1      GLY  45  16.067   3.291  -3.992
  360    HA3  GLY  45           HA2      GLY  45  16.576   1.671  -4.467
  361    H    ILE  46           H        ILE  46  14.349   3.213  -5.542
  362    HA   ILE  46           HA       ILE  46  12.070   1.709  -4.443
  363    HB   ILE  46           HB       ILE  46  11.523   4.017  -6.217
  364   HG12  ILE  46          2HG1      ILE  46  13.368   4.864  -4.754
  365   HG13  ILE  46          3HG1      ILE  46  11.840   5.700  -4.522
  366   HG21  ILE  46          2HG2      ILE  46   9.719   4.355  -4.555
  367   HG22  ILE  46          1HG2      ILE  46  10.345   2.977  -3.647
  368   HG23  ILE  46          3HG2      ILE  46   9.718   2.748  -5.280
  369   HD11  ILE  46          3HD1      ILE  46  12.932   5.318  -2.408
  370   HD12  ILE  46          2HD1      ILE  46  13.005   3.587  -2.729
  371   HD13  ILE  46          1HD1      ILE  46  11.444   4.374  -2.497
  372    H    GLU  47           H        GLU  47  11.042   0.299  -5.712
  373    HA   GLU  47           HA       GLU  47  11.906  -0.108  -8.437
  374    HB2  GLU  47           HB2      GLU  47  11.352  -1.990  -6.922
  375    HB3  GLU  47           HB3      GLU  47   9.688  -1.428  -6.855
  376    HG2  GLU  47           HG2      GLU  47   9.757  -3.236  -8.380
  377    HG3  GLU  47           HG3      GLU  47   9.569  -1.764  -9.331
  378    H    ASN  48           H        ASN  48   8.905   0.801  -6.796
  379    HA   ASN  48           HA       ASN  48   8.013   2.143  -9.257
  380    HB2  ASN  48           HB2      ASN  48   6.771  -0.015  -8.877
  381    HB3  ASN  48           HB3      ASN  48   6.202   0.640  -7.350
  382   HD21  ASN  48          1HD2      ASN  48   4.675   2.280  -7.349
  383   HD22  ASN  48          2HD2      ASN  48   3.740   2.669  -8.754
  384    H    GLU  49           H        GLU  49   8.918   4.042  -8.214
  385    HA   GLU  49           HA       GLU  49   7.931   4.850  -5.669
  386    HB2  GLU  49           HB2      GLU  49   9.100   7.001  -6.157
  387    HB3  GLU  49           HB3      GLU  49  10.117   5.570  -6.213
  388    HG2  GLU  49           HG2      GLU  49   9.907   5.570  -8.661
  389    HG3  GLU  49           HG3      GLU  49   8.997   7.076  -8.552
  390    H    LEU  50           H        LEU  50   6.171   5.877  -5.165
  391    HA   LEU  50           HA       LEU  50   4.282   6.577  -7.213
  392    HB2  LEU  50           HB2      LEU  50   4.149   7.086  -4.238
  393    HB3  LEU  50           HB3      LEU  50   2.806   7.149  -5.364
  394    HG   LEU  50           HG       LEU  50   4.367   4.672  -4.621
  395   HD11  LEU  50          2HD1      LEU  50   1.570   5.551  -3.924
  396   HD12  LEU  50          1HD1      LEU  50   2.937   5.436  -2.816
  397   HD13  LEU  50          3HD1      LEU  50   2.272   3.977  -3.550
  398   HD21  LEU  50          3HD2      LEU  50   1.956   5.000  -6.405
  399   HD22  LEU  50          2HD2      LEU  50   2.687   3.470  -5.924
  400   HD23  LEU  50          1HD2      LEU  50   3.590   4.600  -6.933
  401    H    THR  51           H        THR  51   3.416   8.639  -7.637
  402    HA   THR  51           HA       THR  51   5.238  10.826  -6.905
  403    HB   THR  51           HB       THR  51   4.363  12.030  -8.874
  404    HG1  THR  51           HG1      THR  51   2.796   9.673  -9.139
  405   HG21  THR  51          3HG2      THR  51   5.433   9.276  -9.474
  406   HG22  THR  51          1HG2      THR  51   6.388  10.708  -9.097
  407   HG23  THR  51          2HG2      THR  51   5.446  10.644 -10.587
  408    H    GLU  52           H        GLU  52   3.965  13.037  -7.016
  409    HA   GLU  52           HA       GLU  52   2.428  13.063  -4.683
  410    HB2  GLU  52           HB2      GLU  52   3.769  14.952  -5.859
  411    HB3  GLU  52           HB3      GLU  52   2.269  15.253  -6.727
  412    HG2  GLU  52           HG2      GLU  52   2.302  16.731  -4.893
  413    HG3  GLU  52           HG3      GLU  52   1.142  15.462  -4.496
  414    H    LYS  53           H        LYS  53   1.469  13.229  -8.081
  415    HA   LYS  53           HA       LYS  53  -1.245  13.776  -7.706
  416    HB2  LYS  53           HB2      LYS  53  -1.574  12.938  -9.977
  417    HB3  LYS  53           HB3      LYS  53  -0.138  13.946  -9.885
  418    HG2  LYS  53           HG2      LYS  53   1.252  11.918  -9.789
  419    HG3  LYS  53           HG3      LYS  53  -0.204  10.937  -9.953
  420    HD2  LYS  53           HD2      LYS  53   0.756  12.967 -11.971
  421    HD3  LYS  53           HD3      LYS  53   1.025  11.229 -12.081
  422    HE2  LYS  53           HE2      LYS  53  -0.827  11.483 -13.416
  423    HE3  LYS  53           HE3      LYS  53  -1.571  11.097 -11.867
  424    HZ1  LYS  53           HZ1      LYS  53  -1.181  13.854 -12.900
  425    HZ2  LYS  53           HZ2      LYS  53  -2.047  13.407 -11.512
  426    HZ3  LYS  53           HZ3      LYS  53  -2.621  12.975 -13.047
  427    H    ASP  54           H        ASP  54   0.479  10.696  -7.691
  428    HA   ASP  54           HA       ASP  54  -1.832   9.041  -7.744
  429    HB2  ASP  54           HB2      ASP  54   0.848   8.329  -6.537
  430    HB3  ASP  54           HB3      ASP  54  -0.370   7.222  -7.157
  431    H    VAL  55           H        VAL  55   0.193  10.356  -5.250
  432    HA   VAL  55           HA       VAL  55  -0.871   9.004  -3.041
  433    HB   VAL  55           HB       VAL  55   0.529  11.661  -3.287
  434   HG11  VAL  55          2HG1      VAL  55  -0.124  10.079  -0.811
  435   HG12  VAL  55          1HG1      VAL  55  -0.735  11.679  -1.239
  436   HG13  VAL  55          3HG1      VAL  55   0.977  11.456  -0.872
  437   HG21  VAL  55          3HG2      VAL  55   1.818   9.720  -4.003
  438   HG22  VAL  55          2HG2      VAL  55   1.498   8.930  -2.459
  439   HG23  VAL  55          1HG2      VAL  55   2.471  10.400  -2.513
  440    H    ASN  56           H        ASN  56  -1.699  12.113  -4.502
  441    HA   ASN  56           HA       ASN  56  -3.579  12.761  -2.426
  442    HB2  ASN  56           HB2      ASN  56  -2.833  14.082  -5.030
  443    HB3  ASN  56           HB3      ASN  56  -4.094  14.715  -3.972
  444   HD21  ASN  56          1HD2      ASN  56  -1.344  15.663  -4.794
  445   HD22  ASN  56          2HD2      ASN  56  -0.573  16.055  -3.300
  446    H    ILE  57           H        ILE  57  -3.712  10.897  -5.244
  447    HA   ILE  57           HA       ILE  57  -6.594  11.149  -5.534
  448    HB   ILE  57           HB       ILE  57  -4.563   9.402  -6.929
  449   HG12  ILE  57          2HG1      ILE  57  -6.366  11.613  -7.935
  450   HG13  ILE  57          3HG1      ILE  57  -4.652  11.788  -7.577
  451   HG21  ILE  57          2HG2      ILE  57  -6.614   8.117  -6.683
  452   HG22  ILE  57          1HG2      ILE  57  -6.381   8.605  -8.361
  453   HG23  ILE  57          3HG2      ILE  57  -7.548   9.456  -7.351
  454   HD11  ILE  57          3HD1      ILE  57  -5.830   9.997  -9.688
  455   HD12  ILE  57          2HD1      ILE  57  -4.112  10.207  -9.344
  456   HD13  ILE  57          1HD1      ILE  57  -5.060  11.560  -9.965
  457    H    GLY  58           H        GLY  58  -4.214   8.798  -4.371
  458    HA2  GLY  58           HA1      GLY  58  -5.957   6.708  -3.725
  459    HA3  GLY  58           HA2      GLY  58  -4.409   7.009  -2.953
  460    H    GLU  59           H        GLU  59  -7.361   6.337  -2.191
  461    HA   GLU  59           HA       GLU  59  -8.112   8.393  -0.341
  462    HB2  GLU  59           HB2      GLU  59  -9.077   5.537  -0.631
  463    HB3  GLU  59           HB3      GLU  59  -9.843   6.769   0.359
  464    HG2  GLU  59           HG2      GLU  59  -9.480   7.114  -2.597
  465    HG3  GLU  59           HG3      GLU  59 -10.866   6.267  -1.912
  466    H    VAL  60           H        VAL  60  -6.963   5.043   0.023
  467    HA   VAL  60           HA       VAL  60  -6.008   5.755   2.717
  468    HB   VAL  60           HB       VAL  60  -6.250   3.338   3.295
  469   HG11  VAL  60          2HG1      VAL  60  -7.948   4.976   3.948
  470   HG12  VAL  60          1HG1      VAL  60  -8.665   3.400   3.614
  471   HG13  VAL  60          3HG1      VAL  60  -8.799   4.699   2.429
  472   HG21  VAL  60          3HG2      VAL  60  -7.727   3.209   0.667
  473   HG22  VAL  60          2HG2      VAL  60  -7.685   1.930   1.883
  474   HG23  VAL  60          1HG2      VAL  60  -6.205   2.405   1.048
  475    H    VAL  61           H        VAL  61  -4.047   4.813   3.409
  476    HA   VAL  61           HA       VAL  61  -2.309   3.903   1.203
  477    HB   VAL  61           HB       VAL  61  -1.332   5.257   3.707
  478   HG11  VAL  61          2HG1      VAL  61   0.316   3.975   2.488
  479   HG12  VAL  61          1HG1      VAL  61   0.655   5.700   2.332
  480   HG13  VAL  61          3HG1      VAL  61  -0.092   4.823   0.997
  481   HG21  VAL  61          3HG2      VAL  61  -2.846   6.813   2.606
  482   HG22  VAL  61          2HG2      VAL  61  -1.988   6.583   1.081
  483   HG23  VAL  61          1HG2      VAL  61  -1.172   7.346   2.446
  484    H    ILE  62           H        ILE  62  -1.643   1.859   1.420
  485    HA   ILE  62           HA       ILE  62  -1.697   0.672   4.107
  486    HB   ILE  62           HB       ILE  62  -1.686  -0.607   1.365
  487   HG12  ILE  62          2HG1      ILE  62  -3.747  -1.750   2.379
  488   HG13  ILE  62          3HG1      ILE  62  -3.646  -0.548   3.658
  489   HG21  ILE  62          2HG2      ILE  62  -1.379  -1.985   4.030
  490   HG22  ILE  62          1HG2      ILE  62  -0.169  -1.889   2.752
  491   HG23  ILE  62          3HG2      ILE  62  -1.660  -2.794   2.488
  492   HD11  ILE  62          3HD1      ILE  62  -3.914   1.225   2.004
  493   HD12  ILE  62          2HD1      ILE  62  -5.265   0.092   1.977
  494   HD13  ILE  62          1HD1      ILE  62  -4.023   0.013   0.727
  495    H    PHE  63           H        PHE  63   0.128   0.095   5.117
  496    HA   PHE  63           HA       PHE  63   2.630   0.261   3.577
  497    HB2  PHE  63           HB2      PHE  63   2.072   0.959   6.454
  498    HB3  PHE  63           HB3      PHE  63   3.704   0.697   5.845
  499    HD1  PHE  63           HD1      PHE  63   4.563   2.162   4.017
  500    HD2  PHE  63           HD2      PHE  63   0.977   3.005   6.145
  501    HE1  PHE  63           HE1      PHE  63   4.679   4.504   3.276
  502    HE2  PHE  63           HE2      PHE  63   1.087   5.347   5.407
  503    HZ   PHE  63           HZ       PHE  63   2.939   6.095   3.967
  504    H    ALA  64           H        ALA  64   3.435  -1.645   3.188
  505    HA   ALA  64           HA       ALA  64   3.459  -3.624   5.378
  506    HB1  ALA  64           HB1      ALA  64   3.693  -4.065   2.392
  507    HB2  ALA  64           HB2      ALA  64   3.871  -5.319   3.615
  508    HB3  ALA  64           HB3      ALA  64   2.323  -4.504   3.412
  509    H    VAL  65           H        VAL  65   5.323  -2.883   6.413
  510    HA   VAL  65           HA       VAL  65   7.701  -2.649   4.715
  511    HB   VAL  65           HB       VAL  65   8.395  -0.609   5.953
  512   HG11  VAL  65          2HG1      VAL  65   5.824  -0.428   4.380
  513   HG12  VAL  65          1HG1      VAL  65   7.458  -0.450   3.716
  514   HG13  VAL  65          3HG1      VAL  65   6.922   0.915   4.697
  515   HG21  VAL  65          3HG2      VAL  65   6.991  -0.844   7.927
  516   HG22  VAL  65          2HG2      VAL  65   5.541  -0.653   6.942
  517   HG23  VAL  65          1HG2      VAL  65   6.667   0.692   7.124
  518    H    ASP  66           H        ASP  66   9.474  -3.414   5.439
  519    HA   ASP  66           HA       ASP  66   9.741  -4.296   8.226
  520    HB2  ASP  66           HB2      ASP  66  10.290  -6.085   6.825
  521    HB3  ASP  66           HB3      ASP  66  11.031  -5.045   5.619
  522    H    THR  67           H        THR  67  10.762  -1.966   5.954
  523    HA   THR  67           HA       THR  67  12.806  -0.967   7.812
  524    HB   THR  67           HB       THR  67  13.854  -1.988   5.807
  525    HG1  THR  67           HG1      THR  67  15.293  -0.371   5.567
  526   HG21  THR  67          3HG2      THR  67  12.108  -1.596   4.169
  527   HG22  THR  67          1HG2      THR  67  13.621  -0.875   3.621
  528   HG23  THR  67          2HG2      THR  67  12.350   0.146   4.292
  529    H    LYS  68           H        LYS  68  13.372   1.408   6.598
  530    HA   LYS  68           HA       LYS  68  10.976   2.941   7.191
  531    HB2  LYS  68           HB2      LYS  68  13.139   3.593   8.159
  532    HB3  LYS  68           HB3      LYS  68  13.807   3.792   6.548
  533    HG2  LYS  68           HG2      LYS  68  11.940   5.536   6.223
  534    HG3  LYS  68           HG3      LYS  68  11.816   5.498   7.983
  535    HD2  LYS  68           HD2      LYS  68  13.314   7.274   7.352
  536    HD3  LYS  68           HD3      LYS  68  14.251   5.985   8.112
  537    HE2  LYS  68           HE2      LYS  68  14.780   5.131   5.821
  538    HE3  LYS  68           HE3      LYS  68  13.999   6.568   5.164
  539    HZ1  LYS  68           HZ1      LYS  68  16.311   6.988   5.244
  540    HZ2  LYS  68           HZ2      LYS  68  16.437   6.448   6.849
  541    HZ3  LYS  68           HZ3      LYS  68  15.622   7.894   6.505
  542    H    VAL  69           H        VAL  69  10.006   4.420   5.741
  543    HA   VAL  69           HA       VAL  69  10.874   4.176   2.935
  544    HB   VAL  69           HB       VAL  69   8.588   4.478   2.186
  545   HG11  VAL  69          2HG1      VAL  69   8.810   2.291   4.241
  546   HG12  VAL  69          1HG1      VAL  69   9.314   2.203   2.553
  547   HG13  VAL  69          3HG1      VAL  69   7.605   2.367   2.958
  548   HG21  VAL  69          3HG2      VAL  69   7.776   5.873   4.016
  549   HG22  VAL  69          2HG2      VAL  69   7.802   4.479   5.095
  550   HG23  VAL  69          1HG2      VAL  69   6.699   4.508   3.716
  551    H    ARG  70           H        ARG  70  10.967   6.039   1.719
  552    HA   ARG  70           HA       ARG  70  11.310   8.463   3.211
  553    HB2  ARG  70           HB2      ARG  70  12.078   9.442   1.160
  554    HB3  ARG  70           HB3      ARG  70  12.724   7.810   1.245
  555    HG2  ARG  70           HG2      ARG  70  11.080   7.021  -0.326
  556    HG3  ARG  70           HG3      ARG  70  10.276   8.590  -0.328
  557    HD2  ARG  70           HD2      ARG  70  12.467   9.552  -1.165
  558    HD3  ARG  70           HD3      ARG  70  12.988   7.887  -1.424
  559    HE   ARG  70           HE       ARG  70  10.454   8.560  -2.638
  560   HH11  ARG  70          2HH1      ARG  70  13.930   8.434  -3.081
  561   HH12  ARG  70          1HH1      ARG  70  13.828   8.403  -4.818
  562   HH21  ARG  70          2HH2      ARG  70  10.326   8.528  -4.917
  563   HH22  ARG  70          1HH2      ARG  70  11.788   8.462  -5.858
  564    H    ASN  71           H        ASN  71   8.783   7.115   1.228
  565    HA   ASN  71           HA       ASN  71   7.649   9.686   0.615
  566    HB2  ASN  71           HB2      ASN  71   6.990   6.887  -0.193
  567    HB3  ASN  71           HB3      ASN  71   5.824   8.181  -0.468
  568   HD21  ASN  71          1HD2      ASN  71   7.295   6.591  -2.421
  569   HD22  ASN  71          2HD2      ASN  71   8.190   7.736  -3.367
  570    H    LYS  72           H        LYS  72   7.374   7.693   3.272
  571    HA   LYS  72           HA       LYS  72   4.628   7.865   3.885
  572    HB2  LYS  72           HB2      LYS  72   6.308   6.461   5.134
  573    HB3  LYS  72           HB3      LYS  72   6.880   7.934   5.905
  574    HG2  LYS  72           HG2      LYS  72   4.658   8.288   6.866
  575    HG3  LYS  72           HG3      LYS  72   4.091   6.808   6.091
  576    HD2  LYS  72           HD2      LYS  72   5.834   5.559   7.363
  577    HD3  LYS  72           HD3      LYS  72   6.207   7.051   8.227
  578    HE2  LYS  72           HE2      LYS  72   3.867   7.146   9.010
  579    HE3  LYS  72           HE3      LYS  72   3.551   5.615   8.194
  580    HZ1  LYS  72           HZ1      LYS  72   5.383   4.672   9.609
  581    HZ2  LYS  72           HZ2      LYS  72   3.963   5.095  10.433
  582    HZ3  LYS  72           HZ3      LYS  72   5.326   6.106  10.519
  583    H    GLU  73           H        GLU  73   7.172  10.135   3.924
  584    HA   GLU  73           HA       GLU  73   6.540  12.171   5.553
  585    HB2  GLU  73           HB2      GLU  73   8.370  12.170   3.921
  586    HB3  GLU  73           HB3      GLU  73   7.217  12.371   2.612
  587    HG2  GLU  73           HG2      GLU  73   8.258  14.461   3.064
  588    HG3  GLU  73           HG3      GLU  73   6.573  14.544   3.573
  589    H    ARG  74           H        ARG  74   4.987  11.695   2.345
  590    HA   ARG  74           HA       ARG  74   3.118  13.818   2.903
  591    HB2  ARG  74           HB2      ARG  74   2.267  13.363   0.674
  592    HB3  ARG  74           HB3      ARG  74   4.020  13.492   0.661
  593    HG2  ARG  74           HG2      ARG  74   4.001  10.928   0.825
  594    HG3  ARG  74           HG3      ARG  74   2.307  11.060   0.337
  595    HD2  ARG  74           HD2      ARG  74   3.276  10.902  -1.714
  596    HD3  ARG  74           HD3      ARG  74   3.336  12.646  -1.480
  597    HE   ARG  74           HE       ARG  74   5.681  11.194  -0.609
  598   HH11  ARG  74          2HH1      ARG  74   4.131  13.158  -3.059
  599   HH12  ARG  74          1HH1      ARG  74   5.595  13.390  -3.981
  600   HH21  ARG  74          2HH2      ARG  74   7.609  11.494  -1.819
  601   HH22  ARG  74          1HH2      ARG  74   7.567  12.461  -3.258
  602    H    PHE  75           H        PHE  75   3.047  10.280   2.888
  603    HA   PHE  75           HA       PHE  75   0.254   9.997   3.162
  604    HB2  PHE  75           HB2      PHE  75   2.424   8.144   4.164
  605    HB3  PHE  75           HB3      PHE  75   0.742   7.727   3.883
  606    HD1  PHE  75           HD1      PHE  75   0.094   8.738   1.308
  607    HD2  PHE  75           HD2      PHE  75   3.764   7.081   2.665
  608    HE1  PHE  75           HE1      PHE  75   0.640   8.067  -0.994
  609    HE2  PHE  75           HE2      PHE  75   4.323   6.414   0.369
  610    HZ   PHE  75           HZ       PHE  75   2.757   6.901  -1.467
  611    H    ASP  76           H        ASP  76   2.519  11.296   5.245
  612    HA   ASP  76           HA       ASP  76   1.727  10.480   7.786
  613    HB2  ASP  76           HB2      ASP  76   3.720  11.867   7.301
  614    HB3  ASP  76           HB3      ASP  76   2.665  13.221   6.916
  615    H    GLY  77           H        GLY  77   0.441  13.035   5.702
  616    HA2  GLY  77           HA1      GLY  77  -1.673  13.583   7.656
  617    HA3  GLY  77           HA2      GLY  77  -1.305  14.550   6.234
  618    H    LYS  78           H        LYS  78  -1.811  11.063   6.473
  619    HA   LYS  78           HA       LYS  78  -4.320  11.317   4.994
  620    HB2  LYS  78           HB2      LYS  78  -1.957   9.647   4.114
  621    HB3  LYS  78           HB3      LYS  78  -3.579   9.471   3.460
  622    HG2  LYS  78           HG2      LYS  78  -3.491  11.795   2.669
  623    HG3  LYS  78           HG3      LYS  78  -1.844  11.926   3.287
  624    HD2  LYS  78           HD2      LYS  78  -1.833  11.488   0.895
  625    HD3  LYS  78           HD3      LYS  78  -1.141  10.129   1.780
  626    HE2  LYS  78           HE2      LYS  78  -2.637   9.398  -0.027
  627    HE3  LYS  78           HE3      LYS  78  -3.206   8.889   1.558
  628    HZ1  LYS  78           HZ1      LYS  78  -4.888   9.867  -0.079
  629    HZ2  LYS  78           HZ2      LYS  78  -4.210  11.376   0.317
  630    HZ3  LYS  78           HZ3      LYS  78  -4.926  10.422   1.524
  631    H    VAL  79           H        VAL  79  -5.226   8.958   4.699
  632    HA   VAL  79           HA       VAL  79  -5.184   7.753   7.367
  633    HB   VAL  79           HB       VAL  79  -6.984   7.126   5.014
  634   HG11  VAL  79          2HG1      VAL  79  -6.781   5.262   6.558
  635   HG12  VAL  79          1HG1      VAL  79  -8.381   5.992   6.683
  636   HG13  VAL  79          3HG1      VAL  79  -7.162   6.322   7.915
  637   HG21  VAL  79          3HG2      VAL  79  -7.310   9.413   5.805
  638   HG22  VAL  79          2HG2      VAL  79  -7.512   8.822   7.454
  639   HG23  VAL  79          1HG2      VAL  79  -8.695   8.401   6.216
  640    H    VAL  80           H        VAL  80  -3.941   6.006   7.752
  641    HA   VAL  80           HA       VAL  80  -3.170   4.379   5.429
  642    HB   VAL  80           HB       VAL  80  -0.920   4.263   6.047
  643   HG11  VAL  80          2HG1      VAL  80  -1.812   7.094   6.564
  644   HG12  VAL  80          1HG1      VAL  80  -1.423   6.374   5.002
  645   HG13  VAL  80          3HG1      VAL  80  -0.156   6.600   6.207
  646   HG21  VAL  80          3HG2      VAL  80  -0.005   5.163   8.150
  647   HG22  VAL  80          2HG2      VAL  80  -1.160   3.855   8.406
  648   HG23  VAL  80          1HG2      VAL  80  -1.647   5.528   8.684
  649    H    LEU  81           H        LEU  81  -2.426   2.256   5.912
  650    HA   LEU  81           HA       LEU  81  -3.139   1.177   8.548
  651    HB2  LEU  81           HB2      LEU  81  -4.934   0.745   6.820
  652    HB3  LEU  81           HB3      LEU  81  -3.760  -0.173   5.908
  653    HG   LEU  81           HG       LEU  81  -5.411  -1.499   7.295
  654   HD11  LEU  81          2HD1      LEU  81  -3.761  -3.145   8.016
  655   HD12  LEU  81          1HD1      LEU  81  -2.480  -1.946   7.827
  656   HD13  LEU  81          3HD1      LEU  81  -3.382  -2.506   6.418
  657   HD21  LEU  81          3HD2      LEU  81  -5.412  -0.116   9.287
  658   HD22  LEU  81          2HD2      LEU  81  -3.704  -0.464   9.553
  659   HD23  LEU  81          1HD2      LEU  81  -4.895  -1.758   9.678
  660    H    GLU  82           H        GLU  82  -1.244   0.524   9.358
  661    HA   GLU  82           HA       GLU  82   0.844  -0.352   7.472
  662    HB2  GLU  82           HB2      GLU  82   1.329   1.706   8.754
  663    HB3  GLU  82           HB3      GLU  82   1.144   0.807  10.252
  664    HG2  GLU  82           HG2      GLU  82   3.064  -0.562   9.707
  665    HG3  GLU  82           HG3      GLU  82   3.225   0.248   8.148
  666    H    VAL  83           H        VAL  83   1.496  -2.374   7.528
  667    HA   VAL  83           HA       VAL  83   1.226  -3.967   9.981
  668    HB   VAL  83           HB       VAL  83   0.415  -5.901   8.568
  669   HG11  VAL  83          2HG1      VAL  83  -1.922  -5.228   8.620
  670   HG12  VAL  83          1HG1      VAL  83  -1.443  -3.537   8.767
  671   HG13  VAL  83          3HG1      VAL  83  -1.078  -4.673  10.067
  672   HG21  VAL  83          3HG2      VAL  83  -0.194  -3.718   6.576
  673   HG22  VAL  83          2HG2      VAL  83  -0.681  -5.408   6.446
  674   HG23  VAL  83          1HG2      VAL  83   1.029  -4.974   6.380
  675    HA   PRO  84           HA       PRO  84   5.123  -5.863   8.775
  676    HB2  PRO  84           HB2      PRO  84   3.853  -8.541   8.897
  677    HB3  PRO  84           HB3      PRO  84   5.256  -7.924   9.776
  678    HG2  PRO  84           HG2      PRO  84   2.917  -8.288  11.007
  679    HG3  PRO  84           HG3      PRO  84   3.952  -6.901  11.399
  680    HD2  PRO  84           HD2      PRO  84   1.483  -7.012   9.708
  681    HD3  PRO  84           HD3      PRO  84   1.997  -5.772  10.871
  682    H    VAL  85           H        VAL  85   6.149  -6.706   6.952
  683    HA   VAL  85           HA       VAL  85   4.768  -6.338   4.541
  684    HB   VAL  85           HB       VAL  85   7.205  -6.015   4.823
  685   HG11  VAL  85          2HG1      VAL  85   8.712  -7.939   4.640
  686   HG12  VAL  85          1HG1      VAL  85   7.326  -9.024   4.752
  687   HG13  VAL  85          3HG1      VAL  85   7.746  -7.985   6.114
  688   HG21  VAL  85          3HG2      VAL  85   7.858  -6.911   2.611
  689   HG22  VAL  85          2HG2      VAL  85   6.294  -6.094   2.596
  690   HG23  VAL  85          1HG2      VAL  85   6.369  -7.856   2.587
  691    H    SER  86           H        SER  86   5.267  -9.212   6.434
  692    HA   SER  86           HA       SER  86   4.714 -11.076   4.343
  693    HB2  SER  86           HB2      SER  86   6.024 -11.668   6.356
  694    HB3  SER  86           HB3      SER  86   4.583 -11.451   7.348
  695    HG   SER  86           HG       SER  86   4.472 -13.546   6.957
  696    H    ALA  87           H        ALA  87   2.730  -9.120   6.384
  697    HA   ALA  87           HA       ALA  87   0.516 -10.840   6.670
  698    HB1  ALA  87           HB1      ALA  87  -0.719  -8.888   7.406
  699    HB2  ALA  87           HB2      ALA  87   0.891  -8.917   8.126
  700    HB3  ALA  87           HB3      ALA  87   0.547  -7.831   6.779
  701    HA   PRO  88           HA       PRO  88  -1.599  -8.511   3.018
  702    HB2  PRO  88           HB2      PRO  88   0.559  -7.229   1.501
  703    HB3  PRO  88           HB3      PRO  88  -0.962  -6.548   2.080
  704    HG2  PRO  88           HG2      PRO  88   1.392  -5.853   3.160
  705    HG3  PRO  88           HG3      PRO  88  -0.081  -5.989   4.139
  706    HD2  PRO  88           HD2      PRO  88   2.171  -7.946   3.825
  707    HD3  PRO  88           HD3      PRO  88   1.338  -7.425   5.306
  708    H    ILE  89           H        ILE  89   1.133 -10.432   2.929
  709    HA   ILE  89           HA       ILE  89   1.076 -11.115   0.147
  710    HB   ILE  89           HB       ILE  89   2.354 -12.462   2.526
  711   HG12  ILE  89          2HG1      ILE  89   3.440 -10.831   0.219
  712   HG13  ILE  89          3HG1      ILE  89   3.385 -10.357   1.911
  713   HG21  ILE  89          2HG2      ILE  89   3.545 -13.886   0.912
  714   HG22  ILE  89          1HG2      ILE  89   2.545 -13.229  -0.384
  715   HG23  ILE  89          3HG2      ILE  89   1.805 -14.177   0.907
  716   HD11  ILE  89          3HD1      ILE  89   5.043 -12.578   0.743
  717   HD12  ILE  89          2HD1      ILE  89   4.981 -12.134   2.449
  718   HD13  ILE  89          1HD1      ILE  89   5.625 -10.997   1.264
  719    H    LYS  90           H        LYS  90  -0.196 -12.560   3.125
  720    HA   LYS  90           HA       LYS  90  -1.546 -14.610   1.536
  721    HB2  LYS  90           HB2      LYS  90  -2.039 -15.672   3.707
  722    HB3  LYS  90           HB3      LYS  90  -0.318 -15.409   3.461
  723    HG2  LYS  90           HG2      LYS  90  -0.421 -13.430   4.898
  724    HG3  LYS  90           HG3      LYS  90  -2.144 -13.715   5.155
  725    HD2  LYS  90           HD2      LYS  90  -1.582 -15.933   6.110
  726    HD3  LYS  90           HD3      LYS  90   0.129 -15.531   5.952
  727    HE2  LYS  90           HE2      LYS  90  -0.199 -13.599   7.426
  728    HE3  LYS  90           HE3      LYS  90  -1.903 -14.022   7.591
  729    HZ1  LYS  90           HZ1      LYS  90  -0.775 -14.854   9.479
  730    HZ2  LYS  90           HZ2      LYS  90   0.440 -15.577   8.539
  731    HZ3  LYS  90           HZ3      LYS  90  -1.136 -16.194   8.508
  732    H    ASP  91           H        ASP  91  -2.207 -11.714   3.319
  733    HA   ASP  91           HA       ASP  91  -5.101 -12.215   3.048
  734    HB2  ASP  91           HB2      ASP  91  -3.611 -10.817   5.264
  735    HB3  ASP  91           HB3      ASP  91  -5.349 -10.673   5.046
  736    H    ALA  92           H        ALA  92  -3.659 -11.010   0.995
  737    HA   ALA  92           HA       ALA  92  -3.292  -8.271   1.071
  738    HB1  ALA  92           HB1      ALA  92  -3.463  -8.307  -1.345
  739    HB2  ALA  92           HB2      ALA  92  -2.577  -9.721  -0.776
  740    HB3  ALA  92           HB3      ALA  92  -4.258  -9.881  -1.288
  741    H    GLU  93           H        GLU  93  -6.254 -10.021   0.120
  742    HA   GLU  93           HA       GLU  93  -7.759  -7.714  -0.475
  743    HB2  GLU  93           HB2      GLU  93  -8.678 -10.464   0.379
  744    HB3  GLU  93           HB3      GLU  93  -9.747  -9.206  -0.221
  745    HG2  GLU  93           HG2      GLU  93  -9.399 -10.537  -2.074
  746    HG3  GLU  93           HG3      GLU  93  -8.255  -9.220  -2.311
  747    H    LYS  94           H        LYS  94  -7.222  -9.482   2.517
  748    HA   LYS  94           HA       LYS  94  -9.362  -8.218   3.927
  749    HB2  LYS  94           HB2      LYS  94  -8.405 -10.466   4.501
  750    HB3  LYS  94           HB3      LYS  94  -6.966  -9.645   5.091
  751    HG2  LYS  94           HG2      LYS  94  -8.276  -8.500   6.782
  752    HG3  LYS  94           HG3      LYS  94  -9.753  -9.239   6.163
  753    HD2  LYS  94           HD2      LYS  94  -9.053 -10.467   8.098
  754    HD3  LYS  94           HD3      LYS  94  -8.771 -11.471   6.673
  755    HE2  LYS  94           HE2      LYS  94  -6.405 -10.788   6.688
  756    HE3  LYS  94           HE3      LYS  94  -6.703  -9.846   8.149
  757    HZ1  LYS  94           HZ1      LYS  94  -5.769 -11.954   8.735
  758    HZ2  LYS  94           HZ2      LYS  94  -6.956 -12.791   7.858
  759    HZ3  LYS  94           HZ3      LYS  94  -7.386 -11.923   9.250
  760    H    VAL  95           H        VAL  95  -5.925  -7.648   3.546
  761    HA   VAL  95           HA       VAL  95  -5.647  -5.619   5.489
  762    HB   VAL  95           HB       VAL  95  -4.115  -6.040   2.912
  763   HG11  VAL  95          2HG1      VAL  95  -3.376  -4.406   5.334
  764   HG12  VAL  95          1HG1      VAL  95  -3.835  -3.769   3.755
  765   HG13  VAL  95          3HG1      VAL  95  -2.352  -4.707   3.930
  766   HG21  VAL  95          3HG2      VAL  95  -2.460  -7.152   4.305
  767   HG22  VAL  95          2HG2      VAL  95  -4.028  -7.954   4.437
  768   HG23  VAL  95          1HG2      VAL  95  -3.465  -6.892   5.731
  769    H    ILE  96           H        ILE  96  -6.458  -5.560   2.051
  770    HA   ILE  96           HA       ILE  96  -6.677  -2.764   1.774
  771    HB   ILE  96           HB       ILE  96  -7.979  -5.008   0.218
  772   HG12  ILE  96          2HG1      ILE  96  -5.608  -3.246  -0.436
  773   HG13  ILE  96          3HG1      ILE  96  -5.490  -4.880   0.209
  774   HG21  ILE  96          2HG2      ILE  96  -9.281  -2.961  -0.041
  775   HG22  ILE  96          1HG2      ILE  96  -8.419  -3.356  -1.529
  776   HG23  ILE  96          3HG2      ILE  96  -7.818  -2.076  -0.474
  777   HD11  ILE  96          3HD1      ILE  96  -6.741  -4.125  -2.418
  778   HD12  ILE  96          2HD1      ILE  96  -6.566  -5.759  -1.778
  779   HD13  ILE  96          1HD1      ILE  96  -5.134  -4.817  -2.198
  780    H    ASN  97           H        ASN  97  -9.134  -5.263   2.415
  781    HA   ASN  97           HA       ASN  97 -11.344  -3.549   2.615
  782    HB2  ASN  97           HB2      ASN  97 -10.759  -6.283   3.709
  783    HB3  ASN  97           HB3      ASN  97 -12.237  -5.443   4.166
  784   HD21  ASN  97          1HD2      ASN  97 -11.771  -7.895   2.565
  785   HD22  ASN  97          2HD2      ASN  97 -12.576  -7.603   1.061
  786    H    ALA  98           H        ALA  98  -8.983  -4.558   5.033
  787    HA   ALA  98           HA       ALA  98 -10.272  -3.463   7.284
  788    HB1  ALA  98           HB1      ALA  98  -7.314  -3.852   6.828
  789    HB2  ALA  98           HB2      ALA  98  -8.101  -3.595   8.384
  790    HB3  ALA  98           HB3      ALA  98  -8.429  -5.063   7.463
  791    H    ALA  99           H        ALA  99  -7.846  -2.113   5.074
  792    HA   ALA  99           HA       ALA  99  -7.521   0.365   6.365
  793    HB1  ALA  99           HB1      ALA  99  -6.547   1.130   4.269
  794    HB2  ALA  99           HB2      ALA  99  -5.968  -0.485   4.676
  795    HB3  ALA  99           HB3      ALA  99  -7.205  -0.277   3.435
  796    H    LEU 100           H        LEU 100  -9.757  -0.703   3.850
  797    HA   LEU 100           HA       LEU 100 -10.886   1.831   3.314
  798    HB2  LEU 100           HB2      LEU 100 -12.082  -0.917   2.961
  799    HB3  LEU 100           HB3      LEU 100 -12.716   0.561   2.263
  800    HG   LEU 100           HG       LEU 100 -10.034  -0.669   1.625
  801   HD11  LEU 100          2HD1      LEU 100 -11.024  -1.128  -0.563
  802   HD12  LEU 100          1HD1      LEU 100 -12.572  -0.504   0.007
  803   HD13  LEU 100          3HD1      LEU 100 -11.890  -1.962   0.729
  804   HD21  LEU 100          3HD2      LEU 100  -9.977   1.760   1.470
  805   HD22  LEU 100          2HD2      LEU 100 -11.422   1.743   0.462
  806   HD23  LEU 100          1HD2      LEU 100  -9.921   1.032  -0.136
  807    H    ALA 101           H        ALA 101 -11.636  -0.675   5.654
  808    HA   ALA 101           HA       ALA 101 -14.153   0.350   6.461
  809    HB1  ALA 101           HB1      ALA 101 -12.250  -1.393   8.015
  810    HB2  ALA 101           HB2      ALA 101 -13.969  -1.168   8.339
  811    HB3  ALA 101           HB3      ALA 101 -13.448  -1.969   6.856
  812    H    LEU 102           H        LEU 102 -10.925   1.292   7.168
  813    HA   LEU 102           HA       LEU 102 -11.314   2.416   9.732
  814    HB2  LEU 102           HB2      LEU 102  -9.322   3.208   7.606
  815    HB3  LEU 102           HB3      LEU 102  -9.232   3.636   9.304
  816    HG   LEU 102           HG       LEU 102  -9.011   0.850   8.163
  817   HD11  LEU 102          2HD1      LEU 102  -6.952   2.621   9.471
  818   HD12  LEU 102          1HD1      LEU 102  -7.047   2.251   7.750
  819   HD13  LEU 102          3HD1      LEU 102  -6.699   0.968   8.909
  820   HD21  LEU 102          3HD2      LEU 102  -8.478   0.168  10.451
  821   HD22  LEU 102          2HD2      LEU 102 -10.108   0.835  10.342
  822   HD23  LEU 102          1HD2      LEU 102  -8.801   1.807  11.017
  823    H    ILE 103           H        ILE 103 -12.064   3.531   6.535
  824    HA   ILE 103           HA       ILE 103 -12.868   6.131   7.664
  825    HB   ILE 103           HB       ILE 103 -12.795   7.013   5.335
  826   HG12  ILE 103          2HG1      ILE 103 -11.328   4.430   4.736
  827   HG13  ILE 103          3HG1      ILE 103 -12.950   4.822   4.173
  828   HG21  ILE 103          2HG2      ILE 103 -10.341   7.216   5.260
  829   HG22  ILE 103          1HG2      ILE 103 -10.221   5.944   6.477
  830   HG23  ILE 103          3HG2      ILE 103 -11.002   7.475   6.874
  831   HD11  ILE 103          3HD1      ILE 103 -12.039   6.715   2.913
  832   HD12  ILE 103          2HD1      ILE 103 -11.323   5.179   2.423
  833   HD13  ILE 103          1HD1      ILE 103 -10.419   6.283   3.458
  834    H    ASP 104           H        ASP 104 -13.888   3.384   5.738
  835    HA   ASP 104           HA       ASP 104 -16.653   4.268   6.015
  836    HB2  ASP 104           HB2      ASP 104 -16.026   5.192   3.859
  837    HB3  ASP 104           HB3      ASP 104 -15.368   3.647   3.343
  838    H    GLU 105           H        GLU 105 -15.166   1.810   3.962
  839    HA   GLU 105           HA       GLU 105 -15.452  -0.464   5.484
  840    HB2  GLU 105           HB2      GLU 105 -17.867   0.038   5.594
  841    HB3  GLU 105           HB3      GLU 105 -17.938   0.095   3.839
  842    HG2  GLU 105           HG2      GLU 105 -17.141  -2.301   3.858
  843    HG3  GLU 105           HG3      GLU 105 -17.441  -2.287   5.594
  844    H    LYS 106           H        LYS 106 -16.212   0.913   2.345
  845    HA   LYS 106           HA       LYS 106 -14.255  -0.798   1.053
  846    HB2  LYS 106           HB2      LYS 106 -16.513  -1.988   1.090
  847    HB3  LYS 106           HB3      LYS 106 -17.105  -0.704   0.050
  848    HG2  LYS 106           HG2      LYS 106 -15.421  -1.322  -1.635
  849    HG3  LYS 106           HG3      LYS 106 -14.899  -2.650  -0.593
  850    HD2  LYS 106           HD2      LYS 106 -17.621  -2.280  -1.845
  851    HD3  LYS 106           HD3      LYS 106 -16.425  -3.516  -2.246
  852    HE2  LYS 106           HE2      LYS 106 -16.666  -4.513  -0.058
  853    HE3  LYS 106           HE3      LYS 106 -17.755  -3.222   0.448
  854    HZ1  LYS 106           HZ1      LYS 106 -18.284  -5.235  -1.674
  855    HZ2  LYS 106           HZ2      LYS 106 -19.323  -3.960  -1.262
  856    HZ3  LYS 106           HZ3      LYS 106 -18.998  -5.187  -0.137
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1 -15.361  -2.581  -7.726
    2    H2   MET   1           H2       MET   1 -16.319  -3.069  -6.417
    3    H3   MET   1           H3       MET   1 -14.647  -2.864  -6.218
    4    HA   MET   1           HA       MET   1 -16.525  -0.685  -6.923
    5    HB2  MET   1           HB2      MET   1 -16.922  -1.562  -4.634
    6    HB3  MET   1           HB3      MET   1 -15.227  -1.285  -4.252
    7    HG2  MET   1           HG2      MET   1 -15.572   1.124  -4.723
    8    HG3  MET   1           HG3      MET   1 -17.289   0.794  -4.940
    9    HE1  MET   1           HE1      MET   1 -17.988   2.565  -3.137
   10    HE2  MET   1           HE2      MET   1 -17.286   2.652  -1.521
   11    HE3  MET   1           HE3      MET   1 -16.289   2.994  -2.934
   12    H    LYS   2           H        LYS   2 -15.522   1.159  -7.562
   13    HA   LYS   2           HA       LYS   2 -12.709   1.168  -7.988
   14    HB2  LYS   2           HB2      LYS   2 -14.676   3.457  -8.105
   15    HB3  LYS   2           HB3      LYS   2 -13.011   3.533  -8.656
   16    HG2  LYS   2           HG2      LYS   2 -13.647   1.620 -10.233
   17    HG3  LYS   2           HG3      LYS   2 -15.318   2.051  -9.847
   18    HD2  LYS   2           HD2      LYS   2 -14.710   4.426 -10.458
   19    HD3  LYS   2           HD3      LYS   2 -13.200   3.784 -11.101
   20    HE2  LYS   2           HE2      LYS   2 -14.717   4.014 -12.918
   21    HE3  LYS   2           HE3      LYS   2 -14.558   2.293 -12.574
   22    HZ1  LYS   2           HZ1      LYS   2 -16.728   3.785 -11.281
   23    HZ2  LYS   2           HZ2      LYS   2 -16.676   2.160 -11.772
   24    HZ3  LYS   2           HZ3      LYS   2 -16.887   3.385 -12.920
   25    H    ARG   3           H        ARG   3 -11.275   1.381  -6.410
   26    HA   ARG   3           HA       ARG   3 -11.561   3.698  -4.649
   27    HB2  ARG   3           HB2      ARG   3 -12.123   1.457  -3.494
   28    HB3  ARG   3           HB3      ARG   3 -10.405   1.117  -3.633
   29    HG2  ARG   3           HG2      ARG   3 -10.589   2.009  -1.512
   30    HG3  ARG   3           HG3      ARG   3 -10.081   3.397  -2.481
   31    HD2  ARG   3           HD2      ARG   3 -11.867   4.081  -1.030
   32    HD3  ARG   3           HD3      ARG   3 -12.463   4.057  -2.686
   33    HE   ARG   3           HE       ARG   3 -13.306   1.724  -2.013
   34   HH11  ARG   3          2HH1      ARG   3 -13.254   4.553   0.054
   35   HH12  ARG   3          1HH1      ARG   3 -14.504   3.952   1.115
   36   HH21  ARG   3          2HH2      ARG   3 -14.966   0.961  -0.653
   37   HH22  ARG   3          1HH2      ARG   3 -15.479   1.921   0.707
   38    H    LYS   4           H        LYS   4  -9.773   4.913  -4.689
   39    HA   LYS   4           HA       LYS   4  -7.369   3.943  -5.970
   40    HB2  LYS   4           HB2      LYS   4  -7.877   6.565  -4.553
   41    HB3  LYS   4           HB3      LYS   4  -6.504   6.194  -5.583
   42    HG2  LYS   4           HG2      LYS   4  -9.381   6.446  -6.424
   43    HG3  LYS   4           HG3      LYS   4  -8.061   7.555  -6.794
   44    HD2  LYS   4           HD2      LYS   4  -6.941   5.719  -8.036
   45    HD3  LYS   4           HD3      LYS   4  -8.359   4.710  -7.750
   46    HE2  LYS   4           HE2      LYS   4  -8.209   7.266  -9.336
   47    HE3  LYS   4           HE3      LYS   4  -8.548   5.646  -9.941
   48    HZ1  LYS   4           HZ1      LYS   4 -10.292   7.468  -8.424
   49    HZ2  LYS   4           HZ2      LYS   4 -10.541   5.797  -8.303
   50    HZ3  LYS   4           HZ3      LYS   4 -10.635   6.559  -9.816
   51    H    ILE   5           H        ILE   5  -5.777   2.925  -4.915
   52    HA   ILE   5           HA       ILE   5  -5.516   3.379  -2.013
   53    HB   ILE   5           HB       ILE   5  -5.196   0.695  -3.387
   54   HG12  ILE   5          2HG1      ILE   5  -7.394   1.658  -1.535
   55   HG13  ILE   5          3HG1      ILE   5  -7.566   1.407  -3.269
   56   HG21  ILE   5          2HG2      ILE   5  -4.995  -0.185  -1.115
   57   HG22  ILE   5          1HG2      ILE   5  -5.121   1.449  -0.465
   58   HG23  ILE   5          3HG2      ILE   5  -3.733   0.998  -1.456
   59   HD11  ILE   5          3HD1      ILE   5  -6.934  -0.730  -1.241
   60   HD12  ILE   5          2HD1      ILE   5  -7.138  -0.970  -2.978
   61   HD13  ILE   5          1HD1      ILE   5  -8.503  -0.441  -1.995
   62    H    ILE   6           H        ILE   6  -3.583   4.339  -1.717
   63    HA   ILE   6           HA       ILE   6  -1.364   3.512  -3.433
   64    HB   ILE   6           HB       ILE   6  -0.053   5.344  -2.431
   65   HG12  ILE   6          2HG1      ILE   6  -1.442   5.408  -0.272
   66   HG13  ILE   6          3HG1      ILE   6  -0.908   6.945  -0.941
   67   HG21  ILE   6          2HG2      ILE   6  -2.681   6.162  -3.643
   68   HG22  ILE   6          1HG2      ILE   6  -1.211   5.711  -4.505
   69   HG23  ILE   6          3HG2      ILE   6  -1.249   7.182  -3.537
   70   HD11  ILE   6          3HD1      ILE   6  -3.194   7.072  -0.142
   71   HD12  ILE   6          2HD1      ILE   6  -3.660   5.752  -1.214
   72   HD13  ILE   6          1HD1      ILE   6  -3.135   7.293  -1.890
   73    H    ALA   7           H        ALA   7   0.006   2.044  -2.781
   74    HA   ALA   7           HA       ALA   7   0.193   1.488   0.106
   75    HB1  ALA   7           HB1      ALA   7  -1.274  -0.160  -0.981
   76    HB2  ALA   7           HB2      ALA   7   0.039  -0.587  -2.079
   77    HB3  ALA   7           HB3      ALA   7   0.200  -0.894  -0.350
   78    H    VAL   8           H        VAL   8   2.202   1.325   0.866
   79    HA   VAL   8           HA       VAL   8   4.380   1.202  -1.108
   80    HB   VAL   8           HB       VAL   8   4.458   2.345   1.691
   81   HG11  VAL   8          2HG1      VAL   8   6.685   3.167   1.053
   82   HG12  VAL   8          1HG1      VAL   8   6.556   2.297  -0.476
   83   HG13  VAL   8          3HG1      VAL   8   6.604   1.405   1.045
   84   HG21  VAL   8          3HG2      VAL   8   4.714   4.515   0.548
   85   HG22  VAL   8          2HG2      VAL   8   3.161   3.751   0.200
   86   HG23  VAL   8          1HG2      VAL   8   4.454   3.710  -1.000
   87    H    THR   9           H        THR   9   5.602  -0.518  -1.133
   88    HA   THR   9           HA       THR   9   5.670  -2.275   1.235
   89    HB   THR   9           HB       THR   9   6.338  -4.070  -0.450
   90    HG1  THR   9           HG1      THR   9   6.234  -1.968  -2.088
   91   HG21  THR   9          3HG2      THR   9   4.024  -4.514  -1.144
   92   HG22  THR   9          1HG2      THR   9   3.575  -2.869  -0.693
   93   HG23  THR   9          2HG2      THR   9   4.106  -4.008   0.545
   94    H    ALA  10           H        ALA  10   7.593  -2.354   2.237
   95    HA   ALA  10           HA       ALA  10  10.032  -2.107   0.648
   96    HB1  ALA  10           HB1      ALA  10   9.525  -0.363   3.053
   97    HB2  ALA  10           HB2      ALA  10  10.985  -0.398   2.063
   98    HB3  ALA  10           HB3      ALA  10   9.467   0.178   1.375
   99    H    CYS  11           H        CYS  11  10.644  -4.189   1.116
  100    HA   CYS  11           HA       CYS  11  11.103  -4.797   3.958
  101    HB2  CYS  11           HB2      CYS  11   9.699  -6.428   2.738
  102    HB3  CYS  11           HB3      CYS  11  11.009  -6.694   1.596
  103    HG   CYS  11           HG       CYS  11  10.617  -7.877   4.728
  104    H    ALA  12           H        ALA  12  13.130  -4.775   4.682
  105    HA   ALA  12           HA       ALA  12  15.312  -4.437   2.788
  106    HB1  ALA  12           HB1      ALA  12  15.209  -2.965   4.741
  107    HB2  ALA  12           HB2      ALA  12  15.314  -4.367   5.807
  108    HB3  ALA  12           HB3      ALA  12  16.673  -3.948   4.763
  109    H    THR  13           H        THR  13  14.035  -6.766   5.044
  110    HA   THR  13           HA       THR  13  16.226  -8.508   5.237
  111    HB   THR  13           HB       THR  13  13.294  -9.248   5.302
  112    HG1  THR  13           HG1      THR  13  13.622  -7.635   6.818
  113   HG21  THR  13          3HG2      THR  13  14.825 -11.164   5.177
  114   HG22  THR  13          1HG2      THR  13  14.028 -11.076   6.749
  115   HG23  THR  13          2HG2      THR  13  15.704 -10.552   6.579
  116    H    GLY  14           H        GLY  14  13.323  -8.823   3.174
  117    HA2  GLY  14           HA1      GLY  14  14.990 -10.247   1.219
  118    HA3  GLY  14           HA2      GLY  14  13.496 -10.977   1.786
  119    H    VAL  15           H        VAL  15  14.852  -9.216  -0.630
  120    HA   VAL  15           HA       VAL  15  12.838  -7.356  -1.273
  121    HB   VAL  15           HB       VAL  15  13.805  -7.362  -3.542
  122   HG11  VAL  15          2HG1      VAL  15  14.794  -5.953  -1.856
  123   HG12  VAL  15          1HG1      VAL  15  16.061  -6.605  -2.895
  124   HG13  VAL  15          3HG1      VAL  15  15.799  -7.286  -1.290
  125   HG21  VAL  15          3HG2      VAL  15  14.329  -9.736  -3.735
  126   HG22  VAL  15          2HG2      VAL  15  15.571  -9.568  -2.496
  127   HG23  VAL  15          1HG2      VAL  15  15.756  -8.747  -4.045
  128    H    ALA  16           H        ALA  16  12.997 -10.770  -1.578
  129    HA   ALA  16           HA       ALA  16  11.067 -11.151  -3.605
  130    HB1  ALA  16           HB1      ALA  16  12.556 -12.931  -2.820
  131    HB2  ALA  16           HB2      ALA  16  11.723 -12.938  -1.266
  132    HB3  ALA  16           HB3      ALA  16  10.861 -13.412  -2.730
  133    H    HIS  17           H        HIS  17  10.840 -10.440  -0.183
  134    HA   HIS  17           HA       HIS  17   8.045 -11.026   0.038
  135    HB2  HIS  17           HB2      HIS  17   9.938  -9.454   1.786
  136    HB3  HIS  17           HB3      HIS  17   8.221  -9.582   2.146
  137    HD1  HIS  17           HD1      HIS  17   7.921 -11.232   3.972
  138    HD2  HIS  17           HD2      HIS  17  10.871 -12.400   1.285
  139    HE1  HIS  17           HE1      HIS  17   8.717 -13.474   4.772
  140    HE2  HIS  17           HE2      HIS  17  10.603 -14.094   3.214
  141    H    THR  18           H        THR  18   9.957  -8.116  -0.511
  142    HA   THR  18           HA       THR  18   7.909  -6.224  -0.517
  143    HB   THR  18           HB       THR  18  10.332  -6.189  -2.329
  144    HG1  THR  18           HG1      THR  18  11.512  -5.493  -0.629
  145   HG21  THR  18          3HG2      THR  18   8.706  -4.430  -2.787
  146   HG22  THR  18          1HG2      THR  18  10.166  -3.754  -2.064
  147   HG23  THR  18          2HG2      THR  18   8.714  -3.962  -1.087
  148    H    TYR  19           H        TYR  19   9.233  -8.179  -3.159
  149    HA   TYR  19           HA       TYR  19   7.569  -7.014  -5.154
  150    HB2  TYR  19           HB2      TYR  19   9.847  -8.130  -5.461
  151    HB3  TYR  19           HB3      TYR  19   8.992  -9.665  -5.353
  152    HD1  TYR  19           HD2      TYR  19   8.993  -6.462  -7.259
  153    HD2  TYR  19           HD1      TYR  19   8.111 -10.621  -7.274
  154    HE1  TYR  19           HE2      TYR  19   8.484  -6.338  -9.662
  155    HE2  TYR  19           HE1      TYR  19   7.598 -10.510  -9.675
  156    HH   TYR  19           HH       TYR  19   8.422  -7.870 -11.615
  157    H    MET  20           H        MET  20   7.459 -10.030  -3.288
  158    HA   MET  20           HA       MET  20   5.243 -11.163  -4.615
  159    HB2  MET  20           HB2      MET  20   6.735 -12.463  -3.151
  160    HB3  MET  20           HB3      MET  20   6.143 -11.570  -1.756
  161    HG2  MET  20           HG2      MET  20   5.065 -13.695  -1.816
  162    HG3  MET  20           HG3      MET  20   3.877 -12.455  -2.209
  163    HE1  MET  20           HE1      MET  20   2.129 -14.032  -3.281
  164    HE2  MET  20           HE2      MET  20   2.526 -15.313  -4.427
  165    HE3  MET  20           HE3      MET  20   3.127 -15.395  -2.772
  166    H    ALA  21           H        ALA  21   5.467  -9.082  -1.751
  167    HA   ALA  21           HA       ALA  21   2.743  -9.142  -1.072
  168    HB1  ALA  21           HB1      ALA  21   4.472  -8.310   0.444
  169    HB2  ALA  21           HB2      ALA  21   4.734  -6.924  -0.614
  170    HB3  ALA  21           HB3      ALA  21   3.191  -7.119   0.216
  171    H    ALA  22           H        ALA  22   4.592  -6.889  -3.092
  172    HA   ALA  22           HA       ALA  22   2.494  -5.099  -3.617
  173    HB1  ALA  22           HB1      ALA  22   4.861  -4.579  -3.976
  174    HB2  ALA  22           HB2      ALA  22   4.898  -5.705  -5.332
  175    HB3  ALA  22           HB3      ALA  22   3.893  -4.258  -5.415
  176    H    GLN  23           H        GLN  23   3.438  -8.097  -5.253
  177    HA   GLN  23           HA       GLN  23   1.588  -7.622  -7.414
  178    HB2  GLN  23           HB2      GLN  23   2.188  -9.867  -8.201
  179    HB3  GLN  23           HB3      GLN  23   3.604  -8.876  -7.897
  180    HG2  GLN  23           HG2      GLN  23   3.960 -10.034  -5.780
  181    HG3  GLN  23           HG3      GLN  23   2.534 -11.025  -6.083
  182   HE21  GLN  23          1HE2      GLN  23   4.723 -10.079  -8.620
  183   HE22  GLN  23          2HE2      GLN  23   5.394 -11.646  -8.891
  184    H    ALA  24           H        ALA  24   1.644  -9.660  -4.502
  185    HA   ALA  24           HA       ALA  24  -0.812 -10.970  -5.039
  186    HB1  ALA  24           HB1      ALA  24   0.485 -10.449  -2.362
  187    HB2  ALA  24           HB2      ALA  24  -0.772 -11.639  -2.700
  188    HB3  ALA  24           HB3      ALA  24   0.830 -11.819  -3.417
  189    H    LEU  25           H        LEU  25   0.041  -8.066  -3.245
  190    HA   LEU  25           HA       LEU  25  -2.550  -7.409  -2.344
  191    HB2  LEU  25           HB2      LEU  25  -0.500  -6.462  -1.409
  192    HB3  LEU  25           HB3      LEU  25  -0.160  -5.663  -2.928
  193    HG   LEU  25           HG       LEU  25  -2.192  -4.277  -2.619
  194   HD11  LEU  25          2HD1      LEU  25  -3.266  -4.227  -0.424
  195   HD12  LEU  25          1HD1      LEU  25  -2.269  -5.584   0.102
  196   HD13  LEU  25          3HD1      LEU  25  -3.455  -5.807  -1.186
  197   HD21  LEU  25          3HD2      LEU  25   0.078  -3.554  -1.935
  198   HD22  LEU  25          2HD2      LEU  25  -0.251  -4.165  -0.313
  199   HD23  LEU  25          1HD2      LEU  25  -1.205  -2.830  -0.959
  200    H    LYS  26           H        LYS  26  -0.765  -6.669  -5.294
  201    HA   LYS  26           HA       LYS  26  -2.615  -4.848  -6.399
  202    HB2  LYS  26           HB2      LYS  26  -0.278  -5.206  -7.224
  203    HB3  LYS  26           HB3      LYS  26  -0.795  -6.745  -7.901
  204    HG2  LYS  26           HG2      LYS  26  -2.390  -5.559  -9.337
  205    HG3  LYS  26           HG3      LYS  26  -1.828  -4.026  -8.677
  206    HD2  LYS  26           HD2      LYS  26  -0.101  -6.010 -10.155
  207    HD3  LYS  26           HD3      LYS  26  -0.830  -4.578 -10.876
  208    HE2  LYS  26           HE2      LYS  26   1.330  -3.875 -10.393
  209    HE3  LYS  26           HE3      LYS  26   0.404  -3.283  -9.017
  210    HZ1  LYS  26           HZ1      LYS  26   1.197  -5.093  -7.687
  211    HZ2  LYS  26           HZ2      LYS  26   2.536  -4.350  -8.410
  212    HZ3  LYS  26           HZ3      LYS  26   1.951  -5.820  -9.021
  213    H    LYS  27           H        LYS  27  -2.239  -8.359  -6.752
  214    HA   LYS  27           HA       LYS  27  -4.471  -8.781  -8.414
  215    HB2  LYS  27           HB2      LYS  27  -2.927 -10.502  -6.519
  216    HB3  LYS  27           HB3      LYS  27  -4.373 -11.121  -7.296
  217    HG2  LYS  27           HG2      LYS  27  -3.381 -10.677  -9.488
  218    HG3  LYS  27           HG3      LYS  27  -1.929 -10.059  -8.697
  219    HD2  LYS  27           HD2      LYS  27  -1.693 -12.397  -9.467
  220    HD3  LYS  27           HD3      LYS  27  -1.487 -12.217  -7.724
  221    HE2  LYS  27           HE2      LYS  27  -3.798 -12.960  -7.378
  222    HE3  LYS  27           HE3      LYS  27  -3.999 -13.139  -9.121
  223    HZ1  LYS  27           HZ1      LYS  27  -1.883 -14.584  -7.645
  224    HZ2  LYS  27           HZ2      LYS  27  -2.531 -14.928  -9.180
  225    HZ3  LYS  27           HZ3      LYS  27  -3.453 -15.206  -7.783
  226    H    GLY  28           H        GLY  28  -4.127  -8.736  -4.906
  227    HA2  GLY  28           HA1      GLY  28  -6.756  -9.382  -4.200
  228    HA3  GLY  28           HA2      GLY  28  -5.677  -8.367  -3.252
  229    H    ALA  29           H        ALA  29  -5.325  -6.220  -4.947
  230    HA   ALA  29           HA       ALA  29  -7.677  -4.714  -4.569
  231    HB1  ALA  29           HB1      ALA  29  -6.569  -2.972  -5.871
  232    HB2  ALA  29           HB2      ALA  29  -5.459  -3.687  -4.703
  233    HB3  ALA  29           HB3      ALA  29  -5.353  -4.131  -6.406
  234    H    LYS  30           H        LYS  30  -6.314  -6.308  -7.416
  235    HA   LYS  30           HA       LYS  30  -8.234  -5.554  -9.305
  236    HB2  LYS  30           HB2      LYS  30  -6.243  -7.706  -9.033
  237    HB3  LYS  30           HB3      LYS  30  -7.602  -8.095 -10.076
  238    HG2  LYS  30           HG2      LYS  30  -5.738  -7.197 -11.343
  239    HG3  LYS  30           HG3      LYS  30  -7.141  -6.136 -11.437
  240    HD2  LYS  30           HD2      LYS  30  -6.158  -4.650  -9.788
  241    HD3  LYS  30           HD3      LYS  30  -4.779  -5.739  -9.605
  242    HE2  LYS  30           HE2      LYS  30  -4.232  -3.849 -11.056
  243    HE3  LYS  30           HE3      LYS  30  -4.166  -5.377 -11.934
  244    HZ1  LYS  30           HZ1      LYS  30  -5.281  -3.841 -13.313
  245    HZ2  LYS  30           HZ2      LYS  30  -6.284  -3.309 -12.052
  246    HZ3  LYS  30           HZ3      LYS  30  -6.487  -4.863 -12.696
  247    H    LYS  31           H        LYS  31  -8.247  -8.118  -6.907
  248    HA   LYS  31           HA       LYS  31 -10.452  -9.594  -7.773
  249    HB2  LYS  31           HB2      LYS  31  -8.920 -10.374  -6.036
  250    HB3  LYS  31           HB3      LYS  31  -9.433  -9.077  -4.970
  251    HG2  LYS  31           HG2      LYS  31 -10.495 -11.045  -4.227
  252    HG3  LYS  31           HG3      LYS  31 -11.731 -10.072  -5.025
  253    HD2  LYS  31           HD2      LYS  31 -11.531 -11.435  -7.032
  254    HD3  LYS  31           HD3      LYS  31 -10.250 -12.385  -6.273
  255    HE2  LYS  31           HE2      LYS  31 -11.868 -13.014  -4.488
  256    HE3  LYS  31           HE3      LYS  31 -13.128 -12.190  -5.407
  257    HZ1  LYS  31           HZ1      LYS  31 -13.110 -14.574  -5.817
  258    HZ2  LYS  31           HZ2      LYS  31 -11.513 -14.483  -6.381
  259    HZ3  LYS  31           HZ3      LYS  31 -12.758 -13.711  -7.235
  260    H    MET  32           H        MET  32 -10.252  -6.748  -5.697
  261    HA   MET  32           HA       MET  32 -13.156  -6.732  -5.390
  262    HB2  MET  32           HB2      MET  32 -11.046  -4.997  -4.099
  263    HB3  MET  32           HB3      MET  32 -12.762  -4.990  -3.704
  264    HG2  MET  32           HG2      MET  32 -10.924  -7.349  -3.385
  265    HG3  MET  32           HG3      MET  32 -11.389  -6.246  -2.094
  266    HE1  MET  32           HE1      MET  32 -15.223  -6.937  -1.763
  267    HE2  MET  32           HE2      MET  32 -13.839  -6.049  -1.122
  268    HE3  MET  32           HE3      MET  32 -14.450  -5.689  -2.737
  269    H    GLY  33           H        GLY  33 -11.064  -5.663  -7.626
  270    HA2  GLY  33           HA1      GLY  33 -11.481  -4.366  -9.483
  271    HA3  GLY  33           HA2      GLY  33 -13.043  -3.960  -8.795
  272    H    ASN  34           H        ASN  34  -9.935  -3.388  -7.233
  273    HA   ASN  34           HA       ASN  34 -10.632  -0.542  -7.154
  274    HB2  ASN  34           HB2      ASN  34  -8.468  -2.000  -5.622
  275    HB3  ASN  34           HB3      ASN  34  -8.970  -0.333  -5.377
  276   HD21  ASN  34          1HD2      ASN  34  -9.648  -3.636  -4.782
  277   HD22  ASN  34          2HD2      ASN  34 -10.960  -3.390  -3.687
  278    H    LEU  35           H        LEU  35  -8.709   0.965  -7.183
  279    HA   LEU  35           HA       LEU  35  -6.814   0.144  -9.283
  280    HB2  LEU  35           HB2      LEU  35  -7.863   2.922  -8.706
  281    HB3  LEU  35           HB3      LEU  35  -6.663   2.523  -9.917
  282    HG   LEU  35           HG       LEU  35  -8.556   0.972 -10.865
  283   HD11  LEU  35          2HD1      LEU  35 -10.789   1.925 -10.550
  284   HD12  LEU  35          1HD1      LEU  35 -10.142   3.021  -9.329
  285   HD13  LEU  35          3HD1      LEU  35 -10.127   1.281  -9.048
  286   HD21  LEU  35          3HD2      LEU  35  -7.560   2.831 -12.056
  287   HD22  LEU  35          2HD2      LEU  35  -8.568   3.970 -11.163
  288   HD23  LEU  35          1HD2      LEU  35  -9.309   2.823 -12.282
  289    H    ILE  36           H        ILE  36  -4.929  -0.277  -8.334
  290    HA   ILE  36           HA       ILE  36  -4.321   1.117  -5.833
  291    HB   ILE  36           HB       ILE  36  -4.540  -1.318  -5.668
  292   HG12  ILE  36          2HG1      ILE  36  -1.698  -0.369  -5.272
  293   HG13  ILE  36          3HG1      ILE  36  -3.029  -0.055  -4.169
  294   HG21  ILE  36          2HG2      ILE  36  -2.182  -1.412  -7.545
  295   HG22  ILE  36          1HG2      ILE  36  -3.825  -1.945  -7.904
  296   HG23  ILE  36          3HG2      ILE  36  -2.869  -2.793  -6.688
  297   HD11  ILE  36          3HD1      ILE  36  -1.911  -2.759  -4.864
  298   HD12  ILE  36          2HD1      ILE  36  -3.267  -2.451  -3.779
  299   HD13  ILE  36          1HD1      ILE  36  -1.656  -1.870  -3.361
  300    H    LYS  37           H        LYS  37  -2.485   2.156  -5.506
  301    HA   LYS  37           HA       LYS  37  -0.547   2.323  -7.723
  302    HB2  LYS  37           HB2      LYS  37  -1.872   4.422  -7.152
  303    HB3  LYS  37           HB3      LYS  37  -1.093   4.391  -5.580
  304    HG2  LYS  37           HG2      LYS  37   0.150   5.921  -6.771
  305    HG3  LYS  37           HG3      LYS  37   1.106   4.444  -6.874
  306    HD2  LYS  37           HD2      LYS  37   1.049   5.524  -9.030
  307    HD3  LYS  37           HD3      LYS  37   0.138   4.014  -9.105
  308    HE2  LYS  37           HE2      LYS  37  -1.898   5.097  -9.249
  309    HE3  LYS  37           HE3      LYS  37  -1.290   6.565  -8.486
  310    HZ1  LYS  37           HZ1      LYS  37  -0.428   5.660 -11.178
  311    HZ2  LYS  37           HZ2      LYS  37  -0.153   7.169 -10.451
  312    HZ3  LYS  37           HZ3      LYS  37  -1.722   6.732 -10.931
  313    H    VAL  38           H        VAL  38   0.944   0.832  -7.075
  314    HA   VAL  38           HA       VAL  38   1.640   0.746  -4.231
  315    HB   VAL  38           HB       VAL  38   0.891  -1.378  -5.143
  316   HG11  VAL  38          2HG1      VAL  38   2.186  -2.565  -6.850
  317   HG12  VAL  38          1HG1      VAL  38   3.206  -1.140  -7.052
  318   HG13  VAL  38          3HG1      VAL  38   1.494  -1.065  -7.469
  319   HG21  VAL  38          3HG2      VAL  38   2.751  -2.787  -4.459
  320   HG22  VAL  38          2HG2      VAL  38   2.579  -1.409  -3.371
  321   HG23  VAL  38          1HG2      VAL  38   3.854  -1.417  -4.590
  322    H    GLU  39           H        GLU  39   3.576   1.202  -3.479
  323    HA   GLU  39           HA       GLU  39   5.710   1.894  -5.390
  324    HB2  GLU  39           HB2      GLU  39   4.876   3.704  -3.873
  325    HB3  GLU  39           HB3      GLU  39   5.393   2.741  -2.497
  326    HG2  GLU  39           HG2      GLU  39   7.688   2.902  -3.177
  327    HG3  GLU  39           HG3      GLU  39   7.225   3.719  -4.667
  328    H    THR  40           H        THR  40   7.437   0.613  -5.444
  329    HA   THR  40           HA       THR  40   7.763  -1.373  -3.312
  330    HB   THR  40           HB       THR  40   9.286  -2.399  -5.235
  331    HG1  THR  40           HG1      THR  40   8.403  -1.905  -7.282
  332   HG21  THR  40          3HG2      THR  40   7.382  -3.735  -5.952
  333   HG22  THR  40          1HG2      THR  40   6.270  -2.546  -5.272
  334   HG23  THR  40          2HG2      THR  40   7.327  -3.475  -4.208
  335    H    GLN  41           H        GLN  41   9.181  -0.572  -1.860
  336    HA   GLN  41           HA       GLN  41  11.721   0.571  -2.858
  337    HB2  GLN  41           HB2      GLN  41  10.886   0.485   0.031
  338    HB3  GLN  41           HB3      GLN  41  12.001   1.588  -0.759
  339    HG2  GLN  41           HG2      GLN  41  10.105   2.647  -1.907
  340    HG3  GLN  41           HG3      GLN  41   9.006   1.570  -1.044
  341   HE21  GLN  41          1HE2      GLN  41   9.066   4.429  -0.959
  342   HE22  GLN  41          2HE2      GLN  41   9.392   4.869   0.681
  343    H    GLY  42           H        GLY  42  13.171  -0.006  -0.512
  344    HA2  GLY  42           HA1      GLY  42  13.105  -2.359   0.745
  345    HA3  GLY  42           HA2      GLY  42  13.647  -2.857  -0.851
  346    H    ALA  43           H        ALA  43  15.673  -2.190  -1.605
  347    HA   ALA  43           HA       ALA  43  17.516  -1.575   0.602
  348    HB1  ALA  43           HB1      ALA  43  19.261  -2.555  -0.785
  349    HB2  ALA  43           HB2      ALA  43  17.911  -3.676  -0.598
  350    HB3  ALA  43           HB3      ALA  43  18.109  -2.775  -2.101
  351    H    THR  44           H        THR  44  17.065   0.674   0.548
  352    HA   THR  44           HA       THR  44  17.796   2.786   0.171
  353    HB   THR  44           HB       THR  44  19.557   1.555  -1.953
  354    HG1  THR  44           HG1      THR  44  20.369   2.488   0.605
  355   HG21  THR  44          3HG2      THR  44  19.222   3.959  -2.330
  356   HG22  THR  44          1HG2      THR  44  20.868   3.618  -1.798
  357   HG23  THR  44          2HG2      THR  44  19.695   4.286  -0.663
  358    H    GLY  45           H        GLY  45  16.842   0.949  -2.708
  359    HA2  GLY  45           HA1      GLY  45  16.165   3.497  -4.017
  360    HA3  GLY  45           HA2      GLY  45  16.539   2.005  -4.863
  361    H    ILE  46           H        ILE  46  14.275   3.626  -5.282
  362    HA   ILE  46           HA       ILE  46  12.131   1.803  -4.399
  363    HB   ILE  46           HB       ILE  46  11.861   4.710  -5.218
  364   HG12  ILE  46          2HG1      ILE  46  11.647   3.493  -2.453
  365   HG13  ILE  46          3HG1      ILE  46  13.035   4.404  -3.039
  366   HG21  ILE  46          2HG2      ILE  46   9.897   3.358  -5.716
  367   HG22  ILE  46          1HG2      ILE  46   9.569   4.491  -4.404
  368   HG23  ILE  46          3HG2      ILE  46   9.856   2.788  -4.047
  369   HD11  ILE  46          3HD1      ILE  46  11.688   6.393  -3.248
  370   HD12  ILE  46          2HD1      ILE  46  11.543   5.737  -1.618
  371   HD13  ILE  46          1HD1      ILE  46  10.242   5.495  -2.785
  372    H    GLU  47           H        GLU  47  11.000   0.809  -6.004
  373    HA   GLU  47           HA       GLU  47  12.002   1.079  -8.700
  374    HB2  GLU  47           HB2      GLU  47  11.560  -1.140  -7.781
  375    HB3  GLU  47           HB3      GLU  47   9.869  -0.724  -7.544
  376    HG2  GLU  47           HG2      GLU  47   9.691  -0.406 -10.018
  377    HG3  GLU  47           HG3      GLU  47  11.320  -1.067 -10.153
  378    H    ASN  48           H        ASN  48   8.979   1.751  -6.999
  379    HA   ASN  48           HA       ASN  48   8.059   3.200  -9.387
  380    HB2  ASN  48           HB2      ASN  48   6.848   0.978  -9.001
  381    HB3  ASN  48           HB3      ASN  48   6.184   1.710  -7.550
  382   HD21  ASN  48          1HD2      ASN  48   4.657   3.326  -7.723
  383   HD22  ASN  48          2HD2      ASN  48   3.842   3.679  -9.207
  384    H    GLU  49           H        GLU  49   8.830   5.107  -8.428
  385    HA   GLU  49           HA       GLU  49   8.172   5.884  -5.773
  386    HB2  GLU  49           HB2      GLU  49   8.993   7.691  -8.050
  387    HB3  GLU  49           HB3      GLU  49   9.159   8.007  -6.329
  388    HG2  GLU  49           HG2      GLU  49  10.796   6.232  -6.133
  389    HG3  GLU  49           HG3      GLU  49  10.600   5.843  -7.842
  390    H    LEU  50           H        LEU  50   6.264   6.529  -5.056
  391    HA   LEU  50           HA       LEU  50   4.191   7.382  -6.892
  392    HB2  LEU  50           HB2      LEU  50   4.106   7.396  -3.876
  393    HB3  LEU  50           HB3      LEU  50   2.741   7.431  -4.974
  394    HG   LEU  50           HG       LEU  50   4.596   5.107  -4.465
  395   HD11  LEU  50          2HD1      LEU  50   2.954   5.450  -2.723
  396   HD12  LEU  50          1HD1      LEU  50   2.540   4.022  -3.671
  397   HD13  LEU  50          3HD1      LEU  50   1.663   5.531  -3.921
  398   HD21  LEU  50          3HD2      LEU  50   3.268   3.842  -6.032
  399   HD22  LEU  50          2HD2      LEU  50   3.961   5.245  -6.844
  400   HD23  LEU  50          1HD2      LEU  50   2.261   5.251  -6.367
  401    H    THR  51           H        THR  51   3.994   9.419  -7.564
  402    HA   THR  51           HA       THR  51   5.477  11.543  -6.351
  403    HB   THR  51           HB       THR  51   4.387  13.012  -7.975
  404    HG1  THR  51           HG1      THR  51   2.904  10.718  -8.831
  405   HG21  THR  51          3HG2      THR  51   5.196  10.386  -9.224
  406   HG22  THR  51          1HG2      THR  51   6.302  11.656  -8.701
  407   HG23  THR  51          2HG2      THR  51   5.176  11.959 -10.025
  408    H    GLU  52           H        GLU  52   4.360  13.622  -5.706
  409    HA   GLU  52           HA       GLU  52   2.592  13.174  -3.568
  410    HB2  GLU  52           HB2      GLU  52   4.127  15.181  -4.021
  411    HB3  GLU  52           HB3      GLU  52   2.839  15.787  -5.050
  412    HG2  GLU  52           HG2      GLU  52   1.329  15.889  -3.183
  413    HG3  GLU  52           HG3      GLU  52   2.526  15.133  -2.130
  414    H    LYS  53           H        LYS  53   2.095  13.706  -6.949
  415    HA   LYS  53           HA       LYS  53  -0.662  14.349  -6.900
  416    HB2  LYS  53           HB2      LYS  53   0.808  14.696  -8.871
  417    HB3  LYS  53           HB3      LYS  53   0.925  12.952  -9.062
  418    HG2  LYS  53           HG2      LYS  53  -1.623  12.980  -9.258
  419    HG3  LYS  53           HG3      LYS  53  -1.456  14.722  -9.485
  420    HD2  LYS  53           HD2      LYS  53  -1.524  13.672 -11.644
  421    HD3  LYS  53           HD3      LYS  53   0.114  14.261 -11.363
  422    HE2  LYS  53           HE2      LYS  53   0.800  12.003 -10.688
  423    HE3  LYS  53           HE3      LYS  53  -0.835  11.421 -10.992
  424    HZ1  LYS  53           HZ1      LYS  53  -0.550  12.136 -13.327
  425    HZ2  LYS  53           HZ2      LYS  53   0.523  10.908 -12.865
  426    HZ3  LYS  53           HZ3      LYS  53   1.073  12.507 -12.992
  427    H    ASP  54           H        ASP  54   1.043  11.274  -7.543
  428    HA   ASP  54           HA       ASP  54  -1.200   9.640  -7.833
  429    HB2  ASP  54           HB2      ASP  54   1.488   8.855  -6.684
  430    HB3  ASP  54           HB3      ASP  54   0.270   7.739  -7.283
  431    H    VAL  55           H        VAL  55   0.577  10.566  -4.968
  432    HA   VAL  55           HA       VAL  55  -0.765   8.829  -3.184
  433    HB   VAL  55           HB       VAL  55   0.742  11.384  -2.619
  434   HG11  VAL  55          2HG1      VAL  55  -0.576  10.859  -0.706
  435   HG12  VAL  55          1HG1      VAL  55   1.077  10.328  -0.371
  436   HG13  VAL  55          3HG1      VAL  55  -0.159   9.151  -0.819
  437   HG21  VAL  55          3HG2      VAL  55   2.625   9.901  -2.151
  438   HG22  VAL  55          2HG2      VAL  55   2.064   9.710  -3.812
  439   HG23  VAL  55          1HG2      VAL  55   1.639   8.507  -2.595
  440    H    ASN  56           H        ASN  56  -1.381  12.135  -4.252
  441    HA   ASN  56           HA       ASN  56  -3.500  12.580  -2.380
  442    HB2  ASN  56           HB2      ASN  56  -2.406  14.042  -4.725
  443    HB3  ASN  56           HB3      ASN  56  -4.071  14.390  -4.268
  444   HD21  ASN  56          1HD2      ASN  56  -0.735  14.648  -3.362
  445   HD22  ASN  56          2HD2      ASN  56  -0.978  15.705  -2.006
  446    H    ILE  57           H        ILE  57  -3.240  11.137  -5.523
  447    HA   ILE  57           HA       ILE  57  -6.007  11.115  -6.167
  448    HB   ILE  57           HB       ILE  57  -3.818   9.217  -7.049
  449   HG12  ILE  57          2HG1      ILE  57  -4.997  11.636  -8.433
  450   HG13  ILE  57          3HG1      ILE  57  -3.425  11.588  -7.640
  451   HG21  ILE  57          2HG2      ILE  57  -6.567   9.673  -8.201
  452   HG22  ILE  57          1HG2      ILE  57  -6.020   8.228  -7.353
  453   HG23  ILE  57          3HG2      ILE  57  -5.312   8.657  -8.910
  454   HD11  ILE  57          3HD1      ILE  57  -2.671   9.908  -9.238
  455   HD12  ILE  57          2HD1      ILE  57  -3.203  11.383 -10.044
  456   HD13  ILE  57          1HD1      ILE  57  -4.244   9.960 -10.033
  457    H    GLY  58           H        GLY  58  -3.855   8.725  -4.653
  458    HA2  GLY  58           HA1      GLY  58  -5.794   6.746  -4.197
  459    HA3  GLY  58           HA2      GLY  58  -4.281   6.911  -3.323
  460    H    GLU  59           H        GLU  59  -7.172   6.305  -2.606
  461    HA   GLU  59           HA       GLU  59  -7.934   8.443  -0.821
  462    HB2  GLU  59           HB2      GLU  59  -9.023   5.633  -1.123
  463    HB3  GLU  59           HB3      GLU  59  -9.754   6.907  -0.161
  464    HG2  GLU  59           HG2      GLU  59  -9.344   7.056  -3.136
  465    HG3  GLU  59           HG3      GLU  59 -10.831   6.514  -2.361
  466    H    VAL  60           H        VAL  60  -7.388   4.973  -0.231
  467    HA   VAL  60           HA       VAL  60  -6.450   5.643   2.459
  468    HB   VAL  60           HB       VAL  60  -6.661   3.179   2.897
  469   HG11  VAL  60          2HG1      VAL  60  -9.091   3.215   3.078
  470   HG12  VAL  60          1HG1      VAL  60  -9.162   4.577   1.960
  471   HG13  VAL  60          3HG1      VAL  60  -8.403   4.772   3.540
  472   HG21  VAL  60          3HG2      VAL  60  -8.016   3.173   0.199
  473   HG22  VAL  60          2HG2      VAL  60  -7.968   1.825   1.337
  474   HG23  VAL  60          1HG2      VAL  60  -6.480   2.397   0.583
  475    H    VAL  61           H        VAL  61  -4.539   4.826   3.296
  476    HA   VAL  61           HA       VAL  61  -2.547   4.063   1.260
  477    HB   VAL  61           HB       VAL  61  -2.024   5.293   3.967
  478   HG11  VAL  61          2HG1      VAL  61  -0.243   4.861   1.574
  479   HG12  VAL  61          1HG1      VAL  61  -0.156   4.013   3.117
  480   HG13  VAL  61          3HG1      VAL  61   0.214   5.736   3.035
  481   HG21  VAL  61          3HG2      VAL  61  -3.256   6.869   2.575
  482   HG22  VAL  61          2HG2      VAL  61  -2.089   6.645   1.275
  483   HG23  VAL  61          1HG2      VAL  61  -1.584   7.392   2.791
  484    H    ILE  62           H        ILE  62  -1.427   2.188   1.539
  485    HA   ILE  62           HA       ILE  62  -1.744   0.793   4.120
  486    HB   ILE  62           HB       ILE  62  -1.653  -0.479   1.371
  487   HG12  ILE  62          2HG1      ILE  62  -3.863  -0.392   3.438
  488   HG13  ILE  62          3HG1      ILE  62  -3.827   0.539   1.944
  489   HG21  ILE  62          2HG2      ILE  62  -1.837  -1.769   4.091
  490   HG22  ILE  62          1HG2      ILE  62  -0.446  -1.815   3.010
  491   HG23  ILE  62          3HG2      ILE  62  -1.951  -2.606   2.543
  492   HD11  ILE  62          3HD1      ILE  62  -3.977  -2.459   2.182
  493   HD12  ILE  62          2HD1      ILE  62  -3.872  -1.561   0.667
  494   HD13  ILE  62          1HD1      ILE  62  -5.282  -1.367   1.711
  495    H    PHE  63           H        PHE  63   0.108   0.304   5.095
  496    HA   PHE  63           HA       PHE  63   2.573   0.456   3.493
  497    HB2  PHE  63           HB2      PHE  63   2.038   1.171   6.365
  498    HB3  PHE  63           HB3      PHE  63   3.666   0.836   5.792
  499    HD1  PHE  63           HD2      PHE  63   4.241   2.138   3.524
  500    HD2  PHE  63           HD1      PHE  63   1.407   3.366   6.447
  501    HE1  PHE  63           HE2      PHE  63   4.466   4.461   2.758
  502    HE2  PHE  63           HE1      PHE  63   1.625   5.696   5.683
  503    HZ   PHE  63           HZ       PHE  63   3.160   6.240   3.836
  504    H    ALA  64           H        ALA  64   3.105  -1.559   2.967
  505    HA   ALA  64           HA       ALA  64   3.233  -3.542   5.140
  506    HB1  ALA  64           HB1      ALA  64   3.392  -5.244   3.396
  507    HB2  ALA  64           HB2      ALA  64   1.946  -4.261   3.166
  508    HB3  ALA  64           HB3      ALA  64   3.365  -3.993   2.153
  509    H    VAL  65           H        VAL  65   5.150  -2.911   6.101
  510    HA   VAL  65           HA       VAL  65   7.501  -2.873   4.337
  511    HB   VAL  65           HB       VAL  65   8.401  -0.931   5.650
  512   HG11  VAL  65          2HG1      VAL  65   5.894  -0.468   4.032
  513   HG12  VAL  65          1HG1      VAL  65   7.534  -0.626   3.399
  514   HG13  VAL  65          3HG1      VAL  65   7.106   0.757   4.409
  515   HG21  VAL  65          3HG2      VAL  65   6.792   0.498   6.825
  516   HG22  VAL  65          2HG2      VAL  65   6.933  -1.086   7.588
  517   HG23  VAL  65          1HG2      VAL  65   5.537  -0.716   6.576
  518    H    ASP  66           H        ASP  66   9.395  -3.468   5.149
  519    HA   ASP  66           HA       ASP  66   9.426  -4.724   7.811
  520    HB2  ASP  66           HB2      ASP  66   9.834  -6.316   6.054
  521    HB3  ASP  66           HB3      ASP  66  10.995  -5.250   5.278
  522    H    THR  67           H        THR  67  10.464  -2.117   6.009
  523    HA   THR  67           HA       THR  67  12.369  -1.334   8.075
  524    HB   THR  67           HB       THR  67  13.729  -2.226   6.213
  525    HG1  THR  67           HG1      THR  67  15.034  -0.700   6.861
  526   HG21  THR  67          3HG2      THR  67  12.187  -1.797   4.366
  527   HG22  THR  67          1HG2      THR  67  13.764  -1.076   4.050
  528   HG23  THR  67          2HG2      THR  67  12.418  -0.060   4.563
  529    H    LYS  68           H        LYS  68  13.065   1.132   7.065
  530    HA   LYS  68           HA       LYS  68  10.670   2.593   7.643
  531    HB2  LYS  68           HB2      LYS  68  12.076   4.586   7.478
  532    HB3  LYS  68           HB3      LYS  68  12.850   3.356   8.467
  533    HG2  LYS  68           HG2      LYS  68  14.429   2.855   6.827
  534    HG3  LYS  68           HG3      LYS  68  13.489   3.640   5.555
  535    HD2  LYS  68           HD2      LYS  68  13.895   5.818   6.646
  536    HD3  LYS  68           HD3      LYS  68  14.890   5.000   7.852
  537    HE2  LYS  68           HE2      LYS  68  16.491   4.355   6.204
  538    HE3  LYS  68           HE3      LYS  68  15.441   4.892   4.892
  539    HZ1  LYS  68           HZ1      LYS  68  15.700   7.156   5.617
  540    HZ2  LYS  68           HZ2      LYS  68  17.230   6.470   5.371
  541    HZ3  LYS  68           HZ3      LYS  68  16.635   6.675   6.947
  542    H    VAL  69           H        VAL  69   9.521   3.963   6.339
  543    HA   VAL  69           HA       VAL  69  10.067   3.800   3.458
  544    HB   VAL  69           HB       VAL  69   7.921   2.919   3.740
  545   HG11  VAL  69          2HG1      VAL  69   7.598   3.452   6.079
  546   HG12  VAL  69          1HG1      VAL  69   6.174   3.915   5.147
  547   HG13  VAL  69          3HG1      VAL  69   7.319   5.148   5.678
  548   HG21  VAL  69          3HG2      VAL  69   7.505   5.856   3.204
  549   HG22  VAL  69          2HG2      VAL  69   6.360   4.572   2.824
  550   HG23  VAL  69          1HG2      VAL  69   7.924   4.625   2.012
  551    H    ARG  70           H        ARG  70  10.887   5.528   2.560
  552    HA   ARG  70           HA       ARG  70  11.299   7.932   4.037
  553    HB2  ARG  70           HB2      ARG  70  12.869   6.831   2.354
  554    HB3  ARG  70           HB3      ARG  70  11.831   7.492   1.100
  555    HG2  ARG  70           HG2      ARG  70  12.302   9.757   1.924
  556    HG3  ARG  70           HG3      ARG  70  13.377   9.073   3.147
  557    HD2  ARG  70           HD2      ARG  70  13.699   9.060   0.158
  558    HD3  ARG  70           HD3      ARG  70  14.771   9.760   1.371
  559    HE   ARG  70           HE       ARG  70  14.422   6.901   1.577
  560   HH11  ARG  70          2HH1      ARG  70  16.349   9.506   0.251
  561   HH12  ARG  70          1HH1      ARG  70  17.708   8.481  -0.119
  562   HH21  ARG  70          2HH2      ARG  70  16.219   5.556   1.110
  563   HH22  ARG  70          1HH2      ARG  70  17.639   6.245   0.394
  564    H    ASN  71           H        ASN  71   9.410   7.052   1.191
  565    HA   ASN  71           HA       ASN  71   8.495   9.644   0.582
  566    HB2  ASN  71           HB2      ASN  71   7.648   6.895  -0.263
  567    HB3  ASN  71           HB3      ASN  71   6.708   8.311  -0.746
  568   HD21  ASN  71          1HD2      ASN  71   7.320   7.651  -2.926
  569   HD22  ASN  71          2HD2      ASN  71   8.853   8.159  -3.548
  570    H    LYS  72           H        LYS  72   7.689   7.740   3.176
  571    HA   LYS  72           HA       LYS  72   4.963   7.966   3.538
  572    HB2  LYS  72           HB2      LYS  72   6.318   6.729   5.117
  573    HB3  LYS  72           HB3      LYS  72   7.152   8.197   5.613
  574    HG2  LYS  72           HG2      LYS  72   5.106   9.078   6.558
  575    HG3  LYS  72           HG3      LYS  72   4.215   7.666   5.996
  576    HD2  LYS  72           HD2      LYS  72   6.574   7.298   7.792
  577    HD3  LYS  72           HD3      LYS  72   5.035   7.826   8.476
  578    HE2  LYS  72           HE2      LYS  72   3.988   5.845   7.289
  579    HE3  LYS  72           HE3      LYS  72   5.630   5.285   6.977
  580    HZ1  LYS  72           HZ1      LYS  72   4.572   4.321   8.995
  581    HZ2  LYS  72           HZ2      LYS  72   4.577   5.871   9.689
  582    HZ3  LYS  72           HZ3      LYS  72   6.042   5.112   9.298
  583    H    GLU  73           H        GLU  73   7.349  10.436   3.546
  584    HA   GLU  73           HA       GLU  73   6.410  12.572   4.919
  585    HB2  GLU  73           HB2      GLU  73   7.128  12.777   1.996
  586    HB3  GLU  73           HB3      GLU  73   7.302  14.020   3.221
  587    HG2  GLU  73           HG2      GLU  73   9.107  12.871   4.244
  588    HG3  GLU  73           HG3      GLU  73   8.831  11.434   3.261
  589    H    ARG  74           H        ARG  74   5.135  11.475   1.791
  590    HA   ARG  74           HA       ARG  74   3.157  13.592   1.749
  591    HB2  ARG  74           HB2      ARG  74   2.559  12.668  -0.455
  592    HB3  ARG  74           HB3      ARG  74   4.281  13.000  -0.320
  593    HG2  ARG  74           HG2      ARG  74   4.178  10.406   0.467
  594    HG3  ARG  74           HG3      ARG  74   2.866  10.465  -0.717
  595    HD2  ARG  74           HD2      ARG  74   4.936   9.874  -1.826
  596    HD3  ARG  74           HD3      ARG  74   4.440  11.488  -2.331
  597    HE   ARG  74           HE       ARG  74   6.206  11.686  -0.142
  598   HH11  ARG  74          2HH1      ARG  74   6.224  10.811  -3.530
  599   HH12  ARG  74          1HH1      ARG  74   7.855  11.357  -3.797
  600   HH21  ARG  74          2HH2      ARG  74   8.376  12.373  -0.472
  601   HH22  ARG  74          1HH2      ARG  74   9.061  12.248  -2.061
  602    H    PHE  75           H        PHE  75   3.331  10.271   2.661
  603    HA   PHE  75           HA       PHE  75   0.458   9.894   2.689
  604    HB2  PHE  75           HB2      PHE  75   2.634   8.129   3.815
  605    HB3  PHE  75           HB3      PHE  75   0.964   7.682   3.508
  606    HD1  PHE  75           HD2      PHE  75   0.179   7.316   1.214
  607    HD2  PHE  75           HD1      PHE  75   4.253   8.178   2.056
  608    HE1  PHE  75           HE2      PHE  75   0.814   6.511  -1.023
  609    HE2  PHE  75           HE1      PHE  75   4.893   7.374  -0.174
  610    HZ   PHE  75           HZ       PHE  75   3.173   6.539  -1.719
  611    H    ASP  76           H        ASP  76   2.000  11.914   4.370
  612    HA   ASP  76           HA       ASP  76   1.827  10.894   7.070
  613    HB2  ASP  76           HB2      ASP  76   3.697  12.330   6.485
  614    HB3  ASP  76           HB3      ASP  76   2.597  13.616   6.004
  615    H    GLY  77           H        GLY  77   0.322  13.552   5.233
  616    HA2  GLY  77           HA1      GLY  77  -1.814  13.745   7.209
  617    HA3  GLY  77           HA2      GLY  77  -1.626  14.742   5.768
  618    H    LYS  78           H        LYS  78  -1.758  11.244   6.238
  619    HA   LYS  78           HA       LYS  78  -4.060  11.088   4.417
  620    HB2  LYS  78           HB2      LYS  78  -1.587   9.343   4.286
  621    HB3  LYS  78           HB3      LYS  78  -3.006   9.203   3.260
  622    HG2  LYS  78           HG2      LYS  78  -1.363  11.707   3.344
  623    HG3  LYS  78           HG3      LYS  78  -0.950  10.351   2.293
  624    HD2  LYS  78           HD2      LYS  78  -3.671  11.625   2.304
  625    HD3  LYS  78           HD3      LYS  78  -2.356  12.189   1.270
  626    HE2  LYS  78           HE2      LYS  78  -2.475  10.396  -0.090
  627    HE3  LYS  78           HE3      LYS  78  -2.856   9.289   1.220
  628    HZ1  LYS  78           HZ1      LYS  78  -5.134  10.077   1.189
  629    HZ2  LYS  78           HZ2      LYS  78  -4.697   9.539  -0.359
  630    HZ3  LYS  78           HZ3      LYS  78  -4.772  11.198  -0.031
  631    H    VAL  79           H        VAL  79  -5.068   8.878   4.513
  632    HA   VAL  79           HA       VAL  79  -4.989   7.907   7.277
  633    HB   VAL  79           HB       VAL  79  -7.215   8.435   6.536
  634   HG11  VAL  79          2HG1      VAL  79  -8.284   7.279   4.653
  635   HG12  VAL  79          1HG1      VAL  79  -6.740   6.518   4.262
  636   HG13  VAL  79          3HG1      VAL  79  -6.916   8.268   4.143
  637   HG21  VAL  79          3HG2      VAL  79  -7.015   6.529   8.014
  638   HG22  VAL  79          2HG2      VAL  79  -6.796   5.451   6.635
  639   HG23  VAL  79          1HG2      VAL  79  -8.337   6.274   6.874
  640    H    VAL  80           H        VAL  80  -3.601   6.299   7.658
  641    HA   VAL  80           HA       VAL  80  -3.034   4.456   5.431
  642    HB   VAL  80           HB       VAL  80  -0.775   4.367   5.962
  643   HG11  VAL  80          2HG1      VAL  80  -1.316   6.492   4.941
  644   HG12  VAL  80          1HG1      VAL  80   0.016   6.689   6.078
  645   HG13  VAL  80          3HG1      VAL  80  -1.609   7.208   6.526
  646   HG21  VAL  80          3HG2      VAL  80   0.212   5.296   8.025
  647   HG22  VAL  80          2HG2      VAL  80  -0.905   3.965   8.321
  648   HG23  VAL  80          1HG2      VAL  80  -1.414   5.629   8.621
  649    H    LEU  81           H        LEU  81  -2.597   2.305   5.887
  650    HA   LEU  81           HA       LEU  81  -3.080   1.377   8.642
  651    HB2  LEU  81           HB2      LEU  81  -4.992   1.002   6.940
  652    HB3  LEU  81           HB3      LEU  81  -3.925  -0.152   6.177
  653    HG   LEU  81           HG       LEU  81  -5.625  -1.178   7.662
  654   HD11  LEU  81          2HD1      LEU  81  -3.571  -2.382   7.186
  655   HD12  LEU  81          1HD1      LEU  81  -4.118  -2.697   8.832
  656   HD13  LEU  81          3HD1      LEU  81  -2.777  -1.589   8.547
  657   HD21  LEU  81          3HD2      LEU  81  -5.722   0.581   9.345
  658   HD22  LEU  81          2HD2      LEU  81  -4.086   0.181   9.864
  659   HD23  LEU  81          1HD2      LEU  81  -5.389  -0.990  10.076
  660    H    GLU  82           H        GLU  82  -1.264   0.430   9.367
  661    HA   GLU  82           HA       GLU  82   0.705  -0.425   7.355
  662    HB2  GLU  82           HB2      GLU  82   1.177   0.324  10.239
  663    HB3  GLU  82           HB3      GLU  82   2.410  -0.043   9.046
  664    HG2  GLU  82           HG2      GLU  82   1.740   1.911   7.746
  665    HG3  GLU  82           HG3      GLU  82   0.505   2.283   8.944
  666    H    VAL  83           H        VAL  83   1.483  -2.400   7.283
  667    HA   VAL  83           HA       VAL  83   1.066  -4.278   9.489
  668    HB   VAL  83           HB       VAL  83   0.342  -6.046   7.861
  669   HG11  VAL  83          2HG1      VAL  83  -1.326  -5.015   9.269
  670   HG12  VAL  83          1HG1      VAL  83  -2.000  -5.301   7.664
  671   HG13  VAL  83          3HG1      VAL  83  -1.500  -3.675   8.132
  672   HG21  VAL  83          3HG2      VAL  83  -0.547  -5.394   5.694
  673   HG22  VAL  83          2HG2      VAL  83   1.156  -4.954   5.819
  674   HG23  VAL  83          1HG2      VAL  83  -0.090  -3.718   5.992
  675    HA   PRO  84           HA       PRO  84   5.091  -5.830   8.203
  676    HB2  PRO  84           HB2      PRO  84   4.657  -8.549   8.209
  677    HB3  PRO  84           HB3      PRO  84   5.010  -7.598   9.656
  678    HG2  PRO  84           HG2      PRO  84   2.370  -8.526   8.596
  679    HG3  PRO  84           HG3      PRO  84   2.962  -8.514  10.269
  680    HD2  PRO  84           HD2      PRO  84   1.268  -6.643   9.385
  681    HD3  PRO  84           HD3      PRO  84   2.575  -6.236  10.518
  682    H    VAL  85           H        VAL  85   6.123  -6.632   6.324
  683    HA   VAL  85           HA       VAL  85   4.631  -6.225   3.954
  684    HB   VAL  85           HB       VAL  85   7.076  -5.768   4.209
  685   HG11  VAL  85          2HG1      VAL  85   7.743  -7.806   5.346
  686   HG12  VAL  85          1HG1      VAL  85   8.672  -7.594   3.862
  687   HG13  VAL  85          3HG1      VAL  85   7.345  -8.756   3.913
  688   HG21  VAL  85          3HG2      VAL  85   7.684  -6.466   1.923
  689   HG22  VAL  85          2HG2      VAL  85   6.073  -5.754   2.015
  690   HG23  VAL  85          1HG2      VAL  85   6.258  -7.504   1.883
  691    H    SER  86           H        SER  86   5.438  -9.051   5.771
  692    HA   SER  86           HA       SER  86   4.933 -10.954   3.712
  693    HB2  SER  86           HB2      SER  86   4.958 -11.372   6.707
  694    HB3  SER  86           HB3      SER  86   5.170 -12.605   5.464
  695    HG   SER  86           HG       SER  86   7.065 -11.281   6.611
  696    H    ALA  87           H        ALA  87   2.855  -9.122   5.718
  697    HA   ALA  87           HA       ALA  87   0.831 -11.054   6.165
  698    HB1  ALA  87           HB1      ALA  87  -0.526  -9.251   6.977
  699    HB2  ALA  87           HB2      ALA  87   1.129  -9.027   7.544
  700    HB3  ALA  87           HB3      ALA  87   0.518  -8.060   6.200
  701    HA   PRO  88           HA       PRO  88  -1.731  -8.944   2.687
  702    HB2  PRO  88           HB2      PRO  88   0.152  -7.463   0.993
  703    HB3  PRO  88           HB3      PRO  88  -1.361  -6.923   1.724
  704    HG2  PRO  88           HG2      PRO  88   1.031  -6.036   2.579
  705    HG3  PRO  88           HG3      PRO  88  -0.337  -6.270   3.683
  706    HD2  PRO  88           HD2      PRO  88   2.033  -8.043   3.198
  707    HD3  PRO  88           HD3      PRO  88   1.263  -7.590   4.735
  708    H    ILE  89           H        ILE  89   1.132 -10.608   2.358
  709    HA   ILE  89           HA       ILE  89   0.884 -11.429  -0.364
  710    HB   ILE  89           HB       ILE  89   2.272 -12.750   1.981
  711   HG12  ILE  89          2HG1      ILE  89   3.410 -11.168  -0.328
  712   HG13  ILE  89          3HG1      ILE  89   3.133 -10.515   1.281
  713   HG21  ILE  89          2HG2      ILE  89   2.433 -13.401  -0.962
  714   HG22  ILE  89          1HG2      ILE  89   1.753 -14.424   0.306
  715   HG23  ILE  89          3HG2      ILE  89   3.482 -14.071   0.287
  716   HD11  ILE  89          3HD1      ILE  89   5.006 -12.766   0.580
  717   HD12  ILE  89          2HD1      ILE  89   4.728 -12.122   2.199
  718   HD13  ILE  89          1HD1      ILE  89   5.462 -11.105   0.960
  719    H    LYS  90           H        LYS  90  -0.345 -12.513   2.737
  720    HA   LYS  90           HA       LYS  90  -1.709 -14.759   1.455
  721    HB2  LYS  90           HB2      LYS  90  -0.456 -15.255   3.493
  722    HB3  LYS  90           HB3      LYS  90  -1.406 -14.070   4.380
  723    HG2  LYS  90           HG2      LYS  90  -2.152 -16.353   4.821
  724    HG3  LYS  90           HG3      LYS  90  -3.414 -15.393   4.047
  725    HD2  LYS  90           HD2      LYS  90  -2.733 -16.386   1.863
  726    HD3  LYS  90           HD3      LYS  90  -1.624 -17.441   2.741
  727    HE2  LYS  90           HE2      LYS  90  -3.471 -18.438   3.943
  728    HE3  LYS  90           HE3      LYS  90  -4.602 -17.316   3.188
  729    HZ1  LYS  90           HZ1      LYS  90  -3.941 -18.287   1.014
  730    HZ2  LYS  90           HZ2      LYS  90  -4.729 -19.383   2.044
  731    HZ3  LYS  90           HZ3      LYS  90  -3.048 -19.464   1.849
  732    H    ASP  91           H        ASP  91  -2.576 -12.215   3.843
  733    HA   ASP  91           HA       ASP  91  -5.372 -12.687   3.073
  734    HB2  ASP  91           HB2      ASP  91  -6.009 -11.951   5.294
  735    HB3  ASP  91           HB3      ASP  91  -4.820 -13.239   5.404
  736    H    ALA  92           H        ALA  92  -3.922 -11.037   1.449
  737    HA   ALA  92           HA       ALA  92  -3.895  -8.317   1.952
  738    HB1  ALA  92           HB1      ALA  92  -2.906  -9.339  -0.033
  739    HB2  ALA  92           HB2      ALA  92  -4.517  -9.680  -0.664
  740    HB3  ALA  92           HB3      ALA  92  -3.983  -8.011  -0.467
  741    H    GLU  93           H        GLU  93  -6.596 -10.363   1.002
  742    HA   GLU  93           HA       GLU  93  -8.445  -8.381   0.288
  743    HB2  GLU  93           HB2      GLU  93  -8.984 -11.047   1.614
  744    HB3  GLU  93           HB3      GLU  93 -10.158 -10.075   0.739
  745    HG2  GLU  93           HG2      GLU  93  -9.058 -10.440  -1.325
  746    HG3  GLU  93           HG3      GLU  93  -7.656 -11.147  -0.526
  747    H    LYS  94           H        LYS  94  -7.649  -9.795   3.429
  748    HA   LYS  94           HA       LYS  94  -9.626  -8.416   4.919
  749    HB2  LYS  94           HB2      LYS  94  -6.972  -9.616   5.707
  750    HB3  LYS  94           HB3      LYS  94  -8.095  -8.923   6.866
  751    HG2  LYS  94           HG2      LYS  94  -9.719 -10.599   6.427
  752    HG3  LYS  94           HG3      LYS  94  -8.826 -11.181   5.019
  753    HD2  LYS  94           HD2      LYS  94  -8.550 -12.618   7.030
  754    HD3  LYS  94           HD3      LYS  94  -7.030 -11.972   6.408
  755    HE2  LYS  94           HE2      LYS  94  -7.740 -10.041   8.177
  756    HE3  LYS  94           HE3      LYS  94  -8.396 -11.476   8.964
  757    HZ1  LYS  94           HZ1      LYS  94  -5.589 -11.151   8.038
  758    HZ2  LYS  94           HZ2      LYS  94  -6.218 -12.507   8.841
  759    HZ3  LYS  94           HZ3      LYS  94  -6.111 -11.014   9.645
  760    H    VAL  95           H        VAL  95  -6.219  -7.780   4.231
  761    HA   VAL  95           HA       VAL  95  -5.895  -5.458   5.746
  762    HB   VAL  95           HB       VAL  95  -4.534  -6.108   3.121
  763   HG11  VAL  95          2HG1      VAL  95  -2.700  -4.743   3.987
  764   HG12  VAL  95          1HG1      VAL  95  -3.651  -4.375   5.428
  765   HG13  VAL  95          3HG1      VAL  95  -4.188  -3.806   3.847
  766   HG21  VAL  95          3HG2      VAL  95  -4.350  -7.969   4.685
  767   HG22  VAL  95          2HG2      VAL  95  -3.757  -6.875   5.936
  768   HG23  VAL  95          1HG2      VAL  95  -2.795  -7.162   4.486
  769    H    ILE  96           H        ILE  96  -7.033  -5.890   2.427
  770    HA   ILE  96           HA       ILE  96  -7.222  -3.160   1.745
  771    HB   ILE  96           HB       ILE  96  -8.726  -5.560   0.683
  772   HG12  ILE  96          2HG1      ILE  96  -6.424  -3.958  -0.456
  773   HG13  ILE  96          3HG1      ILE  96  -6.267  -5.520   0.340
  774   HG21  ILE  96          2HG2      ILE  96  -8.638  -2.742  -0.400
  775   HG22  ILE  96          1HG2      ILE  96 -10.048  -3.561   0.270
  776   HG23  ILE  96          3HG2      ILE  96  -9.327  -4.134  -1.234
  777   HD11  ILE  96          3HD1      ILE  96  -7.587  -6.561  -1.402
  778   HD12  ILE  96          2HD1      ILE  96  -6.203  -5.712  -2.086
  779   HD13  ILE  96          1HD1      ILE  96  -7.813  -4.997  -2.186
  780    H    ASN  97           H        ASN  97  -9.688  -5.432   2.946
  781    HA   ASN  97           HA       ASN  97 -11.769  -3.536   3.105
  782    HB2  ASN  97           HB2      ASN  97 -11.309  -6.195   4.430
  783    HB3  ASN  97           HB3      ASN  97 -12.708  -5.209   4.847
  784   HD21  ASN  97          1HD2      ASN  97 -11.227  -7.228   2.478
  785   HD22  ASN  97          2HD2      ASN  97 -12.589  -7.330   1.409
  786    H    ALA  98           H        ALA  98  -9.280  -4.515   5.398
  787    HA   ALA  98           HA       ALA  98 -10.255  -3.158   7.656
  788    HB1  ALA  98           HB1      ALA  98  -7.969  -3.308   8.517
  789    HB2  ALA  98           HB2      ALA  98  -8.486  -4.832   7.798
  790    HB3  ALA  98           HB3      ALA  98  -7.393  -3.766   6.915
  791    H    ALA  99           H        ALA  99  -8.231  -2.095   4.965
  792    HA   ALA  99           HA       ALA  99  -7.701   0.503   6.022
  793    HB1  ALA  99           HB1      ALA  99  -6.891   1.026   3.770
  794    HB2  ALA  99           HB2      ALA  99  -6.251  -0.513   4.345
  795    HB3  ALA  99           HB3      ALA  99  -7.570  -0.489   3.175
  796    H    LEU 100           H        LEU 100 -10.086  -0.824   3.767
  797    HA   LEU 100           HA       LEU 100 -11.305   1.614   3.044
  798    HB2  LEU 100           HB2      LEU 100 -12.593  -1.113   3.216
  799    HB3  LEU 100           HB3      LEU 100 -13.212   0.265   2.329
  800    HG   LEU 100           HG       LEU 100 -10.678  -1.247   1.706
  801   HD11  LEU 100          2HD1      LEU 100 -12.744  -2.449   1.156
  802   HD12  LEU 100          1HD1      LEU 100 -11.855  -1.964  -0.287
  803   HD13  LEU 100          3HD1      LEU 100 -13.288  -1.064   0.209
  804   HD21  LEU 100          3HD2      LEU 100 -11.952   1.094   0.297
  805   HD22  LEU 100          2HD2      LEU 100 -10.570   0.167  -0.291
  806   HD23  LEU 100          1HD2      LEU 100 -10.431   1.114   1.190
  807    H    ALA 101           H        ALA 101 -11.848  -0.617   5.697
  808    HA   ALA 101           HA       ALA 101 -14.283   0.407   6.633
  809    HB1  ALA 101           HB1      ALA 101 -13.793  -0.780   8.699
  810    HB2  ALA 101           HB2      ALA 101 -13.386  -1.769   7.296
  811    HB3  ALA 101           HB3      ALA 101 -12.109  -0.963   8.207
  812    H    LEU 102           H        LEU 102 -11.149   1.763   6.785
  813    HA   LEU 102           HA       LEU 102 -11.489   3.188   9.240
  814    HB2  LEU 102           HB2      LEU 102  -9.564   3.660   6.966
  815    HB3  LEU 102           HB3      LEU 102  -9.484   4.439   8.535
  816    HG   LEU 102           HG       LEU 102  -9.100   1.509   7.949
  817   HD11  LEU 102          2HD1      LEU 102  -7.234   3.595   9.066
  818   HD12  LEU 102          1HD1      LEU 102  -7.189   2.941   7.429
  819   HD13  LEU 102          3HD1      LEU 102  -6.857   1.890   8.807
  820   HD21  LEU 102          3HD2      LEU 102  -9.139   2.926  10.608
  821   HD22  LEU 102          2HD2      LEU 102  -8.726   1.234  10.339
  822   HD23  LEU 102          1HD2      LEU 102 -10.365   1.805  10.015
  823    H    ILE 103           H        ILE 103 -11.944   3.987   5.825
  824    HA   ILE 103           HA       ILE 103 -12.827   6.676   6.584
  825    HB   ILE 103           HB       ILE 103 -12.853   7.128   4.138
  826   HG12  ILE 103          2HG1      ILE 103 -11.556   4.400   3.928
  827   HG13  ILE 103          3HG1      ILE 103 -13.198   4.775   3.415
  828   HG21  ILE 103          2HG2      ILE 103 -10.408   7.182   3.892
  829   HG22  ILE 103          1HG2      ILE 103 -10.259   6.103   5.280
  830   HG23  ILE 103          3HG2      ILE 103 -10.930   7.722   5.488
  831   HD11  ILE 103          3HD1      ILE 103 -10.673   5.944   2.280
  832   HD12  ILE 103          2HD1      ILE 103 -12.311   6.357   1.776
  833   HD13  ILE 103          1HD1      ILE 103 -11.697   4.723   1.526
  834    H    ASP 104           H        ASP 104 -14.051   3.630   5.638
  835    HA   ASP 104           HA       ASP 104 -16.616   4.747   4.801
  836    HB2  ASP 104           HB2      ASP 104 -15.385   2.014   4.640
  837    HB3  ASP 104           HB3      ASP 104 -17.123   2.220   4.462
  838    H    GLU 105           H        GLU 105 -15.167   2.809   7.371
  839    HA   GLU 105           HA       GLU 105 -16.013   1.817   9.235
  840    HB2  GLU 105           HB2      GLU 105 -17.496   4.413   9.069
  841    HB3  GLU 105           HB3      GLU 105 -17.899   3.265  10.338
  842    HG2  GLU 105           HG2      GLU 105 -15.106   4.254   9.858
  843    HG3  GLU 105           HG3      GLU 105 -16.243   5.056  10.940
  844    H    LYS 106           H        LYS 106 -16.959   0.657   6.969
  845    HA   LYS 106           HA       LYS 106 -19.766   0.052   7.618
  846    HB2  LYS 106           HB2      LYS 106 -19.482   1.207   5.436
  847    HB3  LYS 106           HB3      LYS 106 -18.427  -0.095   4.906
  848    HG2  LYS 106           HG2      LYS 106 -20.304  -1.675   5.178
  849    HG3  LYS 106           HG3      LYS 106 -21.351  -0.315   5.589
  850    HD2  LYS 106           HD2      LYS 106 -20.880   0.687   3.399
  851    HD3  LYS 106           HD3      LYS 106 -19.857  -0.692   2.995
  852    HE2  LYS 106           HE2      LYS 106 -22.815  -0.768   3.577
  853    HE3  LYS 106           HE3      LYS 106 -22.061  -0.927   1.994
  854    HZ1  LYS 106           HZ1      LYS 106 -21.768  -2.811   4.275
  855    HZ2  LYS 106           HZ2      LYS 106 -20.957  -2.950   2.796
  856    HZ3  LYS 106           HZ3      LYS 106 -22.645  -3.087   2.850
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1 -17.765   1.611  -8.064
    2    H2   MET   1           H2       MET   1 -17.161   3.059  -8.706
    3    H3   MET   1           H3       MET   1 -18.425   3.096  -7.570
    4    HA   MET   1           HA       MET   1 -16.356   3.729  -6.559
    5    HB2  MET   1           HB2      MET   1 -17.985   2.639  -5.143
    6    HB3  MET   1           HB3      MET   1 -17.461   1.051  -5.689
    7    HG2  MET   1           HG2      MET   1 -16.615   1.536  -3.466
    8    HG3  MET   1           HG3      MET   1 -15.298   1.378  -4.627
    9    HE1  MET   1           HE1      MET   1 -17.407   3.804  -2.404
   10    HE2  MET   1           HE2      MET   1 -16.789   5.384  -2.886
   11    HE3  MET   1           HE3      MET   1 -17.742   4.426  -4.021
   12    H    LYS   2           H        LYS   2 -14.530   3.718  -7.840
   13    HA   LYS   2           HA       LYS   2 -12.908   1.269  -7.639
   14    HB2  LYS   2           HB2      LYS   2 -12.887   3.557  -9.569
   15    HB3  LYS   2           HB3      LYS   2 -11.384   2.717  -9.229
   16    HG2  LYS   2           HG2      LYS   2 -12.344   1.784 -11.197
   17    HG3  LYS   2           HG3      LYS   2 -12.470   0.599  -9.899
   18    HD2  LYS   2           HD2      LYS   2 -14.806   1.219  -9.557
   19    HD3  LYS   2           HD3      LYS   2 -14.681   2.418 -10.846
   20    HE2  LYS   2           HE2      LYS   2 -15.735   0.386 -11.664
   21    HE3  LYS   2           HE3      LYS   2 -14.176   0.637 -12.447
   22    HZ1  LYS   2           HZ1      LYS   2 -13.189  -1.019 -11.063
   23    HZ2  LYS   2           HZ2      LYS   2 -14.595  -1.684 -11.741
   24    HZ3  LYS   2           HZ3      LYS   2 -14.597  -1.167 -10.126
   25    H    ARG   3           H        ARG   3 -12.239   1.512  -5.538
   26    HA   ARG   3           HA       ARG   3 -11.507   3.989  -4.388
   27    HB2  ARG   3           HB2      ARG   3 -12.230   1.937  -3.135
   28    HB3  ARG   3           HB3      ARG   3 -10.654   1.239  -3.478
   29    HG2  ARG   3           HG2      ARG   3 -10.603   2.127  -1.274
   30    HG3  ARG   3           HG3      ARG   3  -9.620   3.177  -2.299
   31    HD2  ARG   3           HD2      ARG   3 -10.976   4.544  -0.859
   32    HD3  ARG   3           HD3      ARG   3 -11.559   4.701  -2.512
   33    HE   ARG   3           HE       ARG   3 -13.010   2.670  -1.246
   34   HH11  ARG   3          2HH1      ARG   3 -12.646   6.158  -1.162
   35   HH12  ARG   3          1HH1      ARG   3 -14.255   6.426  -0.547
   36   HH21  ARG   3          2HH2      ARG   3 -15.120   3.029  -0.447
   37   HH22  ARG   3          1HH2      ARG   3 -15.655   4.663  -0.136
   38    H    LYS   4           H        LYS   4  -9.786   5.148  -4.810
   39    HA   LYS   4           HA       LYS   4  -7.476   4.032  -6.121
   40    HB2  LYS   4           HB2      LYS   4  -7.869   6.800  -4.969
   41    HB3  LYS   4           HB3      LYS   4  -6.612   6.306  -6.099
   42    HG2  LYS   4           HG2      LYS   4  -9.572   6.402  -6.631
   43    HG3  LYS   4           HG3      LYS   4  -8.340   7.487  -7.278
   44    HD2  LYS   4           HD2      LYS   4  -7.418   5.812  -8.636
   45    HD3  LYS   4           HD3      LYS   4  -8.229   4.524  -7.744
   46    HE2  LYS   4           HE2      LYS   4  -9.281   4.884  -9.910
   47    HE3  LYS   4           HE3      LYS   4 -10.385   5.288  -8.595
   48    HZ1  LYS   4           HZ1      LYS   4  -8.775   7.275 -10.108
   49    HZ2  LYS   4           HZ2      LYS   4  -9.963   7.608  -8.942
   50    HZ3  LYS   4           HZ3      LYS   4 -10.400   6.910 -10.423
   51    H    ILE   5           H        ILE   5  -6.098   2.857  -5.020
   52    HA   ILE   5           HA       ILE   5  -5.524   3.612  -2.230
   53    HB   ILE   5           HB       ILE   5  -5.356   0.870  -3.487
   54   HG12  ILE   5          2HG1      ILE   5  -7.326   1.987  -1.477
   55   HG13  ILE   5          3HG1      ILE   5  -7.673   1.637  -3.167
   56   HG21  ILE   5          2HG2      ILE   5  -4.933   1.739  -0.630
   57   HG22  ILE   5          1HG2      ILE   5  -3.680   1.194  -1.748
   58   HG23  ILE   5          3HG2      ILE   5  -4.932   0.071  -1.210
   59   HD11  ILE   5          3HD1      ILE   5  -7.261  -0.730  -2.768
   60   HD12  ILE   5          2HD1      ILE   5  -8.521  -0.105  -1.702
   61   HD13  ILE   5          1HD1      ILE   5  -6.894  -0.384  -1.079
   62    H    ILE   6           H        ILE   6  -3.526   4.223  -1.800
   63    HA   ILE   6           HA       ILE   6  -1.404   3.526  -3.703
   64    HB   ILE   6           HB       ILE   6  -0.049   5.305  -2.638
   65   HG12  ILE   6          2HG1      ILE   6  -1.380   5.259  -0.444
   66   HG13  ILE   6          3HG1      ILE   6  -0.882   6.833  -1.046
   67   HG21  ILE   6          2HG2      ILE   6  -1.246   5.783  -4.670
   68   HG22  ILE   6          1HG2      ILE   6  -1.269   7.205  -3.626
   69   HG23  ILE   6          3HG2      ILE   6  -2.702   6.185  -3.760
   70   HD11  ILE   6          3HD1      ILE   6  -3.631   5.629  -1.299
   71   HD12  ILE   6          2HD1      ILE   6  -3.134   7.202  -1.921
   72   HD13  ILE   6          1HD1      ILE   6  -3.141   6.901  -0.183
   73    H    ALA   7           H        ALA   7   0.211   2.218  -3.095
   74    HA   ALA   7           HA       ALA   7   0.377   1.469  -0.260
   75    HB1  ALA   7           HB1      ALA   7   0.217  -0.499  -2.540
   76    HB2  ALA   7           HB2      ALA   7   0.429  -0.892  -0.834
   77    HB3  ALA   7           HB3      ALA   7  -1.076  -0.158  -1.389
   78    H    VAL   8           H        VAL   8   2.397   0.964   0.453
   79    HA   VAL   8           HA       VAL   8   4.541   0.856  -1.554
   80    HB   VAL   8           HB       VAL   8   4.699   2.325   1.090
   81   HG11  VAL   8          2HG1      VAL   8   6.758   2.016  -1.091
   82   HG12  VAL   8          1HG1      VAL   8   6.807   1.241   0.491
   83   HG13  VAL   8          3HG1      VAL   8   6.934   2.995   0.364
   84   HG21  VAL   8          3HG2      VAL   8   4.958   4.344  -0.257
   85   HG22  VAL   8          2HG2      VAL   8   3.409   3.562  -0.574
   86   HG23  VAL   8          1HG2      VAL   8   4.733   3.397  -1.727
   87    H    THR   9           H        THR   9   5.893  -0.788  -1.303
   88    HA   THR   9           HA       THR   9   5.886  -2.190   1.274
   89    HB   THR   9           HB       THR   9   4.647  -3.588  -0.201
   90    HG1  THR   9           HG1      THR   9   6.131  -4.729   1.051
   91   HG21  THR   9          3HG2      THR   9   5.502  -4.354  -2.358
   92   HG22  THR   9          1HG2      THR   9   6.923  -3.327  -2.158
   93   HG23  THR   9          2HG2      THR   9   5.326  -2.598  -2.319
   94    H    ALA  10           H        ALA  10   7.845  -2.778   2.070
   95    HA   ALA  10           HA       ALA  10  10.263  -2.611   0.555
   96    HB1  ALA  10           HB1      ALA  10   9.765  -0.218   0.735
   97    HB2  ALA  10           HB2      ALA  10   9.695  -0.366   2.492
   98    HB3  ALA  10           HB3      ALA  10  11.216  -0.648   1.644
   99    H    CYS  11           H        CYS  11  10.863  -4.535   1.472
  100    HA   CYS  11           HA       CYS  11  11.123  -4.648   4.379
  101    HB2  CYS  11           HB2      CYS  11  10.251  -6.627   3.172
  102    HB3  CYS  11           HB3      CYS  11  11.767  -6.742   2.287
  103    HG   CYS  11           HG       CYS  11  12.753  -6.749   5.314
  104    H    ALA  12           H        ALA  12  12.909  -3.881   1.604
  105    HA   ALA  12           HA       ALA  12  15.029  -3.245   1.175
  106    HB1  ALA  12           HB1      ALA  12  15.346  -3.133   4.168
  107    HB2  ALA  12           HB2      ALA  12  16.415  -2.394   2.976
  108    HB3  ALA  12           HB3      ALA  12  14.755  -1.826   3.144
  109    H    THR  13           H        THR  13  15.674  -5.074   4.142
  110    HA   THR  13           HA       THR  13  17.915  -6.413   3.096
  111    HB   THR  13           HB       THR  13  16.194  -7.405   5.372
  112    HG1  THR  13           HG1      THR  13  18.095  -5.271   5.282
  113   HG21  THR  13          3HG2      THR  13  18.343  -8.193   6.272
  114   HG22  THR  13          1HG2      THR  13  19.164  -7.579   4.837
  115   HG23  THR  13          2HG2      THR  13  18.004  -8.901   4.691
  116    H    GLY  14           H        GLY  14  14.634  -7.624   3.795
  117    HA2  GLY  14           HA1      GLY  14  15.104  -9.917   2.047
  118    HA3  GLY  14           HA2      GLY  14  13.699  -9.661   3.077
  119    H    VAL  15           H        VAL  15  15.324  -8.308   0.236
  120    HA   VAL  15           HA       VAL  15  13.216  -6.710  -0.650
  121    HB   VAL  15           HB       VAL  15  15.551  -6.513  -1.443
  122   HG11  VAL  15          2HG1      VAL  15  14.914  -8.945  -3.106
  123   HG12  VAL  15          1HG1      VAL  15  16.054  -8.877  -1.761
  124   HG13  VAL  15          3HG1      VAL  15  16.370  -7.957  -3.233
  125   HG21  VAL  15          3HG2      VAL  15  13.479  -6.842  -3.606
  126   HG22  VAL  15          2HG2      VAL  15  15.017  -5.999  -3.793
  127   HG23  VAL  15          1HG2      VAL  15  13.806  -5.385  -2.669
  128    H    ALA  16           H        ALA  16  13.775 -10.139  -1.058
  129    HA   ALA  16           HA       ALA  16  11.997 -10.601  -3.201
  130    HB1  ALA  16           HB1      ALA  16  12.712 -12.478  -0.951
  131    HB2  ALA  16           HB2      ALA  16  12.029 -12.927  -2.512
  132    HB3  ALA  16           HB3      ALA  16  13.653 -12.247  -2.423
  133    H    HIS  17           H        HIS  17  11.488 -10.135   0.220
  134    HA   HIS  17           HA       HIS  17   8.804 -11.126   0.282
  135    HB2  HIS  17           HB2      HIS  17  10.264  -9.257   2.163
  136    HB3  HIS  17           HB3      HIS  17   8.662  -9.916   2.466
  137    HD1  HIS  17           HD1      HIS  17  10.842 -10.532   4.473
  138    HD2  HIS  17           HD2      HIS  17  10.039 -12.930   1.176
  139    HE1  HIS  17           HE1      HIS  17  11.742 -12.806   5.056
  140    HE2  HIS  17           HE2      HIS  17  11.068 -14.283   3.122
  141    H    THR  18           H        THR  18  10.337  -8.069  -0.355
  142    HA   THR  18           HA       THR  18   8.154  -6.340  -0.298
  143    HB   THR  18           HB       THR  18  10.519  -6.261  -2.185
  144    HG1  THR  18           HG1      THR  18  11.538  -5.082  -0.571
  145   HG21  THR  18          3HG2      THR  18   8.768  -4.712  -2.849
  146   HG22  THR  18          1HG2      THR  18  10.146  -3.829  -2.189
  147   HG23  THR  18          2HG2      THR  18   8.697  -4.061  -1.210
  148    H    TYR  19           H        TYR  19   9.383  -8.409  -2.909
  149    HA   TYR  19           HA       TYR  19   7.522  -7.443  -4.843
  150    HB2  TYR  19           HB2      TYR  19   9.352  -9.835  -4.794
  151    HB3  TYR  19           HB3      TYR  19   8.276  -9.493  -6.146
  152    HD1  TYR  19           HD2      TYR  19   8.668  -7.590  -7.602
  153    HD2  TYR  19           HD1      TYR  19  11.284  -8.435  -4.358
  154    HE1  TYR  19           HE2      TYR  19  10.333  -6.053  -8.553
  155    HE2  TYR  19           HE1      TYR  19  12.956  -6.901  -5.301
  156    HH   TYR  19           HH       TYR  19  12.222  -4.744  -7.878
  157    H    MET  20           H        MET  20   7.620 -10.270  -2.724
  158    HA   MET  20           HA       MET  20   5.386 -11.606  -3.784
  159    HB2  MET  20           HB2      MET  20   6.996 -12.631  -2.209
  160    HB3  MET  20           HB3      MET  20   6.356 -11.619  -0.920
  161    HG2  MET  20           HG2      MET  20   5.381 -13.768  -0.694
  162    HG3  MET  20           HG3      MET  20   4.130 -12.676  -1.295
  163    HE1  MET  20           HE1      MET  20   4.054 -15.921  -1.356
  164    HE2  MET  20           HE2      MET  20   2.709 -14.916  -1.898
  165    HE3  MET  20           HE3      MET  20   3.333 -16.192  -2.943
  166    H    ALA  21           H        ALA  21   5.649  -9.230  -1.163
  167    HA   ALA  21           HA       ALA  21   2.930  -9.219  -0.442
  168    HB1  ALA  21           HB1      ALA  21   4.697  -8.259   0.958
  169    HB2  ALA  21           HB2      ALA  21   4.931  -6.973  -0.226
  170    HB3  ALA  21           HB3      ALA  21   3.406  -7.099   0.651
  171    H    ALA  22           H        ALA  22   4.775  -7.193  -2.687
  172    HA   ALA  22           HA       ALA  22   2.751  -5.418  -3.425
  173    HB1  ALA  22           HB1      ALA  22   5.034  -6.434  -5.118
  174    HB2  ALA  22           HB2      ALA  22   4.090  -4.973  -5.411
  175    HB3  ALA  22           HB3      ALA  22   5.110  -5.089  -3.978
  176    H    GLN  23           H        GLN  23   3.694  -8.501  -4.998
  177    HA   GLN  23           HA       GLN  23   1.814  -8.197  -7.093
  178    HB2  GLN  23           HB2      GLN  23   2.273 -10.580  -7.608
  179    HB3  GLN  23           HB3      GLN  23   3.721  -9.598  -7.469
  180    HG2  GLN  23           HG2      GLN  23   4.149 -10.491  -5.259
  181    HG3  GLN  23           HG3      GLN  23   2.653 -11.422  -5.326
  182   HE21  GLN  23          1HE2      GLN  23   2.966 -12.133  -8.117
  183   HE22  GLN  23          2HE2      GLN  23   4.223 -13.329  -8.186
  184    H    ALA  24           H        ALA  24   1.668  -9.961  -4.013
  185    HA   ALA  24           HA       ALA  24  -0.840 -11.198  -4.567
  186    HB1  ALA  24           HB1      ALA  24   0.722 -12.069  -2.890
  187    HB2  ALA  24           HB2      ALA  24   0.450 -10.636  -1.899
  188    HB3  ALA  24           HB3      ALA  24  -0.873 -11.763  -2.200
  189    H    LEU  25           H        LEU  25   0.098  -8.346  -2.690
  190    HA   LEU  25           HA       LEU  25  -2.429  -7.508  -1.857
  191    HB2  LEU  25           HB2      LEU  25  -0.387  -6.563  -0.988
  192    HB3  LEU  25           HB3      LEU  25   0.039  -5.924  -2.561
  193    HG   LEU  25           HG       LEU  25  -1.951  -4.419  -2.418
  194   HD11  LEU  25          2HD1      LEU  25  -2.039  -5.433   0.420
  195   HD12  LEU  25          1HD1      LEU  25  -3.271  -5.687  -0.818
  196   HD13  LEU  25          3HD1      LEU  25  -2.952  -4.062  -0.208
  197   HD21  LEU  25          3HD2      LEU  25   0.033  -4.135  -0.172
  198   HD22  LEU  25          2HD2      LEU  25  -0.864  -2.840  -0.965
  199   HD23  LEU  25          1HD2      LEU  25   0.366  -3.741  -1.859
  200    H    LYS  26           H        LYS  26  -0.640  -6.707  -4.808
  201    HA   LYS  26           HA       LYS  26  -2.557  -4.890  -5.833
  202    HB2  LYS  26           HB2      LYS  26  -0.102  -5.073  -6.424
  203    HB3  LYS  26           HB3      LYS  26  -0.522  -6.466  -7.406
  204    HG2  LYS  26           HG2      LYS  26  -1.827  -5.132  -8.879
  205    HG3  LYS  26           HG3      LYS  26  -1.710  -3.733  -7.804
  206    HD2  LYS  26           HD2      LYS  26   0.753  -3.761  -8.128
  207    HD3  LYS  26           HD3      LYS  26   0.546  -5.053  -9.309
  208    HE2  LYS  26           HE2      LYS  26  -0.725  -3.605 -10.747
  209    HE3  LYS  26           HE3      LYS  26  -0.733  -2.333  -9.524
  210    HZ1  LYS  26           HZ1      LYS  26   1.665  -3.376 -10.941
  211    HZ2  LYS  26           HZ2      LYS  26   1.686  -2.192  -9.727
  212    HZ3  LYS  26           HZ3      LYS  26   0.924  -1.872 -11.205
  213    H    LYS  27           H        LYS  27  -2.151  -8.343  -6.042
  214    HA   LYS  27           HA       LYS  27  -3.806  -8.866  -8.257
  215    HB2  LYS  27           HB2      LYS  27  -2.205 -10.467  -7.271
  216    HB3  LYS  27           HB3      LYS  27  -3.206 -10.569  -5.832
  217    HG2  LYS  27           HG2      LYS  27  -5.033 -11.497  -7.215
  218    HG3  LYS  27           HG3      LYS  27  -3.942 -11.483  -8.604
  219    HD2  LYS  27           HD2      LYS  27  -3.334 -12.897  -6.022
  220    HD3  LYS  27           HD3      LYS  27  -4.114 -13.689  -7.395
  221    HE2  LYS  27           HE2      LYS  27  -1.400 -12.362  -7.432
  222    HE3  LYS  27           HE3      LYS  27  -1.679 -14.097  -7.305
  223    HZ1  LYS  27           HZ1      LYS  27  -1.176 -13.541  -9.564
  224    HZ2  LYS  27           HZ2      LYS  27  -2.379 -12.349  -9.606
  225    HZ3  LYS  27           HZ3      LYS  27  -2.812 -13.986  -9.481
  226    H    GLY  28           H        GLY  28  -4.465  -8.833  -4.758
  227    HA2  GLY  28           HA1      GLY  28  -7.221  -9.507  -5.005
  228    HA3  GLY  28           HA2      GLY  28  -6.441  -8.845  -3.577
  229    H    ALA  29           H        ALA  29  -5.477  -6.482  -5.058
  230    HA   ALA  29           HA       ALA  29  -7.638  -4.751  -4.547
  231    HB1  ALA  29           HB1      ALA  29  -6.236  -3.007  -5.542
  232    HB2  ALA  29           HB2      ALA  29  -5.321  -4.015  -4.420
  233    HB3  ALA  29           HB3      ALA  29  -5.140  -4.244  -6.159
  234    H    LYS  30           H        LYS  30  -6.312  -6.025  -7.590
  235    HA   LYS  30           HA       LYS  30  -8.138  -4.599  -9.241
  236    HB2  LYS  30           HB2      LYS  30  -5.933  -5.623  -9.986
  237    HB3  LYS  30           HB3      LYS  30  -6.755  -7.179  -9.976
  238    HG2  LYS  30           HG2      LYS  30  -8.438  -6.187 -11.554
  239    HG3  LYS  30           HG3      LYS  30  -7.377  -4.787 -11.688
  240    HD2  LYS  30           HD2      LYS  30  -6.935  -6.229 -13.540
  241    HD3  LYS  30           HD3      LYS  30  -5.562  -6.333 -12.434
  242    HE2  LYS  30           HE2      LYS  30  -6.246  -8.447 -11.633
  243    HE3  LYS  30           HE3      LYS  30  -7.838  -8.296 -12.379
  244    HZ1  LYS  30           HZ1      LYS  30  -5.283  -8.488 -13.880
  245    HZ2  LYS  30           HZ2      LYS  30  -6.838  -8.449 -14.543
  246    HZ3  LYS  30           HZ3      LYS  30  -6.347  -9.785 -13.617
  247    H    LYS  31           H        LYS  31  -8.216  -7.669  -7.590
  248    HA   LYS  31           HA       LYS  31 -10.356  -8.912  -8.887
  249    HB2  LYS  31           HB2      LYS  31  -8.985 -10.113  -7.288
  250    HB3  LYS  31           HB3      LYS  31  -9.482  -9.034  -5.992
  251    HG2  LYS  31           HG2      LYS  31 -10.654 -11.104  -5.762
  252    HG3  LYS  31           HG3      LYS  31 -11.802  -9.862  -6.262
  253    HD2  LYS  31           HD2      LYS  31 -11.509 -10.660  -8.618
  254    HD3  LYS  31           HD3      LYS  31 -10.554 -12.001  -7.983
  255    HE2  LYS  31           HE2      LYS  31 -13.439 -11.382  -7.361
  256    HE3  LYS  31           HE3      LYS  31 -12.837 -12.710  -8.350
  257    HZ1  LYS  31           HZ1      LYS  31 -12.340 -12.345  -5.443
  258    HZ2  LYS  31           HZ2      LYS  31 -11.742 -13.618  -6.390
  259    HZ3  LYS  31           HZ3      LYS  31 -13.410 -13.460  -6.136
  260    H    MET  32           H        MET  32 -10.295  -6.632  -6.193
  261    HA   MET  32           HA       MET  32 -13.146  -6.686  -5.843
  262    HB2  MET  32           HB2      MET  32 -10.996  -4.905  -4.688
  263    HB3  MET  32           HB3      MET  32 -12.695  -4.804  -4.245
  264    HG2  MET  32           HG2      MET  32 -11.009  -7.276  -3.924
  265    HG3  MET  32           HG3      MET  32 -11.279  -6.086  -2.654
  266    HE1  MET  32           HE1      MET  32 -13.452  -9.147  -1.493
  267    HE2  MET  32           HE2      MET  32 -11.901  -9.209  -2.329
  268    HE3  MET  32           HE3      MET  32 -12.165  -8.025  -1.047
  269    H    GLY  33           H        GLY  33 -11.185  -5.271  -8.113
  270    HA2  GLY  33           HA1      GLY  33 -11.829  -3.958  -9.901
  271    HA3  GLY  33           HA2      GLY  33 -13.385  -3.716  -9.124
  272    H    ASN  34           H        ASN  34 -10.068  -2.945  -8.067
  273    HA   ASN  34           HA       ASN  34 -10.868  -0.113  -7.967
  274    HB2  ASN  34           HB2      ASN  34  -9.184  -1.539  -5.895
  275    HB3  ASN  34           HB3      ASN  34  -9.607   0.169  -5.885
  276   HD21  ASN  34          1HD2      ASN  34 -10.642  -3.033  -5.230
  277   HD22  ASN  34          2HD2      ASN  34 -12.159  -2.631  -4.508
  278    H    LEU  35           H        LEU  35  -8.820   1.286  -7.608
  279    HA   LEU  35           HA       LEU  35  -6.720   0.284  -9.408
  280    HB2  LEU  35           HB2      LEU  35  -7.798   3.052  -8.964
  281    HB3  LEU  35           HB3      LEU  35  -6.197   2.809  -9.626
  282    HG   LEU  35           HG       LEU  35  -7.266   1.476 -11.482
  283   HD11  LEU  35          2HD1      LEU  35  -9.799   2.670 -10.379
  284   HD12  LEU  35          1HD1      LEU  35  -9.374   0.961 -10.365
  285   HD13  LEU  35          3HD1      LEU  35  -9.636   1.791 -11.897
  286   HD21  LEU  35          3HD2      LEU  35  -6.521   3.751 -11.815
  287   HD22  LEU  35          2HD2      LEU  35  -8.038   4.371 -11.161
  288   HD23  LEU  35          1HD2      LEU  35  -8.033   3.479 -12.685
  289    H    ILE  36           H        ILE  36  -4.769   0.002  -8.558
  290    HA   ILE  36           HA       ILE  36  -4.173   1.341  -6.014
  291    HB   ILE  36           HB       ILE  36  -4.824  -1.015  -5.622
  292   HG12  ILE  36          2HG1      ILE  36  -1.897  -0.472  -5.110
  293   HG13  ILE  36          3HG1      ILE  36  -3.225   0.152  -4.142
  294   HG21  ILE  36          2HG2      ILE  36  -3.327  -2.823  -6.354
  295   HG22  ILE  36          1HG2      ILE  36  -2.412  -1.657  -7.311
  296   HG23  ILE  36          3HG2      ILE  36  -4.096  -1.997  -7.709
  297   HD11  ILE  36          3HD1      ILE  36  -2.516  -2.751  -4.499
  298   HD12  ILE  36          2HD1      ILE  36  -3.854  -2.127  -3.533
  299   HD13  ILE  36          1HD1      ILE  36  -2.189  -1.763  -3.075
  300    H    LYS  37           H        LYS  37  -2.158   2.108  -5.762
  301    HA   LYS  37           HA       LYS  37  -0.227   1.621  -7.939
  302    HB2  LYS  37           HB2      LYS  37  -0.701   4.095  -6.266
  303    HB3  LYS  37           HB3      LYS  37   0.735   3.871  -7.255
  304    HG2  LYS  37           HG2      LYS  37  -2.091   3.875  -8.302
  305    HG3  LYS  37           HG3      LYS  37  -0.987   5.252  -8.349
  306    HD2  LYS  37           HD2      LYS  37  -0.433   2.576  -9.629
  307    HD3  LYS  37           HD3      LYS  37  -1.102   3.968 -10.484
  308    HE2  LYS  37           HE2      LYS  37   1.495   4.108  -8.975
  309    HE3  LYS  37           HE3      LYS  37   1.417   3.577 -10.654
  310    HZ1  LYS  37           HZ1      LYS  37   0.668   5.665 -11.351
  311    HZ2  LYS  37           HZ2      LYS  37   1.898   6.013 -10.238
  312    HZ3  LYS  37           HZ3      LYS  37   0.271   6.170  -9.784
  313    H    VAL  38           H        VAL  38   1.131   0.118  -7.177
  314    HA   VAL  38           HA       VAL  38   1.899   0.257  -4.344
  315    HB   VAL  38           HB       VAL  38   2.398  -2.063  -6.217
  316   HG11  VAL  38          2HG1      VAL  38   2.417  -1.874  -3.208
  317   HG12  VAL  38          1HG1      VAL  38   3.838  -1.978  -4.248
  318   HG13  VAL  38          3HG1      VAL  38   2.709  -3.331  -4.160
  319   HG21  VAL  38          3HG2      VAL  38  -0.006  -1.666  -6.035
  320   HG22  VAL  38          2HG2      VAL  38   0.121  -1.682  -4.277
  321   HG23  VAL  38          1HG2      VAL  38   0.464  -3.146  -5.199
  322    H    GLU  39           H        GLU  39   3.791   1.041  -3.826
  323    HA   GLU  39           HA       GLU  39   5.878   1.317  -5.855
  324    HB2  GLU  39           HB2      GLU  39   5.307   3.292  -4.506
  325    HB3  GLU  39           HB3      GLU  39   5.688   2.406  -3.036
  326    HG2  GLU  39           HG2      GLU  39   8.025   2.156  -3.921
  327    HG3  GLU  39           HG3      GLU  39   7.580   3.285  -5.199
  328    H    THR  40           H        THR  40   7.514  -0.101  -5.958
  329    HA   THR  40           HA       THR  40   7.996  -1.835  -3.653
  330    HB   THR  40           HB       THR  40   9.441  -3.127  -5.301
  331    HG1  THR  40           HG1      THR  40   9.707  -2.245  -7.195
  332   HG21  THR  40          3HG2      THR  40   7.511  -4.215  -6.369
  333   HG22  THR  40          1HG2      THR  40   6.490  -2.859  -5.889
  334   HG23  THR  40          2HG2      THR  40   7.218  -3.892  -4.660
  335    H    GLN  41           H        GLN  41   9.398  -0.978  -2.283
  336    HA   GLN  41           HA       GLN  41  11.794   0.346  -3.377
  337    HB2  GLN  41           HB2      GLN  41  10.253   1.674  -1.885
  338    HB3  GLN  41           HB3      GLN  41  10.659   0.568  -0.582
  339    HG2  GLN  41           HG2      GLN  41  12.899   1.293  -0.530
  340    HG3  GLN  41           HG3      GLN  41  12.734   2.147  -2.064
  341   HE21  GLN  41          1HE2      GLN  41  10.089   3.216  -1.325
  342   HE22  GLN  41          2HE2      GLN  41  10.409   4.481  -0.202
  343    H    GLY  42           H        GLY  42  13.382  -1.098  -3.530
  344    HA2  GLY  42           HA1      GLY  42  13.474  -3.358  -1.697
  345    HA3  GLY  42           HA2      GLY  42  14.483  -3.122  -3.119
  346    H    ALA  43           H        ALA  43  16.477  -2.346  -2.879
  347    HA   ALA  43           HA       ALA  43  17.243  -1.430  -0.177
  348    HB1  ALA  43           HB1      ALA  43  18.923  -3.032  -2.111
  349    HB2  ALA  43           HB2      ALA  43  19.429  -2.464  -0.519
  350    HB3  ALA  43           HB3      ALA  43  18.141  -3.662  -0.660
  351    H    THR  44           H        THR  44  17.012   0.733  -0.665
  352    HA   THR  44           HA       THR  44  17.664   2.801  -1.343
  353    HB   THR  44           HB       THR  44  20.018   1.411  -2.657
  354    HG1  THR  44           HG1      THR  44  20.121   1.013  -0.461
  355   HG21  THR  44          3HG2      THR  44  19.680   3.683  -3.504
  356   HG22  THR  44          1HG2      THR  44  21.119   3.602  -2.490
  357   HG23  THR  44          2HG2      THR  44  19.631   4.301  -1.854
  358    H    GLY  45           H        GLY  45  16.855   0.296  -3.400
  359    HA2  GLY  45           HA1      GLY  45  16.719   2.052  -5.757
  360    HA3  GLY  45           HA2      GLY  45  16.747   0.295  -5.812
  361    H    ILE  46           H        ILE  46  14.822   3.019  -5.876
  362    HA   ILE  46           HA       ILE  46  12.394   1.549  -5.138
  363    HB   ILE  46           HB       ILE  46  12.550   4.459  -5.930
  364   HG12  ILE  46          2HG1      ILE  46  12.788   3.296  -3.145
  365   HG13  ILE  46          3HG1      ILE  46  14.095   4.061  -4.043
  366   HG21  ILE  46          2HG2      ILE  46  10.575   2.884  -4.286
  367   HG22  ILE  46          1HG2      ILE  46  10.337   3.457  -5.935
  368   HG23  ILE  46          3HG2      ILE  46  10.484   4.615  -4.615
  369   HD11  ILE  46          3HD1      ILE  46  13.160   5.570  -2.396
  370   HD12  ILE  46          2HD1      ILE  46  11.562   5.399  -3.122
  371   HD13  ILE  46          1HD1      ILE  46  12.863   6.169  -4.028
  372    H    GLU  47           H        GLU  47  10.948   0.899  -6.690
  373    HA   GLU  47           HA       GLU  47  11.848   1.353  -9.455
  374    HB2  GLU  47           HB2      GLU  47  10.075  -0.835  -8.373
  375    HB3  GLU  47           HB3      GLU  47  10.717  -0.725 -10.006
  376    HG2  GLU  47           HG2      GLU  47  12.980  -0.943  -9.142
  377    HG3  GLU  47           HG3      GLU  47  12.349  -1.036  -7.499
  378    H    ASN  48           H        ASN  48   9.989   3.095  -7.816
  379    HA   ASN  48           HA       ASN  48   8.096   3.573  -9.912
  380    HB2  ASN  48           HB2      ASN  48   7.042   1.705  -8.545
  381    HB3  ASN  48           HB3      ASN  48   6.932   2.854  -7.214
  382   HD21  ASN  48          1HD2      ASN  48   5.623   1.817 -10.212
  383   HD22  ASN  48          2HD2      ASN  48   4.292   2.926 -10.264
  384    H    GLU  49           H        GLU  49   8.205   4.137  -6.409
  385    HA   GLU  49           HA       GLU  49   8.043   5.971  -5.134
  386    HB2  GLU  49           HB2      GLU  49  10.196   6.609  -6.040
  387    HB3  GLU  49           HB3      GLU  49   9.431   7.310  -7.461
  388    HG2  GLU  49           HG2      GLU  49   8.539   9.095  -6.237
  389    HG3  GLU  49           HG3      GLU  49   8.832   8.298  -4.694
  390    H    LEU  50           H        LEU  50   5.952   6.256  -4.876
  391    HA   LEU  50           HA       LEU  50   4.120   7.037  -6.862
  392    HB2  LEU  50           HB2      LEU  50   3.868   7.360  -3.868
  393    HB3  LEU  50           HB3      LEU  50   2.548   7.389  -5.021
  394    HG   LEU  50           HG       LEU  50   4.294   5.001  -4.407
  395   HD11  LEU  50          2HD1      LEU  50   1.420   5.589  -3.714
  396   HD12  LEU  50          1HD1      LEU  50   2.774   5.529  -2.588
  397   HD13  LEU  50          3HD1      LEU  50   2.257   4.065  -3.423
  398   HD21  LEU  50          3HD2      LEU  50   2.746   3.755  -5.819
  399   HD22  LEU  50          2HD2      LEU  50   3.550   5.030  -6.735
  400   HD23  LEU  50          1HD2      LEU  50   1.883   5.245  -6.202
  401    H    THR  51           H        THR  51   3.512   8.958  -7.636
  402    HA   THR  51           HA       THR  51   5.053  11.277  -6.983
  403    HB   THR  51           HB       THR  51   3.834  12.409  -8.716
  404    HG1  THR  51           HG1      THR  51   2.089  10.275  -9.235
  405   HG21  THR  51          3HG2      THR  51   5.470  10.816  -9.535
  406   HG22  THR  51          1HG2      THR  51   4.079  10.849 -10.618
  407   HG23  THR  51          2HG2      THR  51   4.278   9.519  -9.476
  408    H    GLU  52           H        GLU  52   4.114  13.347  -6.346
  409    HA   GLU  52           HA       GLU  52   2.471  13.214  -4.079
  410    HB2  GLU  52           HB2      GLU  52   3.970  15.071  -4.420
  411    HB3  GLU  52           HB3      GLU  52   3.158  15.518  -5.912
  412    HG2  GLU  52           HG2      GLU  52   1.394  15.484  -3.587
  413    HG3  GLU  52           HG3      GLU  52   2.724  16.636  -3.462
  414    H    LYS  53           H        LYS  53   1.737  13.659  -7.472
  415    HA   LYS  53           HA       LYS  53  -0.962  14.429  -7.174
  416    HB2  LYS  53           HB2      LYS  53   0.655  14.389  -9.275
  417    HB3  LYS  53           HB3      LYS  53  -0.088  12.815  -9.531
  418    HG2  LYS  53           HG2      LYS  53  -1.257  14.500 -10.800
  419    HG3  LYS  53           HG3      LYS  53  -2.304  13.881  -9.519
  420    HD2  LYS  53           HD2      LYS  53  -1.711  15.830  -8.130
  421    HD3  LYS  53           HD3      LYS  53  -0.731  16.457  -9.456
  422    HE2  LYS  53           HE2      LYS  53  -2.901  17.548  -9.396
  423    HE3  LYS  53           HE3      LYS  53  -2.727  16.589 -10.864
  424    HZ1  LYS  53           HZ1      LYS  53  -4.120  14.908  -9.976
  425    HZ2  LYS  53           HZ2      LYS  53  -4.917  16.381  -9.717
  426    HZ3  LYS  53           HZ3      LYS  53  -4.124  15.612  -8.434
  427    H    ASP  54           H        ASP  54   0.515  11.247  -7.877
  428    HA   ASP  54           HA       ASP  54  -1.825   9.712  -7.802
  429    HB2  ASP  54           HB2      ASP  54   1.043   9.027  -7.175
  430    HB3  ASP  54           HB3      ASP  54  -0.234   7.826  -7.041
  431    H    VAL  55           H        VAL  55   0.323  10.728  -5.240
  432    HA   VAL  55           HA       VAL  55  -0.746   9.209  -3.149
  433    HB   VAL  55           HB       VAL  55   0.765  11.810  -3.207
  434   HG11  VAL  55          2HG1      VAL  55  -0.590  11.850  -1.199
  435   HG12  VAL  55          1HG1      VAL  55   1.106  11.572  -0.795
  436   HG13  VAL  55          3HG1      VAL  55  -0.038  10.229  -0.776
  437   HG21  VAL  55          3HG2      VAL  55   2.035   9.900  -3.885
  438   HG22  VAL  55          2HG2      VAL  55   1.479   8.978  -2.489
  439   HG23  VAL  55          1HG2      VAL  55   2.541  10.361  -2.262
  440    H    ASN  56           H        ASN  56  -1.737  12.321  -4.471
  441    HA   ASN  56           HA       ASN  56  -3.677  12.756  -2.372
  442    HB2  ASN  56           HB2      ASN  56  -2.905  14.238  -4.857
  443    HB3  ASN  56           HB3      ASN  56  -4.430  14.610  -4.059
  444   HD21  ASN  56          1HD2      ASN  56  -0.967  14.722  -3.822
  445   HD22  ASN  56          2HD2      ASN  56  -0.901  15.787  -2.454
  446    H    ILE  57           H        ILE  57  -3.640  11.475  -5.628
  447    HA   ILE  57           HA       ILE  57  -6.438  11.372  -6.022
  448    HB   ILE  57           HB       ILE  57  -4.290   9.564  -7.159
  449   HG12  ILE  57          2HG1      ILE  57  -5.663  11.978  -8.365
  450   HG13  ILE  57          3HG1      ILE  57  -4.039  11.983  -7.686
  451   HG21  ILE  57          2HG2      ILE  57  -5.932   9.020  -8.903
  452   HG22  ILE  57          1HG2      ILE  57  -7.146   9.974  -8.048
  453   HG23  ILE  57          3HG2      ILE  57  -6.485   8.519  -7.303
  454   HD11  ILE  57          3HD1      ILE  57  -3.949  11.851 -10.090
  455   HD12  ILE  57          2HD1      ILE  57  -4.967  10.411 -10.077
  456   HD13  ILE  57          1HD1      ILE  57  -3.349  10.353  -9.380
  457    H    GLY  58           H        GLY  58  -4.122   8.945  -4.833
  458    HA2  GLY  58           HA1      GLY  58  -6.061   7.036  -4.057
  459    HA3  GLY  58           HA2      GLY  58  -4.407   7.134  -3.462
  460    H    GLU  59           H        GLU  59  -7.028   6.634  -2.090
  461    HA   GLU  59           HA       GLU  59  -7.188   8.984  -0.344
  462    HB2  GLU  59           HB2      GLU  59  -9.013   6.586  -0.578
  463    HB3  GLU  59           HB3      GLU  59  -9.261   7.934   0.524
  464    HG2  GLU  59           HG2      GLU  59  -9.421   9.451  -1.410
  465    HG3  GLU  59           HG3      GLU  59  -9.244   8.064  -2.485
  466    H    VAL  60           H        VAL  60  -7.395   5.456   0.174
  467    HA   VAL  60           HA       VAL  60  -6.149   5.834   2.765
  468    HB   VAL  60           HB       VAL  60  -8.235   4.522   2.636
  469   HG11  VAL  60          2HG1      VAL  60  -8.213   2.271   1.647
  470   HG12  VAL  60          1HG1      VAL  60  -6.606   2.590   0.993
  471   HG13  VAL  60          3HG1      VAL  60  -7.987   3.534   0.436
  472   HG21  VAL  60          3HG2      VAL  60  -7.468   2.611   3.949
  473   HG22  VAL  60          2HG2      VAL  60  -6.666   4.108   4.425
  474   HG23  VAL  60          1HG2      VAL  60  -5.815   2.932   3.427
  475    H    VAL  61           H        VAL  61  -4.265   4.769   3.371
  476    HA   VAL  61           HA       VAL  61  -2.604   3.919   1.090
  477    HB   VAL  61           HB       VAL  61  -1.597   4.936   3.749
  478   HG11  VAL  61          2HG1      VAL  61  -0.010   3.637   2.427
  479   HG12  VAL  61          1HG1      VAL  61   0.471   5.331   2.512
  480   HG13  VAL  61          3HG1      VAL  61  -0.278   4.700   1.046
  481   HG21  VAL  61          3HG2      VAL  61  -1.240   7.107   2.645
  482   HG22  VAL  61          2HG2      VAL  61  -2.951   6.692   2.771
  483   HG23  VAL  61          1HG2      VAL  61  -2.111   6.515   1.230
  484    H    ILE  62           H        ILE  62  -1.444   2.043   1.206
  485    HA   ILE  62           HA       ILE  62  -1.796   0.408   3.633
  486    HB   ILE  62           HB       ILE  62  -1.619  -0.535   0.766
  487   HG12  ILE  62          2HG1      ILE  62  -3.859  -0.712   2.793
  488   HG13  ILE  62          3HG1      ILE  62  -3.818   0.368   1.405
  489   HG21  ILE  62          2HG2      ILE  62  -1.935  -2.800   1.700
  490   HG22  ILE  62          1HG2      ILE  62  -1.772  -2.130   3.324
  491   HG23  ILE  62          3HG2      ILE  62  -0.413  -2.063   2.203
  492   HD11  ILE  62          3HD1      ILE  62  -3.888  -2.639   1.307
  493   HD12  ILE  62          2HD1      ILE  62  -3.831  -1.562  -0.090
  494   HD13  ILE  62          1HD1      ILE  62  -5.235  -1.548   0.978
  495    H    PHE  63           H        PHE  63   0.039   0.181   4.701
  496    HA   PHE  63           HA       PHE  63   2.557   0.197   3.188
  497    HB2  PHE  63           HB2      PHE  63   1.844   1.044   5.957
  498    HB3  PHE  63           HB3      PHE  63   3.457   0.390   5.685
  499    HD1  PHE  63           HD2      PHE  63   3.738   1.471   2.836
  500    HD2  PHE  63           HD1      PHE  63   2.501   3.257   6.494
  501    HE1  PHE  63           HE2      PHE  63   4.487   3.663   2.016
  502    HE2  PHE  63           HE1      PHE  63   3.246   5.455   5.677
  503    HZ   PHE  63           HZ       PHE  63   4.238   5.655   3.432
  504    H    ALA  64           H        ALA  64   3.383  -1.692   2.785
  505    HA   ALA  64           HA       ALA  64   3.317  -3.715   4.926
  506    HB1  ALA  64           HB1      ALA  64   3.337  -4.167   1.935
  507    HB2  ALA  64           HB2      ALA  64   3.507  -5.435   3.152
  508    HB3  ALA  64           HB3      ALA  64   2.006  -4.513   3.042
  509    H    VAL  65           H        VAL  65   5.248  -3.064   5.840
  510    HA   VAL  65           HA       VAL  65   7.633  -3.206   4.145
  511    HB   VAL  65           HB       VAL  65   8.491  -1.067   5.062
  512   HG11  VAL  65          2HG1      VAL  65   7.481  -1.085   2.849
  513   HG12  VAL  65          1HG1      VAL  65   7.131   0.431   3.681
  514   HG13  VAL  65          3HG1      VAL  65   5.888  -0.815   3.559
  515   HG21  VAL  65          3HG2      VAL  65   7.170  -0.932   7.090
  516   HG22  VAL  65          2HG2      VAL  65   5.692  -0.759   6.145
  517   HG23  VAL  65          1HG2      VAL  65   6.914   0.512   6.110
  518    H    ASP  66           H        ASP  66   9.622  -2.816   5.496
  519    HA   ASP  66           HA       ASP  66   9.312  -3.640   8.296
  520    HB2  ASP  66           HB2      ASP  66   9.955  -5.663   7.150
  521    HB3  ASP  66           HB3      ASP  66  11.222  -4.823   6.265
  522    H    THR  67           H        THR  67  10.683  -1.644   5.927
  523    HA   THR  67           HA       THR  67  12.664  -0.610   7.838
  524    HB   THR  67           HB       THR  67  13.711  -1.798   5.923
  525    HG1  THR  67           HG1      THR  67  15.272  -0.388   6.090
  526   HG21  THR  67          3HG2      THR  67  13.631  -0.781   3.689
  527   HG22  THR  67          1HG2      THR  67  12.436   0.382   4.268
  528   HG23  THR  67          2HG2      THR  67  12.042  -1.338   4.214
  529    H    LYS  68           H        LYS  68  13.433   1.612   6.422
  530    HA   LYS  68           HA       LYS  68  11.364   3.470   7.041
  531    HB2  LYS  68           HB2      LYS  68  12.987   5.139   6.172
  532    HB3  LYS  68           HB3      LYS  68  13.694   4.051   7.362
  533    HG2  LYS  68           HG2      LYS  68  14.512   2.675   5.384
  534    HG3  LYS  68           HG3      LYS  68  14.086   4.065   4.387
  535    HD2  LYS  68           HD2      LYS  68  15.614   5.471   5.618
  536    HD3  LYS  68           HD3      LYS  68  15.971   4.154   6.741
  537    HE2  LYS  68           HE2      LYS  68  16.805   2.835   4.781
  538    HE3  LYS  68           HE3      LYS  68  16.629   4.292   3.803
  539    HZ1  LYS  68           HZ1      LYS  68  18.399   3.937   6.162
  540    HZ2  LYS  68           HZ2      LYS  68  18.164   5.413   5.354
  541    HZ3  LYS  68           HZ3      LYS  68  18.881   4.107   4.543
  542    H    VAL  69           H        VAL  69  10.314   4.911   5.613
  543    HA   VAL  69           HA       VAL  69  10.272   4.094   2.791
  544    HB   VAL  69           HB       VAL  69   7.887   4.708   4.541
  545   HG11  VAL  69          2HG1      VAL  69   7.514   5.807   2.442
  546   HG12  VAL  69          1HG1      VAL  69   6.525   4.347   2.501
  547   HG13  VAL  69          3HG1      VAL  69   8.012   4.367   1.550
  548   HG21  VAL  69          3HG2      VAL  69   8.679   2.421   4.716
  549   HG22  VAL  69          2HG2      VAL  69   8.641   2.256   2.959
  550   HG23  VAL  69          1HG2      VAL  69   7.139   2.476   3.858
  551    H    ARG  70           H        ARG  70  10.263   5.732   1.340
  552    HA   ARG  70           HA       ARG  70  10.824   8.379   2.376
  553    HB2  ARG  70           HB2      ARG  70  10.983   7.278  -0.435
  554    HB3  ARG  70           HB3      ARG  70  11.507   8.881   0.055
  555    HG2  ARG  70           HG2      ARG  70  13.205   7.899   1.502
  556    HG3  ARG  70           HG3      ARG  70  12.673   6.283   1.038
  557    HD2  ARG  70           HD2      ARG  70  14.637   6.889  -0.234
  558    HD3  ARG  70           HD3      ARG  70  13.240   6.799  -1.305
  559    HE   ARG  70           HE       ARG  70  14.644   9.237  -0.453
  560   HH11  ARG  70          2HH1      ARG  70  12.198   7.689  -2.421
  561   HH12  ARG  70          1HH1      ARG  70  11.930   9.077  -3.435
  562   HH21  ARG  70          2HH2      ARG  70  14.318  11.068  -1.788
  563   HH22  ARG  70          1HH2      ARG  70  13.139  11.001  -3.067
  564    H    ASN  71           H        ASN  71   8.221   6.676   0.986
  565    HA   ASN  71           HA       ASN  71   6.874   9.072   0.087
  566    HB2  ASN  71           HB2      ASN  71   6.548   6.309  -0.434
  567    HB3  ASN  71           HB3      ASN  71   5.071   6.874   0.343
  568   HD21  ASN  71          1HD2      ASN  71   7.022   7.001  -2.490
  569   HD22  ASN  71          2HD2      ASN  71   5.949   7.981  -3.430
  570    H    LYS  72           H        LYS  72   7.473   7.744   3.058
  571    HA   LYS  72           HA       LYS  72   5.001   7.589   4.328
  572    HB2  LYS  72           HB2      LYS  72   7.751   8.161   5.378
  573    HB3  LYS  72           HB3      LYS  72   6.355   8.154   6.440
  574    HG2  LYS  72           HG2      LYS  72   5.870   5.839   5.702
  575    HG3  LYS  72           HG3      LYS  72   7.384   5.867   4.794
  576    HD2  LYS  72           HD2      LYS  72   7.784   4.795   6.904
  577    HD3  LYS  72           HD3      LYS  72   8.576   6.371   6.923
  578    HE2  LYS  72           HE2      LYS  72   6.688   7.299   8.176
  579    HE3  LYS  72           HE3      LYS  72   5.900   5.721   8.156
  580    HZ1  LYS  72           HZ1      LYS  72   8.500   6.353   9.450
  581    HZ2  LYS  72           HZ2      LYS  72   7.761   4.826   9.421
  582    HZ3  LYS  72           HZ3      LYS  72   7.025   6.104  10.250
  583    H    GLU  73           H        GLU  73   7.136  10.380   3.926
  584    HA   GLU  73           HA       GLU  73   5.713  12.146   5.586
  585    HB2  GLU  73           HB2      GLU  73   6.666  13.932   3.929
  586    HB3  GLU  73           HB3      GLU  73   7.749  13.020   4.969
  587    HG2  GLU  73           HG2      GLU  73   7.181  11.976   2.244
  588    HG3  GLU  73           HG3      GLU  73   8.253  13.366   2.417
  589    H    ARG  74           H        ARG  74   5.113  11.162   2.283
  590    HA   ARG  74           HA       ARG  74   3.174  13.122   1.679
  591    HB2  ARG  74           HB2      ARG  74   3.961  10.470   0.535
  592    HB3  ARG  74           HB3      ARG  74   2.542  11.317  -0.072
  593    HG2  ARG  74           HG2      ARG  74   3.770  13.066  -0.890
  594    HG3  ARG  74           HG3      ARG  74   5.155  12.735   0.144
  595    HD2  ARG  74           HD2      ARG  74   4.379  10.656  -1.809
  596    HD3  ARG  74           HD3      ARG  74   5.117  12.119  -2.454
  597    HE   ARG  74           HE       ARG  74   6.473  10.709  -0.277
  598   HH11  ARG  74          2HH1      ARG  74   6.266  11.399  -3.695
  599   HH12  ARG  74          1HH1      ARG  74   7.927  11.022  -4.011
  600   HH21  ARG  74          2HH2      ARG  74   8.686  10.195  -0.688
  601   HH22  ARG  74          1HH2      ARG  74   9.298  10.337  -2.308
  602    H    PHE  75           H        PHE  75   2.987   9.925   3.160
  603    HA   PHE  75           HA       PHE  75   0.074  10.125   3.271
  604    HB2  PHE  75           HB2      PHE  75   1.798   7.832   4.198
  605    HB3  PHE  75           HB3      PHE  75   0.084   7.812   3.819
  606    HD1  PHE  75           HD2      PHE  75  -0.164   9.013   1.254
  607    HD2  PHE  75           HD1      PHE  75   2.935   6.508   2.738
  608    HE1  PHE  75           HE2      PHE  75   0.360   8.305  -1.040
  609    HE2  PHE  75           HE1      PHE  75   3.465   5.797   0.445
  610    HZ   PHE  75           HZ       PHE  75   2.174   6.693  -1.447
  611    H    ASP  76           H        ASP  76   2.250  11.542   4.983
  612    HA   ASP  76           HA       ASP  76   2.164  10.299   7.543
  613    HB2  ASP  76           HB2      ASP  76   4.062  11.702   6.753
  614    HB3  ASP  76           HB3      ASP  76   3.022  13.118   6.873
  615    H    GLY  77           H        GLY  77   0.498  13.046   6.094
  616    HA2  GLY  77           HA1      GLY  77  -1.096  13.330   8.550
  617    HA3  GLY  77           HA2      GLY  77  -1.012  14.501   7.242
  618    H    LYS  78           H        LYS  78  -1.382  11.094   6.646
  619    HA   LYS  78           HA       LYS  78  -4.183  11.561   5.884
  620    HB2  LYS  78           HB2      LYS  78  -2.460   9.767   4.209
  621    HB3  LYS  78           HB3      LYS  78  -3.904  10.665   3.756
  622    HG2  LYS  78           HG2      LYS  78  -2.311  12.726   4.284
  623    HG3  LYS  78           HG3      LYS  78  -1.077  11.542   3.869
  624    HD2  LYS  78           HD2      LYS  78  -3.408  12.328   2.121
  625    HD3  LYS  78           HD3      LYS  78  -1.762  12.931   1.960
  626    HE2  LYS  78           HE2      LYS  78  -1.875  11.274   0.353
  627    HE3  LYS  78           HE3      LYS  78  -1.102  10.456   1.706
  628    HZ1  LYS  78           HZ1      LYS  78  -2.915   9.186   0.569
  629    HZ2  LYS  78           HZ2      LYS  78  -4.025  10.320   1.165
  630    HZ3  LYS  78           HZ3      LYS  78  -3.129   9.365   2.236
  631    H    VAL  79           H        VAL  79  -4.996   9.136   5.140
  632    HA   VAL  79           HA       VAL  79  -4.712   7.630   7.630
  633    HB   VAL  79           HB       VAL  79  -6.728   7.223   5.411
  634   HG11  VAL  79          2HG1      VAL  79  -6.645   6.181   8.244
  635   HG12  VAL  79          1HG1      VAL  79  -6.369   5.238   6.780
  636   HG13  VAL  79          3HG1      VAL  79  -7.959   5.933   7.093
  637   HG21  VAL  79          3HG2      VAL  79  -6.964   9.433   6.431
  638   HG22  VAL  79          2HG2      VAL  79  -7.034   8.691   8.029
  639   HG23  VAL  79          1HG2      VAL  79  -8.315   8.382   6.857
  640    H    VAL  80           H        VAL  80  -3.517   5.849   7.720
  641    HA   VAL  80           HA       VAL  80  -3.135   4.229   5.330
  642    HB   VAL  80           HB       VAL  80  -1.265   5.683   5.129
  643   HG11  VAL  80          2HG1      VAL  80  -0.648   5.143   8.028
  644   HG12  VAL  80          1HG1      VAL  80  -1.288   6.645   7.362
  645   HG13  VAL  80          3HG1      VAL  80   0.331   6.106   6.920
  646   HG21  VAL  80          3HG2      VAL  80  -0.351   3.136   6.456
  647   HG22  VAL  80          2HG2      VAL  80   0.650   4.183   5.450
  648   HG23  VAL  80          1HG2      VAL  80  -0.737   3.346   4.746
  649    H    LEU  81           H        LEU  81  -2.947   2.112   5.738
  650    HA   LEU  81           HA       LEU  81  -2.840   1.236   8.537
  651    HB2  LEU  81           HB2      LEU  81  -4.689   0.336   7.242
  652    HB3  LEU  81           HB3      LEU  81  -3.578  -0.251   6.017
  653    HG   LEU  81           HG       LEU  81  -2.540  -1.649   7.914
  654   HD11  LEU  81          2HD1      LEU  81  -5.230  -1.078   9.142
  655   HD12  LEU  81          1HD1      LEU  81  -3.676  -0.513   9.758
  656   HD13  LEU  81          3HD1      LEU  81  -4.037  -2.241   9.724
  657   HD21  LEU  81          3HD2      LEU  81  -4.221  -3.416   7.580
  658   HD22  LEU  81          2HD2      LEU  81  -3.722  -2.631   6.083
  659   HD23  LEU  81          1HD2      LEU  81  -5.276  -2.226   6.815
  660    H    GLU  82           H        GLU  82  -0.975   0.484   9.316
  661    HA   GLU  82           HA       GLU  82   1.083  -0.339   7.380
  662    HB2  GLU  82           HB2      GLU  82   1.631   1.569   8.903
  663    HB3  GLU  82           HB3      GLU  82   1.460   0.476  10.269
  664    HG2  GLU  82           HG2      GLU  82   3.252  -0.631   8.315
  665    HG3  GLU  82           HG3      GLU  82   3.755   0.996   8.769
  666    H    VAL  83           H        VAL  83   1.027  -2.457   7.099
  667    HA   VAL  83           HA       VAL  83   0.903  -4.169   9.496
  668    HB   VAL  83           HB       VAL  83   0.054  -5.976   7.996
  669   HG11  VAL  83          2HG1      VAL  83  -1.667  -3.498   8.072
  670   HG12  VAL  83          1HG1      VAL  83  -1.482  -4.666   9.381
  671   HG13  VAL  83          3HG1      VAL  83  -2.234  -5.154   7.863
  672   HG21  VAL  83          3HG2      VAL  83  -0.860  -5.379   5.806
  673   HG22  VAL  83          2HG2      VAL  83   0.882  -5.101   5.870
  674   HG23  VAL  83          1HG2      VAL  83  -0.234  -3.741   5.988
  675    HA   PRO  84           HA       PRO  84   4.858  -5.970   8.480
  676    HB2  PRO  84           HB2      PRO  84   3.511  -8.618   8.571
  677    HB3  PRO  84           HB3      PRO  84   4.930  -8.051   9.455
  678    HG2  PRO  84           HG2      PRO  84   2.577  -8.322  10.679
  679    HG3  PRO  84           HG3      PRO  84   3.659  -6.971  11.067
  680    HD2  PRO  84           HD2      PRO  84   1.172  -6.998   9.414
  681    HD3  PRO  84           HD3      PRO  84   1.779  -5.750  10.522
  682    H    VAL  85           H        VAL  85   5.936  -6.834   6.673
  683    HA   VAL  85           HA       VAL  85   4.593  -6.482   4.224
  684    HB   VAL  85           HB       VAL  85   7.038  -6.116   4.603
  685   HG11  VAL  85          2HG1      VAL  85   7.592  -8.122   5.822
  686   HG12  VAL  85          1HG1      VAL  85   8.566  -8.020   4.355
  687   HG13  VAL  85          3HG1      VAL  85   7.188  -9.117   4.424
  688   HG21  VAL  85          3HG2      VAL  85   6.260  -7.870   2.282
  689   HG22  VAL  85          2HG2      VAL  85   7.742  -6.921   2.379
  690   HG23  VAL  85          1HG2      VAL  85   6.176  -6.110   2.362
  691    H    SER  86           H        SER  86   5.098  -9.280   6.206
  692    HA   SER  86           HA       SER  86   4.517 -11.241   4.211
  693    HB2  SER  86           HB2      SER  86   4.354 -11.466   7.226
  694    HB3  SER  86           HB3      SER  86   4.403 -12.809   6.084
  695    HG   SER  86           HG       SER  86   6.431 -10.937   6.709
  696    H    ALA  87           H        ALA  87   2.546  -9.084   5.978
  697    HA   ALA  87           HA       ALA  87   0.335 -10.770   6.508
  698    HB1  ALA  87           HB1      ALA  87   0.743  -8.752   7.792
  699    HB2  ALA  87           HB2      ALA  87   0.419  -7.768   6.363
  700    HB3  ALA  87           HB3      ALA  87  -0.870  -8.737   7.077
  701    HA   PRO  88           HA       PRO  88  -1.908  -8.745   2.790
  702    HB2  PRO  88           HB2      PRO  88  -0.521  -7.499   0.852
  703    HB3  PRO  88           HB3      PRO  88  -1.016  -6.669   2.332
  704    HG2  PRO  88           HG2      PRO  88   1.638  -7.873   1.635
  705    HG3  PRO  88           HG3      PRO  88   1.286  -6.303   2.381
  706    HD2  PRO  88           HD2      PRO  88   2.047  -8.478   3.815
  707    HD3  PRO  88           HD3      PRO  88   0.976  -7.224   4.468
  708    H    ILE  89           H        ILE  89   0.334 -11.027   2.832
  709    HA   ILE  89           HA       ILE  89   0.415 -11.715   0.030
  710    HB   ILE  89           HB       ILE  89   1.405 -13.186   2.476
  711   HG12  ILE  89          2HG1      ILE  89   2.907 -11.762   0.265
  712   HG13  ILE  89          3HG1      ILE  89   2.569 -11.066   1.845
  713   HG21  ILE  89          2HG2      ILE  89   2.569 -14.679   0.922
  714   HG22  ILE  89          1HG2      ILE  89   1.778 -13.880  -0.435
  715   HG23  ILE  89          3HG2      ILE  89   0.819 -14.784   0.734
  716   HD11  ILE  89          3HD1      ILE  89   4.835 -11.901   1.737
  717   HD12  ILE  89          2HD1      ILE  89   4.248 -13.505   1.301
  718   HD13  ILE  89          1HD1      ILE  89   3.892 -12.839   2.895
  719    H    LYS  90           H        LYS  90  -0.852 -13.383   2.951
  720    HA   LYS  90           HA       LYS  90  -2.614 -14.931   1.196
  721    HB2  LYS  90           HB2      LYS  90  -2.068 -15.227   4.155
  722    HB3  LYS  90           HB3      LYS  90  -3.082 -16.294   3.195
  723    HG2  LYS  90           HG2      LYS  90  -1.067 -16.809   1.800
  724    HG3  LYS  90           HG3      LYS  90  -0.110 -15.902   2.974
  725    HD2  LYS  90           HD2      LYS  90  -0.871 -17.409   4.750
  726    HD3  LYS  90           HD3      LYS  90  -1.806 -18.325   3.567
  727    HE2  LYS  90           HE2      LYS  90   0.351 -18.718   2.333
  728    HE3  LYS  90           HE3      LYS  90   1.184 -18.023   3.725
  729    HZ1  LYS  90           HZ1      LYS  90   1.165 -20.388   3.938
  730    HZ2  LYS  90           HZ2      LYS  90  -0.511 -20.460   3.696
  731    HZ3  LYS  90           HZ3      LYS  90   0.111 -19.756   5.108
  732    H    ASP  91           H        ASP  91  -2.723 -12.146   3.077
  733    HA   ASP  91           HA       ASP  91  -5.652 -12.349   3.303
  734    HB2  ASP  91           HB2      ASP  91  -3.695 -11.229   5.307
  735    HB3  ASP  91           HB3      ASP  91  -5.412 -10.847   5.347
  736    H    ALA  92           H        ALA  92  -4.260 -11.255   1.118
  737    HA   ALA  92           HA       ALA  92  -3.821  -8.507   1.172
  738    HB1  ALA  92           HB1      ALA  92  -3.220  -9.965  -0.712
  739    HB2  ALA  92           HB2      ALA  92  -4.927 -10.117  -1.125
  740    HB3  ALA  92           HB3      ALA  92  -4.131  -8.547  -1.231
  741    H    GLU  93           H        GLU  93  -6.828 -10.275   0.493
  742    HA   GLU  93           HA       GLU  93  -8.416  -7.997  -0.035
  743    HB2  GLU  93           HB2      GLU  93  -9.242 -10.723   0.987
  744    HB3  GLU  93           HB3      GLU  93 -10.333  -9.515   0.326
  745    HG2  GLU  93           HG2      GLU  93  -9.405  -9.724  -1.838
  746    HG3  GLU  93           HG3      GLU  93  -8.042 -10.668  -1.237
  747    H    LYS  94           H        LYS  94  -7.517  -9.643   2.917
  748    HA   LYS  94           HA       LYS  94  -9.462  -8.476   4.622
  749    HB2  LYS  94           HB2      LYS  94  -6.693  -9.366   5.438
  750    HB3  LYS  94           HB3      LYS  94  -8.132  -9.290   6.441
  751    HG2  LYS  94           HG2      LYS  94  -7.836 -11.141   4.093
  752    HG3  LYS  94           HG3      LYS  94  -7.425 -11.581   5.749
  753    HD2  LYS  94           HD2      LYS  94  -9.757 -11.079   6.412
  754    HD3  LYS  94           HD3      LYS  94 -10.139 -10.766   4.717
  755    HE2  LYS  94           HE2      LYS  94 -10.764 -13.041   5.391
  756    HE3  LYS  94           HE3      LYS  94  -9.528 -13.041   4.133
  757    HZ1  LYS  94           HZ1      LYS  94  -9.044 -13.440   7.038
  758    HZ2  LYS  94           HZ2      LYS  94  -7.848 -13.452   5.834
  759    HZ3  LYS  94           HZ3      LYS  94  -9.043 -14.659   5.862
  760    H    VAL  95           H        VAL  95  -6.159  -7.659   3.727
  761    HA   VAL  95           HA       VAL  95  -5.780  -5.447   5.403
  762    HB   VAL  95           HB       VAL  95  -4.593  -5.955   2.664
  763   HG11  VAL  95          2HG1      VAL  95  -4.275  -3.653   3.331
  764   HG12  VAL  95          1HG1      VAL  95  -2.748  -4.526   3.442
  765   HG13  VAL  95          3HG1      VAL  95  -3.665  -4.163   4.904
  766   HG21  VAL  95          3HG2      VAL  95  -2.702  -6.917   3.888
  767   HG22  VAL  95          2HG2      VAL  95  -4.194  -7.811   4.184
  768   HG23  VAL  95          1HG2      VAL  95  -3.573  -6.696   5.405
  769    H    ILE  96           H        ILE  96  -7.042  -5.694   2.107
  770    HA   ILE  96           HA       ILE  96  -7.349  -2.942   1.621
  771    HB   ILE  96           HB       ILE  96  -8.920  -5.267   0.491
  772   HG12  ILE  96          2HG1      ILE  96  -6.554  -3.766  -0.649
  773   HG13  ILE  96          3HG1      ILE  96  -6.462  -5.346   0.118
  774   HG21  ILE  96          2HG2      ILE  96  -9.473  -3.753  -1.361
  775   HG22  ILE  96          1HG2      ILE  96  -8.677  -2.430  -0.509
  776   HG23  ILE  96          3HG2      ILE  96 -10.124  -3.176   0.172
  777   HD11  ILE  96          3HD1      ILE  96  -6.443  -5.558  -2.288
  778   HD12  ILE  96          2HD1      ILE  96  -7.969  -4.680  -2.398
  779   HD13  ILE  96          1HD1      ILE  96  -7.917  -6.262  -1.622
  780    H    ASN  97           H        ASN  97  -9.621  -5.359   2.880
  781    HA   ASN  97           HA       ASN  97 -11.817  -3.601   3.151
  782    HB2  ASN  97           HB2      ASN  97 -11.143  -6.246   4.414
  783    HB3  ASN  97           HB3      ASN  97 -12.620  -5.378   4.824
  784   HD21  ASN  97          1HD2      ASN  97 -12.344  -7.959   3.593
  785   HD22  ASN  97          2HD2      ASN  97 -13.130  -7.862   2.052
  786    H    ALA  98           H        ALA  98  -9.219  -4.527   5.346
  787    HA   ALA  98           HA       ALA  98 -10.307  -3.250   7.634
  788    HB1  ALA  98           HB1      ALA  98  -7.429  -3.954   7.051
  789    HB2  ALA  98           HB2      ALA  98  -8.104  -3.553   8.631
  790    HB3  ALA  98           HB3      ALA  98  -8.619  -5.021   7.798
  791    H    ALA  99           H        ALA  99  -8.121  -2.232   5.075
  792    HA   ALA  99           HA       ALA  99  -7.368   0.255   6.139
  793    HB1  ALA  99           HB1      ALA  99  -6.818   0.866   3.828
  794    HB2  ALA  99           HB2      ALA  99  -6.231  -0.746   4.232
  795    HB3  ALA  99           HB3      ALA  99  -7.681  -0.559   3.248
  796    H    LEU 100           H        LEU 100 -10.177  -0.763   4.257
  797    HA   LEU 100           HA       LEU 100 -11.251   1.857   3.928
  798    HB2  LEU 100           HB2      LEU 100 -12.697  -0.795   3.857
  799    HB3  LEU 100           HB3      LEU 100 -13.312   0.731   3.260
  800    HG   LEU 100           HG       LEU 100 -10.940  -0.756   2.134
  801   HD11  LEU 100          2HD1      LEU 100 -12.402  -1.128   0.202
  802   HD12  LEU 100          1HD1      LEU 100 -13.735  -0.372   1.072
  803   HD13  LEU 100          3HD1      LEU 100 -13.040  -1.882   1.663
  804   HD21  LEU 100          3HD2      LEU 100 -12.317   1.760   1.200
  805   HD22  LEU 100          2HD2      LEU 100 -11.033   0.909   0.341
  806   HD23  LEU 100          1HD2      LEU 100 -10.701   1.658   1.904
  807    H    ALA 101           H        ALA 101 -11.484  -0.598   6.421
  808    HA   ALA 101           HA       ALA 101 -13.692   0.531   7.806
  809    HB1  ALA 101           HB1      ALA 101 -12.961  -1.775   8.169
  810    HB2  ALA 101           HB2      ALA 101 -11.454  -1.188   8.875
  811    HB3  ALA 101           HB3      ALA 101 -12.990  -0.865   9.680
  812    H    LEU 102           H        LEU 102 -10.255   1.168   7.815
  813    HA   LEU 102           HA       LEU 102 -10.133   2.730  10.158
  814    HB2  LEU 102           HB2      LEU 102  -8.459   2.897   7.649
  815    HB3  LEU 102           HB3      LEU 102  -8.079   3.693   9.162
  816    HG   LEU 102           HG       LEU 102  -8.202   0.710   8.716
  817   HD11  LEU 102          2HD1      LEU 102  -5.793   0.796   9.072
  818   HD12  LEU 102          1HD1      LEU 102  -5.869   2.551   9.228
  819   HD13  LEU 102          3HD1      LEU 102  -6.263   1.785   7.688
  820   HD21  LEU 102          3HD2      LEU 102  -7.327   0.551  11.003
  821   HD22  LEU 102          2HD2      LEU 102  -8.927   1.293  10.965
  822   HD23  LEU 102          1HD2      LEU 102  -7.494   2.297  11.183
  823    H    ILE 103           H        ILE 103 -10.938   3.513   6.819
  824    HA   ILE 103           HA       ILE 103 -11.337   6.324   7.516
  825    HB   ILE 103           HB       ILE 103 -11.718   6.730   5.171
  826   HG12  ILE 103          2HG1      ILE 103 -11.570   3.729   4.791
  827   HG13  ILE 103          3HG1      ILE 103 -13.036   4.697   4.682
  828   HG21  ILE 103          2HG2      ILE 103  -9.402   6.576   5.845
  829   HG22  ILE 103          1HG2      ILE 103  -9.594   5.934   4.212
  830   HG23  ILE 103          3HG2      ILE 103  -9.415   4.832   5.578
  831   HD11  ILE 103          3HD1      ILE 103 -12.125   5.871   2.755
  832   HD12  ILE 103          2HD1      ILE 103 -12.169   4.129   2.485
  833   HD13  ILE 103          1HD1      ILE 103 -10.642   4.924   2.872
  834    H    ASP 104           H        ASP 104 -12.990   3.602   7.928
  835    HA   ASP 104           HA       ASP 104 -15.119   2.883   8.044
  836    HB2  ASP 104           HB2      ASP 104 -15.434   4.869   9.456
  837    HB3  ASP 104           HB3      ASP 104 -15.832   5.820   8.027
  838    H    GLU 105           H        GLU 105 -15.315   1.827   6.201
  839    HA   GLU 105           HA       GLU 105 -15.185   2.675   3.641
  840    HB2  GLU 105           HB2      GLU 105 -16.565   0.652   3.052
  841    HB3  GLU 105           HB3      GLU 105 -15.166   0.355   4.072
  842    HG2  GLU 105           HG2      GLU 105 -16.688   0.361   6.041
  843    HG3  GLU 105           HG3      GLU 105 -18.046   0.465   4.920
  844    H    LYS 106           H        LYS 106 -16.258   3.880   2.348
  845    HA   LYS 106           HA       LYS 106 -19.120   4.073   2.342
  846    HB2  LYS 106           HB2      LYS 106 -19.154   6.545   2.677
  847    HB3  LYS 106           HB3      LYS 106 -18.702   5.652   4.121
  848    HG2  LYS 106           HG2      LYS 106 -16.331   6.160   3.655
  849    HG3  LYS 106           HG3      LYS 106 -16.837   7.123   2.266
  850    HD2  LYS 106           HD2      LYS 106 -16.412   8.556   4.182
  851    HD3  LYS 106           HD3      LYS 106 -18.126   8.582   3.767
  852    HE2  LYS 106           HE2      LYS 106 -18.652   7.100   5.576
  853    HE3  LYS 106           HE3      LYS 106 -16.941   6.833   5.917
  854    HZ1  LYS 106           HZ1      LYS 106 -16.724   9.119   6.585
  855    HZ2  LYS 106           HZ2      LYS 106 -17.985   8.407   7.467
  856    HZ3  LYS 106           HZ3      LYS 106 -18.336   9.447   6.170
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1 -16.661  -0.782  -4.469
    2    H2   MET   1           H2       MET   1 -15.716  -1.926  -3.639
    3    H3   MET   1           H3       MET   1 -17.127  -2.413  -4.437
    4    HA   MET   1           HA       MET   1 -15.044  -2.973  -5.608
    5    HB2  MET   1           HB2      MET   1 -17.167  -1.262  -6.864
    6    HB3  MET   1           HB3      MET   1 -15.835  -1.882  -7.826
    7    HG2  MET   1           HG2      MET   1 -17.668  -3.617  -6.197
    8    HG3  MET   1           HG3      MET   1 -17.920  -3.241  -7.903
    9    HE1  MET   1           HE1      MET   1 -16.722  -6.984  -7.950
   10    HE2  MET   1           HE2      MET   1 -17.718  -6.218  -6.711
   11    HE3  MET   1           HE3      MET   1 -18.001  -5.862  -8.416
   12    H    LYS   2           H        LYS   2 -15.746   0.296  -6.748
   13    HA   LYS   2           HA       LYS   2 -12.918   0.548  -7.292
   14    HB2  LYS   2           HB2      LYS   2 -15.263   2.271  -8.076
   15    HB3  LYS   2           HB3      LYS   2 -13.604   2.574  -8.570
   16    HG2  LYS   2           HG2      LYS   2 -13.570   0.373  -9.690
   17    HG3  LYS   2           HG3      LYS   2 -15.265   0.155  -9.250
   18    HD2  LYS   2           HD2      LYS   2 -14.195   2.420 -10.930
   19    HD3  LYS   2           HD3      LYS   2 -14.960   0.964 -11.567
   20    HE2  LYS   2           HE2      LYS   2 -16.294   2.855  -9.639
   21    HE3  LYS   2           HE3      LYS   2 -16.467   2.959 -11.390
   22    HZ1  LYS   2           HZ1      LYS   2 -18.300   1.757 -10.355
   23    HZ2  LYS   2           HZ2      LYS   2 -17.221   0.607  -9.732
   24    HZ3  LYS   2           HZ3      LYS   2 -17.426   0.758 -11.406
   25    H    ARG   3           H        ARG   3 -11.593   1.422  -5.931
   26    HA   ARG   3           HA       ARG   3 -12.127   4.076  -4.913
   27    HB2  ARG   3           HB2      ARG   3 -12.737   2.238  -3.169
   28    HB3  ARG   3           HB3      ARG   3 -11.002   2.028  -3.021
   29    HG2  ARG   3           HG2      ARG   3 -11.701   3.500  -1.287
   30    HG3  ARG   3           HG3      ARG   3 -10.821   4.459  -2.479
   31    HD2  ARG   3           HD2      ARG   3 -12.987   5.136  -3.467
   32    HD3  ARG   3           HD3      ARG   3 -13.818   4.255  -2.187
   33    HE   ARG   3           HE       ARG   3 -12.004   6.505  -1.604
   34   HH11  ARG   3          2HH1      ARG   3 -15.086   4.896  -1.273
   35   HH12  ARG   3          1HH1      ARG   3 -15.700   6.018  -0.099
   36   HH21  ARG   3          2HH2      ARG   3 -12.794   8.018  -0.079
   37   HH22  ARG   3          1HH2      ARG   3 -14.396   7.795   0.589
   38    H    LYS   4           H        LYS   4 -10.193   5.259  -4.613
   39    HA   LYS   4           HA       LYS   4  -7.872   4.158  -5.963
   40    HB2  LYS   4           HB2      LYS   4  -8.191   6.846  -4.626
   41    HB3  LYS   4           HB3      LYS   4  -6.935   6.380  -5.760
   42    HG2  LYS   4           HG2      LYS   4  -9.868   6.661  -6.372
   43    HG3  LYS   4           HG3      LYS   4  -8.589   7.781  -6.833
   44    HD2  LYS   4           HD2      LYS   4  -7.539   5.911  -8.129
   45    HD3  LYS   4           HD3      LYS   4  -8.982   4.951  -7.793
   46    HE2  LYS   4           HE2      LYS   4 -10.355   6.695  -8.871
   47    HE3  LYS   4           HE3      LYS   4  -8.886   7.587  -9.259
   48    HZ1  LYS   4           HZ1      LYS   4  -8.166   5.526 -10.489
   49    HZ2  LYS   4           HZ2      LYS   4  -9.447   6.394 -11.175
   50    HZ3  LYS   4           HZ3      LYS   4  -9.761   4.963 -10.317
   51    H    ILE   5           H        ILE   5  -6.222   3.173  -4.963
   52    HA   ILE   5           HA       ILE   5  -5.748   3.794  -2.122
   53    HB   ILE   5           HB       ILE   5  -5.706   1.017  -3.329
   54   HG12  ILE   5          2HG1      ILE   5  -7.575   2.226  -1.275
   55   HG13  ILE   5          3HG1      ILE   5  -7.986   1.899  -2.956
   56   HG21  ILE   5          2HG2      ILE   5  -3.982   1.285  -1.638
   57   HG22  ILE   5          1HG2      ILE   5  -5.280   0.258  -1.029
   58   HG23  ILE   5          3HG2      ILE   5  -5.165   1.938  -0.504
   59   HD11  ILE   5          3HD1      ILE   5  -7.658  -0.486  -2.570
   60   HD12  ILE   5          2HD1      ILE   5  -8.870   0.189  -1.481
   61   HD13  ILE   5          1HD1      ILE   5  -7.246  -0.157  -0.887
   62    H    ILE   6           H        ILE   6  -3.672   4.231  -1.659
   63    HA   ILE   6           HA       ILE   6  -1.635   3.345  -3.589
   64    HB   ILE   6           HB       ILE   6  -0.154   5.124  -2.759
   65   HG12  ILE   6          2HG1      ILE   6  -1.346   5.361  -0.513
   66   HG13  ILE   6          3HG1      ILE   6  -0.818   6.846  -1.290
   67   HG21  ILE   6          2HG2      ILE   6  -2.796   6.097  -3.824
   68   HG22  ILE   6          1HG2      ILE   6  -1.432   5.493  -4.767
   69   HG23  ILE   6          3HG2      ILE   6  -1.280   7.001  -3.863
   70   HD11  ILE   6          3HD1      ILE   6  -3.100   7.249  -2.057
   71   HD12  ILE   6          2HD1      ILE   6  -3.011   7.099  -0.302
   72   HD13  ILE   6          1HD1      ILE   6  -3.624   5.760  -1.272
   73    H    ALA   7           H        ALA   7   0.089   2.179  -2.851
   74    HA   ALA   7           HA       ALA   7   0.190   1.625   0.026
   75    HB1  ALA   7           HB1      ALA   7  -1.287  -0.065  -0.956
   76    HB2  ALA   7           HB2      ALA   7  -0.008  -0.529  -2.078
   77    HB3  ALA   7           HB3      ALA   7   0.204  -0.780  -0.345
   78    H    VAL   8           H        VAL   8   2.190   1.269   0.795
   79    HA   VAL   8           HA       VAL   8   4.365   1.101  -1.182
   80    HB   VAL   8           HB       VAL   8   4.484   2.181   1.641
   81   HG11  VAL   8          2HG1      VAL   8   6.619   2.029  -0.487
   82   HG12  VAL   8          1HG1      VAL   8   6.567   1.087   1.001
   83   HG13  VAL   8          3HG1      VAL   8   6.780   2.834   1.074
   84   HG21  VAL   8          3HG2      VAL   8   3.319   3.678   0.097
   85   HG22  VAL   8          2HG2      VAL   8   4.691   3.607  -1.010
   86   HG23  VAL   8          1HG2      VAL   8   4.878   4.343   0.581
   87    H    THR   9           H        THR   9   5.124  -0.860  -1.355
   88    HA   THR   9           HA       THR   9   5.134  -2.635   0.979
   89    HB   THR   9           HB       THR   9   5.709  -4.399  -0.789
   90    HG1  THR   9           HG1      THR   9   6.040  -2.413  -2.341
   91   HG21  THR   9          3HG2      THR   9   3.487  -4.215   0.216
   92   HG22  THR   9          1HG2      THR   9   3.365  -4.633  -1.494
   93   HG23  THR   9          2HG2      THR   9   3.045  -2.982  -0.964
   94    H    ALA  10           H        ALA  10   6.978  -2.657   2.091
   95    HA   ALA  10           HA       ALA  10   9.490  -2.302   0.594
   96    HB1  ALA  10           HB1      ALA  10   8.907  -0.201   1.675
   97    HB2  ALA  10           HB2      ALA  10   8.803  -1.021   3.234
   98    HB3  ALA  10           HB3      ALA  10  10.352  -0.907   2.399
   99    H    CYS  11           H        CYS  11  11.238  -3.456   1.283
  100    HA   CYS  11           HA       CYS  11  11.335  -4.697   3.861
  101    HB2  CYS  11           HB2      CYS  11   9.903  -6.302   2.592
  102    HB3  CYS  11           HB3      CYS  11  11.215  -6.509   1.437
  103    HG   CYS  11           HG       CYS  11  10.709  -8.040   4.303
  104    H    ALA  12           H        ALA  12  13.412  -4.882   4.474
  105    HA   ALA  12           HA       ALA  12  15.451  -4.470   2.380
  106    HB1  ALA  12           HB1      ALA  12  16.829  -3.403   4.075
  107    HB2  ALA  12           HB2      ALA  12  15.259  -2.609   3.957
  108    HB3  ALA  12           HB3      ALA  12  15.591  -3.709   5.293
  109    H    THR  13           H        THR  13  14.313  -6.593   4.777
  110    HA   THR  13           HA       THR  13  16.846  -7.949   5.139
  111    HB   THR  13           HB       THR  13  15.410  -9.570   6.467
  112    HG1  THR  13           HG1      THR  13  13.425  -7.571   6.510
  113   HG21  THR  13          3HG2      THR  13  16.702  -7.775   7.530
  114   HG22  THR  13          1HG2      THR  13  15.171  -8.046   8.366
  115   HG23  THR  13          2HG2      THR  13  15.355  -6.662   7.286
  116    H    GLY  14           H        GLY  14  13.641  -8.764   3.824
  117    HA2  GLY  14           HA1      GLY  14  14.938 -10.866   2.199
  118    HA3  GLY  14           HA2      GLY  14  13.261 -10.917   2.731
  119    H    VAL  15           H        VAL  15  15.471  -9.769   0.374
  120    HA   VAL  15           HA       VAL  15  14.097  -7.615  -0.730
  121    HB   VAL  15           HB       VAL  15  15.806  -9.588  -2.251
  122   HG11  VAL  15          2HG1      VAL  15  16.299  -7.689  -3.704
  123   HG12  VAL  15          1HG1      VAL  15  15.214  -6.674  -2.753
  124   HG13  VAL  15          3HG1      VAL  15  14.569  -8.035  -3.671
  125   HG21  VAL  15          3HG2      VAL  15  16.993  -8.841  -0.275
  126   HG22  VAL  15          2HG2      VAL  15  16.619  -7.160  -0.657
  127   HG23  VAL  15          1HG2      VAL  15  17.684  -8.087  -1.713
  128    H    ALA  16           H        ALA  16  13.831 -11.075  -1.471
  129    HA   ALA  16           HA       ALA  16  12.081 -10.889  -3.650
  130    HB1  ALA  16           HB1      ALA  16  13.260 -12.945  -3.043
  131    HB2  ALA  16           HB2      ALA  16  12.260 -13.092  -1.599
  132    HB3  ALA  16           HB3      ALA  16  11.524 -13.218  -3.197
  133    H    HIS  17           H        HIS  17  11.494 -10.527  -0.242
  134    HA   HIS  17           HA       HIS  17   8.701 -11.094  -0.261
  135    HB2  HIS  17           HB2      HIS  17  10.357  -9.436   1.655
  136    HB3  HIS  17           HB3      HIS  17   8.665  -9.840   1.909
  137    HD1  HIS  17           HD1      HIS  17  10.171 -10.794   4.135
  138    HD2  HIS  17           HD2      HIS  17  10.123 -12.989   0.598
  139    HE1  HIS  17           HE1      HIS  17  10.816 -13.137   4.778
  140    HE2  HIS  17           HE2      HIS  17  11.015 -14.380   2.595
  141    H    THR  18           H        THR  18  10.633  -8.219  -0.796
  142    HA   THR  18           HA       THR  18   8.620  -6.281  -0.655
  143    HB   THR  18           HB       THR  18  10.965  -6.130  -2.543
  144    HG1  THR  18           HG1      THR  18  12.141  -5.394  -0.655
  145   HG21  THR  18          3HG2      THR  18   9.431  -4.249  -2.603
  146   HG22  THR  18          1HG2      THR  18  10.940  -3.761  -1.833
  147   HG23  THR  18          2HG2      THR  18   9.516  -4.095  -0.848
  148    H    TYR  19           H        TYR  19   9.860  -8.127  -3.431
  149    HA   TYR  19           HA       TYR  19   8.109  -6.919  -5.322
  150    HB2  TYR  19           HB2      TYR  19   9.486  -9.601  -5.534
  151    HB3  TYR  19           HB3      TYR  19   8.856  -8.633  -6.861
  152    HD1  TYR  19           HD1      TYR  19   9.926  -6.264  -7.144
  153    HD2  TYR  19           HD2      TYR  19  11.708  -9.447  -4.961
  154    HE1  TYR  19           HE1      TYR  19  12.130  -5.198  -7.403
  155    HE2  TYR  19           HE2      TYR  19  13.914  -8.397  -5.209
  156    HH   TYR  19           HH       TYR  19  15.062  -6.832  -6.607
  157    H    MET  20           H        MET  20   7.996  -9.794  -3.325
  158    HA   MET  20           HA       MET  20   5.793 -11.037  -4.588
  159    HB2  MET  20           HB2      MET  20   7.375 -12.249  -3.156
  160    HB3  MET  20           HB3      MET  20   6.804 -11.346  -1.760
  161    HG2  MET  20           HG2      MET  20   4.581 -12.325  -2.042
  162    HG3  MET  20           HG3      MET  20   5.168 -13.241  -3.428
  163    HE1  MET  20           HE1      MET  20   8.114 -14.033  -2.452
  164    HE2  MET  20           HE2      MET  20   7.810 -15.620  -1.744
  165    HE3  MET  20           HE3      MET  20   7.023 -15.164  -3.254
  166    H    ALA  21           H        ALA  21   6.032  -8.931  -1.745
  167    HA   ALA  21           HA       ALA  21   3.370  -9.125  -0.911
  168    HB1  ALA  21           HB1      ALA  21   5.157  -8.161   0.460
  169    HB2  ALA  21           HB2      ALA  21   5.225  -6.766  -0.619
  170    HB3  ALA  21           HB3      ALA  21   3.771  -7.075   0.332
  171    H    ALA  22           H        ALA  22   4.898  -6.870  -3.175
  172    HA   ALA  22           HA       ALA  22   2.648  -5.213  -3.556
  173    HB1  ALA  22           HB1      ALA  22   3.832  -4.369  -5.510
  174    HB2  ALA  22           HB2      ALA  22   4.931  -4.542  -4.141
  175    HB3  ALA  22           HB3      ALA  22   4.949  -5.733  -5.443
  176    H    GLN  23           H        GLN  23   3.882  -7.931  -5.517
  177    HA   GLN  23           HA       GLN  23   1.878  -7.707  -7.511
  178    HB2  GLN  23           HB2      GLN  23   2.675  -9.889  -8.297
  179    HB3  GLN  23           HB3      GLN  23   4.017  -8.809  -7.951
  180    HG2  GLN  23           HG2      GLN  23   4.272  -9.940  -5.749
  181    HG3  GLN  23           HG3      GLN  23   3.043 -11.096  -6.262
  182   HE21  GLN  23          1HE2      GLN  23   6.284  -9.955  -6.736
  183   HE22  GLN  23          2HE2      GLN  23   6.845 -11.306  -7.661
  184    H    ALA  24           H        ALA  24   2.088  -9.560  -4.524
  185    HA   ALA  24           HA       ALA  24  -0.236 -11.142  -4.999
  186    HB1  ALA  24           HB1      ALA  24   1.112 -10.422  -2.395
  187    HB2  ALA  24           HB2      ALA  24  -0.085 -11.698  -2.620
  188    HB3  ALA  24           HB3      ALA  24   1.489 -11.820  -3.403
  189    H    LEU  25           H        LEU  25   0.414  -8.134  -3.289
  190    HA   LEU  25           HA       LEU  25  -2.173  -7.632  -2.329
  191    HB2  LEU  25           HB2      LEU  25  -0.175  -6.451  -1.566
  192    HB3  LEU  25           HB3      LEU  25   0.012  -5.715  -3.144
  193    HG   LEU  25           HG       LEU  25  -2.065  -4.456  -2.813
  194   HD11  LEU  25          2HD1      LEU  25  -2.078  -5.697  -0.063
  195   HD12  LEU  25          1HD1      LEU  25  -3.222  -6.055  -1.357
  196   HD13  LEU  25          3HD1      LEU  25  -3.171  -4.442  -0.645
  197   HD21  LEU  25          3HD2      LEU  25  -1.203  -2.916  -1.176
  198   HD22  LEU  25          2HD2      LEU  25   0.138  -3.565  -2.125
  199   HD23  LEU  25          1HD2      LEU  25  -0.165  -4.168  -0.493
  200    H    LYS  26           H        LYS  26  -0.618  -6.861  -5.405
  201    HA   LYS  26           HA       LYS  26  -2.570  -5.273  -6.577
  202    HB2  LYS  26           HB2      LYS  26  -0.678  -7.282  -7.790
  203    HB3  LYS  26           HB3      LYS  26  -1.721  -6.264  -8.764
  204    HG2  LYS  26           HG2      LYS  26   0.346  -5.247  -6.831
  205    HG3  LYS  26           HG3      LYS  26   0.581  -5.418  -8.570
  206    HD2  LYS  26           HD2      LYS  26  -1.470  -3.662  -7.222
  207    HD3  LYS  26           HD3      LYS  26   0.031  -3.115  -7.973
  208    HE2  LYS  26           HE2      LYS  26  -2.265  -4.481  -9.376
  209    HE3  LYS  26           HE3      LYS  26  -1.895  -2.760  -9.437
  210    HZ1  LYS  26           HZ1      LYS  26   0.225  -3.305 -10.496
  211    HZ2  LYS  26           HZ2      LYS  26  -1.087  -3.879 -11.403
  212    HZ3  LYS  26           HZ3      LYS  26  -0.171  -4.956 -10.469
  213    H    LYS  27           H        LYS  27  -2.344  -8.810  -6.459
  214    HA   LYS  27           HA       LYS  27  -4.524  -9.374  -8.132
  215    HB2  LYS  27           HB2      LYS  27  -3.175 -10.915  -5.941
  216    HB3  LYS  27           HB3      LYS  27  -4.594 -11.558  -6.753
  217    HG2  LYS  27           HG2      LYS  27  -1.970 -10.830  -8.036
  218    HG3  LYS  27           HG3      LYS  27  -2.597 -12.456  -7.752
  219    HD2  LYS  27           HD2      LYS  27  -4.560 -11.842  -9.192
  220    HD3  LYS  27           HD3      LYS  27  -3.708 -10.355  -9.604
  221    HE2  LYS  27           HE2      LYS  27  -2.817 -13.180 -10.159
  222    HE3  LYS  27           HE3      LYS  27  -3.342 -11.982 -11.338
  223    HZ1  LYS  27           HZ1      LYS  27  -0.846 -12.023  -9.754
  224    HZ2  LYS  27           HZ2      LYS  27  -1.391 -10.612 -10.515
  225    HZ3  LYS  27           HZ3      LYS  27  -1.024 -11.986 -11.441
  226    H    GLY  28           H        GLY  28  -4.356  -9.058  -4.599
  227    HA2  GLY  28           HA1      GLY  28  -7.074  -9.636  -4.111
  228    HA3  GLY  28           HA2      GLY  28  -6.002  -8.765  -3.024
  229    H    ALA  29           H        ALA  29  -5.393  -6.586  -4.697
  230    HA   ALA  29           HA       ALA  29  -7.595  -4.904  -4.133
  231    HB1  ALA  29           HB1      ALA  29  -5.186  -4.404  -5.871
  232    HB2  ALA  29           HB2      ALA  29  -6.294  -3.171  -5.270
  233    HB3  ALA  29           HB3      ALA  29  -5.306  -4.095  -4.140
  234    H    LYS  30           H        LYS  30  -6.291  -6.126  -7.216
  235    HA   LYS  30           HA       LYS  30  -8.230  -4.786  -8.791
  236    HB2  LYS  30           HB2      LYS  30  -5.955  -5.675  -9.539
  237    HB3  LYS  30           HB3      LYS  30  -6.711  -7.259  -9.619
  238    HG2  LYS  30           HG2      LYS  30  -6.632  -6.227 -11.811
  239    HG3  LYS  30           HG3      LYS  30  -8.302  -6.421 -11.275
  240    HD2  LYS  30           HD2      LYS  30  -8.415  -4.083 -10.659
  241    HD3  LYS  30           HD3      LYS  30  -6.709  -3.865 -11.048
  242    HE2  LYS  30           HE2      LYS  30  -8.813  -4.699 -13.037
  243    HE3  LYS  30           HE3      LYS  30  -8.285  -3.036 -12.795
  244    HZ1  LYS  30           HZ1      LYS  30  -7.150  -4.077 -14.662
  245    HZ2  LYS  30           HZ2      LYS  30  -6.545  -5.289 -13.647
  246    HZ3  LYS  30           HZ3      LYS  30  -6.050  -3.680 -13.435
  247    H    LYS  31           H        LYS  31  -8.193  -7.829  -7.110
  248    HA   LYS  31           HA       LYS  31 -10.401  -9.033  -8.428
  249    HB2  LYS  31           HB2      LYS  31  -8.768 -10.220  -6.913
  250    HB3  LYS  31           HB3      LYS  31  -9.570  -9.447  -5.550
  251    HG2  LYS  31           HG2      LYS  31 -11.715 -10.507  -6.437
  252    HG3  LYS  31           HG3      LYS  31 -10.659 -11.499  -7.443
  253    HD2  LYS  31           HD2      LYS  31 -10.620 -11.330  -4.430
  254    HD3  LYS  31           HD3      LYS  31 -11.246 -12.668  -5.392
  255    HE2  LYS  31           HE2      LYS  31  -9.000 -13.063  -6.291
  256    HE3  LYS  31           HE3      LYS  31  -8.379 -11.729  -5.319
  257    HZ1  LYS  31           HZ1      LYS  31  -9.650 -14.192  -4.246
  258    HZ2  LYS  31           HZ2      LYS  31  -9.021 -12.918  -3.315
  259    HZ3  LYS  31           HZ3      LYS  31  -7.987 -13.876  -4.262
  260    H    MET  32           H        MET  32 -10.083  -6.780  -5.762
  261    HA   MET  32           HA       MET  32 -12.898  -6.920  -5.109
  262    HB2  MET  32           HB2      MET  32 -10.627  -5.255  -4.036
  263    HB3  MET  32           HB3      MET  32 -12.288  -5.062  -3.496
  264    HG2  MET  32           HG2      MET  32 -10.672  -7.594  -3.304
  265    HG3  MET  32           HG3      MET  32 -10.981  -6.466  -1.982
  266    HE1  MET  32           HE1      MET  32 -11.579  -9.598  -1.854
  267    HE2  MET  32           HE2      MET  32 -11.911  -8.511  -0.505
  268    HE3  MET  32           HE3      MET  32 -13.160  -9.618  -1.074
  269    H    GLY  33           H        GLY  33 -11.096  -5.363  -7.423
  270    HA2  GLY  33           HA1      GLY  33 -12.051  -4.172  -9.179
  271    HA3  GLY  33           HA2      GLY  33 -13.465  -3.879  -8.185
  272    H    ASN  34           H        ASN  34 -10.385  -3.131  -6.801
  273    HA   ASN  34           HA       ASN  34 -11.007  -0.289  -7.215
  274    HB2  ASN  34           HB2      ASN  34  -9.615   0.135  -5.183
  275    HB3  ASN  34           HB3      ASN  34 -11.067  -0.804  -4.878
  276   HD21  ASN  34          1HD2      ASN  34 -10.896  -2.925  -4.266
  277   HD22  ASN  34          2HD2      ASN  34  -9.400  -3.640  -3.782
  278    H    LEU  35           H        LEU  35  -8.968   1.117  -7.009
  279    HA   LEU  35           HA       LEU  35  -6.988  -0.012  -8.872
  280    HB2  LEU  35           HB2      LEU  35  -7.989   2.819  -8.563
  281    HB3  LEU  35           HB3      LEU  35  -6.582   2.397  -9.517
  282    HG   LEU  35           HG       LEU  35  -8.342   2.650 -11.054
  283   HD11  LEU  35          2HD1      LEU  35  -8.067  -0.299 -10.502
  284   HD12  LEU  35          1HD1      LEU  35  -6.963   0.688 -11.460
  285   HD13  LEU  35          3HD1      LEU  35  -8.617   0.429 -12.013
  286   HD21  LEU  35          3HD2      LEU  35 -10.507   1.539 -10.871
  287   HD22  LEU  35          2HD2      LEU  35 -10.214   2.595  -9.489
  288   HD23  LEU  35          1HD2      LEU  35 -10.031   0.849  -9.320
  289    H    ILE  36           H        ILE  36  -5.057  -0.321  -8.023
  290    HA   ILE  36           HA       ILE  36  -4.295   1.296  -5.687
  291    HB   ILE  36           HB       ILE  36  -4.903  -1.050  -5.105
  292   HG12  ILE  36          2HG1      ILE  36  -1.981  -0.394  -4.689
  293   HG13  ILE  36          3HG1      ILE  36  -3.305   0.301  -3.762
  294   HG21  ILE  36          2HG2      ILE  36  -4.154  -2.166  -7.131
  295   HG22  ILE  36          1HG2      ILE  36  -3.373  -2.867  -5.714
  296   HG23  ILE  36          3HG2      ILE  36  -2.480  -1.758  -6.755
  297   HD11  ILE  36          3HD1      ILE  36  -2.200  -1.505  -2.561
  298   HD12  ILE  36          2HD1      ILE  36  -2.592  -2.619  -3.869
  299   HD13  ILE  36          1HD1      ILE  36  -3.883  -1.896  -2.910
  300    H    LYS  37           H        LYS  37  -2.247   2.025  -5.550
  301    HA   LYS  37           HA       LYS  37  -0.418   1.406  -7.781
  302    HB2  LYS  37           HB2      LYS  37  -1.441   3.724  -7.828
  303    HB3  LYS  37           HB3      LYS  37  -0.612   4.047  -6.314
  304    HG2  LYS  37           HG2      LYS  37   0.620   4.987  -8.161
  305    HG3  LYS  37           HG3      LYS  37   1.543   3.674  -7.426
  306    HD2  LYS  37           HD2      LYS  37   0.904   2.173  -9.202
  307    HD3  LYS  37           HD3      LYS  37  -0.161   3.396  -9.900
  308    HE2  LYS  37           HE2      LYS  37   2.821   3.711  -9.587
  309    HE3  LYS  37           HE3      LYS  37   2.030   3.164 -11.065
  310    HZ1  LYS  37           HZ1      LYS  37   0.948   5.242 -11.305
  311    HZ2  LYS  37           HZ2      LYS  37   2.578   5.583 -10.993
  312    HZ3  LYS  37           HZ3      LYS  37   1.429   5.768  -9.767
  313    H    VAL  38           H        VAL  38   1.155   0.153  -6.967
  314    HA   VAL  38           HA       VAL  38   1.839   0.465  -4.138
  315    HB   VAL  38           HB       VAL  38   2.878  -1.781  -4.346
  316   HG11  VAL  38          2HG1      VAL  38   0.760  -3.012  -4.447
  317   HG12  VAL  38          1HG1      VAL  38  -0.023  -1.587  -5.132
  318   HG13  VAL  38          3HG1      VAL  38   0.623  -1.536  -3.491
  319   HG21  VAL  38          3HG2      VAL  38   2.343  -3.160  -6.301
  320   HG22  VAL  38          2HG2      VAL  38   3.368  -1.790  -6.726
  321   HG23  VAL  38          1HG2      VAL  38   1.643  -1.750  -7.097
  322    H    GLU  39           H        GLU  39   3.748   1.100  -3.447
  323    HA   GLU  39           HA       GLU  39   5.895   1.607  -5.372
  324    HB2  GLU  39           HB2      GLU  39   5.417   3.464  -3.921
  325    HB3  GLU  39           HB3      GLU  39   5.479   2.441  -2.493
  326    HG2  GLU  39           HG2      GLU  39   7.840   2.204  -2.668
  327    HG3  GLU  39           HG3      GLU  39   7.866   2.962  -4.260
  328    H    THR  40           H        THR  40   7.720   0.429  -5.443
  329    HA   THR  40           HA       THR  40   8.004  -1.784  -3.555
  330    HB   THR  40           HB       THR  40   9.670  -1.303  -6.027
  331    HG1  THR  40           HG1      THR  40   7.739  -3.179  -6.367
  332   HG21  THR  40          3HG2      THR  40  10.522  -2.963  -4.445
  333   HG22  THR  40          1HG2      THR  40   9.978  -3.736  -5.934
  334   HG23  THR  40          2HG2      THR  40   8.973  -3.806  -4.486
  335    H    GLN  41           H        GLN  41   8.966  -0.981  -1.756
  336    HA   GLN  41           HA       GLN  41  11.192   0.916  -2.105
  337    HB2  GLN  41           HB2      GLN  41   9.169   1.647  -0.835
  338    HB3  GLN  41           HB3      GLN  41   9.492   0.384   0.338
  339    HG2  GLN  41           HG2      GLN  41  10.237   2.578   1.099
  340    HG3  GLN  41           HG3      GLN  41  11.576   1.439   0.948
  341   HE21  GLN  41          1HE2      GLN  41   9.963   4.163  -0.569
  342   HE22  GLN  41          2HE2      GLN  41  11.345   4.704  -1.458
  343    H    GLY  42           H        GLY  42  13.190   0.298  -1.599
  344    HA2  GLY  42           HA1      GLY  42  13.490  -2.080   0.138
  345    HA3  GLY  42           HA2      GLY  42  14.516  -1.788  -1.260
  346    H    ALA  43           H        ALA  43  13.642   1.007   0.414
  347    HA   ALA  43           HA       ALA  43  14.693   2.478   1.777
  348    HB1  ALA  43           HB1      ALA  43  14.897   0.630   3.384
  349    HB2  ALA  43           HB2      ALA  43  16.433   0.173   2.650
  350    HB3  ALA  43           HB3      ALA  43  16.270   1.733   3.458
  351    H    THR  44           H        THR  44  17.085   0.265   0.365
  352    HA   THR  44           HA       THR  44  19.066   2.243  -0.081
  353    HB   THR  44           HB       THR  44  18.751  -0.352  -1.602
  354    HG1  THR  44           HG1      THR  44  19.179  -1.383   0.197
  355   HG21  THR  44          3HG2      THR  44  20.513   1.116  -2.431
  356   HG22  THR  44          1HG2      THR  44  21.220  -0.286  -1.627
  357   HG23  THR  44          2HG2      THR  44  21.173   1.272  -0.804
  358    H    GLY  45           H        GLY  45  16.207   1.295  -1.796
  359    HA2  GLY  45           HA1      GLY  45  16.527   3.412  -3.689
  360    HA3  GLY  45           HA2      GLY  45  16.773   1.833  -4.421
  361    H    ILE  46           H        ILE  46  14.716   3.803  -4.929
  362    HA   ILE  46           HA       ILE  46  12.283   2.361  -4.088
  363    HB   ILE  46           HB       ILE  46  12.419   4.997  -5.558
  364   HG12  ILE  46          2HG1      ILE  46  12.252   4.554  -2.566
  365   HG13  ILE  46          3HG1      ILE  46  13.643   5.206  -3.426
  366   HG21  ILE  46          2HG2      ILE  46  10.260   3.741  -3.868
  367   HG22  ILE  46          1HG2      ILE  46  10.294   3.781  -5.631
  368   HG23  ILE  46          3HG2      ILE  46  10.156   5.282  -4.717
  369   HD11  ILE  46          3HD1      ILE  46  12.317   7.138  -4.104
  370   HD12  ILE  46          2HD1      ILE  46  12.368   6.966  -2.349
  371   HD13  ILE  46          1HD1      ILE  46  10.925   6.483  -3.242
  372    H    GLU  47           H        GLU  47  11.385   0.990  -5.536
  373    HA   GLU  47           HA       GLU  47  12.475   0.927  -8.231
  374    HB2  GLU  47           HB2      GLU  47  12.145  -1.156  -6.920
  375    HB3  GLU  47           HB3      GLU  47  10.409  -0.874  -6.960
  376    HG2  GLU  47           HG2      GLU  47  11.073  -2.505  -8.631
  377    HG3  GLU  47           HG3      GLU  47  10.422  -1.049  -9.382
  378    H    ASN  48           H        ASN  48   9.435   1.640  -6.627
  379    HA   ASN  48           HA       ASN  48   8.516   2.892  -9.111
  380    HB2  ASN  48           HB2      ASN  48   7.385   0.650  -8.780
  381    HB3  ASN  48           HB3      ASN  48   6.674   1.309  -7.311
  382   HD21  ASN  48          1HD2      ASN  48   4.577   1.226  -7.996
  383   HD22  ASN  48          2HD2      ASN  48   3.962   2.222  -9.270
  384    H    GLU  49           H        GLU  49   9.073   4.877  -8.236
  385    HA   GLU  49           HA       GLU  49   8.419   5.693  -5.612
  386    HB2  GLU  49           HB2      GLU  49  10.248   6.714  -6.834
  387    HB3  GLU  49           HB3      GLU  49   9.140   7.297  -8.067
  388    HG2  GLU  49           HG2      GLU  49   8.078   8.761  -6.434
  389    HG3  GLU  49           HG3      GLU  49   9.173   8.165  -5.187
  390    H    LEU  50           H        LEU  50   6.491   6.189  -4.816
  391    HA   LEU  50           HA       LEU  50   4.308   6.937  -6.563
  392    HB2  LEU  50           HB2      LEU  50   4.436   6.882  -3.544
  393    HB3  LEU  50           HB3      LEU  50   2.983   7.082  -4.505
  394    HG   LEU  50           HG       LEU  50   4.705   4.614  -4.301
  395   HD11  LEU  50          2HD1      LEU  50   1.834   5.131  -3.544
  396   HD12  LEU  50          1HD1      LEU  50   3.191   4.990  -2.426
  397   HD13  LEU  50          3HD1      LEU  50   2.694   3.598  -3.386
  398   HD21  LEU  50          3HD2      LEU  50   3.954   4.895  -6.604
  399   HD22  LEU  50          2HD2      LEU  50   2.292   5.092  -6.047
  400   HD23  LEU  50          1HD2      LEU  50   3.120   3.551  -5.826
  401    H    THR  51           H        THR  51   4.286   8.915  -7.384
  402    HA   THR  51           HA       THR  51   5.695  11.074  -6.104
  403    HB   THR  51           HB       THR  51   4.911  12.432  -8.040
  404    HG1  THR  51           HG1      THR  51   3.546  10.001  -8.667
  405   HG21  THR  51          3HG2      THR  51   6.208  11.237  -9.735
  406   HG22  THR  51          1HG2      THR  51   6.129   9.768  -8.763
  407   HG23  THR  51          2HG2      THR  51   7.005  11.177  -8.162
  408    H    GLU  52           H        GLU  52   4.572  13.261  -5.925
  409    HA   GLU  52           HA       GLU  52   2.556  13.234  -4.021
  410    HB2  GLU  52           HB2      GLU  52   3.019  15.449  -6.037
  411    HB3  GLU  52           HB3      GLU  52   2.230  15.605  -4.477
  412    HG2  GLU  52           HG2      GLU  52   4.365  16.501  -4.173
  413    HG3  GLU  52           HG3      GLU  52   4.444  14.896  -3.451
  414    H    LYS  53           H        LYS  53   2.361  13.543  -7.513
  415    HA   LYS  53           HA       LYS  53  -0.341  13.917  -7.911
  416    HB2  LYS  53           HB2      LYS  53   1.324  13.990  -9.681
  417    HB3  LYS  53           HB3      LYS  53   1.626  12.270  -9.505
  418    HG2  LYS  53           HG2      LYS  53  -0.663  11.806 -10.260
  419    HG3  LYS  53           HG3      LYS  53  -0.924  13.541 -10.478
  420    HD2  LYS  53           HD2      LYS  53   0.877  13.631 -12.105
  421    HD3  LYS  53           HD3      LYS  53   1.214  11.917 -11.857
  422    HE2  LYS  53           HE2      LYS  53  -1.019  11.366 -12.705
  423    HE3  LYS  53           HE3      LYS  53  -1.340  13.083 -12.962
  424    HZ1  LYS  53           HZ1      LYS  53  -0.638  11.952 -15.002
  425    HZ2  LYS  53           HZ2      LYS  53   0.841  11.544 -14.272
  426    HZ3  LYS  53           HZ3      LYS  53   0.454  13.173 -14.550
  427    H    ASP  54           H        ASP  54   1.388  10.813  -7.593
  428    HA   ASP  54           HA       ASP  54  -0.873   9.152  -7.891
  429    HB2  ASP  54           HB2      ASP  54   1.723   8.629  -6.425
  430    HB3  ASP  54           HB3      ASP  54   0.517   7.400  -6.777
  431    H    VAL  55           H        VAL  55   0.686  10.539  -5.074
  432    HA   VAL  55           HA       VAL  55  -0.795   9.067  -3.161
  433    HB   VAL  55           HB       VAL  55   0.641  11.692  -2.775
  434   HG11  VAL  55          2HG1      VAL  55   0.834  10.961  -0.451
  435   HG12  VAL  55          1HG1      VAL  55  -0.104   9.518  -0.830
  436   HG13  VAL  55          3HG1      VAL  55  -0.852  11.110  -0.943
  437   HG21  VAL  55          3HG2      VAL  55   2.119  10.030  -3.772
  438   HG22  VAL  55          2HG2      VAL  55   1.667   8.869  -2.525
  439   HG23  VAL  55          1HG2      VAL  55   2.555  10.329  -2.091
  440    H    ASN  56           H        ASN  56  -1.287  12.188  -4.708
  441    HA   ASN  56           HA       ASN  56  -3.328  13.080  -2.941
  442    HB2  ASN  56           HB2      ASN  56  -2.534  13.888  -5.729
  443    HB3  ASN  56           HB3      ASN  56  -3.951  14.564  -4.943
  444   HD21  ASN  56          1HD2      ASN  56  -1.047  13.764  -3.172
  445   HD22  ASN  56          2HD2      ASN  56  -0.575  15.400  -2.851
  446    H    ILE  57           H        ILE  57  -3.302  10.915  -5.637
  447    HA   ILE  57           HA       ILE  57  -6.115  11.141  -6.200
  448    HB   ILE  57           HB       ILE  57  -4.104   9.074  -7.115
  449   HG12  ILE  57          2HG1      ILE  57  -3.556  11.304  -7.928
  450   HG13  ILE  57          3HG1      ILE  57  -4.172  10.323  -9.255
  451   HG21  ILE  57          2HG2      ILE  57  -5.744   8.480  -8.826
  452   HG22  ILE  57          1HG2      ILE  57  -6.896   9.614  -8.119
  453   HG23  ILE  57          3HG2      ILE  57  -6.378   8.198  -7.204
  454   HD11  ILE  57          3HD1      ILE  57  -5.721  12.396  -7.720
  455   HD12  ILE  57          2HD1      ILE  57  -6.343  11.422  -9.053
  456   HD13  ILE  57          1HD1      ILE  57  -5.048  12.586  -9.339
  457    H    GLY  58           H        GLY  58  -4.029   8.700  -4.665
  458    HA2  GLY  58           HA1      GLY  58  -6.119   6.897  -4.063
  459    HA3  GLY  58           HA2      GLY  58  -4.522   6.900  -3.335
  460    H    GLU  59           H        GLU  59  -7.300   6.522  -2.275
  461    HA   GLU  59           HA       GLU  59  -7.756   8.727  -0.476
  462    HB2  GLU  59           HB2      GLU  59  -8.945   5.943  -0.543
  463    HB3  GLU  59           HB3      GLU  59  -9.523   7.273   0.448
  464    HG2  GLU  59           HG2      GLU  59  -9.397   7.503  -2.531
  465    HG3  GLU  59           HG3      GLU  59 -10.757   6.722  -1.727
  466    H    VAL  60           H        VAL  60  -7.240   5.267   0.185
  467    HA   VAL  60           HA       VAL  60  -6.038   5.985   2.753
  468    HB   VAL  60           HB       VAL  60  -6.289   3.526   3.264
  469   HG11  VAL  60          2HG1      VAL  60  -8.808   5.045   2.598
  470   HG12  VAL  60          1HG1      VAL  60  -7.869   5.193   4.084
  471   HG13  VAL  60          3HG1      VAL  60  -8.683   3.675   3.705
  472   HG21  VAL  60          3HG2      VAL  60  -7.894   3.571   0.710
  473   HG22  VAL  60          2HG2      VAL  60  -7.863   2.247   1.876
  474   HG23  VAL  60          1HG2      VAL  60  -6.398   2.677   0.992
  475    H    VAL  61           H        VAL  61  -4.105   5.111   3.450
  476    HA   VAL  61           HA       VAL  61  -2.323   4.204   1.291
  477    HB   VAL  61           HB       VAL  61  -1.535   5.473   3.915
  478   HG11  VAL  61          2HG1      VAL  61   0.029   4.919   1.398
  479   HG12  VAL  61          1HG1      VAL  61   0.186   4.076   2.940
  480   HG13  VAL  61          3HG1      VAL  61   0.638   5.776   2.814
  481   HG21  VAL  61          3HG2      VAL  61  -1.785   6.764   1.195
  482   HG22  VAL  61          2HG2      VAL  61  -1.089   7.519   2.630
  483   HG23  VAL  61          1HG2      VAL  61  -2.798   7.088   2.601
  484    H    ILE  62           H        ILE  62  -1.832   2.125   1.371
  485    HA   ILE  62           HA       ILE  62  -1.952   0.712   3.933
  486    HB   ILE  62           HB       ILE  62  -1.697  -0.361   1.116
  487   HG12  ILE  62          2HG1      ILE  62  -3.987  -0.466   3.097
  488   HG13  ILE  62          3HG1      ILE  62  -3.919   0.559   1.669
  489   HG21  ILE  62          2HG2      ILE  62  -2.001  -2.579   2.131
  490   HG22  ILE  62          1HG2      ILE  62  -1.934  -1.845   3.733
  491   HG23  ILE  62          3HG2      ILE  62  -0.519  -1.799   2.681
  492   HD11  ILE  62          3HD1      ILE  62  -3.970  -2.449   1.685
  493   HD12  ILE  62          2HD1      ILE  62  -3.894  -1.428   0.248
  494   HD13  ILE  62          1HD1      ILE  62  -5.318  -1.383   1.289
  495    H    PHE  63           H        PHE  63  -0.130   0.465   5.053
  496    HA   PHE  63           HA       PHE  63   2.410   0.499   3.572
  497    HB2  PHE  63           HB2      PHE  63   1.697   1.356   6.350
  498    HB3  PHE  63           HB3      PHE  63   3.347   0.866   5.979
  499    HD1  PHE  63           HD2      PHE  63   4.103   1.950   3.565
  500    HD2  PHE  63           HD1      PHE  63   1.406   3.615   6.394
  501    HE1  PHE  63           HE2      PHE  63   4.588   4.201   2.694
  502    HE2  PHE  63           HE1      PHE  63   1.877   5.868   5.529
  503    HZ   PHE  63           HZ       PHE  63   3.470   6.161   3.675
  504    H    ALA  64           H        ALA  64   3.024  -1.491   3.129
  505    HA   ALA  64           HA       ALA  64   3.165  -3.382   5.387
  506    HB1  ALA  64           HB1      ALA  64   1.790  -4.263   3.569
  507    HB2  ALA  64           HB2      ALA  64   3.102  -3.983   2.427
  508    HB3  ALA  64           HB3      ALA  64   3.289  -5.179   3.707
  509    H    VAL  65           H        VAL  65   5.133  -2.706   6.193
  510    HA   VAL  65           HA       VAL  65   7.364  -2.732   4.292
  511    HB   VAL  65           HB       VAL  65   8.341  -0.758   5.408
  512   HG11  VAL  65          2HG1      VAL  65   6.850   0.916   4.389
  513   HG12  VAL  65          1HG1      VAL  65   5.607  -0.321   4.205
  514   HG13  VAL  65          3HG1      VAL  65   7.130  -0.463   3.325
  515   HG21  VAL  65          3HG2      VAL  65   7.207  -0.904   7.556
  516   HG22  VAL  65          2HG2      VAL  65   5.660  -0.563   6.780
  517   HG23  VAL  65          1HG2      VAL  65   6.921   0.670   6.813
  518    H    ASP  66           H        ASP  66   9.120  -3.675   4.906
  519    HA   ASP  66           HA       ASP  66   9.486  -4.561   7.671
  520    HB2  ASP  66           HB2      ASP  66   9.895  -6.304   6.120
  521    HB3  ASP  66           HB3      ASP  66  10.787  -5.248   5.036
  522    H    THR  67           H        THR  67  10.503  -2.218   5.408
  523    HA   THR  67           HA       THR  67  12.587  -1.273   7.247
  524    HB   THR  67           HB       THR  67  13.598  -2.276   5.217
  525    HG1  THR  67           HG1      THR  67  14.892  -0.720   5.971
  526   HG21  THR  67          3HG2      THR  67  13.346  -1.121   3.055
  527   HG22  THR  67          1HG2      THR  67  12.094  -0.102   3.759
  528   HG23  THR  67          2HG2      THR  67  11.834  -1.842   3.608
  529    H    LYS  68           H        LYS  68  13.169   1.115   6.056
  530    HA   LYS  68           HA       LYS  68  10.860   2.655   6.844
  531    HB2  LYS  68           HB2      LYS  68  12.360   4.583   6.619
  532    HB3  LYS  68           HB3      LYS  68  13.101   3.309   7.580
  533    HG2  LYS  68           HG2      LYS  68  14.430   2.611   5.676
  534    HG3  LYS  68           HG3      LYS  68  13.650   3.832   4.667
  535    HD2  LYS  68           HD2      LYS  68  14.557   5.588   6.145
  536    HD3  LYS  68           HD3      LYS  68  15.385   4.342   7.083
  537    HE2  LYS  68           HE2      LYS  68  16.669   3.688   5.136
  538    HE3  LYS  68           HE3      LYS  68  15.803   4.857   4.141
  539    HZ1  LYS  68           HZ1      LYS  68  17.927   5.743   4.766
  540    HZ2  LYS  68           HZ2      LYS  68  17.617   5.475   6.414
  541    HZ3  LYS  68           HZ3      LYS  68  16.717   6.629   5.560
  542    H    VAL  69           H        VAL  69  10.354   4.666   5.534
  543    HA   VAL  69           HA       VAL  69  10.670   4.373   2.662
  544    HB   VAL  69           HB       VAL  69   8.662   3.149   2.846
  545   HG11  VAL  69          2HG1      VAL  69   8.093   3.649   5.148
  546   HG12  VAL  69          1HG1      VAL  69   6.695   3.891   4.101
  547   HG13  VAL  69          3HG1      VAL  69   7.605   5.282   4.693
  548   HG21  VAL  69          3HG2      VAL  69   7.917   6.001   2.216
  549   HG22  VAL  69          2HG2      VAL  69   6.974   4.577   1.777
  550   HG23  VAL  69          1HG2      VAL  69   8.581   4.818   1.089
  551    H    ARG  70           H        ARG  70  11.201   6.281   1.874
  552    HA   ARG  70           HA       ARG  70  11.282   8.575   3.542
  553    HB2  ARG  70           HB2      ARG  70  13.027   8.104   1.887
  554    HB3  ARG  70           HB3      ARG  70  11.860   8.273   0.586
  555    HG2  ARG  70           HG2      ARG  70  12.205  10.582   2.416
  556    HG3  ARG  70           HG3      ARG  70  13.514  10.226   1.289
  557    HD2  ARG  70           HD2      ARG  70  12.005  10.395  -0.586
  558    HD3  ARG  70           HD3      ARG  70  10.626  10.591   0.495
  559    HE   ARG  70           HE       ARG  70  12.170  12.659   1.211
  560   HH11  ARG  70          2HH1      ARG  70  11.203  11.522  -1.972
  561   HH12  ARG  70          1HH1      ARG  70  11.174  13.121  -2.661
  562   HH21  ARG  70          2HH2      ARG  70  12.122  14.740   0.293
  563   HH22  ARG  70          1HH2      ARG  70  11.701  14.938  -1.379
  564    H    ASN  71           H        ASN  71   9.264   7.573   0.846
  565    HA   ASN  71           HA       ASN  71   8.031  10.089   0.442
  566    HB2  ASN  71           HB2      ASN  71   7.276   7.296  -0.404
  567    HB3  ASN  71           HB3      ASN  71   6.318   8.708  -0.840
  568   HD21  ASN  71          1HD2      ASN  71   7.831   6.830  -2.536
  569   HD22  ASN  71          2HD2      ASN  71   8.937   7.825  -3.426
  570    H    LYS  72           H        LYS  72   7.724   7.964   2.983
  571    HA   LYS  72           HA       LYS  72   5.010   7.833   3.552
  572    HB2  LYS  72           HB2      LYS  72   7.001   6.747   4.782
  573    HB3  LYS  72           HB3      LYS  72   7.053   8.234   5.719
  574    HG2  LYS  72           HG2      LYS  72   4.747   7.869   6.435
  575    HG3  LYS  72           HG3      LYS  72   4.688   6.384   5.486
  576    HD2  LYS  72           HD2      LYS  72   5.163   5.575   7.594
  577    HD3  LYS  72           HD3      LYS  72   6.777   5.727   6.897
  578    HE2  LYS  72           HE2      LYS  72   6.949   6.651   9.049
  579    HE3  LYS  72           HE3      LYS  72   6.853   8.032   7.958
  580    HZ1  LYS  72           HZ1      LYS  72   4.594   6.910   9.538
  581    HZ2  LYS  72           HZ2      LYS  72   4.495   8.236   8.490
  582    HZ3  LYS  72           HZ3      LYS  72   5.437   8.338   9.890
  583    H    GLU  73           H        GLU  73   7.160  10.509   3.720
  584    HA   GLU  73           HA       GLU  73   6.219  12.306   5.519
  585    HB2  GLU  73           HB2      GLU  73   6.601  13.032   2.613
  586    HB3  GLU  73           HB3      GLU  73   6.796  14.084   3.999
  587    HG2  GLU  73           HG2      GLU  73   8.836  13.154   4.576
  588    HG3  GLU  73           HG3      GLU  73   8.541  11.683   3.650
  589    H    ARG  74           H        ARG  74   4.801  11.738   2.334
  590    HA   ARG  74           HA       ARG  74   2.713  13.681   2.747
  591    HB2  ARG  74           HB2      ARG  74   2.100  13.122   0.438
  592    HB3  ARG  74           HB3      ARG  74   3.820  13.460   0.585
  593    HG2  ARG  74           HG2      ARG  74   3.831  10.789   0.931
  594    HG3  ARG  74           HG3      ARG  74   2.428  10.968  -0.127
  595    HD2  ARG  74           HD2      ARG  74   4.394  10.618  -1.468
  596    HD3  ARG  74           HD3      ARG  74   3.823  12.269  -1.687
  597    HE   ARG  74           HE       ARG  74   5.901  11.958   0.305
  598   HH11  ARG  74          2HH1      ARG  74   5.149  12.501  -3.035
  599   HH12  ARG  74          1HH1      ARG  74   6.609  13.367  -3.393
  600   HH21  ARG  74          2HH2      ARG  74   7.898  13.074  -0.116
  601   HH22  ARG  74          1HH2      ARG  74   8.182  13.679  -1.730
  602    H    PHE  75           H        PHE  75   3.004  10.177   2.723
  603    HA   PHE  75           HA       PHE  75   0.225   9.612   2.565
  604    HB2  PHE  75           HB2      PHE  75   2.478   7.920   3.664
  605    HB3  PHE  75           HB3      PHE  75   0.873   7.347   3.251
  606    HD1  PHE  75           HD1      PHE  75   0.146   7.671   0.776
  607    HD2  PHE  75           HD2      PHE  75   4.173   7.786   2.123
  608    HE1  PHE  75           HE1      PHE  75   0.921   7.134  -1.495
  609    HE2  PHE  75           HE2      PHE  75   4.957   7.262  -0.146
  610    HZ   PHE  75           HZ       PHE  75   3.329   6.930  -1.958
  611    H    ASP  76           H        ASP  76   2.440  10.334   5.116
  612    HA   ASP  76           HA       ASP  76   1.088   9.089   7.259
  613    HB2  ASP  76           HB2      ASP  76   3.502   9.809   7.192
  614    HB3  ASP  76           HB3      ASP  76   2.946  11.462   7.429
  615    H    GLY  77           H        GLY  77   0.678  12.155   5.685
  616    HA2  GLY  77           HA1      GLY  77  -1.029  13.189   7.813
  617    HA3  GLY  77           HA2      GLY  77  -0.584  14.030   6.335
  618    H    LYS  78           H        LYS  78  -1.570  10.848   5.815
  619    HA   LYS  78           HA       LYS  78  -4.283  11.723   5.063
  620    HB2  LYS  78           HB2      LYS  78  -2.403   9.812   3.656
  621    HB3  LYS  78           HB3      LYS  78  -4.106   9.976   3.247
  622    HG2  LYS  78           HG2      LYS  78  -3.813  12.207   2.511
  623    HG3  LYS  78           HG3      LYS  78  -2.196  12.296   3.207
  624    HD2  LYS  78           HD2      LYS  78  -2.228  12.027   0.722
  625    HD3  LYS  78           HD3      LYS  78  -1.334  10.765   1.582
  626    HE2  LYS  78           HE2      LYS  78  -2.713   9.836  -0.211
  627    HE3  LYS  78           HE3      LYS  78  -3.227   9.258   1.366
  628    HZ1  LYS  78           HZ1      LYS  78  -5.095  10.710   1.330
  629    HZ2  LYS  78           HZ2      LYS  78  -5.063   9.924  -0.171
  630    HZ3  LYS  78           HZ3      LYS  78  -4.530  11.523  -0.042
  631    H    VAL  79           H        VAL  79  -5.276   9.187   4.396
  632    HA   VAL  79           HA       VAL  79  -5.657   8.102   7.059
  633    HB   VAL  79           HB       VAL  79  -6.821   7.057   4.472
  634   HG11  VAL  79          2HG1      VAL  79  -8.546   6.108   5.945
  635   HG12  VAL  79          1HG1      VAL  79  -7.670   6.719   7.348
  636   HG13  VAL  79          3HG1      VAL  79  -6.940   5.487   6.321
  637   HG21  VAL  79          3HG2      VAL  79  -8.005   9.067   6.383
  638   HG22  VAL  79          2HG2      VAL  79  -8.809   8.375   4.973
  639   HG23  VAL  79          1HG2      VAL  79  -7.401   9.415   4.763
  640    H    VAL  80           H        VAL  80  -4.386   6.557   7.867
  641    HA   VAL  80           HA       VAL  80  -2.767   5.015   5.949
  642    HB   VAL  80           HB       VAL  80  -2.020   5.885   8.746
  643   HG11  VAL  80          2HG1      VAL  80   0.212   5.025   8.182
  644   HG12  VAL  80          1HG1      VAL  80  -0.429   4.409   6.660
  645   HG13  VAL  80          3HG1      VAL  80  -1.010   3.754   8.190
  646   HG21  VAL  80          3HG2      VAL  80  -0.991   6.830   6.073
  647   HG22  VAL  80          2HG2      VAL  80  -0.402   7.347   7.653
  648   HG23  VAL  80          1HG2      VAL  80  -2.047   7.740   7.152
  649    H    LEU  81           H        LEU  81  -2.696   2.869   6.082
  650    HA   LEU  81           HA       LEU  81  -3.587   1.542   8.551
  651    HB2  LEU  81           HB2      LEU  81  -5.319   1.476   6.686
  652    HB3  LEU  81           HB3      LEU  81  -4.178   0.522   5.764
  653    HG   LEU  81           HG       LEU  81  -6.020  -0.755   6.933
  654   HD11  LEU  81          2HD1      LEU  81  -4.564  -2.586   7.646
  655   HD12  LEU  81          1HD1      LEU  81  -3.179  -1.495   7.612
  656   HD13  LEU  81          3HD1      LEU  81  -4.033  -1.883   6.118
  657   HD21  LEU  81          3HD2      LEU  81  -6.064   0.460   9.023
  658   HD22  LEU  81          2HD2      LEU  81  -4.408  -0.029   9.375
  659   HD23  LEU  81          1HD2      LEU  81  -5.691  -1.236   9.321
  660    H    GLU  82           H        GLU  82  -1.867   0.507   9.349
  661    HA   GLU  82           HA       GLU  82   0.273  -0.271   7.499
  662    HB2  GLU  82           HB2      GLU  82   0.282   0.375  10.441
  663    HB3  GLU  82           HB3      GLU  82   1.669  -0.277   9.590
  664    HG2  GLU  82           HG2      GLU  82   1.681   1.682   8.122
  665    HG3  GLU  82           HG3      GLU  82   0.302   2.334   9.007
  666    H    VAL  83           H        VAL  83   0.936  -2.305   7.330
  667    HA   VAL  83           HA       VAL  83   0.173  -4.288   9.347
  668    HB   VAL  83           HB       VAL  83  -0.359  -5.929   7.512
  669   HG11  VAL  83          2HG1      VAL  83  -2.187  -3.540   7.714
  670   HG12  VAL  83          1HG1      VAL  83  -2.140  -4.909   8.823
  671   HG13  VAL  83          3HG1      VAL  83  -2.649  -5.146   7.153
  672   HG21  VAL  83          3HG2      VAL  83  -1.003  -5.052   5.317
  673   HG22  VAL  83          2HG2      VAL  83   0.701  -4.754   5.662
  674   HG23  VAL  83          1HG2      VAL  83  -0.471  -3.445   5.806
  675    HA   PRO  84           HA       PRO  84   4.284  -5.908   8.533
  676    HB2  PRO  84           HB2      PRO  84   3.805  -8.612   8.457
  677    HB3  PRO  84           HB3      PRO  84   3.964  -7.679   9.949
  678    HG2  PRO  84           HG2      PRO  84   1.495  -8.592   8.533
  679    HG3  PRO  84           HG3      PRO  84   1.842  -8.553  10.272
  680    HD2  PRO  84           HD2      PRO  84   0.304  -6.694   9.071
  681    HD3  PRO  84           HD3      PRO  84   1.362  -6.300  10.442
  682    H    VAL  85           H        VAL  85   5.545  -6.862   6.831
  683    HA   VAL  85           HA       VAL  85   4.441  -6.364   4.271
  684    HB   VAL  85           HB       VAL  85   6.842  -6.073   4.826
  685   HG11  VAL  85          2HG1      VAL  85   6.970  -9.083   4.678
  686   HG12  VAL  85          1HG1      VAL  85   7.166  -8.110   6.135
  687   HG13  VAL  85          3HG1      VAL  85   8.344  -7.988   4.830
  688   HG21  VAL  85          3HG2      VAL  85   7.732  -6.897   2.701
  689   HG22  VAL  85          2HG2      VAL  85   6.146  -6.153   2.501
  690   HG23  VAL  85          1HG2      VAL  85   6.304  -7.909   2.497
  691    H    SER  86           H        SER  86   4.659  -9.222   6.201
  692    HA   SER  86           HA       SER  86   4.267 -11.120   4.113
  693    HB2  SER  86           HB2      SER  86   3.691 -11.408   7.069
  694    HB3  SER  86           HB3      SER  86   3.913 -12.717   5.908
  695    HG   SER  86           HG       SER  86   5.941 -12.586   6.384
  696    H    ALA  87           H        ALA  87   2.177  -8.977   5.791
  697    HA   ALA  87           HA       ALA  87  -0.142 -10.563   5.940
  698    HB1  ALA  87           HB1      ALA  87  -1.342  -8.521   6.430
  699    HB2  ALA  87           HB2      ALA  87   0.190  -8.560   7.302
  700    HB3  ALA  87           HB3      ALA  87   0.020  -7.556   5.862
  701    HA   PRO  88           HA       PRO  88  -1.818  -8.412   2.005
  702    HB2  PRO  88           HB2      PRO  88   0.436  -7.192   0.597
  703    HB3  PRO  88           HB3      PRO  88  -1.092  -6.464   1.098
  704    HG2  PRO  88           HG2      PRO  88   1.253  -5.824   2.263
  705    HG3  PRO  88           HG3      PRO  88  -0.276  -5.853   3.162
  706    HD2  PRO  88           HD2      PRO  88   1.899  -7.918   3.056
  707    HD3  PRO  88           HD3      PRO  88   1.001  -7.302   4.462
  708    H    ILE  89           H        ILE  89   0.674 -10.508   2.274
  709    HA   ILE  89           HA       ILE  89   0.764 -11.280  -0.523
  710    HB   ILE  89           HB       ILE  89   1.974 -12.592   1.920
  711   HG12  ILE  89          2HG1      ILE  89   3.221 -10.926  -0.279
  712   HG13  ILE  89          3HG1      ILE  89   2.920 -10.381   1.367
  713   HG21  ILE  89          2HG2      ILE  89   2.321 -13.222  -1.011
  714   HG22  ILE  89          1HG2      ILE  89   1.577 -14.254   0.212
  715   HG23  ILE  89          3HG2      ILE  89   3.302 -13.895   0.290
  716   HD11  ILE  89          3HD1      ILE  89   4.803 -12.578   0.540
  717   HD12  ILE  89          2HD1      ILE  89   4.489 -12.065   2.199
  718   HD13  ILE  89          1HD1      ILE  89   5.247 -10.952   1.059
  719    H    LYS  90           H        LYS  90  -0.320 -12.687   2.557
  720    HA   LYS  90           HA       LYS  90  -1.936 -14.624   1.079
  721    HB2  LYS  90           HB2      LYS  90  -1.199 -14.429   3.998
  722    HB3  LYS  90           HB3      LYS  90  -2.308 -15.632   3.354
  723    HG2  LYS  90           HG2      LYS  90  -0.510 -16.473   1.896
  724    HG3  LYS  90           HG3      LYS  90   0.596 -15.307   2.626
  725    HD2  LYS  90           HD2      LYS  90   0.819 -17.536   3.634
  726    HD3  LYS  90           HD3      LYS  90   0.268 -16.340   4.809
  727    HE2  LYS  90           HE2      LYS  90  -2.043 -17.109   4.479
  728    HE3  LYS  90           HE3      LYS  90  -1.464 -18.322   3.337
  729    HZ1  LYS  90           HZ1      LYS  90  -0.236 -19.387   5.079
  730    HZ2  LYS  90           HZ2      LYS  90  -1.846 -19.207   5.583
  731    HZ3  LYS  90           HZ3      LYS  90  -0.647 -18.170   6.186
  732    H    ASP  91           H        ASP  91  -2.258 -11.782   3.060
  733    HA   ASP  91           HA       ASP  91  -5.177 -12.207   3.187
  734    HB2  ASP  91           HB2      ASP  91  -3.397 -10.847   5.226
  735    HB3  ASP  91           HB3      ASP  91  -5.148 -10.996   5.334
  736    H    ALA  92           H        ALA  92  -3.761 -10.852   1.100
  737    HA   ALA  92           HA       ALA  92  -3.481  -8.110   1.337
  738    HB1  ALA  92           HB1      ALA  92  -3.703  -8.009  -1.065
  739    HB2  ALA  92           HB2      ALA  92  -2.787  -9.447  -0.612
  740    HB3  ALA  92           HB3      ALA  92  -4.480  -9.593  -1.088
  741    H    GLU  93           H        GLU  93  -6.384  -9.950   0.501
  742    HA   GLU  93           HA       GLU  93  -7.995  -7.693  -0.036
  743    HB2  GLU  93           HB2      GLU  93  -8.784 -10.514   0.700
  744    HB3  GLU  93           HB3      GLU  93  -9.862  -9.299   0.021
  745    HG2  GLU  93           HG2      GLU  93  -8.622  -9.234  -2.017
  746    HG3  GLU  93           HG3      GLU  93  -7.366 -10.269  -1.338
  747    H    LYS  94           H        LYS  94  -7.285  -9.478   2.895
  748    HA   LYS  94           HA       LYS  94  -9.364  -8.326   4.469
  749    HB2  LYS  94           HB2      LYS  94  -6.737  -9.554   5.324
  750    HB3  LYS  94           HB3      LYS  94  -8.066  -9.155   6.403
  751    HG2  LYS  94           HG2      LYS  94  -9.482 -10.790   5.313
  752    HG3  LYS  94           HG3      LYS  94  -8.200 -11.148   4.151
  753    HD2  LYS  94           HD2      LYS  94  -6.751 -11.856   6.020
  754    HD3  LYS  94           HD3      LYS  94  -8.090 -11.579   7.133
  755    HE2  LYS  94           HE2      LYS  94  -9.371 -13.324   6.158
  756    HE3  LYS  94           HE3      LYS  94  -8.259 -13.470   4.796
  757    HZ1  LYS  94           HZ1      LYS  94  -6.536 -14.188   6.366
  758    HZ2  LYS  94           HZ2      LYS  94  -7.866 -15.239   6.360
  759    HZ3  LYS  94           HZ3      LYS  94  -7.665 -14.140   7.630
  760    H    VAL  95           H        VAL  95  -5.990  -7.558   3.842
  761    HA   VAL  95           HA       VAL  95  -5.684  -5.405   5.610
  762    HB   VAL  95           HB       VAL  95  -4.406  -5.775   2.892
  763   HG11  VAL  95          2HG1      VAL  95  -2.621  -4.345   3.756
  764   HG12  VAL  95          1HG1      VAL  95  -3.536  -4.105   5.244
  765   HG13  VAL  95          3HG1      VAL  95  -4.167  -3.498   3.713
  766   HG21  VAL  95          3HG2      VAL  95  -3.450  -6.631   5.621
  767   HG22  VAL  95          2HG2      VAL  95  -2.544  -6.783   4.115
  768   HG23  VAL  95          1HG2      VAL  95  -4.036  -7.698   4.343
  769    H    ILE  96           H        ILE  96  -6.855  -5.538   2.273
  770    HA   ILE  96           HA       ILE  96  -7.292  -2.796   1.890
  771    HB   ILE  96           HB       ILE  96  -8.830  -5.125   0.730
  772   HG12  ILE  96          2HG1      ILE  96  -6.498  -3.563  -0.399
  773   HG13  ILE  96          3HG1      ILE  96  -6.378  -5.165   0.321
  774   HG21  ILE  96          2HG2      ILE  96  -9.453  -3.584  -1.065
  775   HG22  ILE  96          1HG2      ILE  96  -8.637  -2.268  -0.222
  776   HG23  ILE  96          3HG2      ILE  96 -10.058  -3.029   0.496
  777   HD11  ILE  96          3HD1      ILE  96  -6.392  -5.307  -2.086
  778   HD12  ILE  96          2HD1      ILE  96  -7.928  -4.442  -2.151
  779   HD13  ILE  96          1HD1      ILE  96  -7.849  -6.044  -1.419
  780    H    ASN  97           H        ASN  97  -9.443  -5.329   3.154
  781    HA   ASN  97           HA       ASN  97 -11.691  -3.671   3.537
  782    HB2  ASN  97           HB2      ASN  97 -10.865  -6.339   4.597
  783    HB3  ASN  97           HB3      ASN  97 -12.229  -5.512   5.343
  784   HD21  ASN  97          1HD2      ASN  97 -11.024  -7.053   2.474
  785   HD22  ASN  97          2HD2      ASN  97 -12.554  -7.196   1.678
  786    H    ALA  98           H        ALA  98  -8.903  -4.365   5.551
  787    HA   ALA  98           HA       ALA  98  -9.837  -3.191   7.932
  788    HB1  ALA  98           HB1      ALA  98  -7.497  -3.034   8.582
  789    HB2  ALA  98           HB2      ALA  98  -7.821  -4.592   7.821
  790    HB3  ALA  98           HB3      ALA  98  -6.998  -3.322   6.915
  791    H    ALA  99           H        ALA  99  -8.114  -1.841   5.154
  792    HA   ALA  99           HA       ALA  99  -7.954   0.805   6.161
  793    HB1  ALA  99           HB1      ALA  99  -7.365   1.436   3.887
  794    HB2  ALA  99           HB2      ALA  99  -6.504  -0.028   4.363
  795    HB3  ALA  99           HB3      ALA  99  -7.904  -0.135   3.295
  796    H    LEU 100           H        LEU 100 -10.285  -0.902   4.131
  797    HA   LEU 100           HA       LEU 100 -11.944   1.297   3.542
  798    HB2  LEU 100           HB2      LEU 100 -12.594  -1.642   3.754
  799    HB3  LEU 100           HB3      LEU 100 -13.699  -0.435   3.127
  800    HG   LEU 100           HG       LEU 100 -11.026  -1.160   1.920
  801   HD11  LEU 100          2HD1      LEU 100 -12.687  -2.922   1.646
  802   HD12  LEU 100          1HD1      LEU 100 -12.366  -2.115   0.111
  803   HD13  LEU 100          3HD1      LEU 100 -13.840  -1.750   1.007
  804   HD21  LEU 100          3HD2      LEU 100 -11.764   0.255   0.044
  805   HD22  LEU 100          2HD2      LEU 100 -11.559   1.174   1.534
  806   HD23  LEU 100          1HD2      LEU 100 -13.175   0.740   0.983
  807    H    ALA 101           H        ALA 101 -11.789  -0.869   6.303
  808    HA   ALA 101           HA       ALA 101 -14.264  -0.184   7.470
  809    HB1  ALA 101           HB1      ALA 101 -11.744  -1.163   8.807
  810    HB2  ALA 101           HB2      ALA 101 -13.356  -1.150   9.525
  811    HB3  ALA 101           HB3      ALA 101 -13.020  -2.170   8.126
  812    H    LEU 102           H        LEU 102 -11.238   1.480   7.342
  813    HA   LEU 102           HA       LEU 102 -11.704   3.111   9.659
  814    HB2  LEU 102           HB2      LEU 102  -9.778   3.520   7.370
  815    HB3  LEU 102           HB3      LEU 102  -9.748   4.370   8.903
  816    HG   LEU 102           HG       LEU 102  -9.238   1.422   8.498
  817   HD11  LEU 102          2HD1      LEU 102  -7.412   2.822   7.716
  818   HD12  LEU 102          1HD1      LEU 102  -6.959   1.977   9.197
  819   HD13  LEU 102          3HD1      LEU 102  -7.396   3.686   9.252
  820   HD21  LEU 102          3HD2      LEU 102  -9.186   3.090  11.012
  821   HD22  LEU 102          2HD2      LEU 102  -8.654   1.413  10.882
  822   HD23  LEU 102          1HD2      LEU 102 -10.350   1.823  10.621
  823    H    ILE 103           H        ILE 103 -12.011   3.547   6.153
  824    HA   ILE 103           HA       ILE 103 -12.963   6.274   6.557
  825    HB   ILE 103           HB       ILE 103 -12.973   6.389   4.056
  826   HG12  ILE 103          2HG1      ILE 103 -11.531   3.736   4.241
  827   HG13  ILE 103          3HG1      ILE 103 -13.200   3.914   3.711
  828   HG21  ILE 103          2HG2      ILE 103 -10.376   5.632   5.378
  829   HG22  ILE 103          1HG2      ILE 103 -11.122   7.230   5.385
  830   HG23  ILE 103          3HG2      ILE 103 -10.540   6.532   3.871
  831   HD11  ILE 103          3HD1      ILE 103 -12.473   5.253   1.825
  832   HD12  ILE 103          2HD1      ILE 103 -11.666   3.686   1.837
  833   HD13  ILE 103          1HD1      ILE 103 -10.800   5.128   2.366
  834    H    ASP 104           H        ASP 104 -14.170   3.164   5.398
  835    HA   ASP 104           HA       ASP 104 -16.775   4.454   4.902
  836    HB2  ASP 104           HB2      ASP 104 -15.480   3.504   2.914
  837    HB3  ASP 104           HB3      ASP 104 -15.819   1.913   3.589
  838    H    GLU 105           H        GLU 105 -15.078   2.068   6.651
  839    HA   GLU 105           HA       GLU 105 -15.689   0.677   8.345
  840    HB2  GLU 105           HB2      GLU 105 -17.123   2.657   8.976
  841    HB3  GLU 105           HB3      GLU 105 -18.447   1.900   8.109
  842    HG2  GLU 105           HG2      GLU 105 -18.478   0.059   9.646
  843    HG3  GLU 105           HG3      GLU 105 -17.024   0.654  10.448
  844    H    LYS 106           H        LYS 106 -16.052   0.104   5.466
  845    HA   LYS 106           HA       LYS 106 -18.278  -1.745   5.320
  846    HB2  LYS 106           HB2      LYS 106 -17.755  -0.316   3.399
  847    HB3  LYS 106           HB3      LYS 106 -16.145  -1.003   3.307
  848    HG2  LYS 106           HG2      LYS 106 -17.429  -1.993   1.593
  849    HG3  LYS 106           HG3      LYS 106 -17.212  -3.218   2.841
  850    HD2  LYS 106           HD2      LYS 106 -19.656  -1.493   2.854
  851    HD3  LYS 106           HD3      LYS 106 -19.556  -2.857   1.743
  852    HE2  LYS 106           HE2      LYS 106 -19.271  -2.987   4.743
  853    HE3  LYS 106           HE3      LYS 106 -20.690  -3.475   3.817
  854    HZ1  LYS 106           HZ1      LYS 106 -17.993  -4.705   3.655
  855    HZ2  LYS 106           HZ2      LYS 106 -19.324  -5.153   2.710
  856    HZ3  LYS 106           HZ3      LYS 106 -19.357  -5.388   4.387
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1 -16.079  -2.795  -6.284
    2    H2   MET   1           H2       MET   1 -14.381  -2.820  -6.244
    3    H3   MET   1           H3       MET   1 -15.188  -2.545  -7.706
    4    HA   MET   1           HA       MET   1 -16.050  -0.464  -6.917
    5    HB2  MET   1           HB2      MET   1 -16.176  -1.100  -4.524
    6    HB3  MET   1           HB3      MET   1 -14.420  -1.052  -4.433
    7    HG2  MET   1           HG2      MET   1 -14.502   1.351  -5.037
    8    HG3  MET   1           HG3      MET   1 -16.259   1.268  -4.978
    9    HE1  MET   1           HE1      MET   1 -16.871   0.414  -1.183
   10    HE2  MET   1           HE2      MET   1 -17.636   0.718  -2.743
   11    HE3  MET   1           HE3      MET   1 -16.673  -0.741  -2.501
   12    H    LYS   2           H        LYS   2 -14.984   1.095  -7.956
   13    HA   LYS   2           HA       LYS   2 -12.186   0.677  -8.607
   14    HB2  LYS   2           HB2      LYS   2 -14.083   2.886  -9.431
   15    HB3  LYS   2           HB3      LYS   2 -12.474   2.628 -10.090
   16    HG2  LYS   2           HG2      LYS   2 -14.793   0.720 -10.317
   17    HG3  LYS   2           HG3      LYS   2 -14.216   1.805 -11.585
   18    HD2  LYS   2           HD2      LYS   2 -12.051   0.657 -11.572
   19    HD3  LYS   2           HD3      LYS   2 -12.638  -0.427 -10.309
   20    HE2  LYS   2           HE2      LYS   2 -13.778  -0.164 -13.087
   21    HE3  LYS   2           HE3      LYS   2 -12.749  -1.474 -12.512
   22    HZ1  LYS   2           HZ1      LYS   2 -14.480  -2.032 -10.882
   23    HZ2  LYS   2           HZ2      LYS   2 -15.038  -2.154 -12.476
   24    HZ3  LYS   2           HZ3      LYS   2 -15.477  -0.819 -11.525
   25    H    ARG   3           H        ARG   3 -11.926   0.971  -6.092
   26    HA   ARG   3           HA       ARG   3 -11.889   3.765  -5.289
   27    HB2  ARG   3           HB2      ARG   3 -12.565   1.682  -3.838
   28    HB3  ARG   3           HB3      ARG   3 -10.832   1.557  -3.564
   29    HG2  ARG   3           HG2      ARG   3 -11.820   2.814  -1.771
   30    HG3  ARG   3           HG3      ARG   3 -10.837   3.902  -2.757
   31    HD2  ARG   3           HD2      ARG   3 -12.909   4.571  -3.965
   32    HD3  ARG   3           HD3      ARG   3 -13.835   3.600  -2.823
   33    HE   ARG   3           HE       ARG   3 -12.269   6.001  -2.111
   34   HH11  ARG   3          2HH1      ARG   3 -14.884   3.763  -1.506
   35   HH12  ARG   3          1HH1      ARG   3 -15.591   4.723  -0.245
   36   HH21  ARG   3          2HH2      ARG   3 -13.191   7.299  -0.501
   37   HH22  ARG   3          1HH2      ARG   3 -14.642   6.764   0.311
   38    H    LYS   4           H        LYS   4 -10.113   4.972  -4.942
   39    HA   LYS   4           HA       LYS   4  -7.659   4.101  -6.208
   40    HB2  LYS   4           HB2      LYS   4  -8.087   6.731  -4.802
   41    HB3  LYS   4           HB3      LYS   4  -7.005   6.369  -6.141
   42    HG2  LYS   4           HG2      LYS   4 -10.010   6.369  -6.329
   43    HG3  LYS   4           HG3      LYS   4  -8.975   7.723  -6.780
   44    HD2  LYS   4           HD2      LYS   4  -7.919   6.399  -8.501
   45    HD3  LYS   4           HD3      LYS   4  -8.822   4.967  -7.994
   46    HE2  LYS   4           HE2      LYS   4  -9.812   5.999  -9.983
   47    HE3  LYS   4           HE3      LYS   4 -10.914   6.045  -8.608
   48    HZ1  LYS   4           HZ1      LYS   4 -10.974   8.144  -9.700
   49    HZ2  LYS   4           HZ2      LYS   4  -9.284   8.292  -9.668
   50    HZ3  LYS   4           HZ3      LYS   4 -10.171   8.368  -8.222
   51    H    ILE   5           H        ILE   5  -5.895   3.367  -5.133
   52    HA   ILE   5           HA       ILE   5  -5.644   3.973  -2.269
   53    HB   ILE   5           HB       ILE   5  -5.404   1.180  -3.412
   54   HG12  ILE   5          2HG1      ILE   5  -7.454   2.309  -1.487
   55   HG13  ILE   5          3HG1      ILE   5  -7.751   1.939  -3.183
   56   HG21  ILE   5          2HG2      ILE   5  -3.800   1.556  -1.641
   57   HG22  ILE   5          1HG2      ILE   5  -5.083   0.486  -1.073
   58   HG23  ILE   5          3HG2      ILE   5  -5.070   2.182  -0.589
   59   HD11  ILE   5          3HD1      ILE   5  -7.318  -0.417  -2.751
   60   HD12  ILE   5          2HD1      ILE   5  -8.613   0.198  -1.726
   61   HD13  ILE   5          1HD1      ILE   5  -7.001  -0.052  -1.054
   62    H    ILE   6           H        ILE   6  -3.567   4.379  -1.648
   63    HA   ILE   6           HA       ILE   6  -1.436   3.537  -3.494
   64    HB   ILE   6           HB       ILE   6   0.021   5.271  -2.597
   65   HG12  ILE   6          2HG1      ILE   6  -1.184   5.414  -0.338
   66   HG13  ILE   6          3HG1      ILE   6  -0.603   6.923  -1.031
   67   HG21  ILE   6          2HG2      ILE   6  -1.244   5.769  -4.583
   68   HG22  ILE   6          1HG2      ILE   6  -1.083   7.224  -3.597
   69   HG23  ILE   6          3HG2      ILE   6  -2.605   6.333  -3.612
   70   HD11  ILE   6          3HD1      ILE   6  -2.864   7.428  -1.800
   71   HD12  ILE   6          2HD1      ILE   6  -2.802   7.188  -0.054
   72   HD13  ILE   6          1HD1      ILE   6  -3.440   5.916  -1.098
   73    H    ALA   7           H        ALA   7   0.135   2.243  -2.739
   74    HA   ALA   7           HA       ALA   7   0.214   1.687   0.133
   75    HB1  ALA   7           HB1      ALA   7  -0.150  -0.461  -1.953
   76    HB2  ALA   7           HB2      ALA   7   0.052  -0.711  -0.218
   77    HB3  ALA   7           HB3      ALA   7  -1.390   0.098  -0.829
   78    H    VAL   8           H        VAL   8   2.227   1.325   0.860
   79    HA   VAL   8           HA       VAL   8   4.332   1.073  -1.181
   80    HB   VAL   8           HB       VAL   8   4.600   2.185   1.618
   81   HG11  VAL   8          2HG1      VAL   8   6.814   2.935   0.837
   82   HG12  VAL   8          1HG1      VAL   8   6.553   2.070  -0.679
   83   HG13  VAL   8          3HG1      VAL   8   6.661   1.177   0.839
   84   HG21  VAL   8          3HG2      VAL   8   4.478   3.603  -1.044
   85   HG22  VAL   8          2HG2      VAL   8   4.894   4.361   0.494
   86   HG23  VAL   8          1HG2      VAL   8   3.282   3.687   0.251
   87    H    THR   9           H        THR   9   5.057  -0.914  -1.340
   88    HA   THR   9           HA       THR   9   5.257  -2.597   1.046
   89    HB   THR   9           HB       THR   9   5.983  -4.352  -0.661
   90    HG1  THR   9           HG1      THR   9   6.246  -2.434  -2.265
   91   HG21  THR   9          3HG2      THR   9   3.229  -3.138  -0.906
   92   HG22  THR   9          1HG2      THR   9   3.741  -4.342   0.276
   93   HG23  THR   9          2HG2      THR   9   3.676  -4.759  -1.437
   94    H    ALA  10           H        ALA  10   7.086  -2.338   2.168
   95    HA   ALA  10           HA       ALA  10   9.561  -1.821   0.665
   96    HB1  ALA  10           HB1      ALA  10   8.758  -0.471   3.238
   97    HB2  ALA  10           HB2      ALA  10  10.278  -0.240   2.371
   98    HB3  ALA  10           HB3      ALA  10   8.759   0.270   1.637
   99    H    CYS  11           H        CYS  11  10.590  -3.710   0.871
  100    HA   CYS  11           HA       CYS  11  11.153  -4.594   3.619
  101    HB2  CYS  11           HB2      CYS  11   9.688  -6.220   2.445
  102    HB3  CYS  11           HB3      CYS  11  10.905  -6.378   1.182
  103    HG   CYS  11           HG       CYS  11  12.057  -6.954   4.275
  104    H    ALA  12           H        ALA  12  13.255  -4.719   4.125
  105    HA   ALA  12           HA       ALA  12  15.181  -4.321   1.931
  106    HB1  ALA  12           HB1      ALA  12  15.467  -3.642   4.855
  107    HB2  ALA  12           HB2      ALA  12  16.673  -3.344   3.603
  108    HB3  ALA  12           HB3      ALA  12  15.124  -2.500   3.556
  109    H    THR  13           H        THR  13  14.347  -6.282   4.689
  110    HA   THR  13           HA       THR  13  16.793  -7.725   4.829
  111    HB   THR  13           HB       THR  13  14.108  -8.706   5.789
  112    HG1  THR  13           HG1      THR  13  14.145  -6.793   6.788
  113   HG21  THR  13          3HG2      THR  13  16.001 -10.272   5.939
  114   HG22  THR  13          1HG2      THR  13  15.441  -9.774   7.536
  115   HG23  THR  13          2HG2      THR  13  16.911  -9.074   6.859
  116    H    GLY  14           H        GLY  14  13.558  -8.614   3.591
  117    HA2  GLY  14           HA1      GLY  14  14.876 -10.690   1.961
  118    HA3  GLY  14           HA2      GLY  14  13.237 -10.820   2.586
  119    H    VAL  15           H        VAL  15  15.263  -9.520   0.117
  120    HA   VAL  15           HA       VAL  15  13.531  -7.630  -1.004
  121    HB   VAL  15           HB       VAL  15  14.902  -7.975  -3.090
  122   HG11  VAL  15          2HG1      VAL  15  15.465  -6.298  -1.425
  123   HG12  VAL  15          1HG1      VAL  15  16.928  -7.014  -2.105
  124   HG13  VAL  15          3HG1      VAL  15  16.370  -7.499  -0.502
  125   HG21  VAL  15          3HG2      VAL  15  16.391  -9.919  -1.324
  126   HG22  VAL  15          2HG2      VAL  15  16.914  -9.357  -2.912
  127   HG23  VAL  15          1HG2      VAL  15  15.454 -10.335  -2.759
  128    H    ALA  16           H        ALA  16  13.493 -11.086  -1.153
  129    HA   ALA  16           HA       ALA  16  11.939 -11.335  -3.531
  130    HB1  ALA  16           HB1      ALA  16  13.199 -13.219  -2.595
  131    HB2  ALA  16           HB2      ALA  16  12.142 -13.220  -1.183
  132    HB3  ALA  16           HB3      ALA  16  11.488 -13.609  -2.772
  133    H    HIS  17           H        HIS  17  11.243 -10.560  -0.224
  134    HA   HIS  17           HA       HIS  17   8.439 -11.169  -0.345
  135    HB2  HIS  17           HB2      HIS  17  10.144  -9.681   1.648
  136    HB3  HIS  17           HB3      HIS  17   8.394  -9.758   1.804
  137    HD1  HIS  17           HD1      HIS  17   7.901 -11.386   3.607
  138    HD2  HIS  17           HD2      HIS  17  10.984 -12.696   1.142
  139    HE1  HIS  17           HE1      HIS  17   8.483 -13.689   4.416
  140    HE2  HIS  17           HE2      HIS  17  10.477 -14.380   3.043
  141    H    THR  18           H        THR  18  10.448  -8.342  -0.855
  142    HA   THR  18           HA       THR  18   8.557  -6.320  -0.799
  143    HB   THR  18           HB       THR  18  10.756  -6.357  -2.850
  144    HG1  THR  18           HG1      THR  18  12.207  -5.804  -1.177
  145   HG21  THR  18          3HG2      THR  18  10.946  -3.984  -2.178
  146   HG22  THR  18          1HG2      THR  18   9.604  -4.214  -1.057
  147   HG23  THR  18          2HG2      THR  18   9.343  -4.382  -2.793
  148    H    TYR  19           H        TYR  19   9.627  -8.235  -3.611
  149    HA   TYR  19           HA       TYR  19   7.785  -6.925  -5.372
  150    HB2  TYR  19           HB2      TYR  19   9.411  -9.432  -5.840
  151    HB3  TYR  19           HB3      TYR  19   8.631  -8.447  -7.076
  152    HD1  TYR  19           HD2      TYR  19   9.329  -5.854  -6.925
  153    HD2  TYR  19           HD1      TYR  19  11.671  -9.121  -5.542
  154    HE1  TYR  19           HE2      TYR  19  11.349  -4.464  -7.094
  155    HE2  TYR  19           HE1      TYR  19  13.702  -7.741  -5.700
  156    HH   TYR  19           HH       TYR  19  13.582  -4.343  -6.166
  157    H    MET  20           H        MET  20   7.807  -9.935  -3.562
  158    HA   MET  20           HA       MET  20   5.588 -11.089  -4.921
  159    HB2  MET  20           HB2      MET  20   7.147 -12.470  -3.636
  160    HB3  MET  20           HB3      MET  20   6.652 -11.664  -2.153
  161    HG2  MET  20           HG2      MET  20   4.397 -12.535  -2.406
  162    HG3  MET  20           HG3      MET  20   4.857 -13.311  -3.922
  163    HE1  MET  20           HE1      MET  20   7.456 -15.984  -2.706
  164    HE2  MET  20           HE2      MET  20   6.569 -15.352  -4.092
  165    HE3  MET  20           HE3      MET  20   7.774 -14.348  -3.284
  166    H    ALA  21           H        ALA  21   5.921  -9.183  -1.955
  167    HA   ALA  21           HA       ALA  21   3.237  -9.336  -1.130
  168    HB1  ALA  21           HB1      ALA  21   3.728  -7.378   0.241
  169    HB2  ALA  21           HB2      ALA  21   5.028  -8.566   0.340
  170    HB3  ALA  21           HB3      ALA  21   5.228  -7.123  -0.652
  171    H    ALA  22           H        ALA  22   4.942  -6.980  -3.155
  172    HA   ALA  22           HA       ALA  22   2.857  -5.171  -3.542
  173    HB1  ALA  22           HB1      ALA  22   4.064  -4.474  -5.557
  174    HB2  ALA  22           HB2      ALA  22   5.158  -4.706  -4.194
  175    HB3  ALA  22           HB3      ALA  22   5.059  -5.928  -5.463
  176    H    GLN  23           H        GLN  23   3.747  -8.016  -5.492
  177    HA   GLN  23           HA       GLN  23   1.663  -7.633  -7.387
  178    HB2  GLN  23           HB2      GLN  23   3.392 -10.024  -6.752
  179    HB3  GLN  23           HB3      GLN  23   2.230  -9.991  -8.070
  180    HG2  GLN  23           HG2      GLN  23   3.411  -8.178  -9.125
  181    HG3  GLN  23           HG3      GLN  23   4.529  -8.080  -7.765
  182   HE21  GLN  23          1HE2      GLN  23   6.113  -9.619  -7.532
  183   HE22  GLN  23          2HE2      GLN  23   6.545 -10.712  -8.802
  184    H    ALA  24           H        ALA  24   1.953  -9.620  -4.463
  185    HA   ALA  24           HA       ALA  24  -0.513 -10.988  -4.787
  186    HB1  ALA  24           HB1      ALA  24   1.236 -11.773  -3.267
  187    HB2  ALA  24           HB2      ALA  24   0.990 -10.353  -2.250
  188    HB3  ALA  24           HB3      ALA  24  -0.295 -11.549  -2.420
  189    H    LEU  25           H        LEU  25   0.418  -8.008  -3.153
  190    HA   LEU  25           HA       LEU  25  -2.095  -7.319  -2.089
  191    HB2  LEU  25           HB2      LEU  25  -0.007  -6.243  -1.427
  192    HB3  LEU  25           HB3      LEU  25   0.176  -5.571  -3.035
  193    HG   LEU  25           HG       LEU  25  -1.841  -4.198  -2.673
  194   HD11  LEU  25          2HD1      LEU  25  -3.002  -5.627  -1.075
  195   HD12  LEU  25          1HD1      LEU  25  -2.781  -4.004  -0.421
  196   HD13  LEU  25          3HD1      LEU  25  -1.745  -5.323   0.124
  197   HD21  LEU  25          3HD2      LEU  25   0.429  -3.370  -2.176
  198   HD22  LEU  25          2HD2      LEU  25   0.227  -3.892  -0.504
  199   HD23  LEU  25          1HD2      LEU  25  -0.810  -2.625  -1.163
  200    H    LYS  26           H        LYS  26  -0.553  -6.487  -5.191
  201    HA   LYS  26           HA       LYS  26  -2.644  -4.992  -6.296
  202    HB2  LYS  26           HB2      LYS  26  -0.599  -6.784  -7.609
  203    HB3  LYS  26           HB3      LYS  26  -1.727  -5.796  -8.521
  204    HG2  LYS  26           HG2      LYS  26  -0.786  -3.785  -7.457
  205    HG3  LYS  26           HG3      LYS  26   0.385  -4.807  -6.618
  206    HD2  LYS  26           HD2      LYS  26   1.251  -5.579  -8.778
  207    HD3  LYS  26           HD3      LYS  26   0.084  -4.550  -9.611
  208    HE2  LYS  26           HE2      LYS  26   1.108  -2.582  -8.510
  209    HE3  LYS  26           HE3      LYS  26   2.325  -3.644  -7.806
  210    HZ1  LYS  26           HZ1      LYS  26   3.101  -2.536  -9.824
  211    HZ2  LYS  26           HZ2      LYS  26   1.868  -3.280 -10.720
  212    HZ3  LYS  26           HZ3      LYS  26   3.083  -4.219 -10.008
  213    H    LYS  27           H        LYS  27  -2.062  -8.466  -6.263
  214    HA   LYS  27           HA       LYS  27  -4.109  -9.236  -8.018
  215    HB2  LYS  27           HB2      LYS  27  -2.135 -10.591  -7.032
  216    HB3  LYS  27           HB3      LYS  27  -3.219 -10.913  -5.686
  217    HG2  LYS  27           HG2      LYS  27  -3.273 -12.737  -7.264
  218    HG3  LYS  27           HG3      LYS  27  -4.833 -11.909  -7.240
  219    HD2  LYS  27           HD2      LYS  27  -4.331 -10.764  -9.283
  220    HD3  LYS  27           HD3      LYS  27  -2.666 -11.345  -9.258
  221    HE2  LYS  27           HE2      LYS  27  -5.139 -13.042  -9.579
  222    HE3  LYS  27           HE3      LYS  27  -4.011 -12.596 -10.860
  223    HZ1  LYS  27           HZ1      LYS  27  -3.593 -14.435  -8.587
  224    HZ2  LYS  27           HZ2      LYS  27  -2.272 -13.717  -9.373
  225    HZ3  LYS  27           HZ3      LYS  27  -3.336 -14.707 -10.245
  226    H    GLY  28           H        GLY  28  -4.079  -8.825  -4.496
  227    HA2  GLY  28           HA1      GLY  28  -6.796  -9.639  -4.144
  228    HA3  GLY  28           HA2      GLY  28  -5.805  -8.792  -2.965
  229    H    ALA  29           H        ALA  29  -5.195  -6.513  -4.507
  230    HA   ALA  29           HA       ALA  29  -7.483  -4.927  -4.012
  231    HB1  ALA  29           HB1      ALA  29  -5.197  -4.050  -3.909
  232    HB2  ALA  29           HB2      ALA  29  -5.046  -4.249  -5.654
  233    HB3  ALA  29           HB3      ALA  29  -6.213  -3.101  -4.994
  234    H    LYS  30           H        LYS  30  -6.068  -6.232  -6.979
  235    HA   LYS  30           HA       LYS  30  -7.914  -4.970  -8.718
  236    HB2  LYS  30           HB2      LYS  30  -5.689  -5.851  -9.423
  237    HB3  LYS  30           HB3      LYS  30  -6.293  -7.482  -9.192
  238    HG2  LYS  30           HG2      LYS  30  -6.554  -7.269 -11.443
  239    HG3  LYS  30           HG3      LYS  30  -8.131  -6.700 -10.900
  240    HD2  LYS  30           HD2      LYS  30  -5.803  -4.875 -11.488
  241    HD3  LYS  30           HD3      LYS  30  -7.035  -5.298 -12.676
  242    HE2  LYS  30           HE2      LYS  30  -8.750  -4.365 -11.132
  243    HE3  LYS  30           HE3      LYS  30  -7.445  -3.834 -10.073
  244    HZ1  LYS  30           HZ1      LYS  30  -7.635  -3.013 -12.908
  245    HZ2  LYS  30           HZ2      LYS  30  -6.652  -2.345 -11.694
  246    HZ3  LYS  30           HZ3      LYS  30  -8.335  -2.125 -11.645
  247    H    LYS  31           H        LYS  31  -7.929  -7.932  -6.896
  248    HA   LYS  31           HA       LYS  31 -10.110  -9.233  -8.100
  249    HB2  LYS  31           HB2      LYS  31  -8.636 -10.306  -6.450
  250    HB3  LYS  31           HB3      LYS  31  -9.237  -9.226  -5.200
  251    HG2  LYS  31           HG2      LYS  31 -11.488 -10.196  -5.499
  252    HG3  LYS  31           HG3      LYS  31 -10.807 -11.337  -6.662
  253    HD2  LYS  31           HD2      LYS  31  -9.295 -12.182  -4.922
  254    HD3  LYS  31           HD3      LYS  31 -10.010 -11.061  -3.765
  255    HE2  LYS  31           HE2      LYS  31 -10.993 -13.225  -3.446
  256    HE3  LYS  31           HE3      LYS  31 -12.204 -12.151  -4.144
  257    HZ1  LYS  31           HZ1      LYS  31 -11.674 -13.121  -6.336
  258    HZ2  LYS  31           HZ2      LYS  31 -12.298 -14.254  -5.241
  259    HZ3  LYS  31           HZ3      LYS  31 -10.635 -14.227  -5.576
  260    H    MET  32           H        MET  32  -9.889  -6.647  -5.761
  261    HA   MET  32           HA       MET  32 -12.750  -6.552  -5.297
  262    HB2  MET  32           HB2      MET  32 -10.516  -4.709  -4.420
  263    HB3  MET  32           HB3      MET  32 -12.191  -4.571  -3.906
  264    HG2  MET  32           HG2      MET  32 -10.525  -7.024  -3.428
  265    HG3  MET  32           HG3      MET  32 -10.624  -5.685  -2.287
  266    HE1  MET  32           HE1      MET  32 -14.374  -5.720  -1.257
  267    HE2  MET  32           HE2      MET  32 -12.785  -5.013  -0.957
  268    HE3  MET  32           HE3      MET  32 -13.596  -4.744  -2.502
  269    H    GLY  33           H        GLY  33 -10.724  -5.562  -7.715
  270    HA2  GLY  33           HA1      GLY  33 -11.204  -4.346  -9.620
  271    HA3  GLY  33           HA2      GLY  33 -12.730  -3.865  -8.893
  272    H    ASN  34           H        ASN  34  -9.912  -3.362  -7.015
  273    HA   ASN  34           HA       ASN  34 -10.439  -0.550  -6.916
  274    HB2  ASN  34           HB2      ASN  34  -8.217  -2.201  -5.712
  275    HB3  ASN  34           HB3      ASN  34  -8.484  -0.498  -5.376
  276   HD21  ASN  34          1HD2      ASN  34  -8.633  -3.130  -3.854
  277   HD22  ASN  34          2HD2      ASN  34 -10.112  -2.997  -2.970
  278    H    LEU  35           H        LEU  35  -8.690   1.040  -7.097
  279    HA   LEU  35           HA       LEU  35  -6.801   0.408  -9.269
  280    HB2  LEU  35           HB2      LEU  35  -8.094   3.059  -8.599
  281    HB3  LEU  35           HB3      LEU  35  -6.844   2.835  -9.806
  282    HG   LEU  35           HG       LEU  35  -9.602   1.606  -9.905
  283   HD11  LEU  35          2HD1      LEU  35  -9.967   3.157 -11.774
  284   HD12  LEU  35          1HD1      LEU  35  -8.401   3.901 -11.446
  285   HD13  LEU  35          3HD1      LEU  35  -9.694   4.001 -10.250
  286   HD21  LEU  35          3HD2      LEU  35  -7.354   1.589 -11.915
  287   HD22  LEU  35          2HD2      LEU  35  -8.982   0.969 -12.188
  288   HD23  LEU  35          1HD2      LEU  35  -7.937   0.205 -10.990
  289    H    ILE  36           H        ILE  36  -5.077  -0.163  -8.033
  290    HA   ILE  36           HA       ILE  36  -4.331   1.632  -5.828
  291    HB   ILE  36           HB       ILE  36  -4.982  -0.662  -5.150
  292   HG12  ILE  36          2HG1      ILE  36  -2.054  -0.050  -4.725
  293   HG13  ILE  36          3HG1      ILE  36  -3.380   0.668  -3.821
  294   HG21  ILE  36          2HG2      ILE  36  -4.243  -1.870  -7.126
  295   HG22  ILE  36          1HG2      ILE  36  -3.514  -2.548  -5.669
  296   HG23  ILE  36          3HG2      ILE  36  -2.559  -1.512  -6.732
  297   HD11  ILE  36          3HD1      ILE  36  -3.979  -1.542  -2.963
  298   HD12  ILE  36          2HD1      ILE  36  -2.323  -1.098  -2.550
  299   HD13  ILE  36          1HD1      ILE  36  -2.629  -2.246  -3.853
  300    H    LYS  37           H        LYS  37  -2.258   2.340  -5.644
  301    HA   LYS  37           HA       LYS  37  -0.379   1.540  -7.768
  302    HB2  LYS  37           HB2      LYS  37  -0.554   4.170  -6.280
  303    HB3  LYS  37           HB3      LYS  37   0.698   3.753  -7.444
  304    HG2  LYS  37           HG2      LYS  37  -2.253   4.013  -8.024
  305    HG3  LYS  37           HG3      LYS  37  -0.995   5.173  -8.457
  306    HD2  LYS  37           HD2      LYS  37  -1.003   2.312  -9.404
  307    HD3  LYS  37           HD3      LYS  37  -1.751   3.629 -10.306
  308    HE2  LYS  37           HE2      LYS  37   1.131   3.686  -9.445
  309    HE3  LYS  37           HE3      LYS  37   0.611   2.982 -10.978
  310    HZ1  LYS  37           HZ1      LYS  37   0.110   5.795 -10.131
  311    HZ2  LYS  37           HZ2      LYS  37  -0.315   5.100 -11.622
  312    HZ3  LYS  37           HZ3      LYS  37   1.317   5.298 -11.217
  313    H    VAL  38           H        VAL  38   0.875   0.031  -6.886
  314    HA   VAL  38           HA       VAL  38   1.602   0.227  -4.062
  315    HB   VAL  38           HB       VAL  38   2.184  -2.025  -5.988
  316   HG11  VAL  38          2HG1      VAL  38   2.525  -3.346  -3.954
  317   HG12  VAL  38          1HG1      VAL  38   2.239  -1.907  -2.976
  318   HG13  VAL  38          3HG1      VAL  38   3.643  -1.983  -4.039
  319   HG21  VAL  38          3HG2      VAL  38  -0.222  -1.688  -5.778
  320   HG22  VAL  38          2HG2      VAL  38  -0.082  -1.741  -4.019
  321   HG23  VAL  38          1HG2      VAL  38   0.283  -3.177  -4.978
  322    H    GLU  39           H        GLU  39   3.421   1.133  -3.490
  323    HA   GLU  39           HA       GLU  39   5.544   1.559  -5.450
  324    HB2  GLU  39           HB2      GLU  39   4.705   3.491  -4.199
  325    HB3  GLU  39           HB3      GLU  39   5.083   2.694  -2.681
  326    HG2  GLU  39           HG2      GLU  39   7.426   2.838  -3.115
  327    HG3  GLU  39           HG3      GLU  39   7.133   3.435  -4.749
  328    H    THR  40           H        THR  40   7.730   0.997  -4.997
  329    HA   THR  40           HA       THR  40   8.003  -1.094  -2.952
  330    HB   THR  40           HB       THR  40   9.800  -2.016  -4.589
  331    HG1  THR  40           HG1      THR  40   9.234  -1.570  -6.796
  332   HG21  THR  40          3HG2      THR  40   7.751  -3.212  -4.027
  333   HG22  THR  40          1HG2      THR  40   8.101  -3.370  -5.746
  334   HG23  THR  40          2HG2      THR  40   6.850  -2.254  -5.202
  335    H    GLN  41           H        GLN  41   9.194  -0.302  -1.368
  336    HA   GLN  41           HA       GLN  41  11.690   1.132  -2.051
  337    HB2  GLN  41           HB2      GLN  41  10.253   2.602  -0.804
  338    HB3  GLN  41           HB3      GLN  41   9.890   1.349   0.372
  339    HG2  GLN  41           HG2      GLN  41  12.005   1.507   1.361
  340    HG3  GLN  41           HG3      GLN  41  12.676   2.386  -0.011
  341   HE21  GLN  41          1HE2      GLN  41  13.409   4.004   1.399
  342   HE22  GLN  41          2HE2      GLN  41  12.340   5.172   2.070
  343    H    GLY  42           H        GLY  42  13.569   0.493  -0.956
  344    HA2  GLY  42           HA1      GLY  42  13.386  -1.824   0.817
  345    HA3  GLY  42           HA2      GLY  42  14.266  -2.036  -0.691
  346    H    ALA  43           H        ALA  43  16.035  -0.495  -1.108
  347    HA   ALA  43           HA       ALA  43  17.451   0.021   1.419
  348    HB1  ALA  43           HB1      ALA  43  18.600  -0.392  -1.341
  349    HB2  ALA  43           HB2      ALA  43  19.521  -0.149   0.144
  350    HB3  ALA  43           HB3      ALA  43  18.539  -1.599  -0.056
  351    H    THR  44           H        THR  44  16.296   2.018   1.642
  352    HA   THR  44           HA       THR  44  16.315   4.282   1.727
  353    HB   THR  44           HB       THR  44  18.710   4.121  -0.110
  354    HG1  THR  44           HG1      THR  44  19.419   3.190   1.697
  355   HG21  THR  44          3HG2      THR  44  19.238   6.361   0.758
  356   HG22  THR  44          1HG2      THR  44  17.714   6.370   1.647
  357   HG23  THR  44          2HG2      THR  44  17.707   6.348  -0.117
  358    H    GLY  45           H        GLY  45  16.511   2.847  -1.488
  359    HA2  GLY  45           HA1      GLY  45  15.483   5.318  -2.675
  360    HA3  GLY  45           HA2      GLY  45  16.202   3.973  -3.545
  361    H    ILE  46           H        ILE  46  14.007   4.925  -4.593
  362    HA   ILE  46           HA       ILE  46  11.872   3.055  -3.790
  363    HB   ILE  46           HB       ILE  46  11.549   5.753  -5.131
  364   HG12  ILE  46          2HG1      ILE  46  12.209   5.930  -2.737
  365   HG13  ILE  46          3HG1      ILE  46  10.594   6.555  -3.053
  366   HG21  ILE  46          2HG2      ILE  46   9.845   4.213  -5.829
  367   HG22  ILE  46          1HG2      ILE  46   9.144   5.388  -4.715
  368   HG23  ILE  46          3HG2      ILE  46   9.520   3.758  -4.157
  369   HD11  ILE  46          3HD1      ILE  46   9.637   4.473  -2.194
  370   HD12  ILE  46          2HD1      ILE  46  10.638   5.294  -0.995
  371   HD13  ILE  46          1HD1      ILE  46  11.262   3.881  -1.847
  372    H    GLU  47           H        GLU  47  11.325   1.596  -5.320
  373    HA   GLU  47           HA       GLU  47  12.545   1.852  -7.943
  374    HB2  GLU  47           HB2      GLU  47  10.913  -0.360  -6.699
  375    HB3  GLU  47           HB3      GLU  47  11.564  -0.420  -8.333
  376    HG2  GLU  47           HG2      GLU  47  13.840  -0.140  -7.370
  377    HG3  GLU  47           HG3      GLU  47  13.122  -0.274  -5.764
  378    H    ASN  48           H        ASN  48   9.240   0.837  -7.027
  379    HA   ASN  48           HA       ASN  48   8.207   2.071  -9.426
  380    HB2  ASN  48           HB2      ASN  48   7.311  -0.098  -8.390
  381    HB3  ASN  48           HB3      ASN  48   6.532   0.933  -7.192
  382   HD21  ASN  48          1HD2      ASN  48   4.450   0.513  -7.802
  383   HD22  ASN  48          2HD2      ASN  48   3.795   0.987  -9.333
  384    H    GLU  49           H        GLU  49   9.070   4.110  -8.752
  385    HA   GLU  49           HA       GLU  49   8.353   5.598  -6.535
  386    HB2  GLU  49           HB2      GLU  49  10.184   6.145  -8.039
  387    HB3  GLU  49           HB3      GLU  49   9.048   6.499  -9.329
  388    HG2  GLU  49           HG2      GLU  49   8.149   8.353  -7.949
  389    HG3  GLU  49           HG3      GLU  49   9.425   8.034  -6.772
  390    H    LEU  50           H        LEU  50   6.430   6.282  -5.866
  391    HA   LEU  50           HA       LEU  50   4.273   6.785  -7.744
  392    HB2  LEU  50           HB2      LEU  50   4.411   7.230  -4.759
  393    HB3  LEU  50           HB3      LEU  50   2.966   7.360  -5.742
  394    HG   LEU  50           HG       LEU  50   4.532   4.843  -5.184
  395   HD11  LEU  50          2HD1      LEU  50   1.783   5.747  -4.340
  396   HD12  LEU  50          1HD1      LEU  50   3.201   5.594  -3.301
  397   HD13  LEU  50          3HD1      LEU  50   2.481   4.158  -4.028
  398   HD21  LEU  50          3HD2      LEU  50   2.810   3.682  -6.442
  399   HD22  LEU  50          2HD2      LEU  50   3.634   4.855  -7.465
  400   HD23  LEU  50          1HD2      LEU  50   2.031   5.217  -6.826
  401    H    THR  51           H        THR  51   3.278   8.847  -8.034
  402    HA   THR  51           HA       THR  51   5.079  11.084  -7.378
  403    HB   THR  51           HB       THR  51   4.065  12.303  -9.262
  404    HG1  THR  51           HG1      THR  51   2.469   9.976  -9.380
  405   HG21  THR  51          3HG2      THR  51   5.156   9.580  -9.986
  406   HG22  THR  51          1HG2      THR  51   6.096  11.040  -9.675
  407   HG23  THR  51          2HG2      THR  51   5.043  10.953 -11.089
  408    H    GLU  52           H        GLU  52   3.821  13.241  -7.226
  409    HA   GLU  52           HA       GLU  52   2.203  13.067  -4.954
  410    HB2  GLU  52           HB2      GLU  52   2.718  15.312  -6.884
  411    HB3  GLU  52           HB3      GLU  52   1.686  15.510  -5.472
  412    HG2  GLU  52           HG2      GLU  52   4.575  14.674  -5.437
  413    HG3  GLU  52           HG3      GLU  52   3.958  16.281  -5.050
  414    H    LYS  53           H        LYS  53   1.336  13.183  -8.355
  415    HA   LYS  53           HA       LYS  53  -1.395  13.699  -8.072
  416    HB2  LYS  53           HB2      LYS  53  -0.286  13.599 -10.264
  417    HB3  LYS  53           HB3      LYS  53  -0.059  11.865 -10.072
  418    HG2  LYS  53           HG2      LYS  53  -2.483  11.550 -10.037
  419    HG3  LYS  53           HG3      LYS  53  -2.709  13.288 -10.235
  420    HD2  LYS  53           HD2      LYS  53  -2.977  12.156 -12.363
  421    HD3  LYS  53           HD3      LYS  53  -1.536  13.174 -12.393
  422    HE2  LYS  53           HE2      LYS  53  -0.114  11.257 -12.068
  423    HE3  LYS  53           HE3      LYS  53  -1.515  10.209 -11.842
  424    HZ1  LYS  53           HZ1      LYS  53  -0.512  10.076 -14.087
  425    HZ2  LYS  53           HZ2      LYS  53  -0.943  11.695 -14.348
  426    HZ3  LYS  53           HZ3      LYS  53  -2.149  10.529 -14.106
  427    H    ASP  54           H        ASP  54   0.331  10.584  -8.071
  428    HA   ASP  54           HA       ASP  54  -1.890   8.931  -7.675
  429    HB2  ASP  54           HB2      ASP  54   0.910   8.452  -6.635
  430    HB3  ASP  54           HB3      ASP  54  -0.322   7.230  -6.923
  431    H    VAL  55           H        VAL  55   0.298  10.431  -5.373
  432    HA   VAL  55           HA       VAL  55  -0.735   9.311  -3.033
  433    HB   VAL  55           HB       VAL  55   0.579  12.010  -3.389
  434   HG11  VAL  55          2HG1      VAL  55   0.252  10.298  -0.930
  435   HG12  VAL  55          1HG1      VAL  55  -0.563  11.827  -1.254
  436   HG13  VAL  55          3HG1      VAL  55   1.185  11.792  -1.028
  437   HG21  VAL  55          3HG2      VAL  55   2.650  10.849  -2.772
  438   HG22  VAL  55          2HG2      VAL  55   1.959  10.200  -4.260
  439   HG23  VAL  55          1HG2      VAL  55   1.779   9.316  -2.744
  440    H    ASN  56           H        ASN  56  -1.732  12.178  -4.841
  441    HA   ASN  56           HA       ASN  56  -3.610  12.916  -2.751
  442    HB2  ASN  56           HB2      ASN  56  -2.784  14.210  -5.333
  443    HB3  ASN  56           HB3      ASN  56  -4.193  14.771  -4.439
  444   HD21  ASN  56          1HD2      ASN  56  -0.731  14.496  -4.455
  445   HD22  ASN  56          2HD2      ASN  56  -0.441  15.579  -3.133
  446    H    ILE  57           H        ILE  57  -3.643  10.946  -5.493
  447    HA   ILE  57           HA       ILE  57  -6.514  11.197  -5.873
  448    HB   ILE  57           HB       ILE  57  -4.466   9.392  -7.160
  449   HG12  ILE  57          2HG1      ILE  57  -4.347  11.714  -7.878
  450   HG13  ILE  57          3HG1      ILE  57  -4.976  10.710  -9.179
  451   HG21  ILE  57          2HG2      ILE  57  -6.247   8.685  -8.697
  452   HG22  ILE  57          1HG2      ILE  57  -7.422   9.563  -7.718
  453   HG23  ILE  57          3HG2      ILE  57  -6.560   8.183  -7.036
  454   HD11  ILE  57          3HD1      ILE  57  -6.618  12.450  -7.354
  455   HD12  ILE  57          2HD1      ILE  57  -7.233  11.469  -8.683
  456   HD13  ILE  57          1HD1      ILE  57  -6.160  12.829  -9.013
  457    H    GLY  58           H        GLY  58  -4.175   8.786  -4.722
  458    HA2  GLY  58           HA1      GLY  58  -6.006   6.761  -4.082
  459    HA3  GLY  58           HA2      GLY  58  -4.410   6.948  -3.375
  460    H    GLU  59           H        GLU  59  -7.279   6.332  -2.407
  461    HA   GLU  59           HA       GLU  59  -7.957   8.439  -0.598
  462    HB2  GLU  59           HB2      GLU  59  -8.866   5.551  -0.565
  463    HB3  GLU  59           HB3      GLU  59  -9.658   6.909   0.217
  464    HG2  GLU  59           HG2      GLU  59  -9.276   6.844  -2.750
  465    HG3  GLU  59           HG3      GLU  59 -10.617   6.002  -1.982
  466    H    VAL  60           H        VAL  60  -7.100   5.063   0.082
  467    HA   VAL  60           HA       VAL  60  -6.147   5.889   2.718
  468    HB   VAL  60           HB       VAL  60  -6.318   3.458   3.279
  469   HG11  VAL  60          2HG1      VAL  60  -8.779   3.407   3.362
  470   HG12  VAL  60          1HG1      VAL  60  -8.829   4.774   2.248
  471   HG13  VAL  60          3HG1      VAL  60  -8.126   4.969   3.853
  472   HG21  VAL  60          3HG2      VAL  60  -7.578   3.281   0.542
  473   HG22  VAL  60          2HG2      VAL  60  -7.605   2.006   1.761
  474   HG23  VAL  60          1HG2      VAL  60  -6.073   2.519   1.055
  475    H    VAL  61           H        VAL  61  -4.182   5.091   3.554
  476    HA   VAL  61           HA       VAL  61  -2.239   4.364   1.465
  477    HB   VAL  61           HB       VAL  61  -1.656   5.623   4.146
  478   HG11  VAL  61          2HG1      VAL  61   0.542   6.095   3.131
  479   HG12  VAL  61          1HG1      VAL  61   0.053   5.182   1.703
  480   HG13  VAL  61          3HG1      VAL  61   0.209   4.367   3.261
  481   HG21  VAL  61          3HG2      VAL  61  -1.319   7.717   2.949
  482   HG22  VAL  61          2HG2      VAL  61  -2.972   7.142   2.743
  483   HG23  VAL  61          1HG2      VAL  61  -1.800   6.945   1.439
  484    H    ILE  62           H        ILE  62  -1.653   2.317   1.504
  485    HA   ILE  62           HA       ILE  62  -1.761   0.843   4.045
  486    HB   ILE  62           HB       ILE  62  -1.641  -0.180   1.201
  487   HG12  ILE  62          2HG1      ILE  62  -3.877  -0.253   3.243
  488   HG13  ILE  62          3HG1      ILE  62  -3.812   0.800   1.833
  489   HG21  ILE  62          2HG2      ILE  62  -1.955  -2.404   2.154
  490   HG22  ILE  62          1HG2      ILE  62  -1.876  -1.726   3.780
  491   HG23  ILE  62          3HG2      ILE  62  -0.459  -1.669   2.731
  492   HD11  ILE  62          3HD1      ILE  62  -3.973  -2.206   1.803
  493   HD12  ILE  62          2HD1      ILE  62  -3.868  -1.171   0.377
  494   HD13  ILE  62          1HD1      ILE  62  -5.279  -1.079   1.433
  495    H    PHE  63           H        PHE  63   0.093   0.338   5.039
  496    HA   PHE  63           HA       PHE  63   2.560   0.357   3.428
  497    HB2  PHE  63           HB2      PHE  63   2.104   1.018   6.329
  498    HB3  PHE  63           HB3      PHE  63   3.703   0.629   5.705
  499    HD1  PHE  63           HD2      PHE  63   4.232   1.977   3.426
  500    HD2  PHE  63           HD1      PHE  63   1.629   3.234   6.542
  501    HE1  PHE  63           HE2      PHE  63   4.539   4.312   2.730
  502    HE2  PHE  63           HE1      PHE  63   1.924   5.577   5.847
  503    HZ   PHE  63           HZ       PHE  63   3.383   6.117   3.940
  504    H    ALA  64           H        ALA  64   2.795  -1.706   2.815
  505    HA   ALA  64           HA       ALA  64   2.832  -3.775   4.900
  506    HB1  ALA  64           HB1      ALA  64   1.579  -4.355   2.890
  507    HB2  ALA  64           HB2      ALA  64   2.994  -4.020   1.891
  508    HB3  ALA  64           HB3      ALA  64   3.016  -5.369   3.028
  509    H    VAL  65           H        VAL  65   4.757  -3.380   5.945
  510    HA   VAL  65           HA       VAL  65   7.130  -3.183   4.222
  511    HB   VAL  65           HB       VAL  65   8.064  -1.485   5.784
  512   HG11  VAL  65          2HG1      VAL  65   6.722   0.382   4.901
  513   HG12  VAL  65          1HG1      VAL  65   5.496  -0.772   4.374
  514   HG13  VAL  65          3HG1      VAL  65   7.110  -0.812   3.662
  515   HG21  VAL  65          3HG2      VAL  65   6.528  -0.267   7.257
  516   HG22  VAL  65          2HG2      VAL  65   6.667  -1.960   7.733
  517   HG23  VAL  65          1HG2      VAL  65   5.241  -1.406   6.857
  518    H    ASP  66           H        ASP  66   9.078  -3.746   5.059
  519    HA   ASP  66           HA       ASP  66   9.087  -5.420   7.485
  520    HB2  ASP  66           HB2      ASP  66   9.733  -6.847   5.762
  521    HB3  ASP  66           HB3      ASP  66  10.516  -5.564   4.855
  522    H    THR  67           H        THR  67  10.355  -2.691   5.835
  523    HA   THR  67           HA       THR  67  11.960  -2.001   8.197
  524    HB   THR  67           HB       THR  67  13.426  -2.619   6.265
  525    HG1  THR  67           HG1      THR  67  14.798  -1.091   6.845
  526   HG21  THR  67          3HG2      THR  67  12.176  -0.202   4.951
  527   HG22  THR  67          1HG2      THR  67  11.997  -1.879   4.432
  528   HG23  THR  67          2HG2      THR  67  13.574  -1.093   4.348
  529    H    LYS  68           H        LYS  68  12.530   0.638   7.494
  530    HA   LYS  68           HA       LYS  68   9.885   1.805   7.803
  531    HB2  LYS  68           HB2      LYS  68  11.035   3.850   8.374
  532    HB3  LYS  68           HB3      LYS  68  11.794   2.519   9.234
  533    HG2  LYS  68           HG2      LYS  68  13.601   2.472   7.611
  534    HG3  LYS  68           HG3      LYS  68  12.831   3.782   6.710
  535    HD2  LYS  68           HD2      LYS  68  13.078   5.255   8.644
  536    HD3  LYS  68           HD3      LYS  68  13.831   3.942   9.553
  537    HE2  LYS  68           HE2      LYS  68  15.644   3.856   7.910
  538    HE3  LYS  68           HE3      LYS  68  14.897   5.180   7.017
  539    HZ1  LYS  68           HZ1      LYS  68  15.176   6.591   8.969
  540    HZ2  LYS  68           HZ2      LYS  68  16.662   5.987   8.426
  541    HZ3  LYS  68           HZ3      LYS  68  15.927   5.316   9.801
  542    H    VAL  69           H        VAL  69   9.437   3.885   6.585
  543    HA   VAL  69           HA       VAL  69  10.426   3.694   3.822
  544    HB   VAL  69           HB       VAL  69   8.290   4.330   2.935
  545   HG11  VAL  69          2HG1      VAL  69   6.918   2.395   3.511
  546   HG12  VAL  69          1HG1      VAL  69   7.942   2.091   4.914
  547   HG13  VAL  69          3HG1      VAL  69   8.610   1.954   3.287
  548   HG21  VAL  69          3HG2      VAL  69   6.310   4.645   4.300
  549   HG22  VAL  69          2HG2      VAL  69   7.571   5.797   4.739
  550   HG23  VAL  69          1HG2      VAL  69   7.267   4.392   5.763
  551    H    ARG  70           H        ARG  70  10.400   5.687   2.633
  552    HA   ARG  70           HA       ARG  70  10.967   7.971   4.369
  553    HB2  ARG  70           HB2      ARG  70  11.549   7.410   1.468
  554    HB3  ARG  70           HB3      ARG  70  11.846   8.975   2.210
  555    HG2  ARG  70           HG2      ARG  70  13.449   8.040   3.713
  556    HG3  ARG  70           HG3      ARG  70  13.052   6.400   3.197
  557    HD2  ARG  70           HD2      ARG  70  15.144   7.249   2.194
  558    HD3  ARG  70           HD3      ARG  70  13.922   6.831   0.996
  559    HE   ARG  70           HE       ARG  70  13.933   9.614   1.769
  560   HH11  ARG  70          2HH1      ARG  70  15.233   7.201  -0.424
  561   HH12  ARG  70          1HH1      ARG  70  15.678   8.355  -1.646
  562   HH21  ARG  70          2HH2      ARG  70  14.493  11.137   0.168
  563   HH22  ARG  70          1HH2      ARG  70  15.270  10.608  -1.298
  564    H    ASN  71           H        ASN  71   8.751   6.946   1.872
  565    HA   ASN  71           HA       ASN  71   7.840   9.586   1.281
  566    HB2  ASN  71           HB2      ASN  71   7.015   6.864   0.347
  567    HB3  ASN  71           HB3      ASN  71   6.056   8.288  -0.057
  568   HD21  ASN  71          1HD2      ASN  71   7.501   6.580  -1.871
  569   HD22  ASN  71          2HD2      ASN  71   8.665   7.597  -2.659
  570    H    LYS  72           H        LYS  72   7.154   7.625   3.866
  571    HA   LYS  72           HA       LYS  72   4.378   7.887   4.203
  572    HB2  LYS  72           HB2      LYS  72   5.800   6.469   5.664
  573    HB3  LYS  72           HB3      LYS  72   6.500   7.921   6.368
  574    HG2  LYS  72           HG2      LYS  72   4.264   8.569   7.184
  575    HG3  LYS  72           HG3      LYS  72   3.618   7.062   6.535
  576    HD2  LYS  72           HD2      LYS  72   5.817   7.214   8.592
  577    HD3  LYS  72           HD3      LYS  72   4.110   7.015   8.985
  578    HE2  LYS  72           HE2      LYS  72   4.103   4.947   7.586
  579    HE3  LYS  72           HE3      LYS  72   5.847   5.127   7.401
  580    HZ1  LYS  72           HZ1      LYS  72   4.470   4.886  10.022
  581    HZ2  LYS  72           HZ2      LYS  72   6.141   4.859   9.744
  582    HZ3  LYS  72           HZ3      LYS  72   5.168   3.577   9.200
  583    H    GLU  73           H        GLU  73   6.972  10.103   4.513
  584    HA   GLU  73           HA       GLU  73   6.156  12.226   5.945
  585    HB2  GLU  73           HB2      GLU  73   8.214  12.028   4.572
  586    HB3  GLU  73           HB3      GLU  73   7.258  12.348   3.135
  587    HG2  GLU  73           HG2      GLU  73   8.356  14.345   3.732
  588    HG3  GLU  73           HG3      GLU  73   6.648  14.542   4.118
  589    H    ARG  74           H        ARG  74   5.092  11.624   2.559
  590    HA   ARG  74           HA       ARG  74   3.296  13.874   2.680
  591    HB2  ARG  74           HB2      ARG  74   2.778  13.304   0.368
  592    HB3  ARG  74           HB3      ARG  74   4.514  13.367   0.637
  593    HG2  ARG  74           HG2      ARG  74   4.266  10.792   0.991
  594    HG3  ARG  74           HG3      ARG  74   2.760  11.018   0.087
  595    HD2  ARG  74           HD2      ARG  74   4.424  10.504  -1.518
  596    HD3  ARG  74           HD3      ARG  74   4.132  12.235  -1.624
  597    HE   ARG  74           HE       ARG  74   6.367  11.344   0.019
  598   HH11  ARG  74          2HH1      ARG  74   5.226  12.882  -2.918
  599   HH12  ARG  74          1HH1      ARG  74   6.810  13.473  -3.354
  600   HH21  ARG  74          2HH2      ARG  74   8.427  12.168  -0.536
  601   HH22  ARG  74          1HH2      ARG  74   8.605  13.090  -2.002
  602    H    PHE  75           H        PHE  75   3.045  10.409   3.045
  603    HA   PHE  75           HA       PHE  75   0.201  10.318   2.826
  604    HB2  PHE  75           HB2      PHE  75   2.078   8.351   4.145
  605    HB3  PHE  75           HB3      PHE  75   0.423   8.042   3.644
  606    HD1  PHE  75           HD2      PHE  75   0.147   8.926   0.996
  607    HD2  PHE  75           HD1      PHE  75   3.586   7.259   2.852
  608    HE1  PHE  75           HE2      PHE  75   0.971   8.186  -1.201
  609    HE2  PHE  75           HE1      PHE  75   4.422   6.518   0.667
  610    HZ   PHE  75           HZ       PHE  75   3.112   6.980  -1.370
  611    H    ASP  76           H        ASP  76   2.227  11.569   5.156
  612    HA   ASP  76           HA       ASP  76   1.134  10.677   7.574
  613    HB2  ASP  76           HB2      ASP  76   3.267  11.851   7.456
  614    HB3  ASP  76           HB3      ASP  76   2.450  13.321   6.935
  615    H    GLY  77           H        GLY  77   0.242  13.429   5.527
  616    HA2  GLY  77           HA1      GLY  77  -1.835  14.279   7.356
  617    HA3  GLY  77           HA2      GLY  77  -1.492  14.959   5.772
  618    H    LYS  78           H        LYS  78  -1.793  11.570   5.894
  619    HA   LYS  78           HA       LYS  78  -4.549  11.712   4.869
  620    HB2  LYS  78           HB2      LYS  78  -2.246  10.040   3.832
  621    HB3  LYS  78           HB3      LYS  78  -3.913   9.880   3.296
  622    HG2  LYS  78           HG2      LYS  78  -3.901  11.990   2.264
  623    HG3  LYS  78           HG3      LYS  78  -2.423  12.478   3.094
  624    HD2  LYS  78           HD2      LYS  78  -2.032  11.940   0.726
  625    HD3  LYS  78           HD3      LYS  78  -1.138  10.876   1.809
  626    HE2  LYS  78           HE2      LYS  78  -2.081   9.576   0.026
  627    HE3  LYS  78           HE3      LYS  78  -2.900   9.174   1.527
  628    HZ1  LYS  78           HZ1      LYS  78  -3.906  10.819  -0.717
  629    HZ2  LYS  78           HZ2      LYS  78  -4.656  10.824   0.798
  630    HZ3  LYS  78           HZ3      LYS  78  -4.573   9.391  -0.104
  631    H    VAL  79           H        VAL  79  -5.169   9.094   4.650
  632    HA   VAL  79           HA       VAL  79  -5.090   8.222   7.426
  633    HB   VAL  79           HB       VAL  79  -7.280   8.243   6.466
  634   HG11  VAL  79          2HG1      VAL  79  -6.199   6.423   4.328
  635   HG12  VAL  79          1HG1      VAL  79  -6.695   8.103   4.124
  636   HG13  VAL  79          3HG1      VAL  79  -7.892   6.874   4.534
  637   HG21  VAL  79          3HG2      VAL  79  -7.982   5.925   6.795
  638   HG22  VAL  79          2HG2      VAL  79  -6.823   6.431   8.024
  639   HG23  VAL  79          1HG2      VAL  79  -6.302   5.401   6.690
  640    H    VAL  80           H        VAL  80  -3.959   6.523   8.157
  641    HA   VAL  80           HA       VAL  80  -2.354   5.064   6.155
  642    HB   VAL  80           HB       VAL  80  -1.488   6.053   8.881
  643   HG11  VAL  80          2HG1      VAL  80   0.728   5.204   8.289
  644   HG12  VAL  80          1HG1      VAL  80   0.064   4.525   6.802
  645   HG13  VAL  80          3HG1      VAL  80  -0.464   3.906   8.366
  646   HG21  VAL  80          3HG2      VAL  80  -0.576   6.872   6.126
  647   HG22  VAL  80          2HG2      VAL  80   0.034   7.498   7.658
  648   HG23  VAL  80          1HG2      VAL  80  -1.634   7.814   7.178
  649    H    LEU  81           H        LEU  81  -2.286   2.913   6.299
  650    HA   LEU  81           HA       LEU  81  -2.934   1.612   8.853
  651    HB2  LEU  81           HB2      LEU  81  -4.877   1.501   7.286
  652    HB3  LEU  81           HB3      LEU  81  -3.861   0.676   6.125
  653    HG   LEU  81           HG       LEU  81  -5.485  -0.730   7.524
  654   HD11  LEU  81          2HD1      LEU  81  -3.929  -2.601   7.674
  655   HD12  LEU  81          1HD1      LEU  81  -2.573  -1.493   7.466
  656   HD13  LEU  81          3HD1      LEU  81  -3.734  -1.719   6.158
  657   HD21  LEU  81          3HD2      LEU  81  -5.029   0.256   9.690
  658   HD22  LEU  81          2HD2      LEU  81  -3.345  -0.263   9.592
  659   HD23  LEU  81          1HD2      LEU  81  -4.633  -1.463   9.698
  660    H    GLU  82           H        GLU  82  -1.194   0.487   9.486
  661    HA   GLU  82           HA       GLU  82   0.721  -0.360   7.427
  662    HB2  GLU  82           HB2      GLU  82   1.155   0.179  10.360
  663    HB3  GLU  82           HB3      GLU  82   2.393  -0.383   9.248
  664    HG2  GLU  82           HG2      GLU  82   2.073   1.682   7.924
  665    HG3  GLU  82           HG3      GLU  82   0.944   2.248   9.155
  666    H    VAL  83           H        VAL  83   1.377  -2.388   7.239
  667    HA   VAL  83           HA       VAL  83   0.784  -4.359   9.321
  668    HB   VAL  83           HB       VAL  83   0.079  -6.018   7.575
  669   HG11  VAL  83          2HG1      VAL  83  -2.221  -5.238   7.372
  670   HG12  VAL  83          1HG1      VAL  83  -1.715  -3.607   7.809
  671   HG13  VAL  83          3HG1      VAL  83  -1.586  -4.913   8.986
  672   HG21  VAL  83          3HG2      VAL  83   1.021  -4.886   5.625
  673   HG22  VAL  83          2HG2      VAL  83  -0.152  -3.583   5.810
  674   HG23  VAL  83          1HG2      VAL  83  -0.699  -5.210   5.407
  675    HA   PRO  84           HA       PRO  84   4.804  -5.970   8.130
  676    HB2  PRO  84           HB2      PRO  84   4.348  -8.678   8.057
  677    HB3  PRO  84           HB3      PRO  84   4.627  -7.765   9.544
  678    HG2  PRO  84           HG2      PRO  84   2.056  -8.686   8.336
  679    HG3  PRO  84           HG3      PRO  84   2.550  -8.664  10.039
  680    HD2  PRO  84           HD2      PRO  84   0.896  -6.804   9.001
  681    HD3  PRO  84           HD3      PRO  84   2.063  -6.420  10.282
  682    H    VAL  85           H        VAL  85   5.897  -6.631   6.274
  683    HA   VAL  85           HA       VAL  85   4.564  -6.184   3.855
  684    HB   VAL  85           HB       VAL  85   6.977  -5.792   4.196
  685   HG11  VAL  85          2HG1      VAL  85   8.555  -7.674   3.983
  686   HG12  VAL  85          1HG1      VAL  85   7.195  -8.792   4.084
  687   HG13  VAL  85          3HG1      VAL  85   7.583  -7.749   5.452
  688   HG21  VAL  85          3HG2      VAL  85   7.742  -6.594   1.993
  689   HG22  VAL  85          2HG2      VAL  85   6.142  -5.855   1.938
  690   HG23  VAL  85          1HG2      VAL  85   6.304  -7.610   1.889
  691    H    SER  86           H        SER  86   5.271  -9.168   5.533
  692    HA   SER  86           HA       SER  86   4.707 -10.891   3.339
  693    HB2  SER  86           HB2      SER  86   4.792 -11.510   6.298
  694    HB3  SER  86           HB3      SER  86   4.883 -12.684   4.984
  695    HG   SER  86           HG       SER  86   6.937 -11.830   6.026
  696    H    ALA  87           H        ALA  87   2.707  -9.154   5.485
  697    HA   ALA  87           HA       ALA  87   0.640 -11.007   5.926
  698    HB1  ALA  87           HB1      ALA  87   0.432  -8.005   5.925
  699    HB2  ALA  87           HB2      ALA  87  -0.686  -9.139   6.684
  700    HB3  ALA  87           HB3      ALA  87   0.966  -8.995   7.283
  701    HA   PRO  88           HA       PRO  88  -1.909  -8.781   2.435
  702    HB2  PRO  88           HB2      PRO  88   0.190  -7.705   0.656
  703    HB3  PRO  88           HB3      PRO  88  -1.317  -6.962   1.201
  704    HG2  PRO  88           HG2      PRO  88   1.029  -6.143   2.158
  705    HG3  PRO  88           HG3      PRO  88  -0.397  -6.255   3.207
  706    HD2  PRO  88           HD2      PRO  88   1.914  -8.147   2.946
  707    HD3  PRO  88           HD3      PRO  88   1.099  -7.564   4.412
  708    H    ILE  89           H        ILE  89   0.901 -10.666   2.031
  709    HA   ILE  89           HA       ILE  89   0.483 -11.609  -0.597
  710    HB   ILE  89           HB       ILE  89   1.775 -13.020   1.747
  711   HG12  ILE  89          2HG1      ILE  89   2.951 -11.392  -0.519
  712   HG13  ILE  89          3HG1      ILE  89   2.851 -10.891   1.166
  713   HG21  ILE  89          2HG2      ILE  89   2.867 -14.418   0.044
  714   HG22  ILE  89          1HG2      ILE  89   1.907 -13.627  -1.206
  715   HG23  ILE  89          3HG2      ILE  89   1.114 -14.609   0.026
  716   HD11  ILE  89          3HD1      ILE  89   4.461 -13.199   0.098
  717   HD12  ILE  89          2HD1      ILE  89   4.366 -12.700   1.788
  718   HD13  ILE  89          1HD1      ILE  89   5.089 -11.625   0.590
  719    H    LYS  90           H        LYS  90  -0.671 -12.706   2.561
  720    HA   LYS  90           HA       LYS  90  -2.491 -14.561   1.217
  721    HB2  LYS  90           HB2      LYS  90  -2.977 -15.057   3.813
  722    HB3  LYS  90           HB3      LYS  90  -1.710 -15.852   2.894
  723    HG2  LYS  90           HG2      LYS  90  -0.121 -14.113   3.738
  724    HG3  LYS  90           HG3      LYS  90  -1.415 -13.537   4.793
  725    HD2  LYS  90           HD2      LYS  90  -0.568 -16.416   4.793
  726    HD3  LYS  90           HD3      LYS  90   0.303 -15.211   5.740
  727    HE2  LYS  90           HE2      LYS  90  -2.662 -15.718   5.950
  728    HE3  LYS  90           HE3      LYS  90  -1.456 -16.448   7.010
  729    HZ1  LYS  90           HZ1      LYS  90  -0.748 -14.067   7.485
  730    HZ2  LYS  90           HZ2      LYS  90  -2.211 -14.584   8.162
  731    HZ3  LYS  90           HZ3      LYS  90  -2.221 -13.596   6.781
  732    H    ASP  91           H        ASP  91  -2.561 -11.923   3.599
  733    HA   ASP  91           HA       ASP  91  -5.474 -11.932   3.618
  734    HB2  ASP  91           HB2      ASP  91  -3.534 -10.114   5.061
  735    HB3  ASP  91           HB3      ASP  91  -5.259 -10.236   5.368
  736    H    ALA  92           H        ALA  92  -4.456 -11.227   1.092
  737    HA   ALA  92           HA       ALA  92  -3.732  -8.591   0.661
  738    HB1  ALA  92           HB1      ALA  92  -4.313  -8.942  -1.658
  739    HB2  ALA  92           HB2      ALA  92  -3.565 -10.400  -1.004
  740    HB3  ALA  92           HB3      ALA  92  -5.312 -10.330  -1.227
  741    H    GLU  93           H        GLU  93  -7.037  -9.950   0.397
  742    HA   GLU  93           HA       GLU  93  -8.151  -7.347  -0.120
  743    HB2  GLU  93           HB2      GLU  93  -9.741  -9.767   0.704
  744    HB3  GLU  93           HB3      GLU  93 -10.255  -8.410  -0.286
  745    HG2  GLU  93           HG2      GLU  93  -9.941  -9.877  -1.956
  746    HG3  GLU  93           HG3      GLU  93  -8.267  -9.343  -1.817
  747    H    LYS  94           H        LYS  94  -7.446  -9.231   2.652
  748    HA   LYS  94           HA       LYS  94  -9.322  -8.003   4.430
  749    HB2  LYS  94           HB2      LYS  94  -8.324 -10.242   4.824
  750    HB3  LYS  94           HB3      LYS  94  -6.755  -9.483   5.045
  751    HG2  LYS  94           HG2      LYS  94  -7.542  -8.334   7.011
  752    HG3  LYS  94           HG3      LYS  94  -9.172  -8.970   6.763
  753    HD2  LYS  94           HD2      LYS  94  -8.304 -11.253   7.027
  754    HD3  LYS  94           HD3      LYS  94  -6.690 -10.597   7.313
  755    HE2  LYS  94           HE2      LYS  94  -9.111  -9.970   8.988
  756    HE3  LYS  94           HE3      LYS  94  -7.921 -11.208   9.384
  757    HZ1  LYS  94           HZ1      LYS  94  -7.507  -9.121  10.544
  758    HZ2  LYS  94           HZ2      LYS  94  -7.337  -8.310   9.066
  759    HZ3  LYS  94           HZ3      LYS  94  -6.224  -9.512   9.507
  760    H    VAL  95           H        VAL  95  -5.942  -7.537   3.589
  761    HA   VAL  95           HA       VAL  95  -5.312  -5.450   5.352
  762    HB   VAL  95           HB       VAL  95  -4.293  -6.012   2.559
  763   HG11  VAL  95          2HG1      VAL  95  -3.833  -3.695   3.190
  764   HG12  VAL  95          1HG1      VAL  95  -2.358  -4.661   3.135
  765   HG13  VAL  95          3HG1      VAL  95  -3.087  -4.254   4.690
  766   HG21  VAL  95          3HG2      VAL  95  -3.925  -7.837   4.114
  767   HG22  VAL  95          2HG2      VAL  95  -3.197  -6.725   5.274
  768   HG23  VAL  95          1HG2      VAL  95  -2.399  -7.036   3.734
  769    H    ILE  96           H        ILE  96  -6.822  -5.437   2.163
  770    HA   ILE  96           HA       ILE  96  -7.057  -2.664   1.806
  771    HB   ILE  96           HB       ILE  96  -8.946  -4.836   0.875
  772   HG12  ILE  96          2HG1      ILE  96  -6.620  -3.546  -0.564
  773   HG13  ILE  96          3HG1      ILE  96  -6.573  -5.139   0.187
  774   HG21  ILE  96          2HG2      ILE  96  -9.637  -3.251  -0.842
  775   HG22  ILE  96          1HG2      ILE  96  -8.558  -2.030  -0.168
  776   HG23  ILE  96          3HG2      ILE  96  -9.941  -2.599   0.768
  777   HD11  ILE  96          3HD1      ILE  96  -8.323  -5.897  -1.339
  778   HD12  ILE  96          2HD1      ILE  96  -6.897  -5.319  -2.200
  779   HD13  ILE  96          1HD1      ILE  96  -8.338  -4.307  -2.102
  780    H    ASN  97           H        ASN  97  -9.307  -5.018   3.242
  781    HA   ASN  97           HA       ASN  97 -11.322  -3.187   3.925
  782    HB2  ASN  97           HB2      ASN  97 -10.595  -5.932   4.864
  783    HB3  ASN  97           HB3      ASN  97 -11.789  -5.010   5.772
  784   HD21  ASN  97          1HD2      ASN  97 -11.069  -6.606   2.768
  785   HD22  ASN  97          2HD2      ASN  97 -12.693  -6.614   2.157
  786    H    ALA  98           H        ALA  98  -8.426  -4.221   5.627
  787    HA   ALA  98           HA       ALA  98  -8.945  -3.051   8.117
  788    HB1  ALA  98           HB1      ALA  98  -6.529  -3.126   8.469
  789    HB2  ALA  98           HB2      ALA  98  -7.114  -4.624   7.743
  790    HB3  ALA  98           HB3      ALA  98  -6.283  -3.428   6.749
  791    H    ALA  99           H        ALA  99  -7.475  -1.715   5.188
  792    HA   ALA  99           HA       ALA  99  -6.786   0.802   6.258
  793    HB1  ALA  99           HB1      ALA  99  -6.597   1.542   3.947
  794    HB2  ALA  99           HB2      ALA  99  -5.876  -0.055   4.147
  795    HB3  ALA  99           HB3      ALA  99  -7.464   0.108   3.399
  796    H    LEU 100           H        LEU 100  -9.660  -0.263   4.442
  797    HA   LEU 100           HA       LEU 100 -11.048   2.179   4.565
  798    HB2  LEU 100           HB2      LEU 100 -11.872  -0.671   4.164
  799    HB3  LEU 100           HB3      LEU 100 -13.094   0.570   4.351
  800    HG   LEU 100           HG       LEU 100 -12.671   0.054   2.001
  801   HD11  LEU 100          2HD1      LEU 100 -12.323   2.341   1.205
  802   HD12  LEU 100          1HD1      LEU 100 -11.749   2.804   2.806
  803   HD13  LEU 100          3HD1      LEU 100 -13.420   2.286   2.584
  804   HD21  LEU 100          3HD2      LEU 100  -9.890   1.100   2.481
  805   HD22  LEU 100          2HD2      LEU 100 -10.580   0.641   0.923
  806   HD23  LEU 100          1HD2      LEU 100 -10.316  -0.583   2.167
  807    H    ALA 101           H        ALA 101 -10.630  -0.377   6.869
  808    HA   ALA 101           HA       ALA 101 -12.777   0.238   8.596
  809    HB1  ALA 101           HB1      ALA 101 -11.660  -1.148  10.222
  810    HB2  ALA 101           HB2      ALA 101 -11.546  -1.900   8.631
  811    HB3  ALA 101           HB3      ALA 101 -10.153  -1.057   9.310
  812    H    LEU 102           H        LEU 102  -9.834   1.863   8.001
  813    HA   LEU 102           HA       LEU 102  -9.681   3.115  10.605
  814    HB2  LEU 102           HB2      LEU 102  -8.061   3.114   8.134
  815    HB3  LEU 102           HB3      LEU 102  -8.007   4.586   9.082
  816    HG   LEU 102           HG       LEU 102  -6.154   3.070   9.630
  817   HD11  LEU 102          2HD1      LEU 102  -6.982   4.595  11.336
  818   HD12  LEU 102          1HD1      LEU 102  -6.429   3.083  12.057
  819   HD13  LEU 102          3HD1      LEU 102  -8.155   3.388  11.862
  820   HD21  LEU 102          3HD2      LEU 102  -6.589   0.976  10.820
  821   HD22  LEU 102          2HD2      LEU 102  -7.240   0.942   9.181
  822   HD23  LEU 102          1HD2      LEU 102  -8.321   1.188  10.553
  823    H    ILE 103           H        ILE 103 -11.533   3.625   7.844
  824    HA   ILE 103           HA       ILE 103 -12.008   6.407   8.686
  825    HB   ILE 103           HB       ILE 103 -12.778   6.879   6.347
  826   HG12  ILE 103          2HG1      ILE 103 -11.357   4.278   5.726
  827   HG13  ILE 103          3HG1      ILE 103 -13.099   4.528   5.640
  828   HG21  ILE 103          2HG2      ILE 103 -10.510   7.172   5.451
  829   HG22  ILE 103          1HG2      ILE 103  -9.885   6.119   6.722
  830   HG23  ILE 103          3HG2      ILE 103 -10.631   7.661   7.142
  831   HD11  ILE 103          3HD1      ILE 103 -12.765   6.188   3.879
  832   HD12  ILE 103          2HD1      ILE 103 -12.095   4.618   3.439
  833   HD13  ILE 103          1HD1      ILE 103 -11.024   5.918   3.961
  834    H    ASP 104           H        ASP 104 -13.437   3.383   7.636
  835    HA   ASP 104           HA       ASP 104 -16.026   4.305   8.663
  836    HB2  ASP 104           HB2      ASP 104 -15.528   3.119   5.941
  837    HB3  ASP 104           HB3      ASP 104 -17.101   3.023   6.718
  838    H    GLU 105           H        GLU 105 -14.183   1.590   7.382
  839    HA   GLU 105           HA       GLU 105 -13.996  -0.583   7.931
  840    HB2  GLU 105           HB2      GLU 105 -14.204  -1.254  10.070
  841    HB3  GLU 105           HB3      GLU 105 -14.498   0.445  10.388
  842    HG2  GLU 105           HG2      GLU 105 -16.883   0.069  10.403
  843    HG3  GLU 105           HG3      GLU 105 -16.643  -1.622   9.958
  844    H    LYS 106           H        LYS 106 -16.672   0.989   7.005
  845    HA   LYS 106           HA       LYS 106 -17.724  -1.428   5.800
  846    HB2  LYS 106           HB2      LYS 106 -19.119  -1.084   7.818
  847    HB3  LYS 106           HB3      LYS 106 -19.503   0.538   7.257
  848    HG2  LYS 106           HG2      LYS 106 -20.525  -0.465   5.226
  849    HG3  LYS 106           HG3      LYS 106 -20.249  -2.058   5.935
  850    HD2  LYS 106           HD2      LYS 106 -21.619  -1.391   7.877
  851    HD3  LYS 106           HD3      LYS 106 -21.956   0.148   7.081
  852    HE2  LYS 106           HE2      LYS 106 -22.954  -1.094   5.190
  853    HE3  LYS 106           HE3      LYS 106 -22.687  -2.599   6.070
  854    HZ1  LYS 106           HZ1      LYS 106 -24.097  -1.683   7.867
  855    HZ2  LYS 106           HZ2      LYS 106 -24.928  -1.903   6.405
  856    HZ3  LYS 106           HZ3      LYS 106 -24.449  -0.349   6.876
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1 -16.100  -1.499  -4.802
    2    H2   MET   1           H2       MET   1 -17.754  -1.315  -5.085
    3    H3   MET   1           H3       MET   1 -16.876  -0.062  -4.352
    4    HA   MET   1           HA       MET   1 -16.621  -1.035  -7.132
    5    HB2  MET   1           HB2      MET   1 -17.655   1.515  -5.899
    6    HB3  MET   1           HB3      MET   1 -17.136   1.442  -7.578
    7    HG2  MET   1           HG2      MET   1 -19.281  -0.287  -6.370
    8    HG3  MET   1           HG3      MET   1 -19.570   1.189  -7.288
    9    HE1  MET   1           HE1      MET   1 -20.693  -1.712  -9.710
   10    HE2  MET   1           HE2      MET   1 -20.842  -1.678  -7.953
   11    HE3  MET   1           HE3      MET   1 -21.196  -0.231  -8.896
   12    H    LYS   2           H        LYS   2 -15.333   0.887  -8.329
   13    HA   LYS   2           HA       LYS   2 -12.680   0.369  -7.556
   14    HB2  LYS   2           HB2      LYS   2 -13.660   2.498  -9.458
   15    HB3  LYS   2           HB3      LYS   2 -12.029   1.848  -9.373
   16    HG2  LYS   2           HG2      LYS   2 -12.955  -0.375  -9.993
   17    HG3  LYS   2           HG3      LYS   2 -14.522   0.401 -10.230
   18    HD2  LYS   2           HD2      LYS   2 -11.966   1.032 -11.704
   19    HD3  LYS   2           HD3      LYS   2 -13.365   0.176 -12.354
   20    HE2  LYS   2           HE2      LYS   2 -13.307   3.043 -11.415
   21    HE3  LYS   2           HE3      LYS   2 -13.333   2.500 -13.092
   22    HZ1  LYS   2           HZ1      LYS   2 -15.529   3.104 -12.482
   23    HZ2  LYS   2           HZ2      LYS   2 -15.477   2.187 -11.066
   24    HZ3  LYS   2           HZ3      LYS   2 -15.498   1.410 -12.573
   25    H    ARG   3           H        ARG   3 -11.851   1.156  -5.722
   26    HA   ARG   3           HA       ARG   3 -12.203   4.011  -5.142
   27    HB2  ARG   3           HB2      ARG   3 -12.512   1.991  -3.444
   28    HB3  ARG   3           HB3      ARG   3 -10.769   2.164  -3.288
   29    HG2  ARG   3           HG2      ARG   3 -11.807   3.454  -1.575
   30    HG3  ARG   3           HG3      ARG   3 -11.118   4.567  -2.764
   31    HD2  ARG   3           HD2      ARG   3 -13.392   4.649  -3.836
   32    HD3  ARG   3           HD3      ARG   3 -14.002   3.769  -2.436
   33    HE   ARG   3           HE       ARG   3 -12.722   6.425  -2.269
   34   HH11  ARG   3          2HH1      ARG   3 -15.142   4.102  -1.262
   35   HH12  ARG   3          1HH1      ARG   3 -15.907   5.190  -0.142
   36   HH21  ARG   3          2HH2      ARG   3 -13.703   7.855  -0.814
   37   HH22  ARG   3          1HH2      ARG   3 -15.081   7.342   0.126
   38    H    LYS   4           H        LYS   4 -10.200   5.110  -4.257
   39    HA   LYS   4           HA       LYS   4  -7.913   4.444  -5.971
   40    HB2  LYS   4           HB2      LYS   4  -8.189   6.935  -4.312
   41    HB3  LYS   4           HB3      LYS   4  -7.228   6.688  -5.759
   42    HG2  LYS   4           HG2      LYS   4 -10.230   6.787  -5.674
   43    HG3  LYS   4           HG3      LYS   4  -9.183   8.129  -6.128
   44    HD2  LYS   4           HD2      LYS   4  -8.310   6.747  -7.996
   45    HD3  LYS   4           HD3      LYS   4  -9.467   5.486  -7.559
   46    HE2  LYS   4           HE2      LYS   4 -11.300   7.108  -7.891
   47    HE3  LYS   4           HE3      LYS   4 -10.119   8.302  -8.418
   48    HZ1  LYS   4           HZ1      LYS   4  -9.497   6.710 -10.212
   49    HZ2  LYS   4           HZ2      LYS   4 -11.072   7.327 -10.332
   50    HZ3  LYS   4           HZ3      LYS   4 -10.825   5.754  -9.756
   51    H    ILE   5           H        ILE   5  -6.432   3.161  -4.999
   52    HA   ILE   5           HA       ILE   5  -5.868   3.667  -2.144
   53    HB   ILE   5           HB       ILE   5  -5.693   1.010  -3.583
   54   HG12  ILE   5          2HG1      ILE   5  -7.633   1.989  -1.472
   55   HG13  ILE   5          3HG1      ILE   5  -8.015   1.682  -3.162
   56   HG21  ILE   5          2HG2      ILE   5  -3.984   1.209  -1.876
   57   HG22  ILE   5          1HG2      ILE   5  -5.234   0.084  -1.346
   58   HG23  ILE   5          3HG2      ILE   5  -5.188   1.723  -0.695
   59   HD11  ILE   5          3HD1      ILE   5  -7.135  -0.386  -1.153
   60   HD12  ILE   5          2HD1      ILE   5  -7.543  -0.688  -2.842
   61   HD13  ILE   5          1HD1      ILE   5  -8.784  -0.125  -1.723
   62    H    ILE   6           H        ILE   6  -3.847   4.290  -1.700
   63    HA   ILE   6           HA       ILE   6  -1.723   3.478  -3.567
   64    HB   ILE   6           HB       ILE   6  -0.322   5.294  -2.694
   65   HG12  ILE   6          2HG1      ILE   6  -1.573   5.461  -0.463
   66   HG13  ILE   6          3HG1      ILE   6  -1.052   6.970  -1.199
   67   HG21  ILE   6          2HG2      ILE   6  -2.976   6.194  -3.790
   68   HG22  ILE   6          1HG2      ILE   6  -1.578   5.653  -4.718
   69   HG23  ILE   6          3HG2      ILE   6  -1.496   7.152  -3.794
   70   HD11  ILE   6          3HD1      ILE   6  -3.840   5.834  -1.303
   71   HD12  ILE   6          2HD1      ILE   6  -3.314   7.362  -2.010
   72   HD13  ILE   6          1HD1      ILE   6  -3.285   7.144  -0.260
   73    H    ALA   7           H        ALA   7  -0.057   2.274  -2.810
   74    HA   ALA   7           HA       ALA   7   0.007   1.698   0.064
   75    HB1  ALA   7           HB1      ALA   7  -1.459   0.024  -0.935
   76    HB2  ALA   7           HB2      ALA   7  -0.190  -0.419  -2.076
   77    HB3  ALA   7           HB3      ALA   7   0.034  -0.709  -0.350
   78    H    VAL   8           H        VAL   8   1.974   0.997   0.851
   79    HA   VAL   8           HA       VAL   8   4.189   0.970  -1.092
   80    HB   VAL   8           HB       VAL   8   4.300   2.016   1.744
   81   HG11  VAL   8          2HG1      VAL   8   6.583   2.707   1.165
   82   HG12  VAL   8          1HG1      VAL   8   6.418   1.915  -0.402
   83   HG13  VAL   8          3HG1      VAL   8   6.386   0.957   1.079
   84   HG21  VAL   8          3HG2      VAL   8   4.671   4.205   0.714
   85   HG22  VAL   8          2HG2      VAL   8   3.109   3.534   0.245
   86   HG23  VAL   8          1HG2      VAL   8   4.462   3.489  -0.885
   87    H    THR   9           H        THR   9   5.250  -0.857  -1.169
   88    HA   THR   9           HA       THR   9   5.137  -2.686   1.135
   89    HB   THR   9           HB       THR   9   5.861  -4.422  -0.586
   90    HG1  THR   9           HG1      THR   9   6.175  -2.371  -2.110
   91   HG21  THR   9          3HG2      THR   9   3.595  -4.749  -1.430
   92   HG22  THR   9          1HG2      THR   9   3.179  -3.092  -0.992
   93   HG23  THR   9          2HG2      THR   9   3.561  -4.268   0.265
   94    H    ALA  10           H        ALA  10   6.976  -3.125   2.197
   95    HA   ALA  10           HA       ALA  10   9.563  -2.722   0.921
   96    HB1  ALA  10           HB1      ALA  10  10.358  -1.159   2.607
   97    HB2  ALA  10           HB2      ALA  10   8.968  -0.491   1.752
   98    HB3  ALA  10           HB3      ALA  10   8.769  -1.156   3.373
   99    H    CYS  11           H        CYS  11  11.259  -3.771   1.982
  100    HA   CYS  11           HA       CYS  11  10.889  -4.883   4.611
  101    HB2  CYS  11           HB2      CYS  11   9.756  -6.519   3.047
  102    HB3  CYS  11           HB3      CYS  11  11.333  -6.804   2.316
  103    HG   CYS  11           HG       CYS  11  11.693  -7.169   5.532
  104    H    ALA  12           H        ALA  12  12.845  -5.465   5.573
  105    HA   ALA  12           HA       ALA  12  15.197  -4.534   4.074
  106    HB1  ALA  12           HB1      ALA  12  14.779  -4.824   7.047
  107    HB2  ALA  12           HB2      ALA  12  16.245  -4.223   6.271
  108    HB3  ALA  12           HB3      ALA  12  14.738  -3.320   6.127
  109    H    THR  13           H        THR  13  14.096  -7.163   6.201
  110    HA   THR  13           HA       THR  13  16.562  -8.623   5.668
  111    HB   THR  13           HB       THR  13  14.231  -9.531   7.358
  112    HG1  THR  13           HG1      THR  13  14.833  -7.896   8.585
  113   HG21  THR  13          3HG2      THR  13  15.890 -10.957   8.427
  114   HG22  THR  13          1HG2      THR  13  17.153 -10.302   7.384
  115   HG23  THR  13          2HG2      THR  13  15.851 -11.269   6.691
  116    H    GLY  14           H        GLY  14  13.078  -9.472   5.552
  117    HA2  GLY  14           HA1      GLY  14  13.605 -11.591   3.648
  118    HA3  GLY  14           HA2      GLY  14  12.034 -11.113   4.278
  119    H    VAL  15           H        VAL  15  14.608  -9.957   2.137
  120    HA   VAL  15           HA       VAL  15  13.342  -7.828   0.952
  121    HB   VAL  15           HB       VAL  15  15.249  -9.726  -0.422
  122   HG11  VAL  15          2HG1      VAL  15  14.170  -8.157  -1.955
  123   HG12  VAL  15          1HG1      VAL  15  15.888  -7.801  -1.767
  124   HG13  VAL  15          3HG1      VAL  15  14.686  -6.809  -0.941
  125   HG21  VAL  15          3HG2      VAL  15  16.145  -8.991   1.716
  126   HG22  VAL  15          2HG2      VAL  15  15.827  -7.310   1.290
  127   HG23  VAL  15          1HG2      VAL  15  17.021  -8.239   0.384
  128    H    ALA  16           H        ALA  16  13.021 -11.242   0.104
  129    HA   ALA  16           HA       ALA  16  11.779 -10.923  -2.398
  130    HB1  ALA  16           HB1      ALA  16  11.475 -13.168  -0.413
  131    HB2  ALA  16           HB2      ALA  16  11.029 -13.232  -2.119
  132    HB3  ALA  16           HB3      ALA  16  12.719 -13.037  -1.655
  133    H    HIS  17           H        HIS  17  10.540 -10.527   0.803
  134    HA   HIS  17           HA       HIS  17   7.796 -11.045   0.266
  135    HB2  HIS  17           HB2      HIS  17   9.098  -9.387   2.438
  136    HB3  HIS  17           HB3      HIS  17   7.379  -9.754   2.378
  137    HD1  HIS  17           HD1      HIS  17   7.604 -11.005   4.678
  138    HD2  HIS  17           HD2      HIS  17   9.814 -12.662   1.567
  139    HE1  HIS  17           HE1      HIS  17   8.320 -13.272   5.487
  140    HE2  HIS  17           HE2      HIS  17   9.834 -14.157   3.679
  141    H    THR  18           H        THR  18   9.844  -8.232   0.002
  142    HA   THR  18           HA       THR  18   7.958  -6.201  -0.232
  143    HB   THR  18           HB       THR  18  10.537  -6.359  -1.798
  144    HG1  THR  18           HG1      THR  18  11.502  -6.429   0.068
  145   HG21  THR  18          3HG2      THR  18  10.568  -3.930  -1.493
  146   HG22  THR  18          1HG2      THR  18   9.036  -4.017  -0.622
  147   HG23  THR  18          2HG2      THR  18   9.106  -4.450  -2.331
  148    H    TYR  19           H        TYR  19   9.358  -8.309  -2.718
  149    HA   TYR  19           HA       TYR  19   7.999  -6.902  -4.835
  150    HB2  TYR  19           HB2      TYR  19   9.635  -9.443  -4.947
  151    HB3  TYR  19           HB3      TYR  19   9.160  -8.446  -6.321
  152    HD1  TYR  19           HD2      TYR  19  10.033  -6.054  -6.421
  153    HD2  TYR  19           HD1      TYR  19  11.610  -8.975  -3.760
  154    HE1  TYR  19           HE2      TYR  19  12.061  -4.695  -6.135
  155    HE2  TYR  19           HE1      TYR  19  13.639  -7.618  -3.465
  156    HH   TYR  19           HH       TYR  19  14.883  -5.880  -4.625
  157    H    MET  20           H        MET  20   7.397  -9.637  -2.845
  158    HA   MET  20           HA       MET  20   5.463 -10.819  -4.622
  159    HB2  MET  20           HB2      MET  20   6.702 -12.206  -3.005
  160    HB3  MET  20           HB3      MET  20   5.935 -11.333  -1.683
  161    HG2  MET  20           HG2      MET  20   4.816 -13.428  -2.002
  162    HG3  MET  20           HG3      MET  20   3.735 -12.113  -2.482
  163    HE1  MET  20           HE1      MET  20   2.754 -14.983  -4.958
  164    HE2  MET  20           HE2      MET  20   3.208 -15.130  -3.262
  165    HE3  MET  20           HE3      MET  20   2.160 -13.811  -3.781
  166    H    ALA  21           H        ALA  21   5.366  -8.931  -1.616
  167    HA   ALA  21           HA       ALA  21   2.586  -8.982  -1.265
  168    HB1  ALA  21           HB1      ALA  21   4.148  -8.364   0.508
  169    HB2  ALA  21           HB2      ALA  21   4.541  -6.877  -0.352
  170    HB3  ALA  21           HB3      ALA  21   2.914  -7.124   0.280
  171    H    ALA  22           H        ALA  22   4.647  -6.794  -3.089
  172    HA   ALA  22           HA       ALA  22   2.847  -4.743  -3.607
  173    HB1  ALA  22           HB1      ALA  22   4.965  -5.798  -5.476
  174    HB2  ALA  22           HB2      ALA  22   4.227  -4.197  -5.524
  175    HB3  ALA  22           HB3      ALA  22   5.247  -4.658  -4.160
  176    H    GLN  23           H        GLN  23   3.386  -7.759  -5.406
  177    HA   GLN  23           HA       GLN  23   1.360  -7.096  -7.348
  178    HB2  GLN  23           HB2      GLN  23   2.884  -9.664  -6.901
  179    HB3  GLN  23           HB3      GLN  23   1.829  -9.336  -8.268
  180    HG2  GLN  23           HG2      GLN  23   4.345  -7.827  -7.591
  181    HG3  GLN  23           HG3      GLN  23   4.191  -9.067  -8.832
  182   HE21  GLN  23          1HE2      GLN  23   4.730  -7.765 -10.524
  183   HE22  GLN  23          2HE2      GLN  23   3.738  -6.463 -11.088
  184    H    ALA  24           H        ALA  24   1.600  -9.073  -4.463
  185    HA   ALA  24           HA       ALA  24  -0.807 -10.506  -4.766
  186    HB1  ALA  24           HB1      ALA  24   0.522  -9.633  -2.203
  187    HB2  ALA  24           HB2      ALA  24  -0.677 -10.914  -2.374
  188    HB3  ALA  24           HB3      ALA  24   0.915 -11.091  -3.112
  189    H    LEU  25           H        LEU  25  -0.071  -7.412  -3.200
  190    HA   LEU  25           HA       LEU  25  -2.673  -6.763  -2.385
  191    HB2  LEU  25           HB2      LEU  25  -0.327  -5.050  -3.167
  192    HB3  LEU  25           HB3      LEU  25  -1.847  -4.351  -2.642
  193    HG   LEU  25           HG       LEU  25  -0.108  -6.195  -1.001
  194   HD11  LEU  25          2HD1      LEU  25   0.350  -4.222   0.347
  195   HD12  LEU  25          1HD1      LEU  25  -0.623  -3.236  -0.743
  196   HD13  LEU  25          3HD1      LEU  25   0.871  -3.973  -1.320
  197   HD21  LEU  25          3HD2      LEU  25  -1.635  -5.643   0.825
  198   HD22  LEU  25          2HD2      LEU  25  -2.480  -6.454  -0.493
  199   HD23  LEU  25          1HD2      LEU  25  -2.634  -4.709  -0.289
  200    H    LYS  26           H        LYS  26  -1.038  -6.285  -5.483
  201    HA   LYS  26           HA       LYS  26  -3.048  -4.770  -6.730
  202    HB2  LYS  26           HB2      LYS  26  -1.017  -6.675  -7.888
  203    HB3  LYS  26           HB3      LYS  26  -2.097  -5.707  -8.877
  204    HG2  LYS  26           HG2      LYS  26  -0.967  -3.853  -7.190
  205    HG3  LYS  26           HG3      LYS  26   0.359  -4.970  -7.527
  206    HD2  LYS  26           HD2      LYS  26  -0.205  -4.752  -9.964
  207    HD3  LYS  26           HD3      LYS  26  -1.326  -3.464  -9.522
  208    HE2  LYS  26           HE2      LYS  26   0.679  -2.400 -10.176
  209    HE3  LYS  26           HE3      LYS  26   0.626  -2.314  -8.415
  210    HZ1  LYS  26           HZ1      LYS  26   2.193  -4.254 -10.032
  211    HZ2  LYS  26           HZ2      LYS  26   2.115  -4.240  -8.340
  212    HZ3  LYS  26           HZ3      LYS  26   2.818  -2.937  -9.162
  213    H    LYS  27           H        LYS  27  -2.487  -8.275  -6.688
  214    HA   LYS  27           HA       LYS  27  -4.621  -8.988  -8.355
  215    HB2  LYS  27           HB2      LYS  27  -2.641 -10.340  -6.911
  216    HB3  LYS  27           HB3      LYS  27  -4.161 -10.959  -6.278
  217    HG2  LYS  27           HG2      LYS  27  -3.419 -12.352  -8.094
  218    HG3  LYS  27           HG3      LYS  27  -4.873 -11.479  -8.585
  219    HD2  LYS  27           HD2      LYS  27  -3.406  -9.796  -9.694
  220    HD3  LYS  27           HD3      LYS  27  -2.022 -10.824  -9.318
  221    HE2  LYS  27           HE2      LYS  27  -4.401 -11.613 -10.992
  222    HE3  LYS  27           HE3      LYS  27  -2.821 -11.147 -11.615
  223    HZ1  LYS  27           HZ1      LYS  27  -1.857 -13.060 -10.471
  224    HZ2  LYS  27           HZ2      LYS  27  -3.056 -13.533 -11.571
  225    HZ3  LYS  27           HZ3      LYS  27  -3.392 -13.512  -9.911
  226    H    GLY  28           H        GLY  28  -4.451  -8.637  -4.830
  227    HA2  GLY  28           HA1      GLY  28  -7.122  -9.402  -4.299
  228    HA3  GLY  28           HA2      GLY  28  -6.102  -8.427  -3.247
  229    H    ALA  29           H        ALA  29  -5.649  -6.246  -4.939
  230    HA   ALA  29           HA       ALA  29  -7.958  -4.707  -4.442
  231    HB1  ALA  29           HB1      ALA  29  -6.815  -2.920  -5.645
  232    HB2  ALA  29           HB2      ALA  29  -5.714  -3.737  -4.536
  233    HB3  ALA  29           HB3      ALA  29  -5.639  -4.077  -6.263
  234    H    LYS  30           H        LYS  30  -6.660  -6.148  -7.402
  235    HA   LYS  30           HA       LYS  30  -8.710  -5.117  -9.086
  236    HB2  LYS  30           HB2      LYS  30  -6.558  -7.158  -9.378
  237    HB3  LYS  30           HB3      LYS  30  -7.866  -7.152 -10.554
  238    HG2  LYS  30           HG2      LYS  30  -5.946  -5.864 -11.328
  239    HG3  LYS  30           HG3      LYS  30  -7.371  -4.846 -11.133
  240    HD2  LYS  30           HD2      LYS  30  -6.505  -4.098  -8.950
  241    HD3  LYS  30           HD3      LYS  30  -5.061  -5.079  -9.204
  242    HE2  LYS  30           HE2      LYS  30  -4.583  -2.789  -9.777
  243    HE3  LYS  30           HE3      LYS  30  -4.572  -3.772 -11.239
  244    HZ1  LYS  30           HZ1      LYS  30  -6.811  -2.996 -11.733
  245    HZ2  LYS  30           HZ2      LYS  30  -5.729  -1.697 -11.603
  246    HZ3  LYS  30           HZ3      LYS  30  -6.805  -2.032 -10.336
  247    H    LYS  31           H        LYS  31  -8.396  -7.981  -7.115
  248    HA   LYS  31           HA       LYS  31 -10.578  -9.438  -8.144
  249    HB2  LYS  31           HB2      LYS  31  -8.904 -10.398  -6.611
  250    HB3  LYS  31           HB3      LYS  31  -9.501  -9.365  -5.318
  251    HG2  LYS  31           HG2      LYS  31 -10.351 -11.624  -5.089
  252    HG3  LYS  31           HG3      LYS  31 -11.665 -10.491  -5.409
  253    HD2  LYS  31           HD2      LYS  31 -11.919 -12.560  -6.700
  254    HD3  LYS  31           HD3      LYS  31 -11.694 -11.161  -7.751
  255    HE2  LYS  31           HE2      LYS  31  -9.336 -11.737  -8.018
  256    HE3  LYS  31           HE3      LYS  31  -9.548 -13.121  -6.946
  257    HZ1  LYS  31           HZ1      LYS  31 -11.038 -14.118  -8.519
  258    HZ2  LYS  31           HZ2      LYS  31  -9.593 -13.716  -9.311
  259    HZ3  LYS  31           HZ3      LYS  31 -10.974 -12.752  -9.524
  260    H    MET  32           H        MET  32 -10.334  -7.029  -5.564
  261    HA   MET  32           HA       MET  32 -13.128  -7.033  -4.961
  262    HB2  MET  32           HB2      MET  32 -11.066  -4.890  -4.409
  263    HB3  MET  32           HB3      MET  32 -12.643  -5.024  -3.653
  264    HG2  MET  32           HG2      MET  32 -10.485  -7.104  -3.389
  265    HG3  MET  32           HG3      MET  32 -10.696  -5.766  -2.263
  266    HE1  MET  32           HE1      MET  32 -13.356  -9.492  -2.667
  267    HE2  MET  32           HE2      MET  32 -13.053  -8.452  -4.060
  268    HE3  MET  32           HE3      MET  32 -11.715  -9.300  -3.286
  269    H    GLY  33           H        GLY  33 -11.017  -5.240  -7.101
  270    HA2  GLY  33           HA1      GLY  33 -11.844  -4.375  -9.184
  271    HA3  GLY  33           HA2      GLY  33 -13.393  -4.088  -8.405
  272    H    ASN  34           H        ASN  34  -9.999  -3.180  -7.755
  273    HA   ASN  34           HA       ASN  34 -10.885  -0.380  -7.541
  274    HB2  ASN  34           HB2      ASN  34  -9.105  -1.847  -5.581
  275    HB3  ASN  34           HB3      ASN  34  -9.379  -0.110  -5.572
  276   HD21  ASN  34          1HD2      ASN  34 -10.768  -3.228  -4.961
  277   HD22  ASN  34          2HD2      ASN  34 -12.152  -2.666  -4.091
  278    H    LEU  35           H        LEU  35  -8.977   1.133  -7.431
  279    HA   LEU  35           HA       LEU  35  -6.843   0.221  -9.242
  280    HB2  LEU  35           HB2      LEU  35  -7.838   3.009  -8.623
  281    HB3  LEU  35           HB3      LEU  35  -6.414   2.674  -9.582
  282    HG   LEU  35           HG       LEU  35  -8.092   3.156 -11.138
  283   HD11  LEU  35          2HD1      LEU  35  -8.453   1.077 -12.354
  284   HD12  LEU  35          1HD1      LEU  35  -7.984   0.155 -10.926
  285   HD13  LEU  35          3HD1      LEU  35  -6.805   1.186 -11.736
  286   HD21  LEU  35          3HD2      LEU  35 -10.017   3.066  -9.675
  287   HD22  LEU  35          2HD2      LEU  35  -9.922   1.305  -9.622
  288   HD23  LEU  35          1HD2      LEU  35 -10.317   2.121 -11.134
  289    H    ILE  36           H        ILE  36  -4.838   0.025  -8.423
  290    HA   ILE  36           HA       ILE  36  -4.322   1.287  -5.823
  291    HB   ILE  36           HB       ILE  36  -4.920  -1.083  -5.492
  292   HG12  ILE  36          2HG1      ILE  36  -2.009  -0.495  -4.933
  293   HG13  ILE  36          3HG1      ILE  36  -3.358   0.090  -3.969
  294   HG21  ILE  36          2HG2      ILE  36  -2.473  -1.642  -7.159
  295   HG22  ILE  36          1HG2      ILE  36  -4.145  -2.007  -7.588
  296   HG23  ILE  36          3HG2      ILE  36  -3.378  -2.846  -6.239
  297   HD11  ILE  36          3HD1      ILE  36  -2.630  -2.801  -4.380
  298   HD12  ILE  36          2HD1      ILE  36  -3.950  -2.190  -3.381
  299   HD13  ILE  36          1HD1      ILE  36  -2.277  -1.839  -2.946
  300    H    LYS  37           H        LYS  37  -2.414   2.190  -5.558
  301    HA   LYS  37           HA       LYS  37  -0.345   1.769  -7.619
  302    HB2  LYS  37           HB2      LYS  37  -1.114   4.218  -6.043
  303    HB3  LYS  37           HB3      LYS  37   0.466   4.071  -6.797
  304    HG2  LYS  37           HG2      LYS  37  -2.155   3.896  -8.268
  305    HG3  LYS  37           HG3      LYS  37  -1.155   5.345  -8.150
  306    HD2  LYS  37           HD2      LYS  37   0.712   4.070  -9.185
  307    HD3  LYS  37           HD3      LYS  37  -0.399   2.719  -9.424
  308    HE2  LYS  37           HE2      LYS  37  -0.306   3.924 -11.471
  309    HE3  LYS  37           HE3      LYS  37  -1.865   4.278 -10.726
  310    HZ1  LYS  37           HZ1      LYS  37   0.529   6.022 -10.804
  311    HZ2  LYS  37           HZ2      LYS  37  -0.821   6.351  -9.841
  312    HZ3  LYS  37           HZ3      LYS  37  -0.977   6.306 -11.527
  313    H    VAL  38           H        VAL  38   1.064   0.363  -6.781
  314    HA   VAL  38           HA       VAL  38   1.792   0.653  -3.968
  315    HB   VAL  38           HB       VAL  38   2.889  -1.573  -4.240
  316   HG11  VAL  38          2HG1      VAL  38   0.680  -1.380  -3.254
  317   HG12  VAL  38          1HG1      VAL  38   0.802  -2.851  -4.218
  318   HG13  VAL  38          3HG1      VAL  38  -0.057  -1.448  -4.855
  319   HG21  VAL  38          3HG2      VAL  38   2.280  -2.949  -6.165
  320   HG22  VAL  38          2HG2      VAL  38   3.229  -1.543  -6.646
  321   HG23  VAL  38          1HG2      VAL  38   1.483  -1.560  -6.903
  322    H    GLU  39           H        GLU  39   3.820   0.993  -3.304
  323    HA   GLU  39           HA       GLU  39   5.864   1.521  -5.356
  324    HB2  GLU  39           HB2      GLU  39   5.276   3.482  -3.988
  325    HB3  GLU  39           HB3      GLU  39   5.640   2.577  -2.527
  326    HG2  GLU  39           HG2      GLU  39   7.980   2.411  -3.206
  327    HG3  GLU  39           HG3      GLU  39   7.614   3.312  -4.678
  328    H    THR  40           H        THR  40   7.671   0.258  -5.354
  329    HA   THR  40           HA       THR  40   7.909  -1.685  -3.186
  330    HB   THR  40           HB       THR  40   9.578  -2.819  -4.679
  331    HG1  THR  40           HG1      THR  40  10.162  -1.901  -6.482
  332   HG21  THR  40          3HG2      THR  40   7.267  -3.580  -4.606
  333   HG22  THR  40          1HG2      THR  40   7.906  -3.714  -6.245
  334   HG23  THR  40          2HG2      THR  40   6.819  -2.390  -5.827
  335    H    GLN  41           H        GLN  41   8.975  -0.828  -1.546
  336    HA   GLN  41           HA       GLN  41  11.377   0.760  -2.005
  337    HB2  GLN  41           HB2      GLN  41   9.665   1.344  -0.250
  338    HB3  GLN  41           HB3      GLN  41  10.125  -0.118   0.604
  339    HG2  GLN  41           HG2      GLN  41  11.173   1.833   1.577
  340    HG3  GLN  41           HG3      GLN  41  12.384   0.749   0.887
  341   HE21  GLN  41          1HE2      GLN  41  10.632   3.733   0.425
  342   HE22  GLN  41          2HE2      GLN  41  11.751   4.448  -0.678
  343    H    GLY  42           H        GLY  42  12.688  -0.804  -2.942
  344    HA2  GLY  42           HA1      GLY  42  13.089  -3.364  -1.670
  345    HA3  GLY  42           HA2      GLY  42  13.898  -2.772  -3.114
  346    H    ALA  43           H        ALA  43  13.690  -1.786   0.278
  347    HA   ALA  43           HA       ALA  43  15.242  -1.311   1.854
  348    HB1  ALA  43           HB1      ALA  43  17.338  -2.532   1.866
  349    HB2  ALA  43           HB2      ALA  43  16.010  -3.604   1.423
  350    HB3  ALA  43           HB3      ALA  43  17.103  -2.994   0.180
  351    H    THR  44           H        THR  44  15.184   0.866   1.325
  352    HA   THR  44           HA       THR  44  16.179   2.885   1.028
  353    HB   THR  44           HB       THR  44  18.610   1.412   0.001
  354    HG1  THR  44           HG1      THR  44  18.507   0.722   2.052
  355   HG21  THR  44          3HG2      THR  44  19.809   3.450   0.659
  356   HG22  THR  44          1HG2      THR  44  18.285   4.194   1.136
  357   HG23  THR  44          2HG2      THR  44  18.580   3.798  -0.557
  358    H    GLY  45           H        GLY  45  16.413   0.549  -1.591
  359    HA2  GLY  45           HA1      GLY  45  16.589   2.665  -3.591
  360    HA3  GLY  45           HA2      GLY  45  16.709   0.937  -3.890
  361    H    ILE  46           H        ILE  46  14.800   3.603  -4.245
  362    HA   ILE  46           HA       ILE  46  12.231   2.237  -4.022
  363    HB   ILE  46           HB       ILE  46  12.709   5.035  -5.052
  364   HG12  ILE  46          2HG1      ILE  46  12.269   4.231  -2.166
  365   HG13  ILE  46          3HG1      ILE  46  13.819   4.730  -2.834
  366   HG21  ILE  46          2HG2      ILE  46  10.498   4.098  -5.413
  367   HG22  ILE  46          1HG2      ILE  46  10.434   5.404  -4.229
  368   HG23  ILE  46          3HG2      ILE  46  10.359   3.724  -3.695
  369   HD11  ILE  46          3HD1      ILE  46  11.339   6.427  -2.698
  370   HD12  ILE  46          2HD1      ILE  46  12.906   6.927  -3.334
  371   HD13  ILE  46          1HD1      ILE  46  12.731   6.536  -1.623
  372    H    GLU  47           H        GLU  47  11.167   1.387  -5.778
  373    HA   GLU  47           HA       GLU  47  12.463   1.791  -8.385
  374    HB2  GLU  47           HB2      GLU  47  10.496  -0.346  -7.568
  375    HB3  GLU  47           HB3      GLU  47  11.368  -0.258  -9.093
  376    HG2  GLU  47           HG2      GLU  47  13.485  -0.507  -7.885
  377    HG3  GLU  47           HG3      GLU  47  12.589  -0.645  -6.371
  378    H    ASN  48           H        ASN  48   9.219   1.693  -6.921
  379    HA   ASN  48           HA       ASN  48   8.008   2.684  -9.342
  380    HB2  ASN  48           HB2      ASN  48   6.921   2.111  -6.591
  381    HB3  ASN  48           HB3      ASN  48   5.940   2.858  -7.850
  382   HD21  ASN  48          1HD2      ASN  48   5.275   1.649  -9.594
  383   HD22  ASN  48          2HD2      ASN  48   5.433  -0.076  -9.652
  384    H    GLU  49           H        GLU  49   8.189   3.950  -6.022
  385    HA   GLU  49           HA       GLU  49   8.247   6.038  -5.175
  386    HB2  GLU  49           HB2      GLU  49  10.197   6.411  -6.583
  387    HB3  GLU  49           HB3      GLU  49   9.168   6.794  -7.954
  388    HG2  GLU  49           HG2      GLU  49   8.400   8.800  -6.901
  389    HG3  GLU  49           HG3      GLU  49   9.239   8.391  -5.405
  390    H    LEU  50           H        LEU  50   6.180   6.366  -4.667
  391    HA   LEU  50           HA       LEU  50   4.245   7.164  -6.671
  392    HB2  LEU  50           HB2      LEU  50   4.013   7.009  -3.661
  393    HB3  LEU  50           HB3      LEU  50   2.683   7.305  -4.766
  394    HG   LEU  50           HG       LEU  50   4.313   4.764  -4.603
  395   HD11  LEU  50          2HD1      LEU  50   2.791   5.060  -2.718
  396   HD12  LEU  50          1HD1      LEU  50   2.247   3.764  -3.784
  397   HD13  LEU  50          3HD1      LEU  50   1.454   5.339  -3.835
  398   HD21  LEU  50          3HD2      LEU  50   1.931   5.445  -6.324
  399   HD22  LEU  50          2HD2      LEU  50   2.718   3.870  -6.216
  400   HD23  LEU  50          1HD2      LEU  50   3.590   5.248  -6.889
  401    H    THR  51           H        THR  51   3.568   9.206  -7.067
  402    HA   THR  51           HA       THR  51   5.300  11.300  -6.017
  403    HB   THR  51           HB       THR  51   4.286  12.678  -7.857
  404    HG1  THR  51           HG1      THR  51   3.255  11.071  -9.483
  405   HG21  THR  51          3HG2      THR  51   5.546  10.057  -8.678
  406   HG22  THR  51          1HG2      THR  51   6.405  11.521  -8.199
  407   HG23  THR  51          2HG2      THR  51   5.450  11.504  -9.682
  408    H    GLU  52           H        GLU  52   4.430  13.361  -5.352
  409    HA   GLU  52           HA       GLU  52   2.436  13.355  -3.460
  410    HB2  GLU  52           HB2      GLU  52   4.094  15.158  -3.790
  411    HB3  GLU  52           HB3      GLU  52   3.258  15.658  -5.248
  412    HG2  GLU  52           HG2      GLU  52   1.759  15.599  -2.677
  413    HG3  GLU  52           HG3      GLU  52   2.900  16.906  -2.976
  414    H    LYS  53           H        LYS  53   2.167  14.139  -6.890
  415    HA   LYS  53           HA       LYS  53  -0.550  14.872  -6.883
  416    HB2  LYS  53           HB2      LYS  53   1.062  15.407  -8.677
  417    HB3  LYS  53           HB3      LYS  53   1.102  13.712  -9.130
  418    HG2  LYS  53           HG2      LYS  53  -1.235  13.794  -9.762
  419    HG3  LYS  53           HG3      LYS  53  -1.335  15.479  -9.242
  420    HD2  LYS  53           HD2      LYS  53   0.396  16.056 -10.907
  421    HD3  LYS  53           HD3      LYS  53   0.393  14.379 -11.456
  422    HE2  LYS  53           HE2      LYS  53  -1.920  14.574 -12.139
  423    HE3  LYS  53           HE3      LYS  53  -2.000  16.216 -11.497
  424    HZ1  LYS  53           HZ1      LYS  53  -0.290  15.293 -13.743
  425    HZ2  LYS  53           HZ2      LYS  53  -0.279  16.860 -13.092
  426    HZ3  LYS  53           HZ3      LYS  53  -1.669  16.276 -13.868
  427    H    ASP  54           H        ASP  54   1.058  11.781  -7.512
  428    HA   ASP  54           HA       ASP  54  -1.311  10.394  -8.270
  429    HB2  ASP  54           HB2      ASP  54   1.122   9.788  -8.808
  430    HB3  ASP  54           HB3      ASP  54   1.193   9.104  -7.192
  431    H    VAL  55           H        VAL  55   0.510  10.721  -5.288
  432    HA   VAL  55           HA       VAL  55  -0.976   8.910  -3.715
  433    HB   VAL  55           HB       VAL  55   0.588  11.361  -2.879
  434   HG11  VAL  55          2HG1      VAL  55  -0.473   9.110  -1.181
  435   HG12  VAL  55          1HG1      VAL  55  -1.037  10.781  -1.162
  436   HG13  VAL  55          3HG1      VAL  55   0.601  10.397  -0.635
  437   HG21  VAL  55          3HG2      VAL  55   1.289   8.430  -2.913
  438   HG22  VAL  55          2HG2      VAL  55   2.289   9.705  -2.212
  439   HG23  VAL  55          1HG2      VAL  55   1.965   9.690  -3.947
  440    H    ASN  56           H        ASN  56  -1.451  12.332  -4.472
  441    HA   ASN  56           HA       ASN  56  -3.522  12.739  -2.567
  442    HB2  ASN  56           HB2      ASN  56  -2.535  14.286  -4.930
  443    HB3  ASN  56           HB3      ASN  56  -4.087  14.710  -4.214
  444   HD21  ASN  56          1HD2      ASN  56  -1.308  13.471  -2.460
  445   HD22  ASN  56          2HD2      ASN  56  -1.007  14.914  -1.555
  446    H    ILE  57           H        ILE  57  -3.455  11.315  -5.703
  447    HA   ILE  57           HA       ILE  57  -6.245  11.525  -6.245
  448    HB   ILE  57           HB       ILE  57  -4.244   9.480  -7.233
  449   HG12  ILE  57          2HG1      ILE  57  -3.630  11.743  -7.891
  450   HG13  ILE  57          3HG1      ILE  57  -4.218  10.852  -9.289
  451   HG21  ILE  57          2HG2      ILE  57  -6.519   8.652  -7.443
  452   HG22  ILE  57          1HG2      ILE  57  -5.853   9.040  -9.029
  453   HG23  ILE  57          3HG2      ILE  57  -7.001  10.137  -8.261
  454   HD11  ILE  57          3HD1      ILE  57  -6.358  11.985  -9.134
  455   HD12  ILE  57          2HD1      ILE  57  -5.038  13.148  -9.255
  456   HD13  ILE  57          1HD1      ILE  57  -5.810  12.849  -7.698
  457    H    GLY  58           H        GLY  58  -4.189   9.045  -4.776
  458    HA2  GLY  58           HA1      GLY  58  -6.248   7.199  -4.179
  459    HA3  GLY  58           HA2      GLY  58  -4.666   7.265  -3.415
  460    H    GLU  59           H        GLU  59  -7.162   6.675  -2.146
  461    HA   GLU  59           HA       GLU  59  -7.582   9.064  -0.484
  462    HB2  GLU  59           HB2      GLU  59  -9.359   6.661  -0.928
  463    HB3  GLU  59           HB3      GLU  59  -9.741   8.024   0.117
  464    HG2  GLU  59           HG2      GLU  59  -9.874   9.511  -1.724
  465    HG3  GLU  59           HG3      GLU  59  -9.188   8.315  -2.821
  466    H    VAL  60           H        VAL  60  -7.459   5.504  -0.216
  467    HA   VAL  60           HA       VAL  60  -6.594   5.836   2.568
  468    HB   VAL  60           HB       VAL  60  -7.057   3.401   2.820
  469   HG11  VAL  60          2HG1      VAL  60  -9.349   5.116   1.874
  470   HG12  VAL  60          1HG1      VAL  60  -8.714   5.012   3.516
  471   HG13  VAL  60          3HG1      VAL  60  -9.516   3.619   2.792
  472   HG21  VAL  60          3HG2      VAL  60  -6.802   2.729   0.485
  473   HG22  VAL  60          2HG2      VAL  60  -8.246   3.649   0.058
  474   HG23  VAL  60          1HG2      VAL  60  -8.376   2.247   1.120
  475    H    VAL  61           H        VAL  61  -4.686   4.993   3.314
  476    HA   VAL  61           HA       VAL  61  -2.785   4.194   1.212
  477    HB   VAL  61           HB       VAL  61  -2.110   5.408   3.892
  478   HG11  VAL  61          2HG1      VAL  61   0.071   5.821   2.858
  479   HG12  VAL  61          1HG1      VAL  61  -0.480   5.012   1.390
  480   HG13  VAL  61          3HG1      VAL  61  -0.327   4.103   2.894
  481   HG21  VAL  61          3HG2      VAL  61  -2.319   6.791   1.218
  482   HG22  VAL  61          2HG2      VAL  61  -1.718   7.512   2.710
  483   HG23  VAL  61          1HG2      VAL  61  -3.405   7.015   2.590
  484    H    ILE  62           H        ILE  62  -1.904   2.243   1.331
  485    HA   ILE  62           HA       ILE  62  -2.166   0.739   3.854
  486    HB   ILE  62           HB       ILE  62  -1.912  -0.310   1.027
  487   HG12  ILE  62          2HG1      ILE  62  -4.205  -0.404   3.003
  488   HG13  ILE  62          3HG1      ILE  62  -4.135   0.593   1.553
  489   HG21  ILE  62          2HG2      ILE  62  -0.738  -1.746   2.619
  490   HG22  ILE  62          1HG2      ILE  62  -2.189  -2.535   1.998
  491   HG23  ILE  62          3HG2      ILE  62  -2.189  -1.833   3.617
  492   HD11  ILE  62          3HD1      ILE  62  -5.530  -1.360   1.211
  493   HD12  ILE  62          2HD1      ILE  62  -4.177  -2.414   1.627
  494   HD13  ILE  62          1HD1      ILE  62  -4.105  -1.419   0.173
  495    H    PHE  63           H        PHE  63  -0.343   0.209   4.903
  496    HA   PHE  63           HA       PHE  63   2.183   0.385   3.397
  497    HB2  PHE  63           HB2      PHE  63   1.404   1.549   5.989
  498    HB3  PHE  63           HB3      PHE  63   2.976   0.755   5.976
  499    HD1  PHE  63           HD2      PHE  63   0.964   3.385   4.323
  500    HD2  PHE  63           HD1      PHE  63   4.837   1.771   5.007
  501    HE1  PHE  63           HE2      PHE  63   1.975   5.380   3.298
  502    HE2  PHE  63           HE1      PHE  63   5.854   3.760   3.984
  503    HZ   PHE  63           HZ       PHE  63   4.421   5.569   3.125
  504    H    ALA  64           H        ALA  64   2.875  -1.603   3.043
  505    HA   ALA  64           HA       ALA  64   2.927  -3.453   5.339
  506    HB1  ALA  64           HB1      ALA  64   3.135  -5.276   3.731
  507    HB2  ALA  64           HB2      ALA  64   1.675  -4.339   3.413
  508    HB3  ALA  64           HB3      ALA  64   3.101  -4.122   2.398
  509    H    VAL  65           H        VAL  65   4.812  -2.765   6.266
  510    HA   VAL  65           HA       VAL  65   7.181  -2.737   4.537
  511    HB   VAL  65           HB       VAL  65   8.003  -0.708   5.721
  512   HG11  VAL  65          2HG1      VAL  65   7.039  -0.535   3.505
  513   HG12  VAL  65          1HG1      VAL  65   6.590   0.871   4.471
  514   HG13  VAL  65          3HG1      VAL  65   5.419  -0.419   4.193
  515   HG21  VAL  65          3HG2      VAL  65   6.406   0.700   6.919
  516   HG22  VAL  65          2HG2      VAL  65   6.600  -0.861   7.720
  517   HG23  VAL  65          1HG2      VAL  65   5.166  -0.543   6.742
  518    H    ASP  66           H        ASP  66   8.952  -3.533   5.314
  519    HA   ASP  66           HA       ASP  66   9.123  -4.236   8.169
  520    HB2  ASP  66           HB2      ASP  66   9.147  -6.214   6.821
  521    HB3  ASP  66           HB3      ASP  66  10.294  -5.513   5.690
  522    H    THR  67           H        THR  67  10.064  -2.003   6.002
  523    HA   THR  67           HA       THR  67  12.443  -1.317   7.526
  524    HB   THR  67           HB       THR  67  13.210  -2.630   5.522
  525    HG1  THR  67           HG1      THR  67  14.886  -1.200   5.106
  526   HG21  THR  67          3HG2      THR  67  13.151  -1.549   3.330
  527   HG22  THR  67          1HG2      THR  67  12.174  -0.239   3.999
  528   HG23  THR  67          2HG2      THR  67  11.522  -1.876   3.922
  529    H    LYS  68           H        LYS  68  13.285   0.869   6.625
  530    HA   LYS  68           HA       LYS  68  11.201   2.757   7.058
  531    HB2  LYS  68           HB2      LYS  68  13.435   3.121   7.914
  532    HB3  LYS  68           HB3      LYS  68  14.108   3.062   6.294
  533    HG2  LYS  68           HG2      LYS  68  12.819   5.112   5.744
  534    HG3  LYS  68           HG3      LYS  68  12.312   5.190   7.434
  535    HD2  LYS  68           HD2      LYS  68  14.252   6.639   6.965
  536    HD3  LYS  68           HD3      LYS  68  14.620   5.383   8.150
  537    HE2  LYS  68           HE2      LYS  68  15.659   4.033   6.388
  538    HE3  LYS  68           HE3      LYS  68  15.291   5.293   5.211
  539    HZ1  LYS  68           HZ1      LYS  68  17.604   5.356   6.039
  540    HZ2  LYS  68           HZ2      LYS  68  17.017   5.685   7.599
  541    HZ3  LYS  68           HZ3      LYS  68  16.755   6.794   6.346
  542    H    VAL  69           H        VAL  69  10.253   4.187   5.669
  543    HA   VAL  69           HA       VAL  69  10.757   3.771   2.792
  544    HB   VAL  69           HB       VAL  69   8.170   4.670   4.076
  545   HG11  VAL  69          2HG1      VAL  69   7.203   4.354   1.861
  546   HG12  VAL  69          1HG1      VAL  69   8.783   3.895   1.226
  547   HG13  VAL  69          3HG1      VAL  69   8.511   5.537   1.812
  548   HG21  VAL  69          3HG2      VAL  69   8.909   1.985   2.920
  549   HG22  VAL  69          2HG2      VAL  69   7.295   2.460   3.450
  550   HG23  VAL  69          1HG2      VAL  69   8.610   2.343   4.621
  551    H    ARG  70           H        ARG  70  11.418   5.500   1.669
  552    HA   ARG  70           HA       ARG  70  11.871   7.936   3.133
  553    HB2  ARG  70           HB2      ARG  70  12.683   7.072   0.357
  554    HB3  ARG  70           HB3      ARG  70  13.089   8.640   1.045
  555    HG2  ARG  70           HG2      ARG  70  14.161   7.374   2.955
  556    HG3  ARG  70           HG3      ARG  70  13.979   5.925   1.968
  557    HD2  ARG  70           HD2      ARG  70  15.379   8.398   0.989
  558    HD3  ARG  70           HD3      ARG  70  16.216   7.116   1.857
  559    HE   ARG  70           HE       ARG  70  15.313   5.644  -0.030
  560   HH11  ARG  70          2HH1      ARG  70  16.109   9.023  -0.408
  561   HH12  ARG  70          1HH1      ARG  70  16.641   8.858  -2.057
  562   HH21  ARG  70          2HH2      ARG  70  16.021   5.392  -2.191
  563   HH22  ARG  70          1HH2      ARG  70  16.578   6.782  -3.080
  564    H    ASN  71           H        ASN  71   9.824   6.895   0.461
  565    HA   ASN  71           HA       ASN  71   8.923   9.585  -0.082
  566    HB2  ASN  71           HB2      ASN  71   7.981   6.917  -1.137
  567    HB3  ASN  71           HB3      ASN  71   7.303   8.463  -1.642
  568   HD21  ASN  71          1HD2      ASN  71   8.572   6.522  -3.275
  569   HD22  ASN  71          2HD2      ASN  71   9.968   7.283  -3.974
  570    H    LYS  72           H        LYS  72   8.274   7.378   2.264
  571    HA   LYS  72           HA       LYS  72   5.556   7.221   2.612
  572    HB2  LYS  72           HB2      LYS  72   7.016   5.976   4.021
  573    HB3  LYS  72           HB3      LYS  72   7.784   7.433   4.630
  574    HG2  LYS  72           HG2      LYS  72   5.681   8.052   5.742
  575    HG3  LYS  72           HG3      LYS  72   4.961   6.543   5.172
  576    HD2  LYS  72           HD2      LYS  72   6.458   5.239   6.469
  577    HD3  LYS  72           HD3      LYS  72   7.464   6.643   6.839
  578    HE2  LYS  72           HE2      LYS  72   4.623   6.204   7.751
  579    HE3  LYS  72           HE3      LYS  72   6.070   6.017   8.743
  580    HZ1  LYS  72           HZ1      LYS  72   6.550   8.395   8.313
  581    HZ2  LYS  72           HZ2      LYS  72   5.115   8.150   9.181
  582    HZ3  LYS  72           HZ3      LYS  72   5.050   8.537   7.533
  583    H    GLU  73           H        GLU  73   7.602   9.968   3.084
  584    HA   GLU  73           HA       GLU  73   6.278  11.477   4.963
  585    HB2  GLU  73           HB2      GLU  73   7.566  12.573   2.463
  586    HB3  GLU  73           HB3      GLU  73   7.362  13.404   3.997
  587    HG2  GLU  73           HG2      GLU  73   9.127  11.029   3.466
  588    HG3  GLU  73           HG3      GLU  73   9.645  12.693   3.723
  589    H    ARG  74           H        ARG  74   5.405  11.018   1.573
  590    HA   ARG  74           HA       ARG  74   3.572  13.245   1.605
  591    HB2  ARG  74           HB2      ARG  74   3.123  12.627  -0.716
  592    HB3  ARG  74           HB3      ARG  74   4.845  12.761  -0.396
  593    HG2  ARG  74           HG2      ARG  74   4.594  10.162   0.034
  594    HG3  ARG  74           HG3      ARG  74   3.215  10.381  -1.045
  595    HD2  ARG  74           HD2      ARG  74   5.155   9.819  -2.357
  596    HD3  ARG  74           HD3      ARG  74   4.714  11.497  -2.647
  597    HE   ARG  74           HE       ARG  74   6.615  11.474  -0.617
  598   HH11  ARG  74          2HH1      ARG  74   6.448  10.604  -4.006
  599   HH12  ARG  74          1HH1      ARG  74   8.091  11.061  -4.328
  600   HH21  ARG  74          2HH2      ARG  74   8.787  12.035  -1.034
  601   HH22  ARG  74          1HH2      ARG  74   9.418  11.868  -2.650
  602    H    PHE  75           H        PHE  75   3.307  10.012   2.603
  603    HA   PHE  75           HA       PHE  75   0.414   9.959   2.159
  604    HB2  PHE  75           HB2      PHE  75   2.115   7.916   3.595
  605    HB3  PHE  75           HB3      PHE  75   0.487   7.712   2.960
  606    HD1  PHE  75           HD2      PHE  75   0.112   7.395   0.573
  607    HD2  PHE  75           HD1      PHE  75   4.038   7.826   2.154
  608    HE1  PHE  75           HE2      PHE  75   1.055   6.537  -1.533
  609    HE2  PHE  75           HE1      PHE  75   4.985   6.978   0.053
  610    HZ   PHE  75           HZ       PHE  75   3.493   6.331  -1.794
  611    H    ASP  76           H        ASP  76   2.488  11.320   4.246
  612    HA   ASP  76           HA       ASP  76   1.109  10.725   6.709
  613    HB2  ASP  76           HB2      ASP  76   3.525  12.241   5.948
  614    HB3  ASP  76           HB3      ASP  76   2.635  12.890   7.325
  615    H    GLY  77           H        GLY  77  -0.261  12.068   7.827
  616    HA2  GLY  77           HA1      GLY  77  -1.810  13.810   8.049
  617    HA3  GLY  77           HA2      GLY  77  -1.215  14.499   6.539
  618    H    LYS  78           H        LYS  78  -1.897  11.157   6.702
  619    HA   LYS  78           HA       LYS  78  -4.522  11.464   5.462
  620    HB2  LYS  78           HB2      LYS  78  -2.077  10.344   4.199
  621    HB3  LYS  78           HB3      LYS  78  -3.595   9.512   3.890
  622    HG2  LYS  78           HG2      LYS  78  -4.420  11.194   2.629
  623    HG3  LYS  78           HG3      LYS  78  -3.622  12.447   3.578
  624    HD2  LYS  78           HD2      LYS  78  -2.132  10.600   1.727
  625    HD3  LYS  78           HD3      LYS  78  -2.793  12.154   1.209
  626    HE2  LYS  78           HE2      LYS  78  -0.757  11.683   3.377
  627    HE3  LYS  78           HE3      LYS  78  -0.462  12.383   1.794
  628    HZ1  LYS  78           HZ1      LYS  78  -1.636  14.316   2.346
  629    HZ2  LYS  78           HZ2      LYS  78  -0.697  13.982   3.717
  630    HZ3  LYS  78           HZ3      LYS  78  -2.349  13.612   3.710
  631    H    VAL  79           H        VAL  79  -4.645   8.625   4.802
  632    HA   VAL  79           HA       VAL  79  -4.870   7.634   7.562
  633    HB   VAL  79           HB       VAL  79  -7.059   7.883   6.630
  634   HG11  VAL  79          2HG1      VAL  79  -7.785   6.721   4.607
  635   HG12  VAL  79          1HG1      VAL  79  -6.132   6.164   4.342
  636   HG13  VAL  79          3HG1      VAL  79  -6.504   7.886   4.275
  637   HG21  VAL  79          3HG2      VAL  79  -6.763   5.948   8.042
  638   HG22  VAL  79          2HG2      VAL  79  -6.229   4.983   6.666
  639   HG23  VAL  79          1HG2      VAL  79  -7.895   5.561   6.746
  640    H    VAL  80           H        VAL  80  -3.277   6.300   8.012
  641    HA   VAL  80           HA       VAL  80  -2.213   4.598   5.869
  642    HB   VAL  80           HB       VAL  80  -0.887   5.506   8.431
  643   HG11  VAL  80          2HG1      VAL  80   1.137   4.483   7.560
  644   HG12  VAL  80          1HG1      VAL  80   0.260   3.914   6.142
  645   HG13  VAL  80          3HG1      VAL  80  -0.138   3.277   7.738
  646   HG21  VAL  80          3HG2      VAL  80   0.546   6.841   6.981
  647   HG22  VAL  80          2HG2      VAL  80  -1.146   7.296   6.780
  648   HG23  VAL  80          1HG2      VAL  80  -0.352   6.290   5.567
  649    H    LEU  81           H        LEU  81  -2.950   2.604   5.932
  650    HA   LEU  81           HA       LEU  81  -3.361   1.285   8.522
  651    HB2  LEU  81           HB2      LEU  81  -5.107   1.181   6.681
  652    HB3  LEU  81           HB3      LEU  81  -3.974   0.229   5.750
  653    HG   LEU  81           HG       LEU  81  -5.806  -1.037   6.962
  654   HD11  LEU  81          2HD1      LEU  81  -2.955  -1.801   7.559
  655   HD12  LEU  81          1HD1      LEU  81  -3.843  -2.165   6.081
  656   HD13  LEU  81          3HD1      LEU  81  -4.348  -2.881   7.610
  657   HD21  LEU  81          3HD2      LEU  81  -5.771   0.169   9.060
  658   HD22  LEU  81          2HD2      LEU  81  -4.108  -0.344   9.355
  659   HD23  LEU  81          1HD2      LEU  81  -5.409  -1.536   9.331
  660    H    GLU  82           H        GLU  82  -1.476   0.576   9.295
  661    HA   GLU  82           HA       GLU  82   0.571  -0.339   7.402
  662    HB2  GLU  82           HB2      GLU  82   1.078   1.613   8.875
  663    HB3  GLU  82           HB3      GLU  82   0.912   0.554  10.266
  664    HG2  GLU  82           HG2      GLU  82   2.736  -0.856   9.269
  665    HG3  GLU  82           HG3      GLU  82   2.983   0.438   8.098
  666    H    VAL  83           H        VAL  83   1.046  -2.402   7.315
  667    HA   VAL  83           HA       VAL  83   0.740  -4.080   9.712
  668    HB   VAL  83           HB       VAL  83  -0.067  -5.949   8.261
  669   HG11  VAL  83          2HG1      VAL  83  -1.837  -3.511   8.304
  670   HG12  VAL  83          1HG1      VAL  83  -1.649  -4.683   9.608
  671   HG13  VAL  83          3HG1      VAL  83  -2.380  -5.173   8.079
  672   HG21  VAL  83          3HG2      VAL  83  -1.015  -5.410   6.058
  673   HG22  VAL  83          2HG2      VAL  83   0.727  -5.139   6.113
  674   HG23  VAL  83          1HG2      VAL  83  -0.382  -3.770   6.198
  675    HA   PRO  84           HA       PRO  84   4.725  -5.827   8.616
  676    HB2  PRO  84           HB2      PRO  84   3.488  -8.523   8.763
  677    HB3  PRO  84           HB3      PRO  84   4.888  -7.877   9.627
  678    HG2  PRO  84           HG2      PRO  84   2.560  -8.239  10.877
  679    HG3  PRO  84           HG3      PRO  84   3.584  -6.835  11.234
  680    HD2  PRO  84           HD2      PRO  84   1.094  -6.997   9.584
  681    HD3  PRO  84           HD3      PRO  84   1.629  -5.722  10.699
  682    H    VAL  85           H        VAL  85   5.768  -6.505   6.766
  683    HA   VAL  85           HA       VAL  85   4.303  -6.365   4.363
  684    HB   VAL  85           HB       VAL  85   6.658  -5.650   4.582
  685   HG11  VAL  85          2HG1      VAL  85   8.451  -7.326   4.463
  686   HG12  VAL  85          1HG1      VAL  85   7.250  -8.603   4.664
  687   HG13  VAL  85          3HG1      VAL  85   7.521  -7.437   5.960
  688   HG21  VAL  85          3HG2      VAL  85   5.739  -6.018   2.371
  689   HG22  VAL  85          2HG2      VAL  85   6.162  -7.728   2.452
  690   HG23  VAL  85          1HG2      VAL  85   7.433  -6.506   2.410
  691    H    SER  86           H        SER  86   5.173  -9.051   6.354
  692    HA   SER  86           HA       SER  86   4.961 -11.066   4.349
  693    HB2  SER  86           HB2      SER  86   4.661 -11.401   7.339
  694    HB3  SER  86           HB3      SER  86   5.143 -12.627   6.166
  695    HG   SER  86           HG       SER  86   6.752 -11.182   7.531
  696    H    ALA  87           H        ALA  87   2.663  -9.245   6.122
  697    HA   ALA  87           HA       ALA  87   0.645 -11.229   6.374
  698    HB1  ALA  87           HB1      ALA  87   0.319  -8.237   6.458
  699    HB2  ALA  87           HB2      ALA  87  -0.810  -9.442   7.080
  700    HB3  ALA  87           HB3      ALA  87   0.776  -9.251   7.828
  701    HA   PRO  88           HA       PRO  88  -1.545  -9.033   2.668
  702    HB2  PRO  88           HB2      PRO  88  -0.069  -7.518   0.980
  703    HB3  PRO  88           HB3      PRO  88  -0.857  -6.861   2.420
  704    HG2  PRO  88           HG2      PRO  88   1.989  -7.722   2.048
  705    HG3  PRO  88           HG3      PRO  88   1.358  -6.247   2.809
  706    HD2  PRO  88           HD2      PRO  88   2.159  -8.351   4.271
  707    HD3  PRO  88           HD3      PRO  88   0.780  -7.346   4.760
  708    H    ILE  89           H        ILE  89   1.225 -10.869   2.635
  709    HA   ILE  89           HA       ILE  89   1.134 -11.568  -0.164
  710    HB   ILE  89           HB       ILE  89   2.521 -12.948   2.148
  711   HG12  ILE  89          2HG1      ILE  89   3.538 -11.052   0.018
  712   HG13  ILE  89          3HG1      ILE  89   3.395 -10.709   1.737
  713   HG21  ILE  89          2HG2      ILE  89   2.081 -14.502   0.318
  714   HG22  ILE  89          1HG2      ILE  89   3.802 -14.135   0.430
  715   HG23  ILE  89          3HG2      ILE  89   2.821 -13.381  -0.827
  716   HD11  ILE  89          3HD1      ILE  89   5.695 -11.145   1.129
  717   HD12  ILE  89          2HD1      ILE  89   5.244 -12.721   0.477
  718   HD13  ILE  89          1HD1      ILE  89   5.093 -12.406   2.207
  719    H    LYS  90           H        LYS  90  -0.014 -12.852   2.897
  720    HA   LYS  90           HA       LYS  90  -1.530 -14.945   1.522
  721    HB2  LYS  90           HB2      LYS  90  -0.268 -15.551   3.563
  722    HB3  LYS  90           HB3      LYS  90  -1.209 -14.382   4.478
  723    HG2  LYS  90           HG2      LYS  90  -3.121 -15.980   3.265
  724    HG3  LYS  90           HG3      LYS  90  -1.848 -17.105   3.747
  725    HD2  LYS  90           HD2      LYS  90  -3.276 -15.126   5.522
  726    HD3  LYS  90           HD3      LYS  90  -3.460 -16.880   5.537
  727    HE2  LYS  90           HE2      LYS  90  -1.183 -17.158   6.271
  728    HE3  LYS  90           HE3      LYS  90  -0.883 -15.428   6.117
  729    HZ1  LYS  90           HZ1      LYS  90  -2.784 -16.700   8.015
  730    HZ2  LYS  90           HZ2      LYS  90  -2.503 -15.034   7.869
  731    HZ3  LYS  90           HZ3      LYS  90  -1.265 -16.056   8.412
  732    H    ASP  91           H        ASP  91  -2.009 -12.260   3.793
  733    HA   ASP  91           HA       ASP  91  -4.909 -12.478   3.520
  734    HB2  ASP  91           HB2      ASP  91  -3.200 -10.741   5.321
  735    HB3  ASP  91           HB3      ASP  91  -4.950 -10.855   5.390
  736    H    ALA  92           H        ALA  92  -3.596 -11.543   1.192
  737    HA   ALA  92           HA       ALA  92  -3.053  -8.825   1.002
  738    HB1  ALA  92           HB1      ALA  92  -2.480 -10.467  -0.721
  739    HB2  ALA  92           HB2      ALA  92  -4.184 -10.608  -1.154
  740    HB3  ALA  92           HB3      ALA  92  -3.333  -9.081  -1.400
  741    H    GLU  93           H        GLU  93  -6.128 -10.442   0.169
  742    HA   GLU  93           HA       GLU  93  -7.470  -8.012  -0.474
  743    HB2  GLU  93           HB2      GLU  93  -8.608 -10.709   0.295
  744    HB3  GLU  93           HB3      GLU  93  -9.505  -9.398  -0.460
  745    HG2  GLU  93           HG2      GLU  93  -8.413  -9.652  -2.491
  746    HG3  GLU  93           HG3      GLU  93  -7.074 -10.541  -1.767
  747    H    LYS  94           H        LYS  94  -6.906  -9.782   2.415
  748    HA   LYS  94           HA       LYS  94  -9.027  -8.684   3.983
  749    HB2  LYS  94           HB2      LYS  94  -8.135 -10.843   4.504
  750    HB3  LYS  94           HB3      LYS  94  -6.505 -10.210   4.619
  751    HG2  LYS  94           HG2      LYS  94  -7.069  -9.044   6.661
  752    HG3  LYS  94           HG3      LYS  94  -8.751  -9.579   6.521
  753    HD2  LYS  94           HD2      LYS  94  -8.223 -11.791   6.953
  754    HD3  LYS  94           HD3      LYS  94  -6.536 -11.583   6.487
  755    HE2  LYS  94           HE2      LYS  94  -6.286 -10.123   8.529
  756    HE3  LYS  94           HE3      LYS  94  -7.888 -10.683   9.015
  757    HZ1  LYS  94           HZ1      LYS  94  -7.105 -12.932   9.047
  758    HZ2  LYS  94           HZ2      LYS  94  -6.056 -11.990   9.992
  759    HZ3  LYS  94           HZ3      LYS  94  -5.595 -12.474   8.429
  760    H    VAL  95           H        VAL  95  -5.634  -7.966   3.455
  761    HA   VAL  95           HA       VAL  95  -5.349  -5.904   5.364
  762    HB   VAL  95           HB       VAL  95  -3.903  -6.352   2.742
  763   HG11  VAL  95          2HG1      VAL  95  -3.116  -4.599   5.065
  764   HG12  VAL  95          1HG1      VAL  95  -3.657  -4.038   3.482
  765   HG13  VAL  95          3HG1      VAL  95  -2.142  -4.929   3.633
  766   HG21  VAL  95          3HG2      VAL  95  -3.689  -8.205   4.302
  767   HG22  VAL  95          2HG2      VAL  95  -3.167  -7.093   5.570
  768   HG23  VAL  95          1HG2      VAL  95  -2.158  -7.340   4.143
  769    H    ILE  96           H        ILE  96  -6.301  -5.905   1.964
  770    HA   ILE  96           HA       ILE  96  -6.594  -3.123   1.631
  771    HB   ILE  96           HB       ILE  96  -8.048  -5.387   0.253
  772   HG12  ILE  96          2HG1      ILE  96  -5.608  -3.799  -0.567
  773   HG13  ILE  96          3HG1      ILE  96  -5.577  -5.434   0.084
  774   HG21  ILE  96          2HG2      ILE  96  -9.265  -3.314  -0.047
  775   HG22  ILE  96          1HG2      ILE  96  -8.453  -3.752  -1.550
  776   HG23  ILE  96          3HG2      ILE  96  -7.785  -2.482  -0.523
  777   HD11  ILE  96          3HD1      ILE  96  -6.818  -6.232  -1.843
  778   HD12  ILE  96          2HD1      ILE  96  -5.332  -5.418  -2.331
  779   HD13  ILE  96          1HD1      ILE  96  -6.883  -4.592  -2.492
  780    H    ASN  97           H        ASN  97  -8.972  -5.631   2.500
  781    HA   ASN  97           HA       ASN  97 -11.159  -3.884   2.818
  782    HB2  ASN  97           HB2      ASN  97 -10.547  -6.650   3.799
  783    HB3  ASN  97           HB3      ASN  97 -11.959  -5.801   4.419
  784   HD21  ASN  97          1HD2      ASN  97 -10.498  -7.307   1.657
  785   HD22  ASN  97          2HD2      ASN  97 -11.918  -7.316   0.663
  786    H    ALA  98           H        ALA  98  -8.478  -4.645   4.905
  787    HA   ALA  98           HA       ALA  98  -9.586  -3.773   7.351
  788    HB1  ALA  98           HB1      ALA  98  -6.690  -3.721   6.509
  789    HB2  ALA  98           HB2      ALA  98  -7.304  -3.637   8.160
  790    HB3  ALA  98           HB3      ALA  98  -7.524  -5.107   7.210
  791    H    ALA  99           H        ALA  99  -7.897  -2.087   4.752
  792    HA   ALA  99           HA       ALA  99  -7.778   0.444   6.027
  793    HB1  ALA  99           HB1      ALA  99  -6.375  -0.101   4.098
  794    HB2  ALA  99           HB2      ALA  99  -7.810  -0.222   3.082
  795    HB3  ALA  99           HB3      ALA  99  -7.353   1.331   3.780
  796    H    LEU 100           H        LEU 100 -10.113  -1.122   3.892
  797    HA   LEU 100           HA       LEU 100 -11.916   1.038   3.673
  798    HB2  LEU 100           HB2      LEU 100 -12.123  -1.922   3.283
  799    HB3  LEU 100           HB3      LEU 100 -13.571  -0.939   3.245
  800    HG   LEU 100           HG       LEU 100 -12.677  -1.433   1.005
  801   HD11  LEU 100          2HD1      LEU 100 -14.015   0.562   1.340
  802   HD12  LEU 100          1HD1      LEU 100 -12.754   0.864   0.143
  803   HD13  LEU 100          3HD1      LEU 100 -12.574   1.476   1.789
  804   HD21  LEU 100          3HD2      LEU 100 -10.645  -0.350   0.216
  805   HD22  LEU 100          2HD2      LEU 100 -10.301  -1.491   1.517
  806   HD23  LEU 100          1HD2      LEU 100 -10.322   0.243   1.846
  807    H    ALA 101           H        ALA 101 -11.438  -1.432   6.081
  808    HA   ALA 101           HA       ALA 101 -13.901  -1.131   7.443
  809    HB1  ALA 101           HB1      ALA 101 -12.506  -3.109   7.718
  810    HB2  ALA 101           HB2      ALA 101 -11.251  -2.131   8.478
  811    HB3  ALA 101           HB3      ALA 101 -12.812  -2.336   9.273
  812    H    LEU 102           H        LEU 102 -11.107   0.830   7.303
  813    HA   LEU 102           HA       LEU 102 -11.471   2.071   9.871
  814    HB2  LEU 102           HB2      LEU 102  -9.847   2.965   7.488
  815    HB3  LEU 102           HB3      LEU 102  -9.764   3.661   9.094
  816    HG   LEU 102           HG       LEU 102  -8.999   0.829   8.378
  817   HD11  LEU 102          2HD1      LEU 102  -7.298   3.224   9.056
  818   HD12  LEU 102          1HD1      LEU 102  -7.442   2.464   7.471
  819   HD13  LEU 102          3HD1      LEU 102  -6.713   1.578   8.809
  820   HD21  LEU 102          3HD2      LEU 102  -8.116   0.727  10.656
  821   HD22  LEU 102          2HD2      LEU 102  -9.856   1.017  10.657
  822   HD23  LEU 102          1HD2      LEU 102  -8.740   2.346  10.973
  823    H    ILE 103           H        ILE 103 -12.430   2.734   6.554
  824    HA   ILE 103           HA       ILE 103 -13.508   5.326   7.366
  825    HB   ILE 103           HB       ILE 103 -13.922   5.673   4.916
  826   HG12  ILE 103          2HG1      ILE 103 -12.248   3.164   4.629
  827   HG13  ILE 103          3HG1      ILE 103 -13.970   3.269   4.279
  828   HG21  ILE 103          2HG2      ILE 103 -11.563   6.095   4.392
  829   HG22  ILE 103          1HG2      ILE 103 -11.087   5.101   5.767
  830   HG23  ILE 103          3HG2      ILE 103 -11.974   6.602   6.029
  831   HD11  ILE 103          3HD1      ILE 103 -12.633   3.371   2.251
  832   HD12  ILE 103          2HD1      ILE 103 -11.788   4.788   2.869
  833   HD13  ILE 103          1HD1      ILE 103 -13.511   4.880   2.507
  834    H    ASP 104           H        ASP 104 -14.605   2.323   5.793
  835    HA   ASP 104           HA       ASP 104 -17.379   3.232   6.204
  836    HB2  ASP 104           HB2      ASP 104 -16.199   1.243   4.266
  837    HB3  ASP 104           HB3      ASP 104 -17.927   1.381   4.550
  838    H    GLU 105           H        GLU 105 -15.100   0.681   6.787
  839    HA   GLU 105           HA       GLU 105 -15.134  -1.285   7.885
  840    HB2  GLU 105           HB2      GLU 105 -16.012   0.205   9.752
  841    HB3  GLU 105           HB3      GLU 105 -17.624  -0.360   9.322
  842    HG2  GLU 105           HG2      GLU 105 -16.951  -2.659   9.774
  843    HG3  GLU 105           HG3      GLU 105 -15.327  -2.111  10.179
  844    H    LYS 106           H        LYS 106 -15.645  -2.075   5.761
  845    HA   LYS 106           HA       LYS 106 -18.186  -3.524   5.694
  846    HB2  LYS 106           HB2      LYS 106 -17.049  -1.813   3.473
  847    HB3  LYS 106           HB3      LYS 106 -18.294  -3.026   3.210
  848    HG2  LYS 106           HG2      LYS 106 -19.874  -1.822   4.474
  849    HG3  LYS 106           HG3      LYS 106 -18.635  -0.764   5.154
  850    HD2  LYS 106           HD2      LYS 106 -19.964   0.351   3.405
  851    HD3  LYS 106           HD3      LYS 106 -18.254   0.245   2.988
  852    HE2  LYS 106           HE2      LYS 106 -18.747  -1.718   1.580
  853    HE3  LYS 106           HE3      LYS 106 -20.460  -1.543   1.962
  854    HZ1  LYS 106           HZ1      LYS 106 -19.866  -0.543  -0.184
  855    HZ2  LYS 106           HZ2      LYS 106 -18.800   0.516   0.605
  856    HZ3  LYS 106           HZ3      LYS 106 -20.468   0.610   0.907
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1 -17.349   2.350  -5.761
    2    H2   MET   1           H2       MET   1 -18.277   3.660  -6.309
    3    H3   MET   1           H3       MET   1 -16.608   3.842  -6.075
    4    HA   MET   1           HA       MET   1 -17.856   2.036  -8.063
    5    HB2  MET   1           HB2      MET   1 -16.539   4.740  -8.383
    6    HB3  MET   1           HB3      MET   1 -16.876   3.653  -9.723
    7    HG2  MET   1           HG2      MET   1 -18.936   4.833  -7.873
    8    HG3  MET   1           HG3      MET   1 -18.564   5.405  -9.500
    9    HE1  MET   1           HE1      MET   1 -21.515   4.619  -8.521
   10    HE2  MET   1           HE2      MET   1 -21.143   5.207 -10.142
   11    HE3  MET   1           HE3      MET   1 -22.090   3.731  -9.933
   12    H    LYS   2           H        LYS   2 -14.868   3.871  -7.564
   13    HA   LYS   2           HA       LYS   2 -13.351   1.364  -7.640
   14    HB2  LYS   2           HB2      LYS   2 -12.814   3.821  -9.317
   15    HB3  LYS   2           HB3      LYS   2 -11.592   2.598  -9.005
   16    HG2  LYS   2           HG2      LYS   2 -14.231   2.083 -10.366
   17    HG3  LYS   2           HG3      LYS   2 -12.695   2.352 -11.194
   18    HD2  LYS   2           HD2      LYS   2 -11.771   0.385  -9.969
   19    HD3  LYS   2           HD3      LYS   2 -13.386   0.084  -9.326
   20    HE2  LYS   2           HE2      LYS   2 -12.627   0.127 -12.245
   21    HE3  LYS   2           HE3      LYS   2 -12.911  -1.317 -11.277
   22    HZ1  LYS   2           HZ1      LYS   2 -14.938   0.792 -11.814
   23    HZ2  LYS   2           HZ2      LYS   2 -15.194  -0.663 -10.979
   24    HZ3  LYS   2           HZ3      LYS   2 -14.834  -0.687 -12.638
   25    H    ARG   3           H        ARG   3 -12.716   1.398  -5.544
   26    HA   ARG   3           HA       ARG   3 -12.072   3.748  -4.103
   27    HB2  ARG   3           HB2      ARG   3 -12.755   1.545  -3.107
   28    HB3  ARG   3           HB3      ARG   3 -11.158   0.929  -3.511
   29    HG2  ARG   3           HG2      ARG   3 -11.148   1.543  -1.215
   30    HG3  ARG   3           HG3      ARG   3 -10.180   2.729  -2.094
   31    HD2  ARG   3           HD2      ARG   3 -11.575   3.885  -0.517
   32    HD3  ARG   3           HD3      ARG   3 -12.148   4.231  -2.147
   33    HE   ARG   3           HE       ARG   3 -13.537   2.021  -1.003
   34   HH11  ARG   3          2HH1      ARG   3 -13.356   5.535  -0.989
   35   HH12  ARG   3          1HH1      ARG   3 -15.007   5.733  -0.478
   36   HH21  ARG   3          2HH2      ARG   3 -15.681   2.293  -0.272
   37   HH22  ARG   3          1HH2      ARG   3 -16.325   3.891  -0.042
   38    H    LYS   4           H        LYS   4 -10.283   4.932  -4.110
   39    HA   LYS   4           HA       LYS   4  -8.028   4.031  -5.719
   40    HB2  LYS   4           HB2      LYS   4  -8.559   6.687  -4.374
   41    HB3  LYS   4           HB3      LYS   4  -7.210   6.344  -5.449
   42    HG2  LYS   4           HG2      LYS   4 -10.129   6.309  -6.192
   43    HG3  LYS   4           HG3      LYS   4  -8.954   7.560  -6.608
   44    HD2  LYS   4           HD2      LYS   4  -7.664   5.903  -7.886
   45    HD3  LYS   4           HD3      LYS   4  -8.867   4.674  -7.489
   46    HE2  LYS   4           HE2      LYS   4  -9.353   5.458  -9.681
   47    HE3  LYS   4           HE3      LYS   4 -10.580   6.120  -8.602
   48    HZ1  LYS   4           HZ1      LYS   4  -9.852   7.822 -10.088
   49    HZ2  LYS   4           HZ2      LYS   4  -8.225   7.551  -9.710
   50    HZ3  LYS   4           HZ3      LYS   4  -9.265   8.206  -8.542
   51    H    ILE   5           H        ILE   5  -6.375   3.010  -4.807
   52    HA   ILE   5           HA       ILE   5  -5.691   3.679  -2.020
   53    HB   ILE   5           HB       ILE   5  -5.629   0.910  -3.229
   54   HG12  ILE   5          2HG1      ILE   5  -7.488   2.090  -1.149
   55   HG13  ILE   5          3HG1      ILE   5  -7.927   1.695  -2.807
   56   HG21  ILE   5          2HG2      ILE   5  -5.060   1.845  -0.418
   57   HG22  ILE   5          1HG2      ILE   5  -3.869   1.269  -1.584
   58   HG23  ILE   5          3HG2      ILE   5  -5.094   0.166  -0.959
   59   HD11  ILE   5          3HD1      ILE   5  -8.712  -0.006  -1.269
   60   HD12  ILE   5          2HD1      ILE   5  -7.064  -0.267  -0.692
   61   HD13  ILE   5          1HD1      ILE   5  -7.489  -0.664  -2.357
   62    H    ILE   6           H        ILE   6  -3.583   4.089  -1.660
   63    HA   ILE   6           HA       ILE   6  -1.665   3.187  -3.700
   64    HB   ILE   6           HB       ILE   6  -0.121   4.954  -2.969
   65   HG12  ILE   6          2HG1      ILE   6  -1.227   5.196  -0.656
   66   HG13  ILE   6          3HG1      ILE   6  -0.646   6.658  -1.441
   67   HG21  ILE   6          2HG2      ILE   6  -1.511   5.340  -4.900
   68   HG22  ILE   6          1HG2      ILE   6  -1.299   6.846  -4.005
   69   HG23  ILE   6          3HG2      ILE   6  -2.813   5.952  -3.877
   70   HD11  ILE   6          3HD1      ILE   6  -3.502   5.715  -1.368
   71   HD12  ILE   6          2HD1      ILE   6  -2.918   7.193  -2.130
   72   HD13  ILE   6          1HD1      ILE   6  -2.805   6.997  -0.381
   73    H    ALA   7           H        ALA   7   0.122   2.050  -3.023
   74    HA   ALA   7           HA       ALA   7   0.194   1.385  -0.160
   75    HB1  ALA   7           HB1      ALA   7   0.204  -0.618  -2.412
   76    HB2  ALA   7           HB2      ALA   7   0.437  -0.991  -0.705
   77    HB3  ALA   7           HB3      ALA   7  -1.107  -0.348  -1.265
   78    H    VAL   8           H        VAL   8   2.174   1.284   0.676
   79    HA   VAL   8           HA       VAL   8   4.453   1.302  -1.190
   80    HB   VAL   8           HB       VAL   8   4.404   2.263   1.677
   81   HG11  VAL   8          2HG1      VAL   8   6.507   2.516  -0.469
   82   HG12  VAL   8          1HG1      VAL   8   6.602   1.515   0.981
   83   HG13  VAL   8          3HG1      VAL   8   6.574   3.273   1.122
   84   HG21  VAL   8          3HG2      VAL   8   3.016   3.688   0.268
   85   HG22  VAL   8          2HG2      VAL   8   4.341   3.866  -0.878
   86   HG23  VAL   8          1HG2      VAL   8   4.489   4.529   0.749
   87    H    THR   9           H        THR   9   5.871  -0.333  -1.111
   88    HA   THR   9           HA       THR   9   5.533  -2.300   1.054
   89    HB   THR   9           HB       THR   9   6.514  -3.943  -0.648
   90    HG1  THR   9           HG1      THR   9   5.962  -1.703  -2.299
   91   HG21  THR   9          3HG2      THR   9   4.321  -4.332  -1.689
   92   HG22  THR   9          1HG2      THR   9   3.791  -2.739  -1.147
   93   HG23  THR   9          2HG2      THR   9   4.179  -3.989   0.035
   94    H    ALA  10           H        ALA  10   7.235  -2.792   2.274
   95    HA   ALA  10           HA       ALA  10   9.944  -2.273   1.317
   96    HB1  ALA  10           HB1      ALA  10   9.260  -0.161   2.365
   97    HB2  ALA  10           HB2      ALA  10   8.893  -1.028   3.857
   98    HB3  ALA  10           HB3      ALA  10  10.553  -0.952   3.265
   99    H    CYS  11           H        CYS  11  11.568  -3.219   2.703
  100    HA   CYS  11           HA       CYS  11  11.020  -4.796   4.947
  101    HB2  CYS  11           HB2      CYS  11   9.761  -6.177   3.298
  102    HB3  CYS  11           HB3      CYS  11  11.251  -6.405   2.391
  103    HG   CYS  11           HG       CYS  11  10.077  -8.269   4.743
  104    H    ALA  12           H        ALA  12  12.939  -4.282   2.075
  105    HA   ALA  12           HA       ALA  12  15.146  -3.926   1.757
  106    HB1  ALA  12           HB1      ALA  12  15.081  -2.620   3.836
  107    HB2  ALA  12           HB2      ALA  12  15.436  -4.083   4.755
  108    HB3  ALA  12           HB3      ALA  12  16.623  -3.448   3.615
  109    H    THR  13           H        THR  13  15.175  -6.154   4.552
  110    HA   THR  13           HA       THR  13  17.167  -7.811   3.370
  111    HB   THR  13           HB       THR  13  15.333  -8.388   5.710
  112    HG1  THR  13           HG1      THR  13  16.624  -6.574   6.125
  113   HG21  THR  13          3HG2      THR  13  17.027 -10.027   6.368
  114   HG22  THR  13          1HG2      THR  13  17.947  -9.673   4.903
  115   HG23  THR  13          2HG2      THR  13  16.353 -10.418   4.787
  116    H    GLY  14           H        GLY  14  13.667  -8.231   3.919
  117    HA2  GLY  14           HA1      GLY  14  13.632 -10.659   2.334
  118    HA3  GLY  14           HA2      GLY  14  12.248  -9.887   3.095
  119    H    VAL  15           H        VAL  15  14.531  -9.551   0.426
  120    HA   VAL  15           HA       VAL  15  13.259  -7.465  -0.929
  121    HB   VAL  15           HB       VAL  15  14.844  -9.683  -2.226
  122   HG11  VAL  15          2HG1      VAL  15  13.776  -8.217  -3.817
  123   HG12  VAL  15          1HG1      VAL  15  15.511  -7.893  -3.793
  124   HG13  VAL  15          3HG1      VAL  15  14.396  -6.796  -2.974
  125   HG21  VAL  15          3HG2      VAL  15  16.837  -8.327  -1.790
  126   HG22  VAL  15          2HG2      VAL  15  16.061  -8.847  -0.293
  127   HG23  VAL  15          1HG2      VAL  15  15.857  -7.191  -0.864
  128    H    ALA  16           H        ALA  16  12.984 -10.984  -1.410
  129    HA   ALA  16           HA       ALA  16  11.182 -10.836  -3.574
  130    HB1  ALA  16           HB1      ALA  16  12.491 -12.839  -3.056
  131    HB2  ALA  16           HB2      ALA  16  11.532 -13.082  -1.595
  132    HB3  ALA  16           HB3      ALA  16  10.769 -13.196  -3.182
  133    H    HIS  17           H        HIS  17  10.691 -10.943  -0.093
  134    HA   HIS  17           HA       HIS  17   7.900 -11.336  -0.133
  135    HB2  HIS  17           HB2      HIS  17   9.689 -10.044   1.917
  136    HB3  HIS  17           HB3      HIS  17   7.959 -10.255   2.157
  137    HD1  HIS  17           HD1      HIS  17   7.398 -13.063   1.419
  138    HD2  HIS  17           HD2      HIS  17  10.948 -11.970   3.267
  139    HE1  HIS  17           HE1      HIS  17   8.223 -15.140   2.570
  140    HE2  HIS  17           HE2      HIS  17  10.285 -14.412   3.825
  141    H    THR  18           H        THR  18   9.910  -8.505  -0.447
  142    HA   THR  18           HA       THR  18   7.932  -6.531  -0.084
  143    HB   THR  18           HB       THR  18  10.423  -6.339  -1.795
  144    HG1  THR  18           HG1      THR  18  10.759  -7.030   0.453
  145   HG21  THR  18          3HG2      THR  18  10.312  -3.951  -1.262
  146   HG22  THR  18          1HG2      THR  18   8.813  -4.218  -0.368
  147   HG23  THR  18          2HG2      THR  18   8.862  -4.483  -2.111
  148    H    TYR  19           H        TYR  19   9.238  -8.043  -3.037
  149    HA   TYR  19           HA       TYR  19   7.500  -6.684  -4.815
  150    HB2  TYR  19           HB2      TYR  19   9.036  -9.266  -5.120
  151    HB3  TYR  19           HB3      TYR  19   8.124  -8.519  -6.423
  152    HD1  TYR  19           HD2      TYR  19   8.771  -6.100  -7.062
  153    HD2  TYR  19           HD1      TYR  19  11.260  -8.674  -4.761
  154    HE1  TYR  19           HE2      TYR  19  10.726  -4.733  -7.655
  155    HE2  TYR  19           HE1      TYR  19  13.219  -7.314  -5.352
  156    HH   TYR  19           HH       TYR  19  12.973  -4.234  -6.750
  157    H    MET  20           H        MET  20   7.311  -9.762  -3.114
  158    HA   MET  20           HA       MET  20   5.074 -10.821  -4.398
  159    HB2  MET  20           HB2      MET  20   6.491 -12.104  -2.851
  160    HB3  MET  20           HB3      MET  20   5.861 -11.161  -1.506
  161    HG2  MET  20           HG2      MET  20   4.710 -13.243  -1.552
  162    HG3  MET  20           HG3      MET  20   3.588 -11.977  -2.062
  163    HE1  MET  20           HE1      MET  20   5.868 -14.953  -3.229
  164    HE2  MET  20           HE2      MET  20   5.622 -14.930  -4.975
  165    HE3  MET  20           HE3      MET  20   6.486 -13.609  -4.187
  166    H    ALA  21           H        ALA  21   5.219  -8.909  -1.391
  167    HA   ALA  21           HA       ALA  21   2.454  -8.826  -0.943
  168    HB1  ALA  21           HB1      ALA  21   4.505  -6.769  -0.138
  169    HB2  ALA  21           HB2      ALA  21   2.907  -6.988   0.571
  170    HB3  ALA  21           HB3      ALA  21   4.132  -8.242   0.755
  171    H    ALA  22           H        ALA  22   4.580  -6.649  -2.746
  172    HA   ALA  22           HA       ALA  22   2.720  -4.642  -3.333
  173    HB1  ALA  22           HB1      ALA  22   5.031  -5.587  -5.031
  174    HB2  ALA  22           HB2      ALA  22   4.211  -4.030  -5.162
  175    HB3  ALA  22           HB3      ALA  22   5.134  -4.422  -3.710
  176    H    GLN  23           H        GLN  23   3.601  -7.544  -5.152
  177    HA   GLN  23           HA       GLN  23   1.755  -7.056  -7.268
  178    HB2  GLN  23           HB2      GLN  23   3.344  -9.493  -6.463
  179    HB3  GLN  23           HB3      GLN  23   2.320  -9.439  -7.893
  180    HG2  GLN  23           HG2      GLN  23   3.656  -7.742  -8.883
  181    HG3  GLN  23           HG3      GLN  23   4.561  -7.502  -7.391
  182   HE21  GLN  23          1HE2      GLN  23   4.789 -10.335  -6.836
  183   HE22  GLN  23          2HE2      GLN  23   5.967 -10.958  -7.942
  184    H    ALA  24           H        ALA  24   1.610  -8.788  -4.235
  185    HA   ALA  24           HA       ALA  24  -0.796 -10.212  -4.830
  186    HB1  ALA  24           HB1      ALA  24   0.431  -9.566  -2.152
  187    HB2  ALA  24           HB2      ALA  24  -0.839 -10.751  -2.452
  188    HB3  ALA  24           HB3      ALA  24   0.774 -10.996  -3.124
  189    H    LEU  25           H        LEU  25  -0.049  -7.197  -3.119
  190    HA   LEU  25           HA       LEU  25  -2.669  -6.545  -2.354
  191    HB2  LEU  25           HB2      LEU  25  -0.282  -4.833  -3.000
  192    HB3  LEU  25           HB3      LEU  25  -1.814  -4.136  -2.505
  193    HG   LEU  25           HG       LEU  25  -0.214  -6.093  -0.852
  194   HD11  LEU  25          2HD1      LEU  25   0.964  -3.973  -1.077
  195   HD12  LEU  25          1HD1      LEU  25   0.314  -4.158   0.551
  196   HD13  LEU  25          3HD1      LEU  25  -0.493  -3.101  -0.604
  197   HD21  LEU  25          3HD2      LEU  25  -2.621  -4.406  -0.172
  198   HD22  LEU  25          2HD2      LEU  25  -1.748  -5.467   0.934
  199   HD23  LEU  25          1HD2      LEU  25  -2.628  -6.149  -0.434
  200    H    LYS  26           H        LYS  26  -0.883  -5.711  -5.308
  201    HA   LYS  26           HA       LYS  26  -2.959  -4.303  -6.585
  202    HB2  LYS  26           HB2      LYS  26  -0.609  -4.249  -7.333
  203    HB3  LYS  26           HB3      LYS  26  -0.727  -5.934  -7.819
  204    HG2  LYS  26           HG2      LYS  26  -2.447  -5.313  -9.469
  205    HG3  LYS  26           HG3      LYS  26  -2.246  -3.621  -9.010
  206    HD2  LYS  26           HD2      LYS  26  -0.046  -5.385 -10.080
  207    HD3  LYS  26           HD3      LYS  26  -0.985  -4.252 -11.053
  208    HE2  LYS  26           HE2      LYS  26  -0.162  -2.393  -9.749
  209    HE3  LYS  26           HE3      LYS  26   0.683  -3.491  -8.658
  210    HZ1  LYS  26           HZ1      LYS  26   2.130  -2.459 -10.357
  211    HZ2  LYS  26           HZ2      LYS  26   1.258  -3.274 -11.563
  212    HZ3  LYS  26           HZ3      LYS  26   2.134  -4.151 -10.409
  213    H    LYS  27           H        LYS  27  -2.036  -7.698  -6.627
  214    HA   LYS  27           HA       LYS  27  -3.862  -8.744  -8.433
  215    HB2  LYS  27           HB2      LYS  27  -1.973  -9.948  -7.426
  216    HB3  LYS  27           HB3      LYS  27  -2.781  -9.928  -5.871
  217    HG2  LYS  27           HG2      LYS  27  -4.563 -11.345  -6.812
  218    HG3  LYS  27           HG3      LYS  27  -3.662 -11.412  -8.335
  219    HD2  LYS  27           HD2      LYS  27  -1.719 -12.312  -7.088
  220    HD3  LYS  27           HD3      LYS  27  -2.710 -12.352  -5.632
  221    HE2  LYS  27           HE2      LYS  27  -4.217 -13.945  -6.677
  222    HE3  LYS  27           HE3      LYS  27  -3.286 -13.867  -8.174
  223    HZ1  LYS  27           HZ1      LYS  27  -2.673 -15.810  -6.876
  224    HZ2  LYS  27           HZ2      LYS  27  -2.273 -14.836  -5.552
  225    HZ3  LYS  27           HZ3      LYS  27  -1.367 -14.737  -6.978
  226    H    GLY  28           H        GLY  28  -4.198  -8.340  -4.910
  227    HA2  GLY  28           HA1      GLY  28  -6.864  -9.329  -4.809
  228    HA3  GLY  28           HA2      GLY  28  -6.041  -8.439  -3.539
  229    H    ALA  29           H        ALA  29  -5.502  -6.099  -5.133
  230    HA   ALA  29           HA       ALA  29  -7.866  -4.669  -4.603
  231    HB1  ALA  29           HB1      ALA  29  -6.773  -2.786  -5.722
  232    HB2  ALA  29           HB2      ALA  29  -5.689  -3.598  -4.591
  233    HB3  ALA  29           HB3      ALA  29  -5.525  -3.878  -6.326
  234    H    LYS  30           H        LYS  30  -6.445  -5.721  -7.699
  235    HA   LYS  30           HA       LYS  30  -8.599  -4.689  -9.246
  236    HB2  LYS  30           HB2      LYS  30  -7.617  -5.861 -11.118
  237    HB3  LYS  30           HB3      LYS  30  -6.350  -5.089 -10.180
  238    HG2  LYS  30           HG2      LYS  30  -5.906  -7.289  -9.099
  239    HG3  LYS  30           HG3      LYS  30  -7.058  -8.011 -10.224
  240    HD2  LYS  30           HD2      LYS  30  -4.496  -6.578 -10.919
  241    HD3  LYS  30           HD3      LYS  30  -4.825  -8.303 -11.086
  242    HE2  LYS  30           HE2      LYS  30  -6.531  -7.832 -12.758
  243    HE3  LYS  30           HE3      LYS  30  -6.263  -6.100 -12.566
  244    HZ1  LYS  30           HZ1      LYS  30  -5.085  -6.817 -14.484
  245    HZ2  LYS  30           HZ2      LYS  30  -4.362  -8.104 -13.652
  246    HZ3  LYS  30           HZ3      LYS  30  -3.927  -6.507 -13.285
  247    H    LYS  31           H        LYS  31  -8.056  -7.653  -7.535
  248    HA   LYS  31           HA       LYS  31 -10.097  -9.208  -8.741
  249    HB2  LYS  31           HB2      LYS  31  -8.262 -10.113  -7.310
  250    HB3  LYS  31           HB3      LYS  31  -9.025  -9.363  -5.916
  251    HG2  LYS  31           HG2      LYS  31  -9.598 -11.672  -5.929
  252    HG3  LYS  31           HG3      LYS  31 -11.042 -10.748  -6.353
  253    HD2  LYS  31           HD2      LYS  31 -10.657 -11.230  -8.722
  254    HD3  LYS  31           HD3      LYS  31  -9.207 -12.146  -8.302
  255    HE2  LYS  31           HE2      LYS  31 -10.616 -13.670  -6.953
  256    HE3  LYS  31           HE3      LYS  31 -12.041 -12.788  -7.504
  257    HZ1  LYS  31           HZ1      LYS  31 -11.651 -14.802  -8.799
  258    HZ2  LYS  31           HZ2      LYS  31 -10.126 -14.225  -9.265
  259    HZ3  LYS  31           HZ3      LYS  31 -11.529 -13.416  -9.773
  260    H    MET  32           H        MET  32  -9.996  -7.113  -5.892
  261    HA   MET  32           HA       MET  32 -12.755  -7.511  -5.236
  262    HB2  MET  32           HB2      MET  32 -10.703  -5.516  -4.285
  263    HB3  MET  32           HB3      MET  32 -12.347  -5.580  -3.664
  264    HG2  MET  32           HG2      MET  32 -10.379  -7.853  -3.548
  265    HG3  MET  32           HG3      MET  32 -10.705  -6.730  -2.228
  266    HE1  MET  32           HE1      MET  32 -13.103  -6.560  -0.991
  267    HE2  MET  32           HE2      MET  32 -13.844  -6.283  -2.569
  268    HE3  MET  32           HE3      MET  32 -14.500  -7.514  -1.489
  269    H    GLY  33           H        GLY  33 -11.077  -5.468  -7.411
  270    HA2  GLY  33           HA1      GLY  33 -12.174  -4.286  -9.137
  271    HA3  GLY  33           HA2      GLY  33 -13.620  -4.218  -8.140
  272    H    ASN  34           H        ASN  34 -10.308  -3.289  -7.271
  273    HA   ASN  34           HA       ASN  34 -11.248  -0.499  -7.070
  274    HB2  ASN  34           HB2      ASN  34  -9.202  -1.800  -5.257
  275    HB3  ASN  34           HB3      ASN  34  -9.859  -0.173  -5.113
  276   HD21  ASN  34          1HD2      ASN  34 -10.239  -3.450  -4.312
  277   HD22  ASN  34          2HD2      ASN  34 -11.729  -3.311  -3.445
  278    H    LEU  35           H        LEU  35  -9.105   0.943  -6.777
  279    HA   LEU  35           HA       LEU  35  -7.232   0.095  -8.897
  280    HB2  LEU  35           HB2      LEU  35  -8.256   2.880  -8.317
  281    HB3  LEU  35           HB3      LEU  35  -7.008   2.495  -9.487
  282    HG   LEU  35           HG       LEU  35  -9.888   1.591  -9.631
  283   HD11  LEU  35          2HD1      LEU  35  -9.639   3.967 -10.072
  284   HD12  LEU  35          1HD1      LEU  35 -10.007   3.093 -11.560
  285   HD13  LEU  35          3HD1      LEU  35  -8.358   3.631 -11.237
  286   HD21  LEU  35          3HD2      LEU  35  -9.305   0.756 -11.841
  287   HD22  LEU  35          2HD2      LEU  35  -8.341  -0.040 -10.598
  288   HD23  LEU  35          1HD2      LEU  35  -7.624   1.231 -11.589
  289    H    ILE  36           H        ILE  36  -5.142   0.041  -8.306
  290    HA   ILE  36           HA       ILE  36  -4.384   1.447  -5.841
  291    HB   ILE  36           HB       ILE  36  -4.848  -0.913  -5.320
  292   HG12  ILE  36          2HG1      ILE  36  -1.916  -0.187  -5.183
  293   HG13  ILE  36          3HG1      ILE  36  -3.152   0.348  -4.052
  294   HG21  ILE  36          2HG2      ILE  36  -2.614  -1.494  -7.261
  295   HG22  ILE  36          1HG2      ILE  36  -4.317  -1.913  -7.466
  296   HG23  ILE  36          3HG2      ILE  36  -3.369  -2.673  -6.186
  297   HD11  ILE  36          3HD1      ILE  36  -3.527  -1.980  -3.383
  298   HD12  ILE  36          2HD1      ILE  36  -1.859  -1.470  -3.119
  299   HD13  ILE  36          1HD1      ILE  36  -2.260  -2.491  -4.499
  300    H    LYS  37           H        LYS  37  -2.463   2.413  -5.836
  301    HA   LYS  37           HA       LYS  37  -0.576   1.806  -8.019
  302    HB2  LYS  37           HB2      LYS  37  -0.987   4.415  -6.533
  303    HB3  LYS  37           HB3      LYS  37   0.310   4.122  -7.685
  304    HG2  LYS  37           HG2      LYS  37  -2.640   4.072  -8.292
  305    HG3  LYS  37           HG3      LYS  37  -1.512   5.364  -8.709
  306    HD2  LYS  37           HD2      LYS  37  -1.237   2.517  -9.661
  307    HD3  LYS  37           HD3      LYS  37  -2.055   3.782 -10.579
  308    HE2  LYS  37           HE2      LYS  37   0.800   3.978  -9.641
  309    HE3  LYS  37           HE3      LYS  37   0.335   3.357 -11.223
  310    HZ1  LYS  37           HZ1      LYS  37  -0.246   6.083 -10.192
  311    HZ2  LYS  37           HZ2      LYS  37  -0.714   5.488 -11.704
  312    HZ3  LYS  37           HZ3      LYS  37   0.931   5.687 -11.341
  313    H    VAL  38           H        VAL  38   0.978   0.555  -7.276
  314    HA   VAL  38           HA       VAL  38   1.661   0.744  -4.431
  315    HB   VAL  38           HB       VAL  38   0.907  -1.453  -5.235
  316   HG11  VAL  38          2HG1      VAL  38   1.716  -1.362  -7.520
  317   HG12  VAL  38          1HG1      VAL  38   2.331  -2.799  -6.702
  318   HG13  VAL  38          3HG1      VAL  38   3.385  -1.406  -6.948
  319   HG21  VAL  38          3HG2      VAL  38   2.730  -2.786  -4.281
  320   HG22  VAL  38          2HG2      VAL  38   2.398  -1.342  -3.322
  321   HG23  VAL  38          1HG2      VAL  38   3.800  -1.389  -4.392
  322    H    GLU  39           H        GLU  39   3.624   1.201  -3.710
  323    HA   GLU  39           HA       GLU  39   5.749   1.745  -5.677
  324    HB2  GLU  39           HB2      GLU  39   5.063   3.735  -4.465
  325    HB3  GLU  39           HB3      GLU  39   5.259   2.909  -2.927
  326    HG2  GLU  39           HG2      GLU  39   7.651   2.784  -3.263
  327    HG3  GLU  39           HG3      GLU  39   7.489   3.515  -4.859
  328    H    THR  40           H        THR  40   7.785   0.891  -5.354
  329    HA   THR  40           HA       THR  40   8.014  -1.074  -3.175
  330    HB   THR  40           HB       THR  40   9.502  -1.062  -5.811
  331    HG1  THR  40           HG1      THR  40   7.225  -2.532  -4.919
  332   HG21  THR  40          3HG2      THR  40   9.320  -3.149  -3.631
  333   HG22  THR  40          1HG2      THR  40  10.733  -2.158  -4.002
  334   HG23  THR  40          2HG2      THR  40  10.155  -3.345  -5.173
  335    H    GLN  41           H        GLN  41   9.213  -0.261  -1.565
  336    HA   GLN  41           HA       GLN  41  11.579   1.335  -2.281
  337    HB2  GLN  41           HB2      GLN  41   9.461   2.677  -1.637
  338    HB3  GLN  41           HB3      GLN  41   9.768   2.105  -0.006
  339    HG2  GLN  41           HG2      GLN  41  11.768   3.293   0.160
  340    HG3  GLN  41           HG3      GLN  41  11.875   3.517  -1.588
  341   HE21  GLN  41          1HE2      GLN  41  10.523   5.019  -2.585
  342   HE22  GLN  41          2HE2      GLN  41   9.750   6.287  -1.709
  343    H    GLY  42           H        GLY  42  13.134  -0.036  -1.622
  344    HA2  GLY  42           HA1      GLY  42  12.847  -1.928   0.447
  345    HA3  GLY  42           HA2      GLY  42  14.376  -1.411  -0.256
  346    H    ALA  43           H        ALA  43  14.595   1.133   0.377
  347    HA   ALA  43           HA       ALA  43  13.811   2.047   2.882
  348    HB1  ALA  43           HB1      ALA  43  16.566   0.799   2.933
  349    HB2  ALA  43           HB2      ALA  43  15.838   1.764   4.218
  350    HB3  ALA  43           HB3      ALA  43  15.150   0.195   3.795
  351    H    THR  44           H        THR  44  16.594   1.828   0.717
  352    HA   THR  44           HA       THR  44  16.711   4.777   0.673
  353    HB   THR  44           HB       THR  44  19.009   2.962  -0.055
  354    HG1  THR  44           HG1      THR  44  18.782   2.432   2.039
  355   HG21  THR  44          3HG2      THR  44  19.163   5.293  -0.785
  356   HG22  THR  44          1HG2      THR  44  20.345   4.953   0.481
  357   HG23  THR  44          2HG2      THR  44  18.869   5.837   0.866
  358    H    GLY  45           H        GLY  45  16.447   1.835  -1.132
  359    HA2  GLY  45           HA1      GLY  45  16.806   3.153  -3.711
  360    HA3  GLY  45           HA2      GLY  45  16.495   1.442  -3.441
  361    H    ILE  46           H        ILE  46  15.202   3.620  -5.127
  362    HA   ILE  46           HA       ILE  46  12.448   3.372  -4.093
  363    HB   ILE  46           HB       ILE  46  13.294   5.592  -5.919
  364   HG12  ILE  46          2HG1      ILE  46  14.850   5.633  -3.981
  365   HG13  ILE  46          3HG1      ILE  46  13.799   7.042  -4.046
  366   HG21  ILE  46          2HG2      ILE  46  10.918   5.192  -5.547
  367   HG22  ILE  46          1HG2      ILE  46  11.417   6.749  -4.884
  368   HG23  ILE  46          3HG2      ILE  46  11.156   5.375  -3.808
  369   HD11  ILE  46          3HD1      ILE  46  14.069   6.249  -1.777
  370   HD12  ILE  46          2HD1      ILE  46  13.465   4.659  -2.242
  371   HD13  ILE  46          1HD1      ILE  46  12.396   6.063  -2.303
  372    H    GLU  47           H        GLU  47  11.300   2.002  -5.358
  373    HA   GLU  47           HA       GLU  47  11.841   2.092  -8.250
  374    HB2  GLU  47           HB2      GLU  47  10.695  -0.189  -6.627
  375    HB3  GLU  47           HB3      GLU  47  10.937  -0.196  -8.372
  376    HG2  GLU  47           HG2      GLU  47  13.398   0.277  -7.844
  377    HG3  GLU  47           HG3      GLU  47  12.996  -0.194  -6.194
  378    H    ASN  48           H        ASN  48  10.216   2.381  -9.642
  379    HA   ASN  48           HA       ASN  48   8.262   3.144 -10.473
  380    HB2  ASN  48           HB2      ASN  48   7.150   1.296  -9.218
  381    HB3  ASN  48           HB3      ASN  48   6.973   2.378  -7.842
  382   HD21  ASN  48          1HD2      ASN  48   4.706   2.108  -7.967
  383   HD22  ASN  48          2HD2      ASN  48   3.781   2.947  -9.164
  384    H    GLU  49           H        GLU  49   8.339   3.980  -7.012
  385    HA   GLU  49           HA       GLU  49   8.417   5.945  -5.907
  386    HB2  GLU  49           HB2      GLU  49  10.364   6.322  -7.434
  387    HB3  GLU  49           HB3      GLU  49   9.285   7.182  -8.524
  388    HG2  GLU  49           HG2      GLU  49   8.905   8.898  -6.922
  389    HG3  GLU  49           HG3      GLU  49   9.724   7.981  -5.658
  390    H    LEU  50           H        LEU  50   6.437   6.453  -5.295
  391    HA   LEU  50           HA       LEU  50   4.450   7.338  -7.201
  392    HB2  LEU  50           HB2      LEU  50   4.356   7.052  -4.200
  393    HB3  LEU  50           HB3      LEU  50   2.988   7.523  -5.190
  394    HG   LEU  50           HG       LEU  50   4.423   4.865  -5.292
  395   HD11  LEU  50          2HD1      LEU  50   1.678   5.632  -4.301
  396   HD12  LEU  50          1HD1      LEU  50   3.040   5.098  -3.315
  397   HD13  LEU  50          3HD1      LEU  50   2.284   3.984  -4.455
  398   HD21  LEU  50          3HD2      LEU  50   3.640   5.528  -7.500
  399   HD22  LEU  50          2HD2      LEU  50   2.034   5.850  -6.847
  400   HD23  LEU  50          1HD2      LEU  50   2.667   4.202  -6.861
  401    H    THR  51           H        THR  51   4.572   9.320  -7.946
  402    HA   THR  51           HA       THR  51   5.730  11.490  -6.513
  403    HB   THR  51           HB       THR  51   4.792  12.880  -8.393
  404    HG1  THR  51           HG1      THR  51   4.196  10.542  -9.806
  405   HG21  THR  51          3HG2      THR  51   6.288  11.955 -10.096
  406   HG22  THR  51          1HG2      THR  51   6.388  10.442  -9.193
  407   HG23  THR  51          2HG2      THR  51   7.045  11.926  -8.503
  408    H    GLU  52           H        GLU  52   4.510  13.554  -6.193
  409    HA   GLU  52           HA       GLU  52   2.571  13.300  -4.246
  410    HB2  GLU  52           HB2      GLU  52   3.997  15.328  -4.902
  411    HB3  GLU  52           HB3      GLU  52   2.745  15.683  -6.082
  412    HG2  GLU  52           HG2      GLU  52   2.365  17.005  -4.136
  413    HG3  GLU  52           HG3      GLU  52   1.100  15.780  -4.235
  414    H    LYS  53           H        LYS  53   2.193  13.506  -7.712
  415    HA   LYS  53           HA       LYS  53  -0.557  14.007  -7.857
  416    HB2  LYS  53           HB2      LYS  53   0.894  14.210  -9.791
  417    HB3  LYS  53           HB3      LYS  53   1.272  12.498  -9.733
  418    HG2  LYS  53           HG2      LYS  53  -1.586  13.155 -10.005
  419    HG3  LYS  53           HG3      LYS  53  -0.562  13.593 -11.374
  420    HD2  LYS  53           HD2      LYS  53  -0.797  10.853 -10.121
  421    HD3  LYS  53           HD3      LYS  53  -1.478  11.353 -11.670
  422    HE2  LYS  53           HE2      LYS  53   0.806  11.809 -12.491
  423    HE3  LYS  53           HE3      LYS  53   1.452  11.222 -10.959
  424    HZ1  LYS  53           HZ1      LYS  53   0.332   9.065 -11.456
  425    HZ2  LYS  53           HZ2      LYS  53   1.583   9.466 -12.527
  426    HZ3  LYS  53           HZ3      LYS  53  -0.029   9.662 -13.006
  427    H    ASP  54           H        ASP  54   1.146  10.862  -8.061
  428    HA   ASP  54           HA       ASP  54  -1.258   9.357  -8.150
  429    HB2  ASP  54           HB2      ASP  54   1.569   8.543  -7.471
  430    HB3  ASP  54           HB3      ASP  54   0.236   7.400  -7.604
  431    H    VAL  55           H        VAL  55   0.834  10.410  -5.590
  432    HA   VAL  55           HA       VAL  55  -0.168   8.844  -3.498
  433    HB   VAL  55           HB       VAL  55   1.068  11.595  -3.505
  434   HG11  VAL  55          2HG1      VAL  55   1.548  11.103  -1.088
  435   HG12  VAL  55          1HG1      VAL  55   0.356   9.807  -1.201
  436   HG13  VAL  55          3HG1      VAL  55  -0.126  11.479  -1.478
  437   HG21  VAL  55          3HG2      VAL  55   2.509   9.836  -4.340
  438   HG22  VAL  55          2HG2      VAL  55   2.186   8.863  -2.904
  439   HG23  VAL  55          1HG2      VAL  55   3.065  10.385  -2.759
  440    H    ASN  56           H        ASN  56  -1.299  11.891  -4.869
  441    HA   ASN  56           HA       ASN  56  -3.399  12.029  -2.856
  442    HB2  ASN  56           HB2      ASN  56  -2.464  13.967  -4.965
  443    HB3  ASN  56           HB3      ASN  56  -3.946  14.219  -4.037
  444   HD21  ASN  56          1HD2      ASN  56  -0.482  14.062  -3.919
  445   HD22  ASN  56          2HD2      ASN  56  -0.290  14.756  -2.338
  446    H    ILE  57           H        ILE  57  -3.035  10.351  -5.570
  447    HA   ILE  57           HA       ILE  57  -5.731  10.634  -6.579
  448    HB   ILE  57           HB       ILE  57  -3.619   8.525  -7.091
  449   HG12  ILE  57          2HG1      ILE  57  -3.114  10.716  -8.064
  450   HG13  ILE  57          3HG1      ILE  57  -3.489   9.546  -9.324
  451   HG21  ILE  57          2HG2      ILE  57  -6.321   8.822  -8.400
  452   HG22  ILE  57          1HG2      ILE  57  -5.842   7.538  -7.290
  453   HG23  ILE  57          3HG2      ILE  57  -5.065   7.675  -8.868
  454   HD11  ILE  57          3HD1      ILE  57  -5.347  11.658  -8.258
  455   HD12  ILE  57          2HD1      ILE  57  -5.738  10.482  -9.513
  456   HD13  ILE  57          1HD1      ILE  57  -4.490  11.696  -9.799
  457    H    GLY  58           H        GLY  58  -3.872   8.258  -4.714
  458    HA2  GLY  58           HA1      GLY  58  -6.095   6.624  -4.029
  459    HA3  GLY  58           HA2      GLY  58  -4.522   6.625  -3.239
  460    H    GLU  59           H        GLU  59  -7.304   6.524  -2.168
  461    HA   GLU  59           HA       GLU  59  -7.414   9.058  -0.698
  462    HB2  GLU  59           HB2      GLU  59  -9.709   8.303  -0.055
  463    HB3  GLU  59           HB3      GLU  59  -9.476   8.511  -1.783
  464    HG2  GLU  59           HG2      GLU  59  -9.015   5.998  -1.838
  465    HG3  GLU  59           HG3      GLU  59  -9.718   5.969  -0.221
  466    H    VAL  60           H        VAL  60  -6.984   5.609  -0.247
  467    HA   VAL  60           HA       VAL  60  -6.249   6.173   2.530
  468    HB   VAL  60           HB       VAL  60  -8.289   4.822   2.473
  469   HG11  VAL  60          2HG1      VAL  60  -8.266   2.538   1.561
  470   HG12  VAL  60          1HG1      VAL  60  -6.664   2.834   0.889
  471   HG13  VAL  60          3HG1      VAL  60  -8.047   3.756   0.303
  472   HG21  VAL  60          3HG2      VAL  60  -5.851   3.282   3.287
  473   HG22  VAL  60          2HG2      VAL  60  -7.495   2.937   3.819
  474   HG23  VAL  60          1HG2      VAL  60  -6.725   4.460   4.262
  475    H    VAL  61           H        VAL  61  -4.348   5.143   3.282
  476    HA   VAL  61           HA       VAL  61  -2.636   4.154   1.096
  477    HB   VAL  61           HB       VAL  61  -1.637   5.418   3.645
  478   HG11  VAL  61          2HG1      VAL  61  -0.352   4.941   0.960
  479   HG12  VAL  61          1HG1      VAL  61  -0.050   4.028   2.439
  480   HG13  VAL  61          3HG1      VAL  61   0.410   5.729   2.341
  481   HG21  VAL  61          3HG2      VAL  61  -2.153   6.775   0.999
  482   HG22  VAL  61          2HG2      VAL  61  -1.330   7.498   2.380
  483   HG23  VAL  61          1HG2      VAL  61  -3.032   7.058   2.500
  484    H    ILE  62           H        ILE  62  -1.746   2.200   1.278
  485    HA   ILE  62           HA       ILE  62  -1.909   0.842   3.891
  486    HB   ILE  62           HB       ILE  62  -1.863  -0.385   1.125
  487   HG12  ILE  62          2HG1      ILE  62  -4.044  -0.278   3.221
  488   HG13  ILE  62          3HG1      ILE  62  -4.021   0.629   1.711
  489   HG21  ILE  62          2HG2      ILE  62  -0.652  -1.787   2.692
  490   HG22  ILE  62          1HG2      ILE  62  -2.199  -2.533   2.287
  491   HG23  ILE  62          3HG2      ILE  62  -1.994  -1.708   3.831
  492   HD11  ILE  62          3HD1      ILE  62  -4.114  -1.476   0.462
  493   HD12  ILE  62          2HD1      ILE  62  -5.491  -1.282   1.547
  494   HD13  ILE  62          1HD1      ILE  62  -4.171  -2.365   1.985
  495    H    PHE  63           H        PHE  63  -0.042   0.316   4.845
  496    HA   PHE  63           HA       PHE  63   2.404   0.410   3.207
  497    HB2  PHE  63           HB2      PHE  63   1.926   1.096   6.098
  498    HB3  PHE  63           HB3      PHE  63   3.537   0.706   5.509
  499    HD1  PHE  63           HD2      PHE  63   0.816   3.141   5.439
  500    HD2  PHE  63           HD1      PHE  63   4.719   2.194   4.042
  501    HE1  PHE  63           HE2      PHE  63   1.124   5.475   4.728
  502    HE2  PHE  63           HE1      PHE  63   5.036   4.525   3.329
  503    HZ   PHE  63           HZ       PHE  63   3.241   6.165   3.670
  504    H    ALA  64           H        ALA  64   2.742  -1.656   2.607
  505    HA   ALA  64           HA       ALA  64   2.804  -3.709   4.696
  506    HB1  ALA  64           HB1      ALA  64   3.258  -3.968   1.718
  507    HB2  ALA  64           HB2      ALA  64   3.168  -5.296   2.874
  508    HB3  ALA  64           HB3      ALA  64   1.742  -4.308   2.553
  509    H    VAL  65           H        VAL  65   4.593  -3.134   5.878
  510    HA   VAL  65           HA       VAL  65   7.145  -3.042   4.435
  511    HB   VAL  65           HB       VAL  65   7.874  -1.096   5.781
  512   HG11  VAL  65          2HG1      VAL  65   7.068  -0.764   3.499
  513   HG12  VAL  65          1HG1      VAL  65   6.644   0.607   4.527
  514   HG13  VAL  65          3HG1      VAL  65   5.418  -0.587   4.102
  515   HG21  VAL  65          3HG2      VAL  65   6.320  -1.332   7.653
  516   HG22  VAL  65          2HG2      VAL  65   4.970  -0.922   6.591
  517   HG23  VAL  65          1HG2      VAL  65   6.216   0.278   6.939
  518    H    ASP  66           H        ASP  66   8.928  -3.651   5.589
  519    HA   ASP  66           HA       ASP  66   8.471  -4.645   8.327
  520    HB2  ASP  66           HB2      ASP  66   9.054  -6.338   6.496
  521    HB3  ASP  66           HB3      ASP  66  10.642  -5.582   6.442
  522    H    THR  67           H        THR  67   9.532  -2.104   6.781
  523    HA   THR  67           HA       THR  67  11.419  -1.323   8.803
  524    HB   THR  67           HB       THR  67  12.862  -2.504   7.131
  525    HG1  THR  67           HG1      THR  67  14.183  -1.082   7.957
  526   HG21  THR  67          3HG2      THR  67  11.974  -0.290   5.280
  527   HG22  THR  67          1HG2      THR  67  11.582  -2.002   5.115
  528   HG23  THR  67          2HG2      THR  67  13.252  -1.461   4.950
  529    H    LYS  68           H        LYS  68  12.367   0.998   7.689
  530    HA   LYS  68           HA       LYS  68   9.922   2.570   7.542
  531    HB2  LYS  68           HB2      LYS  68  11.353   4.501   7.852
  532    HB3  LYS  68           HB3      LYS  68  11.793   3.266   9.026
  533    HG2  LYS  68           HG2      LYS  68  13.704   2.625   7.698
  534    HG3  LYS  68           HG3      LYS  68  13.234   3.764   6.433
  535    HD2  LYS  68           HD2      LYS  68  13.607   5.629   7.926
  536    HD3  LYS  68           HD3      LYS  68  13.950   4.528   9.262
  537    HE2  LYS  68           HE2      LYS  68  15.542   4.651   6.706
  538    HE3  LYS  68           HE3      LYS  68  15.982   5.501   8.186
  539    HZ1  LYS  68           HZ1      LYS  68  15.527   2.588   8.256
  540    HZ2  LYS  68           HZ2      LYS  68  16.499   3.547   9.261
  541    HZ3  LYS  68           HZ3      LYS  68  17.004   3.195   7.684
  542    H    VAL  69           H        VAL  69   9.897   4.431   5.985
  543    HA   VAL  69           HA       VAL  69  11.270   3.887   3.464
  544    HB   VAL  69           HB       VAL  69   9.297   4.309   2.127
  545   HG11  VAL  69          2HG1      VAL  69   9.745   1.998   2.731
  546   HG12  VAL  69          1HG1      VAL  69   8.013   2.292   2.576
  547   HG13  VAL  69          3HG1      VAL  69   8.749   2.173   4.175
  548   HG21  VAL  69          3HG2      VAL  69   8.105   5.808   3.592
  549   HG22  VAL  69          2HG2      VAL  69   7.799   4.494   4.731
  550   HG23  VAL  69          1HG2      VAL  69   7.064   4.463   3.126
  551    H    ARG  70           H        ARG  70  10.833   5.820   1.925
  552    HA   ARG  70           HA       ARG  70  11.615   8.186   3.450
  553    HB2  ARG  70           HB2      ARG  70  13.108   7.396   1.663
  554    HB3  ARG  70           HB3      ARG  70  11.808   7.578   0.493
  555    HG2  ARG  70           HG2      ARG  70  11.769  10.009   1.012
  556    HG3  ARG  70           HG3      ARG  70  13.190   9.761   2.029
  557    HD2  ARG  70           HD2      ARG  70  14.375   8.838   0.057
  558    HD3  ARG  70           HD3      ARG  70  12.975   9.248  -0.933
  559    HE   ARG  70           HE       ARG  70  14.074  11.453   0.574
  560   HH11  ARG  70          2HH1      ARG  70  14.106   9.708  -2.470
  561   HH12  ARG  70          1HH1      ARG  70  14.863  11.001  -3.351
  562   HH21  ARG  70          2HH2      ARG  70  15.058  13.159  -0.582
  563   HH22  ARG  70          1HH2      ARG  70  15.396  12.961  -2.280
  564    H    ASN  71           H        ASN  71   9.401   7.202   0.875
  565    HA   ASN  71           HA       ASN  71   8.385   9.847   0.513
  566    HB2  ASN  71           HB2      ASN  71   7.504   7.198  -0.623
  567    HB3  ASN  71           HB3      ASN  71   6.744   8.729  -1.036
  568   HD21  ASN  71          1HD2      ASN  71   8.049   6.967  -2.845
  569   HD22  ASN  71          2HD2      ASN  71   9.404   7.832  -3.501
  570    H    LYS  72           H        LYS  72   7.787   7.623   2.865
  571    HA   LYS  72           HA       LYS  72   5.106   7.422   3.314
  572    HB2  LYS  72           HB2      LYS  72   6.673   6.381   4.794
  573    HB3  LYS  72           HB3      LYS  72   7.323   7.931   5.296
  574    HG2  LYS  72           HG2      LYS  72   5.255   8.460   6.435
  575    HG3  LYS  72           HG3      LYS  72   4.533   6.956   5.859
  576    HD2  LYS  72           HD2      LYS  72   5.266   6.709   8.159
  577    HD3  LYS  72           HD3      LYS  72   6.233   5.685   7.100
  578    HE2  LYS  72           HE2      LYS  72   7.653   6.765   8.735
  579    HE3  LYS  72           HE3      LYS  72   8.016   7.377   7.121
  580    HZ1  LYS  72           HZ1      LYS  72   6.970   9.405   7.578
  581    HZ2  LYS  72           HZ2      LYS  72   7.833   9.058   8.997
  582    HZ3  LYS  72           HZ3      LYS  72   6.158   8.791   8.938
  583    H    GLU  73           H        GLU  73   7.048  10.296   3.646
  584    HA   GLU  73           HA       GLU  73   5.475  11.720   5.452
  585    HB2  GLU  73           HB2      GLU  73   7.211  12.827   3.248
  586    HB3  GLU  73           HB3      GLU  73   6.635  13.720   4.649
  587    HG2  GLU  73           HG2      GLU  73   8.582  11.436   4.588
  588    HG3  GLU  73           HG3      GLU  73   8.864  13.096   5.111
  589    H    ARG  74           H        ARG  74   4.914  11.219   2.022
  590    HA   ARG  74           HA       ARG  74   2.978  13.384   1.939
  591    HB2  ARG  74           HB2      ARG  74   2.690  12.704  -0.412
  592    HB3  ARG  74           HB3      ARG  74   4.369  13.029  -0.004
  593    HG2  ARG  74           HG2      ARG  74   4.352  10.416   0.459
  594    HG3  ARG  74           HG3      ARG  74   3.043  10.486  -0.719
  595    HD2  ARG  74           HD2      ARG  74   5.156  10.091  -1.840
  596    HD3  ARG  74           HD3      ARG  74   4.510  11.672  -2.260
  597    HE   ARG  74           HE       ARG  74   6.229  12.034  -0.115
  598   HH11  ARG  74          2HH1      ARG  74   6.425  10.925  -3.423
  599   HH12  ARG  74          1HH1      ARG  74   8.018  11.569  -3.681
  600   HH21  ARG  74          2HH2      ARG  74   8.323  12.927  -0.464
  601   HH22  ARG  74          1HH2      ARG  74   9.081  12.728  -2.010
  602    H    PHE  75           H        PHE  75   3.006  10.059   2.700
  603    HA   PHE  75           HA       PHE  75   0.168   9.697   2.133
  604    HB2  PHE  75           HB2      PHE  75   2.122   7.755   3.369
  605    HB3  PHE  75           HB3      PHE  75   0.544   7.387   2.706
  606    HD1  PHE  75           HD2      PHE  75   0.204   7.724   0.196
  607    HD2  PHE  75           HD1      PHE  75   4.020   7.615   2.060
  608    HE1  PHE  75           HE2      PHE  75   1.247   7.201  -1.970
  609    HE2  PHE  75           HE1      PHE  75   5.072   7.086  -0.093
  610    HZ   PHE  75           HZ       PHE  75   3.685   6.879  -2.117
  611    H    ASP  76           H        ASP  76   2.249  10.633   4.600
  612    HA   ASP  76           HA       ASP  76   1.278   9.336   6.864
  613    HB2  ASP  76           HB2      ASP  76   3.413  10.463   6.874
  614    HB3  ASP  76           HB3      ASP  76   2.637  12.020   6.605
  615    H    GLY  77           H        GLY  77   0.365  12.515   5.547
  616    HA2  GLY  77           HA1      GLY  77  -1.452  12.969   7.763
  617    HA3  GLY  77           HA2      GLY  77  -1.144  14.059   6.422
  618    H    LYS  78           H        LYS  78  -2.001  10.722   5.908
  619    HA   LYS  78           HA       LYS  78  -4.705  11.574   5.106
  620    HB2  LYS  78           HB2      LYS  78  -2.999   9.437   3.811
  621    HB3  LYS  78           HB3      LYS  78  -4.643   9.848   3.353
  622    HG2  LYS  78           HG2      LYS  78  -3.978  11.962   2.523
  623    HG3  LYS  78           HG3      LYS  78  -2.366  11.802   3.230
  624    HD2  LYS  78           HD2      LYS  78  -1.935   9.879   1.758
  625    HD3  LYS  78           HD3      LYS  78  -3.526  10.100   1.023
  626    HE2  LYS  78           HE2      LYS  78  -1.351  12.169   1.058
  627    HE3  LYS  78           HE3      LYS  78  -1.647  11.071  -0.284
  628    HZ1  LYS  78           HZ1      LYS  78  -3.540  13.114   0.769
  629    HZ2  LYS  78           HZ2      LYS  78  -3.896  12.018  -0.475
  630    HZ3  LYS  78           HZ3      LYS  78  -2.692  13.192  -0.696
  631    H    VAL  79           H        VAL  79  -3.888   8.316   4.717
  632    HA   VAL  79           HA       VAL  79  -4.930   7.531   7.344
  633    HB   VAL  79           HB       VAL  79  -5.929   6.322   4.754
  634   HG11  VAL  79          2HG1      VAL  79  -6.789   5.914   7.614
  635   HG12  VAL  79          1HG1      VAL  79  -5.896   4.766   6.617
  636   HG13  VAL  79          3HG1      VAL  79  -7.557   5.192   6.202
  637   HG21  VAL  79          3HG2      VAL  79  -7.329   8.247   6.606
  638   HG22  VAL  79          2HG2      VAL  79  -8.092   7.381   5.272
  639   HG23  VAL  79          1HG2      VAL  79  -6.825   8.563   4.945
  640    H    VAL  80           H        VAL  80  -3.455   6.184   8.186
  641    HA   VAL  80           HA       VAL  80  -1.712   4.754   6.290
  642    HB   VAL  80           HB       VAL  80  -1.090   5.627   9.118
  643   HG11  VAL  80          2HG1      VAL  80   1.189   4.904   8.647
  644   HG12  VAL  80          1HG1      VAL  80   0.702   4.365   7.041
  645   HG13  VAL  80          3HG1      VAL  80   0.066   3.556   8.471
  646   HG21  VAL  80          3HG2      VAL  80   0.458   7.212   8.057
  647   HG22  VAL  80          2HG2      VAL  80  -1.214   7.518   7.584
  648   HG23  VAL  80          1HG2      VAL  80  -0.117   6.702   6.469
  649    H    LEU  81           H        LEU  81  -2.574   2.764   6.096
  650    HA   LEU  81           HA       LEU  81  -3.050   1.207   8.541
  651    HB2  LEU  81           HB2      LEU  81  -4.673   1.243   6.546
  652    HB3  LEU  81           HB3      LEU  81  -3.473   0.300   5.693
  653    HG   LEU  81           HG       LEU  81  -5.380  -1.005   6.687
  654   HD11  LEU  81          2HD1      LEU  81  -2.604  -1.714   7.618
  655   HD12  LEU  81          1HD1      LEU  81  -3.324  -2.123   6.060
  656   HD13  LEU  81          3HD1      LEU  81  -3.973  -2.822   7.544
  657   HD21  LEU  81          3HD2      LEU  81  -4.003  -0.321   9.279
  658   HD22  LEU  81          2HD2      LEU  81  -5.314  -1.482   9.078
  659   HD23  LEU  81          1HD2      LEU  81  -5.600   0.231   8.773
  660    H    GLU  82           H        GLU  82  -1.128   0.544   9.327
  661    HA   GLU  82           HA       GLU  82   0.953  -0.276   7.426
  662    HB2  GLU  82           HB2      GLU  82   1.452   1.583   9.023
  663    HB3  GLU  82           HB3      GLU  82   1.258   0.442  10.346
  664    HG2  GLU  82           HG2      GLU  82   3.123  -0.869   9.519
  665    HG3  GLU  82           HG3      GLU  82   3.297   0.223   8.145
  666    H    VAL  83           H        VAL  83   1.428  -2.339   7.225
  667    HA   VAL  83           HA       VAL  83   1.154  -4.151   9.512
  668    HB   VAL  83           HB       VAL  83   0.218  -5.919   8.004
  669   HG11  VAL  83          2HG1      VAL  83  -1.246  -4.751   9.547
  670   HG12  VAL  83          1HG1      VAL  83  -2.094  -5.095   8.040
  671   HG13  VAL  83          3HG1      VAL  83  -1.500  -3.467   8.366
  672   HG21  VAL  83          3HG2      VAL  83  -0.883  -5.230   5.921
  673   HG22  VAL  83          2HG2      VAL  83   0.860  -4.970   5.861
  674   HG23  VAL  83          1HG2      VAL  83  -0.226  -3.606   6.119
  675    HA   PRO  84           HA       PRO  84   5.050  -5.823   8.130
  676    HB2  PRO  84           HB2      PRO  84   3.860  -8.525   8.419
  677    HB3  PRO  84           HB3      PRO  84   5.309  -7.849   9.172
  678    HG2  PRO  84           HG2      PRO  84   3.079  -8.210  10.586
  679    HG3  PRO  84           HG3      PRO  84   4.106  -6.786  10.843
  680    HD2  PRO  84           HD2      PRO  84   1.514  -7.014   9.365
  681    HD3  PRO  84           HD3      PRO  84   2.098  -5.713  10.423
  682    H    VAL  85           H        VAL  85   5.969  -6.561   6.248
  683    HA   VAL  85           HA       VAL  85   4.377  -6.424   3.929
  684    HB   VAL  85           HB       VAL  85   6.785  -5.781   4.081
  685   HG11  VAL  85          2HG1      VAL  85   8.492  -7.517   3.769
  686   HG12  VAL  85          1HG1      VAL  85   7.252  -8.753   3.969
  687   HG13  VAL  85          3HG1      VAL  85   7.645  -7.676   5.308
  688   HG21  VAL  85          3HG2      VAL  85   7.378  -6.482   1.832
  689   HG22  VAL  85          2HG2      VAL  85   5.674  -6.035   1.920
  690   HG23  VAL  85          1HG2      VAL  85   6.138  -7.735   1.882
  691    H    SER  86           H        SER  86   5.194  -9.064   5.954
  692    HA   SER  86           HA       SER  86   4.927 -11.161   4.041
  693    HB2  SER  86           HB2      SER  86   4.699 -12.550   6.194
  694    HB3  SER  86           HB3      SER  86   6.207 -11.666   5.951
  695    HG   SER  86           HG       SER  86   4.072 -11.131   7.716
  696    H    ALA  87           H        ALA  87   2.676  -9.326   5.941
  697    HA   ALA  87           HA       ALA  87   0.678 -11.317   6.220
  698    HB1  ALA  87           HB1      ALA  87   0.359  -8.329   6.415
  699    HB2  ALA  87           HB2      ALA  87  -0.754  -9.549   7.035
  700    HB3  ALA  87           HB3      ALA  87   0.862  -9.397   7.726
  701    HA   PRO  88           HA       PRO  88  -1.711  -9.029   2.694
  702    HB2  PRO  88           HB2      PRO  88   0.341  -7.621   1.134
  703    HB3  PRO  88           HB3      PRO  88  -1.198  -7.027   1.763
  704    HG2  PRO  88           HG2      PRO  88   1.141  -6.227   2.803
  705    HG3  PRO  88           HG3      PRO  88  -0.299  -6.467   3.814
  706    HD2  PRO  88           HD2      PRO  88   2.050  -8.288   3.405
  707    HD3  PRO  88           HD3      PRO  88   1.222  -7.842   4.914
  708    H    ILE  89           H        ILE  89   1.029 -10.888   2.494
  709    HA   ILE  89           HA       ILE  89   1.070 -11.467  -0.289
  710    HB   ILE  89           HB       ILE  89   2.066 -13.072   2.071
  711   HG12  ILE  89          2HG1      ILE  89   3.457 -11.256   0.087
  712   HG13  ILE  89          3HG1      ILE  89   3.200 -10.933   1.797
  713   HG21  ILE  89          2HG2      ILE  89   1.618 -14.544   0.181
  714   HG22  ILE  89          1HG2      ILE  89   3.353 -14.382   0.457
  715   HG23  ILE  89          3HG2      ILE  89   2.585 -13.507  -0.870
  716   HD11  ILE  89          3HD1      ILE  89   5.483 -11.591   1.381
  717   HD12  ILE  89          2HD1      ILE  89   4.938 -13.095   0.635
  718   HD13  ILE  89          1HD1      ILE  89   4.666 -12.813   2.356
  719    H    LYS  90           H        LYS  90  -0.333 -13.138   2.518
  720    HA   LYS  90           HA       LYS  90  -1.988 -14.735   0.718
  721    HB2  LYS  90           HB2      LYS  90  -1.099 -16.124   2.375
  722    HB3  LYS  90           HB3      LYS  90  -1.317 -14.923   3.638
  723    HG2  LYS  90           HG2      LYS  90  -2.864 -16.780   3.905
  724    HG3  LYS  90           HG3      LYS  90  -3.725 -15.276   3.583
  725    HD2  LYS  90           HD2      LYS  90  -3.732 -16.018   1.132
  726    HD3  LYS  90           HD3      LYS  90  -3.268 -17.608   1.742
  727    HE2  LYS  90           HE2      LYS  90  -5.677 -17.489   1.454
  728    HE3  LYS  90           HE3      LYS  90  -5.272 -17.632   3.165
  729    HZ1  LYS  90           HZ1      LYS  90  -5.665 -15.294   3.466
  730    HZ2  LYS  90           HZ2      LYS  90  -7.021 -15.974   2.699
  731    HZ3  LYS  90           HZ3      LYS  90  -5.909 -15.068   1.801
  732    H    ASP  91           H        ASP  91  -2.342 -12.414   3.394
  733    HA   ASP  91           HA       ASP  91  -5.243 -12.538   2.971
  734    HB2  ASP  91           HB2      ASP  91  -3.655 -11.625   5.372
  735    HB3  ASP  91           HB3      ASP  91  -5.408 -11.523   5.245
  736    H    ALA  92           H        ALA  92  -3.710 -11.026   1.173
  737    HA   ALA  92           HA       ALA  92  -3.604  -8.292   1.633
  738    HB1  ALA  92           HB1      ALA  92  -4.411  -9.694  -0.917
  739    HB2  ALA  92           HB2      ALA  92  -3.872  -8.020  -0.786
  740    HB3  ALA  92           HB3      ALA  92  -2.761  -9.337  -0.408
  741    H    GLU  93           H        GLU  93  -6.322 -10.341   0.825
  742    HA   GLU  93           HA       GLU  93  -8.311  -8.462   0.338
  743    HB2  GLU  93           HB2      GLU  93  -8.707 -11.033   1.875
  744    HB3  GLU  93           HB3      GLU  93  -9.862 -10.223   0.828
  745    HG2  GLU  93           HG2      GLU  93  -8.698 -10.864  -1.120
  746    HG3  GLU  93           HG3      GLU  93  -7.276 -11.349  -0.196
  747    H    LYS  94           H        LYS  94  -7.212  -9.845   3.421
  748    HA   LYS  94           HA       LYS  94  -9.141  -8.419   4.977
  749    HB2  LYS  94           HB2      LYS  94  -6.650  -9.939   5.752
  750    HB3  LYS  94           HB3      LYS  94  -7.727  -9.184   6.920
  751    HG2  LYS  94           HG2      LYS  94  -9.573 -10.581   6.102
  752    HG3  LYS  94           HG3      LYS  94  -8.464 -11.357   4.970
  753    HD2  LYS  94           HD2      LYS  94  -7.139 -12.220   6.802
  754    HD3  LYS  94           HD3      LYS  94  -8.137 -11.350   7.968
  755    HE2  LYS  94           HE2      LYS  94  -9.115 -13.526   6.125
  756    HE3  LYS  94           HE3      LYS  94  -8.705 -13.745   7.826
  757    HZ1  LYS  94           HZ1      LYS  94 -10.827 -11.935   6.794
  758    HZ2  LYS  94           HZ2      LYS  94 -10.453 -12.205   8.425
  759    HZ3  LYS  94           HZ3      LYS  94 -11.093 -13.459   7.485
  760    H    VAL  95           H        VAL  95  -5.841  -7.856   3.962
  761    HA   VAL  95           HA       VAL  95  -5.345  -5.651   5.688
  762    HB   VAL  95           HB       VAL  95  -4.059  -6.310   3.026
  763   HG11  VAL  95          2HG1      VAL  95  -3.179  -4.474   5.248
  764   HG12  VAL  95          1HG1      VAL  95  -3.640  -4.009   3.610
  765   HG13  VAL  95          3HG1      VAL  95  -2.175  -4.952   3.881
  766   HG21  VAL  95          3HG2      VAL  95  -2.278  -7.315   4.389
  767   HG22  VAL  95          2HG2      VAL  95  -3.827  -8.132   4.614
  768   HG23  VAL  95          1HG2      VAL  95  -3.234  -7.011   5.840
  769    H    ILE  96           H        ILE  96  -6.555  -5.953   2.380
  770    HA   ILE  96           HA       ILE  96  -6.729  -3.218   1.769
  771    HB   ILE  96           HB       ILE  96  -8.293  -5.596   0.746
  772   HG12  ILE  96          2HG1      ILE  96  -6.121  -3.912  -0.530
  773   HG13  ILE  96          3HG1      ILE  96  -5.867  -5.479   0.232
  774   HG21  ILE  96          2HG2      ILE  96  -9.066  -4.148  -1.088
  775   HG22  ILE  96          1HG2      ILE  96  -8.356  -2.753  -0.274
  776   HG23  ILE  96          3HG2      ILE  96  -9.692  -3.626   0.477
  777   HD11  ILE  96          3HD1      ILE  96  -7.591  -4.964  -2.178
  778   HD12  ILE  96          2HD1      ILE  96  -7.292  -6.533  -1.431
  779   HD13  ILE  96          1HD1      ILE  96  -5.970  -5.652  -2.195
  780    H    ASN  97           H        ASN  97  -9.125  -5.454   3.121
  781    HA   ASN  97           HA       ASN  97 -11.141  -3.467   3.404
  782    HB2  ASN  97           HB2      ASN  97 -10.819  -6.260   4.456
  783    HB3  ASN  97           HB3      ASN  97 -12.159  -5.241   4.980
  784   HD21  ASN  97          1HD2      ASN  97 -10.793  -7.072   2.382
  785   HD22  ASN  97          2HD2      ASN  97 -12.156  -6.959   1.320
  786    H    ALA  98           H        ALA  98  -8.423  -4.381   5.307
  787    HA   ALA  98           HA       ALA  98  -9.325  -3.429   7.821
  788    HB1  ALA  98           HB1      ALA  98  -6.983  -3.441   8.473
  789    HB2  ALA  98           HB2      ALA  98  -7.374  -4.909   7.577
  790    HB3  ALA  98           HB3      ALA  98  -6.495  -3.599   6.785
  791    H    ALA  99           H        ALA  99  -7.619  -1.940   5.114
  792    HA   ALA  99           HA       ALA  99  -7.213   0.588   6.320
  793    HB1  ALA  99           HB1      ALA  99  -6.749   1.366   4.059
  794    HB2  ALA  99           HB2      ALA  99  -5.963  -0.185   4.355
  795    HB3  ALA  99           HB3      ALA  99  -7.439  -0.116   3.393
  796    H    LEU 100           H        LEU 100  -9.724  -0.699   4.178
  797    HA   LEU 100           HA       LEU 100 -11.273   1.626   3.997
  798    HB2  LEU 100           HB2      LEU 100 -11.767  -1.281   3.582
  799    HB3  LEU 100           HB3      LEU 100 -13.150  -0.206   3.666
  800    HG   LEU 100           HG       LEU 100 -12.452  -0.625   1.361
  801   HD11  LEU 100          2HD1      LEU 100 -12.359   1.710   0.632
  802   HD12  LEU 100          1HD1      LEU 100 -11.973   2.204   2.280
  803   HD13  LEU 100          3HD1      LEU 100 -13.541   1.480   1.922
  804   HD21  LEU 100          3HD2      LEU 100  -9.892   0.766   2.121
  805   HD22  LEU 100          2HD2      LEU 100 -10.361   0.265   0.495
  806   HD23  LEU 100          1HD2      LEU 100 -10.056  -0.948   1.740
  807    H    ALA 101           H        ALA 101 -11.181  -0.917   6.416
  808    HA   ALA 101           HA       ALA 101 -13.607  -0.313   7.707
  809    HB1  ALA 101           HB1      ALA 101 -11.121  -1.546   8.889
  810    HB2  ALA 101           HB2      ALA 101 -12.746  -1.616   9.571
  811    HB3  ALA 101           HB3      ALA 101 -12.399  -2.415   8.038
  812    H    LEU 102           H        LEU 102 -10.627   1.379   7.679
  813    HA   LEU 102           HA       LEU 102 -11.012   2.660  10.233
  814    HB2  LEU 102           HB2      LEU 102  -9.133   3.340   7.972
  815    HB3  LEU 102           HB3      LEU 102  -9.099   4.061   9.569
  816    HG   LEU 102           HG       LEU 102  -8.502   1.187   8.877
  817   HD11  LEU 102          2HD1      LEU 102  -6.704   2.704   8.318
  818   HD12  LEU 102          1HD1      LEU 102  -6.267   1.757   9.740
  819   HD13  LEU 102          3HD1      LEU 102  -6.786   3.432   9.921
  820   HD21  LEU 102          3HD2      LEU 102  -8.030   0.872  11.240
  821   HD22  LEU 102          2HD2      LEU 102  -9.709   1.358  11.006
  822   HD23  LEU 102          1HD2      LEU 102  -8.522   2.532  11.576
  823    H    ILE 103           H        ILE 103 -11.454   3.526   6.830
  824    HA   ILE 103           HA       ILE 103 -12.433   6.160   7.664
  825    HB   ILE 103           HB       ILE 103 -12.214   6.769   5.261
  826   HG12  ILE 103          2HG1      ILE 103 -10.810   4.091   5.041
  827   HG13  ILE 103          3HG1      ILE 103 -12.389   4.457   4.354
  828   HG21  ILE 103          2HG2      ILE 103  -9.767   6.913   5.323
  829   HG22  ILE 103          1HG2      ILE 103  -9.741   5.742   6.639
  830   HG23  ILE 103          3HG2      ILE 103 -10.496   7.317   6.877
  831   HD11  ILE 103          3HD1      ILE 103 -11.383   6.137   2.913
  832   HD12  ILE 103          2HD1      ILE 103 -10.630   4.558   2.678
  833   HD13  ILE 103          1HD1      ILE 103  -9.800   5.801   3.616
  834    H    ASP 104           H        ASP 104 -13.420   3.301   5.880
  835    HA   ASP 104           HA       ASP 104 -16.019   4.560   5.327
  836    HB2  ASP 104           HB2      ASP 104 -14.535   3.516   3.466
  837    HB3  ASP 104           HB3      ASP 104 -15.069   1.970   4.119
  838    H    GLU 105           H        GLU 105 -14.400   2.144   7.117
  839    HA   GLU 105           HA       GLU 105 -15.026   0.615   8.656
  840    HB2  GLU 105           HB2      GLU 105 -17.490   2.362   8.790
  841    HB3  GLU 105           HB3      GLU 105 -17.112   1.087   9.941
  842    HG2  GLU 105           HG2      GLU 105 -15.021   2.255  10.515
  843    HG3  GLU 105           HG3      GLU 105 -15.469   3.552   9.410
  844    H    LYS 106           H        LYS 106 -15.058  -0.850   6.779
  845    HA   LYS 106           HA       LYS 106 -17.686  -2.130   6.558
  846    HB2  LYS 106           HB2      LYS 106 -15.722  -1.674   4.301
  847    HB3  LYS 106           HB3      LYS 106 -17.144  -2.704   4.194
  848    HG2  LYS 106           HG2      LYS 106 -17.226   0.238   4.814
  849    HG3  LYS 106           HG3      LYS 106 -17.453  -0.455   3.206
  850    HD2  LYS 106           HD2      LYS 106 -19.450  -1.534   3.845
  851    HD3  LYS 106           HD3      LYS 106 -19.126  -1.285   5.562
  852    HE2  LYS 106           HE2      LYS 106 -20.876   0.220   4.649
  853    HE3  LYS 106           HE3      LYS 106 -19.503   1.073   5.354
  854    HZ1  LYS 106           HZ1      LYS 106 -19.865   0.574   2.448
  855    HZ2  LYS 106           HZ2      LYS 106 -18.635   1.492   3.170
  856    HZ3  LYS 106           HZ3      LYS 106 -20.242   2.026   3.234
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1 -16.223  -2.230  -6.935
    2    H2   MET   1           H2       MET   1 -16.780  -1.108  -8.075
    3    H3   MET   1           H3       MET   1 -17.692  -1.417  -6.682
    4    HA   MET   1           HA       MET   1 -16.577   0.670  -6.453
    5    HB2  MET   1           HB2      MET   1 -15.398  -1.546  -4.769
    6    HB3  MET   1           HB3      MET   1 -15.147   0.159  -4.431
    7    HG2  MET   1           HG2      MET   1 -16.867  -0.572  -3.001
    8    HG3  MET   1           HG3      MET   1 -17.635   0.394  -4.257
    9    HE1  MET   1           HE1      MET   1 -19.195  -1.577  -2.273
   10    HE2  MET   1           HE2      MET   1 -19.991  -0.596  -3.503
   11    HE3  MET   1           HE3      MET   1 -20.332  -2.323  -3.396
   12    H    LYS   2           H        LYS   2 -15.247   1.697  -7.794
   13    HA   LYS   2           HA       LYS   2 -12.594   0.590  -8.345
   14    HB2  LYS   2           HB2      LYS   2 -14.133   2.912  -9.501
   15    HB3  LYS   2           HB3      LYS   2 -12.431   2.648  -9.857
   16    HG2  LYS   2           HG2      LYS   2 -14.605   0.632 -10.377
   17    HG3  LYS   2           HG3      LYS   2 -13.973   1.759 -11.581
   18    HD2  LYS   2           HD2      LYS   2 -11.806   0.775 -11.479
   19    HD3  LYS   2           HD3      LYS   2 -12.241  -0.177 -10.060
   20    HE2  LYS   2           HE2      LYS   2 -13.424  -0.485 -12.815
   21    HE3  LYS   2           HE3      LYS   2 -12.206  -1.539 -12.094
   22    HZ1  LYS   2           HZ1      LYS   2 -15.036  -1.195 -11.293
   23    HZ2  LYS   2           HZ2      LYS   2 -13.890  -1.888 -10.256
   24    HZ3  LYS   2           HZ3      LYS   2 -14.231  -2.623 -11.743
   25    H    ARG   3           H        ARG   3 -12.370   0.946  -5.904
   26    HA   ARG   3           HA       ARG   3 -12.026   3.638  -4.989
   27    HB2  ARG   3           HB2      ARG   3 -12.547   1.339  -3.708
   28    HB3  ARG   3           HB3      ARG   3 -10.802   1.362  -3.514
   29    HG2  ARG   3           HG2      ARG   3 -11.655   2.374  -1.586
   30    HG3  ARG   3           HG3      ARG   3 -11.084   3.710  -2.590
   31    HD2  ARG   3           HD2      ARG   3 -13.386   4.048  -3.399
   32    HD3  ARG   3           HD3      ARG   3 -13.936   2.757  -2.335
   33    HE   ARG   3           HE       ARG   3 -12.966   5.408  -1.506
   34   HH11  ARG   3          2HH1      ARG   3 -14.432   2.333  -0.685
   35   HH12  ARG   3          1HH1      ARG   3 -15.026   2.880   0.851
   36   HH21  ARG   3          2HH2      ARG   3 -13.733   6.129   0.526
   37   HH22  ARG   3          1HH2      ARG   3 -14.604   5.019   1.557
   38    H    LYS   4           H        LYS   4 -10.261   4.853  -5.090
   39    HA   LYS   4           HA       LYS   4  -7.853   3.861  -6.316
   40    HB2  LYS   4           HB2      LYS   4  -8.156   6.518  -4.930
   41    HB3  LYS   4           HB3      LYS   4  -7.057   6.094  -6.234
   42    HG2  LYS   4           HG2      LYS   4 -10.040   6.418  -6.418
   43    HG3  LYS   4           HG3      LYS   4  -8.811   7.489  -7.089
   44    HD2  LYS   4           HD2      LYS   4  -8.079   5.730  -8.601
   45    HD3  LYS   4           HD3      LYS   4  -9.245   4.611  -7.890
   46    HE2  LYS   4           HE2      LYS   4  -9.868   7.145  -9.400
   47    HE3  LYS   4           HE3      LYS   4 -10.101   5.496  -9.976
   48    HZ1  LYS   4           HZ1      LYS   4 -12.184   6.366  -9.222
   49    HZ2  LYS   4           HZ2      LYS   4 -11.526   6.807  -7.727
   50    HZ3  LYS   4           HZ3      LYS   4 -11.688   5.168  -8.128
   51    H    ILE   5           H        ILE   5  -6.175   2.958  -5.285
   52    HA   ILE   5           HA       ILE   5  -5.870   3.533  -2.411
   53    HB   ILE   5           HB       ILE   5  -5.566   0.799  -3.673
   54   HG12  ILE   5          2HG1      ILE   5  -7.644   1.807  -1.710
   55   HG13  ILE   5          3HG1      ILE   5  -7.931   1.516  -3.423
   56   HG21  ILE   5          2HG2      ILE   5  -3.978   1.185  -1.863
   57   HG22  ILE   5          1HG2      ILE   5  -5.201   0.007  -1.388
   58   HG23  ILE   5          3HG2      ILE   5  -5.297   1.665  -0.795
   59   HD11  ILE   5          3HD1      ILE   5  -7.192  -0.551  -1.361
   60   HD12  ILE   5          2HD1      ILE   5  -7.420  -0.860  -3.084
   61   HD13  ILE   5          1HD1      ILE   5  -8.777  -0.313  -2.097
   62    H    ILE   6           H        ILE   6  -3.845   4.072  -1.824
   63    HA   ILE   6           HA       ILE   6  -1.668   3.331  -3.657
   64    HB   ILE   6           HB       ILE   6  -0.319   5.145  -2.663
   65   HG12  ILE   6          2HG1      ILE   6  -1.732   5.257  -0.520
   66   HG13  ILE   6          3HG1      ILE   6  -1.156   6.775  -1.192
   67   HG21  ILE   6          2HG2      ILE   6  -2.914   6.027  -3.908
   68   HG22  ILE   6          1HG2      ILE   6  -1.457   5.511  -4.759
   69   HG23  ILE   6          3HG2      ILE   6  -1.444   6.998  -3.810
   70   HD11  ILE   6          3HD1      ILE   6  -3.935   5.646  -1.467
   71   HD12  ILE   6          2HD1      ILE   6  -3.368   7.160  -2.175
   72   HD13  ILE   6          1HD1      ILE   6  -3.436   6.977  -0.422
   73    H    ALA   7           H        ALA   7  -0.111   2.037  -2.931
   74    HA   ALA   7           HA       ALA   7  -0.024   1.453  -0.054
   75    HB1  ALA   7           HB1      ALA   7   0.020  -0.946  -0.509
   76    HB2  ALA   7           HB2      ALA   7  -1.475  -0.216  -1.096
   77    HB3  ALA   7           HB3      ALA   7  -0.190  -0.628  -2.231
   78    H    VAL   8           H        VAL   8   1.973   0.989   0.739
   79    HA   VAL   8           HA       VAL   8   4.186   0.941  -1.211
   80    HB   VAL   8           HB       VAL   8   4.244   2.079   1.594
   81   HG11  VAL   8          2HG1      VAL   8   6.487   2.858   1.016
   82   HG12  VAL   8          1HG1      VAL   8   6.365   2.058  -0.551
   83   HG13  VAL   8          3HG1      VAL   8   6.382   1.099   0.930
   84   HG21  VAL   8          3HG2      VAL   8   4.537   4.251   0.478
   85   HG22  VAL   8          2HG2      VAL   8   2.981   3.512   0.100
   86   HG23  VAL   8          1HG2      VAL   8   4.289   3.467  -1.083
   87    H    THR   9           H        THR   9   5.464  -0.786  -1.156
   88    HA   THR   9           HA       THR   9   5.302  -2.567   1.189
   89    HB   THR   9           HB       THR   9   6.049  -4.358  -0.495
   90    HG1  THR   9           HG1      THR   9   6.333  -2.476  -2.121
   91   HG21  THR   9          3HG2      THR   9   3.816  -4.307   0.473
   92   HG22  THR   9          1HG2      THR   9   3.736  -4.762  -1.229
   93   HG23  THR   9          2HG2      THR   9   3.303  -3.126  -0.732
   94    H    ALA  10           H        ALA  10   7.119  -2.660   2.343
   95    HA   ALA  10           HA       ALA  10   9.689  -2.304   0.953
   96    HB1  ALA  10           HB1      ALA  10   8.913  -0.924   3.520
   97    HB2  ALA  10           HB2      ALA  10  10.506  -0.875   2.765
   98    HB3  ALA  10           HB3      ALA  10   9.120  -0.158   1.946
   99    H    CYS  11           H        CYS  11  10.999  -3.936   1.346
  100    HA   CYS  11           HA       CYS  11  11.002  -5.137   4.029
  101    HB2  CYS  11           HB2      CYS  11   9.860  -6.673   2.491
  102    HB3  CYS  11           HB3      CYS  11  11.250  -6.640   1.411
  103    HG   CYS  11           HG       CYS  11  12.799  -7.588   3.856
  104    H    ALA  12           H        ALA  12  12.692  -3.605   1.593
  105    HA   ALA  12           HA       ALA  12  14.853  -3.088   1.177
  106    HB1  ALA  12           HB1      ALA  12  15.241  -3.833   4.072
  107    HB2  ALA  12           HB2      ALA  12  16.346  -2.874   3.089
  108    HB3  ALA  12           HB3      ALA  12  14.737  -2.257   3.465
  109    H    THR  13           H        THR  13  15.848  -5.456   3.548
  110    HA   THR  13           HA       THR  13  17.371  -6.860   1.517
  111    HB   THR  13           HB       THR  13  18.224  -8.142   3.554
  112    HG1  THR  13           HG1      THR  13  16.351  -7.397   4.861
  113   HG21  THR  13          3HG2      THR  13  18.631  -5.150   3.431
  114   HG22  THR  13          1HG2      THR  13  19.520  -6.364   2.509
  115   HG23  THR  13          2HG2      THR  13  19.688  -6.292   4.262
  116    H    GLY  14           H        GLY  14  15.959  -8.085   0.377
  117    HA2  GLY  14           HA1      GLY  14  15.182 -10.527   0.754
  118    HA3  GLY  14           HA2      GLY  14  14.050  -9.752   1.855
  119    H    VAL  15           H        VAL  15  15.216  -9.542  -1.489
  120    HA   VAL  15           HA       VAL  15  13.091  -8.065  -2.520
  121    HB   VAL  15           HB       VAL  15  13.761  -8.998  -4.728
  122   HG11  VAL  15          2HG1      VAL  15  15.990  -8.039  -2.941
  123   HG12  VAL  15          1HG1      VAL  15  14.865  -7.030  -3.852
  124   HG13  VAL  15          3HG1      VAL  15  16.032  -8.043  -4.704
  125   HG21  VAL  15          3HG2      VAL  15  15.673 -10.491  -4.875
  126   HG22  VAL  15          2HG2      VAL  15  14.373 -11.254  -3.959
  127   HG23  VAL  15          1HG2      VAL  15  15.766 -10.574  -3.116
  128    H    ALA  16           H        ALA  16  13.358 -11.491  -1.846
  129    HA   ALA  16           HA       ALA  16  11.183 -12.403  -3.378
  130    HB1  ALA  16           HB1      ALA  16  11.168 -14.346  -1.911
  131    HB2  ALA  16           HB2      ALA  16  12.818 -13.902  -2.349
  132    HB3  ALA  16           HB3      ALA  16  12.190 -13.492  -0.753
  133    H    HIS  17           H        HIS  17  11.343 -10.930  -0.194
  134    HA   HIS  17           HA       HIS  17   8.501 -11.290   0.264
  135    HB2  HIS  17           HB2      HIS  17  10.766 -10.161   1.835
  136    HB3  HIS  17           HB3      HIS  17   9.150  -9.571   2.198
  137    HD1  HIS  17           HD1      HIS  17   7.481 -11.225   3.257
  138    HD2  HIS  17           HD2      HIS  17  11.282 -12.795   2.633
  139    HE1  HIS  17           HE1      HIS  17   7.567 -13.346   4.606
  140    HE2  HIS  17           HE2      HIS  17   9.948 -14.149   4.391
  141    H    THR  18           H        THR  18  10.671  -8.843  -0.911
  142    HA   THR  18           HA       THR  18   8.904  -6.635  -0.613
  143    HB   THR  18           HB       THR  18  11.227  -6.882  -2.537
  144    HG1  THR  18           HG1      THR  18  11.894  -7.331  -0.380
  145   HG21  THR  18          3HG2      THR  18  11.344  -4.446  -2.310
  146   HG22  THR  18          1HG2      THR  18   9.943  -4.473  -1.239
  147   HG23  THR  18          2HG2      THR  18   9.769  -4.947  -2.931
  148    H    TYR  19           H        TYR  19   9.923  -8.486  -3.499
  149    HA   TYR  19           HA       TYR  19   8.150  -7.119  -5.239
  150    HB2  TYR  19           HB2      TYR  19   9.711  -9.677  -5.523
  151    HB3  TYR  19           HB3      TYR  19   8.663  -9.076  -6.801
  152    HD1  TYR  19           HD1      TYR  19  11.685  -8.302  -4.805
  153    HD2  TYR  19           HD2      TYR  19   9.370  -7.331  -8.240
  154    HE1  TYR  19           HE1      TYR  19  13.526  -6.910  -5.646
  155    HE2  TYR  19           HE2      TYR  19  11.206  -5.930  -9.088
  156    HH   TYR  19           HH       TYR  19  13.165  -4.750  -8.285
  157    H    MET  20           H        MET  20   7.903 -10.180  -3.480
  158    HA   MET  20           HA       MET  20   5.563 -11.069  -4.775
  159    HB2  MET  20           HB2      MET  20   6.940 -12.617  -3.507
  160    HB3  MET  20           HB3      MET  20   6.588 -11.745  -2.020
  161    HG2  MET  20           HG2      MET  20   4.290 -12.388  -2.095
  162    HG3  MET  20           HG3      MET  20   4.484 -13.066  -3.711
  163    HE1  MET  20           HE1      MET  20   7.201 -13.460  -0.937
  164    HE2  MET  20           HE2      MET  20   5.736 -13.432   0.044
  165    HE3  MET  20           HE3      MET  20   6.676 -14.918  -0.091
  166    H    ALA  21           H        ALA  21   6.039  -9.173  -1.811
  167    HA   ALA  21           HA       ALA  21   3.315  -9.108  -1.070
  168    HB1  ALA  21           HB1      ALA  21   3.923  -7.247   0.372
  169    HB2  ALA  21           HB2      ALA  21   5.132  -8.526   0.471
  170    HB3  ALA  21           HB3      ALA  21   5.460  -7.074  -0.475
  171    H    ALA  22           H        ALA  22   5.290  -7.015  -3.104
  172    HA   ALA  22           HA       ALA  22   3.417  -4.960  -3.486
  173    HB1  ALA  22           HB1      ALA  22   4.777  -4.318  -5.409
  174    HB2  ALA  22           HB2      ALA  22   5.788  -4.714  -4.018
  175    HB3  ALA  22           HB3      ALA  22   5.616  -5.868  -5.341
  176    H    GLN  23           H        GLN  23   4.035  -7.926  -5.358
  177    HA   GLN  23           HA       GLN  23   1.952  -7.268  -7.244
  178    HB2  GLN  23           HB2      GLN  23   2.430  -9.439  -8.264
  179    HB3  GLN  23           HB3      GLN  23   3.902  -8.515  -8.010
  180    HG2  GLN  23           HG2      GLN  23   4.347  -9.849  -5.986
  181    HG3  GLN  23           HG3      GLN  23   2.915 -10.814  -6.341
  182   HE21  GLN  23          1HE2      GLN  23   5.720 -11.589  -6.156
  183   HE22  GLN  23          2HE2      GLN  23   6.123 -12.324  -7.668
  184    H    ALA  24           H        ALA  24   2.233  -9.238  -4.345
  185    HA   ALA  24           HA       ALA  24  -0.169 -10.699  -4.663
  186    HB1  ALA  24           HB1      ALA  24   1.154  -9.870  -2.081
  187    HB2  ALA  24           HB2      ALA  24  -0.020 -11.170  -2.293
  188    HB3  ALA  24           HB3      ALA  24   1.578 -11.297  -3.028
  189    H    LEU  25           H        LEU  25   0.577  -7.608  -3.132
  190    HA   LEU  25           HA       LEU  25  -1.980  -6.896  -2.269
  191    HB2  LEU  25           HB2      LEU  25   0.509  -5.520  -2.894
  192    HB3  LEU  25           HB3      LEU  25  -0.899  -4.539  -3.250
  193    HG   LEU  25           HG       LEU  25  -0.422  -5.850  -0.580
  194   HD11  LEU  25          2HD1      LEU  25   1.356  -4.239  -1.076
  195   HD12  LEU  25          1HD1      LEU  25   0.290  -3.659   0.205
  196   HD13  LEU  25          3HD1      LEU  25   0.139  -3.013  -1.429
  197   HD21  LEU  25          3HD2      LEU  25  -2.117  -4.254   0.180
  198   HD22  LEU  25          2HD2      LEU  25  -2.751  -5.331  -1.064
  199   HD23  LEU  25          1HD2      LEU  25  -2.307  -3.674  -1.475
  200    H    LYS  26           H        LYS  26  -0.473  -6.512  -5.444
  201    HA   LYS  26           HA       LYS  26  -2.569  -5.164  -6.725
  202    HB2  LYS  26           HB2      LYS  26  -0.530  -7.085  -7.866
  203    HB3  LYS  26           HB3      LYS  26  -1.565  -6.044  -8.830
  204    HG2  LYS  26           HG2      LYS  26  -0.539  -4.077  -7.754
  205    HG3  LYS  26           HG3      LYS  26   0.545  -5.158  -6.876
  206    HD2  LYS  26           HD2      LYS  26   1.438  -5.986  -8.999
  207    HD3  LYS  26           HD3      LYS  26   0.352  -4.907  -9.878
  208    HE2  LYS  26           HE2      LYS  26   2.486  -3.857  -9.814
  209    HE3  LYS  26           HE3      LYS  26   1.445  -2.991  -8.686
  210    HZ1  LYS  26           HZ1      LYS  26   3.571  -4.959  -8.034
  211    HZ2  LYS  26           HZ2      LYS  26   2.456  -4.382  -6.896
  212    HZ3  LYS  26           HZ3      LYS  26   3.535  -3.308  -7.643
  213    H    LYS  27           H        LYS  27  -1.929  -8.605  -6.264
  214    HA   LYS  27           HA       LYS  27  -3.917  -9.707  -7.863
  215    HB2  LYS  27           HB2      LYS  27  -2.972 -10.717  -5.185
  216    HB3  LYS  27           HB3      LYS  27  -3.810 -11.666  -6.396
  217    HG2  LYS  27           HG2      LYS  27  -1.101 -10.407  -6.760
  218    HG3  LYS  27           HG3      LYS  27  -1.384 -12.090  -6.322
  219    HD2  LYS  27           HD2      LYS  27  -2.560 -12.448  -8.430
  220    HD3  LYS  27           HD3      LYS  27  -2.308 -10.753  -8.863
  221    HE2  LYS  27           HE2      LYS  27   0.099 -11.078  -8.845
  222    HE3  LYS  27           HE3      LYS  27  -0.110 -12.749  -8.324
  223    HZ1  LYS  27           HZ1      LYS  27   0.331 -12.557 -10.706
  224    HZ2  LYS  27           HZ2      LYS  27  -1.082 -11.637 -10.901
  225    HZ3  LYS  27           HZ3      LYS  27  -1.185 -13.253 -10.403
  226    H    GLY  28           H        GLY  28  -4.092  -8.981  -4.390
  227    HA2  GLY  28           HA1      GLY  28  -6.824  -9.586  -4.079
  228    HA3  GLY  28           HA2      GLY  28  -5.874  -8.575  -3.001
  229    H    ALA  29           H        ALA  29  -5.201  -6.583  -4.946
  230    HA   ALA  29           HA       ALA  29  -7.431  -4.881  -4.612
  231    HB1  ALA  29           HB1      ALA  29  -6.168  -3.262  -5.911
  232    HB2  ALA  29           HB2      ALA  29  -5.125  -4.062  -4.735
  233    HB3  ALA  29           HB3      ALA  29  -5.056  -4.526  -6.434
  234    H    LYS  30           H        LYS  30  -6.089  -6.436  -7.530
  235    HA   LYS  30           HA       LYS  30  -8.134  -5.448  -9.245
  236    HB2  LYS  30           HB2      LYS  30  -7.252  -7.015 -10.901
  237    HB3  LYS  30           HB3      LYS  30  -5.952  -6.132 -10.114
  238    HG2  LYS  30           HG2      LYS  30  -5.561  -8.089  -8.656
  239    HG3  LYS  30           HG3      LYS  30  -6.796  -8.968  -9.559
  240    HD2  LYS  30           HD2      LYS  30  -4.553  -9.520 -10.342
  241    HD3  LYS  30           HD3      LYS  30  -5.491  -8.719 -11.604
  242    HE2  LYS  30           HE2      LYS  30  -4.382  -6.576 -10.954
  243    HE3  LYS  30           HE3      LYS  30  -3.358  -7.498  -9.857
  244    HZ1  LYS  30           HZ1      LYS  30  -2.232  -7.108 -11.929
  245    HZ2  LYS  30           HZ2      LYS  30  -3.500  -7.813 -12.807
  246    HZ3  LYS  30           HZ3      LYS  30  -2.552  -8.765 -11.771
  247    H    LYS  31           H        LYS  31  -7.854  -8.209  -7.166
  248    HA   LYS  31           HA       LYS  31  -9.917  -9.800  -8.239
  249    HB2  LYS  31           HB2      LYS  31  -8.293 -10.630  -6.585
  250    HB3  LYS  31           HB3      LYS  31  -8.974  -9.553  -5.372
  251    HG2  LYS  31           HG2      LYS  31 -11.083 -10.753  -5.462
  252    HG3  LYS  31           HG3      LYS  31 -10.443 -11.811  -6.722
  253    HD2  LYS  31           HD2      LYS  31  -8.751 -12.642  -5.193
  254    HD3  LYS  31           HD3      LYS  31  -9.321 -11.542  -3.936
  255    HE2  LYS  31           HE2      LYS  31 -11.496 -12.671  -3.951
  256    HE3  LYS  31           HE3      LYS  31 -10.906 -13.779  -5.191
  257    HZ1  LYS  31           HZ1      LYS  31 -10.805 -14.711  -2.934
  258    HZ2  LYS  31           HZ2      LYS  31  -9.716 -13.489  -2.483
  259    HZ3  LYS  31           HZ3      LYS  31  -9.280 -14.623  -3.664
  260    H    MET  32           H        MET  32  -9.906  -7.254  -5.782
  261    HA   MET  32           HA       MET  32 -12.777  -7.358  -5.480
  262    HB2  MET  32           HB2      MET  32 -10.747  -5.369  -4.444
  263    HB3  MET  32           HB3      MET  32 -12.450  -5.391  -4.009
  264    HG2  MET  32           HG2      MET  32 -12.167  -7.614  -3.028
  265    HG3  MET  32           HG3      MET  32 -10.454  -7.573  -3.449
  266    HE1  MET  32           HE1      MET  32 -12.419  -4.687  -0.427
  267    HE2  MET  32           HE2      MET  32 -12.708  -4.629  -2.167
  268    HE3  MET  32           HE3      MET  32 -13.290  -5.999  -1.221
  269    H    GLY  33           H        GLY  33 -10.567  -5.898  -7.602
  270    HA2  GLY  33           HA1      GLY  33 -11.129  -4.871  -9.612
  271    HA3  GLY  33           HA2      GLY  33 -12.772  -4.674  -9.026
  272    H    ASN  34           H        ASN  34  -9.845  -3.606  -7.380
  273    HA   ASN  34           HA       ASN  34 -10.862  -0.852  -7.578
  274    HB2  ASN  34           HB2      ASN  34  -8.908  -2.051  -5.600
  275    HB3  ASN  34           HB3      ASN  34  -9.416  -0.367  -5.626
  276   HD21  ASN  34          1HD2      ASN  34 -10.236  -3.581  -4.760
  277   HD22  ASN  34          2HD2      ASN  34 -11.711  -3.213  -3.939
  278    H    LEU  35           H        LEU  35  -8.995   0.821  -7.406
  279    HA   LEU  35           HA       LEU  35  -6.951   0.062  -9.392
  280    HB2  LEU  35           HB2      LEU  35  -8.158   2.773  -8.831
  281    HB3  LEU  35           HB3      LEU  35  -6.870   2.467  -9.979
  282    HG   LEU  35           HG       LEU  35  -9.674   1.365 -10.169
  283   HD11  LEU  35          2HD1      LEU  35  -9.584   3.767 -10.561
  284   HD12  LEU  35          1HD1      LEU  35  -9.924   2.889 -12.051
  285   HD13  LEU  35          3HD1      LEU  35  -8.308   3.533 -11.754
  286   HD21  LEU  35          3HD2      LEU  35  -7.357   1.191 -12.092
  287   HD22  LEU  35          2HD2      LEU  35  -8.999   0.624 -12.397
  288   HD23  LEU  35          1HD2      LEU  35  -8.022  -0.139 -11.143
  289    H    ILE  36           H        ILE  36  -5.021  -0.213  -8.480
  290    HA   ILE  36           HA       ILE  36  -4.408   1.376  -6.072
  291    HB   ILE  36           HB       ILE  36  -4.954  -1.006  -5.581
  292   HG12  ILE  36          2HG1      ILE  36  -2.080  -0.236  -5.028
  293   HG13  ILE  36          3HG1      ILE  36  -3.475   0.324  -4.111
  294   HG21  ILE  36          2HG2      ILE  36  -2.444  -1.565  -7.158
  295   HG22  ILE  36          1HG2      ILE  36  -4.087  -2.016  -7.614
  296   HG23  ILE  36          3HG2      ILE  36  -3.334  -2.745  -6.195
  297   HD11  ILE  36          3HD1      ILE  36  -2.521  -2.521  -4.338
  298   HD12  ILE  36          2HD1      ILE  36  -3.943  -1.983  -3.442
  299   HD13  ILE  36          1HD1      ILE  36  -2.336  -1.458  -2.943
  300    H    LYS  37           H        LYS  37  -2.394   2.182  -5.826
  301    HA   LYS  37           HA       LYS  37  -0.385   1.542  -7.891
  302    HB2  LYS  37           HB2      LYS  37  -0.831   4.082  -6.327
  303    HB3  LYS  37           HB3      LYS  37   0.679   3.740  -7.160
  304    HG2  LYS  37           HG2      LYS  37  -1.188   3.298  -9.118
  305    HG3  LYS  37           HG3      LYS  37  -1.875   4.652  -8.214
  306    HD2  LYS  37           HD2      LYS  37   0.254   5.855  -8.425
  307    HD3  LYS  37           HD3      LYS  37   0.909   4.506  -9.357
  308    HE2  LYS  37           HE2      LYS  37  -0.813   4.865 -11.066
  309    HE3  LYS  37           HE3      LYS  37  -1.455   6.216 -10.132
  310    HZ1  LYS  37           HZ1      LYS  37   1.299   6.090 -11.245
  311    HZ2  LYS  37           HZ2      LYS  37   0.590   7.409 -10.440
  312    HZ3  LYS  37           HZ3      LYS  37   0.002   6.924 -11.954
  313    H    VAL  38           H        VAL  38   1.069   0.169  -7.099
  314    HA   VAL  38           HA       VAL  38   1.608   0.192  -4.215
  315    HB   VAL  38           HB       VAL  38   2.326  -1.954  -6.221
  316   HG11  VAL  38          2HG1      VAL  38   2.327  -1.973  -3.205
  317   HG12  VAL  38          1HG1      VAL  38   3.753  -1.930  -4.241
  318   HG13  VAL  38          3HG1      VAL  38   2.701  -3.345  -4.247
  319   HG21  VAL  38          3HG2      VAL  38  -0.094  -1.743  -6.038
  320   HG22  VAL  38          2HG2      VAL  38   0.019  -1.842  -4.281
  321   HG23  VAL  38          1HG2      VAL  38   0.463  -3.231  -5.273
  322    H    GLU  39           H        GLU  39   3.445   0.996  -3.497
  323    HA   GLU  39           HA       GLU  39   5.556   1.647  -5.409
  324    HB2  GLU  39           HB2      GLU  39   4.627   3.360  -3.825
  325    HB3  GLU  39           HB3      GLU  39   5.316   2.433  -2.502
  326    HG2  GLU  39           HG2      GLU  39   7.549   2.784  -3.388
  327    HG3  GLU  39           HG3      GLU  39   6.874   3.667  -4.758
  328    H    THR  40           H        THR  40   7.297   0.394  -5.589
  329    HA   THR  40           HA       THR  40   7.860  -1.633  -3.594
  330    HB   THR  40           HB       THR  40   9.433  -0.999  -6.097
  331    HG1  THR  40           HG1      THR  40   7.920  -1.981  -7.214
  332   HG21  THR  40          3HG2      THR  40   9.193  -3.530  -4.460
  333   HG22  THR  40          1HG2      THR  40  10.579  -2.439  -4.474
  334   HG23  THR  40          2HG2      THR  40  10.148  -3.335  -5.931
  335    H    GLN  41           H        GLN  41   8.874  -0.953  -1.826
  336    HA   GLN  41           HA       GLN  41  11.015   1.059  -2.103
  337    HB2  GLN  41           HB2      GLN  41   9.111   1.870  -0.816
  338    HB3  GLN  41           HB3      GLN  41   9.169   0.453   0.220
  339    HG2  GLN  41           HG2      GLN  41  10.092   2.362   1.359
  340    HG3  GLN  41           HG3      GLN  41  11.353   1.168   1.063
  341   HE21  GLN  41          1HE2      GLN  41  12.941   2.759   1.296
  342   HE22  GLN  41          2HE2      GLN  41  13.250   3.912   0.044
  343    H    GLY  42           H        GLY  42  13.015   0.448  -1.582
  344    HA2  GLY  42           HA1      GLY  42  13.445  -2.126  -0.283
  345    HA3  GLY  42           HA2      GLY  42  14.689  -1.061  -0.936
  346    H    ALA  43           H        ALA  43  15.591   0.487   0.327
  347    HA   ALA  43           HA       ALA  43  14.554   0.771   3.072
  348    HB1  ALA  43           HB1      ALA  43  17.451   0.783   2.211
  349    HB2  ALA  43           HB2      ALA  43  16.864   1.084   3.848
  350    HB3  ALA  43           HB3      ALA  43  16.643  -0.503   3.109
  351    H    THR  44           H        THR  44  16.783   2.272   0.756
  352    HA   THR  44           HA       THR  44  15.438   4.843   1.253
  353    HB   THR  44           HB       THR  44  18.392   4.571   0.655
  354    HG1  THR  44           HG1      THR  44  18.765   4.518   2.806
  355   HG21  THR  44          3HG2      THR  44  16.738   6.834   1.800
  356   HG22  THR  44          1HG2      THR  44  17.398   6.762   0.166
  357   HG23  THR  44          2HG2      THR  44  18.484   6.861   1.552
  358    H    GLY  45           H        GLY  45  15.725   2.473  -0.852
  359    HA2  GLY  45           HA1      GLY  45  15.928   4.231  -3.216
  360    HA3  GLY  45           HA2      GLY  45  16.341   2.520  -3.222
  361    H    ILE  46           H        ILE  46  14.256   4.343  -4.595
  362    HA   ILE  46           HA       ILE  46  11.864   2.774  -3.872
  363    HB   ILE  46           HB       ILE  46  11.732   5.451  -5.235
  364   HG12  ILE  46          2HG1      ILE  46  11.757   5.016  -2.237
  365   HG13  ILE  46          3HG1      ILE  46  13.071   5.740  -3.159
  366   HG21  ILE  46          2HG2      ILE  46   9.731   4.075  -5.199
  367   HG22  ILE  46          1HG2      ILE  46   9.515   5.503  -4.185
  368   HG23  ILE  46          3HG2      ILE  46   9.838   3.936  -3.444
  369   HD11  ILE  46          3HD1      ILE  46  10.286   6.850  -2.913
  370   HD12  ILE  46          2HD1      ILE  46  11.626   7.585  -3.794
  371   HD13  ILE  46          1HD1      ILE  46  11.712   7.419  -2.039
  372    H    GLU  47           H        GLU  47  10.701   1.817  -5.540
  373    HA   GLU  47           HA       GLU  47  11.985   1.808  -8.162
  374    HB2  GLU  47           HB2      GLU  47  11.355  -0.339  -7.161
  375    HB3  GLU  47           HB3      GLU  47   9.679   0.181  -7.070
  376    HG2  GLU  47           HG2      GLU  47   9.689   0.379  -9.556
  377    HG3  GLU  47           HG3      GLU  47  11.290  -0.357  -9.549
  378    H    ASN  48           H        ASN  48   8.907   2.659  -6.670
  379    HA   ASN  48           HA       ASN  48   7.840   3.474  -9.271
  380    HB2  ASN  48           HB2      ASN  48   6.472   3.122  -6.597
  381    HB3  ASN  48           HB3      ASN  48   5.660   3.586  -8.091
  382   HD21  ASN  48          1HD2      ASN  48   5.237   2.059  -9.621
  383   HD22  ASN  48          2HD2      ASN  48   5.492   0.367  -9.368
  384    H    GLU  49           H        GLU  49   7.909   4.700  -5.948
  385    HA   GLU  49           HA       GLU  49   7.995   6.760  -5.049
  386    HB2  GLU  49           HB2      GLU  49   9.862   6.954  -6.910
  387    HB3  GLU  49           HB3      GLU  49   8.703   8.033  -7.669
  388    HG2  GLU  49           HG2      GLU  49   9.602   8.404  -4.832
  389    HG3  GLU  49           HG3      GLU  49  10.495   9.067  -6.195
  390    H    LEU  50           H        LEU  50   5.812   6.692  -4.713
  391    HA   LEU  50           HA       LEU  50   3.940   7.694  -6.663
  392    HB2  LEU  50           HB2      LEU  50   3.796   6.722  -3.840
  393    HB3  LEU  50           HB3      LEU  50   2.473   7.689  -4.459
  394    HG   LEU  50           HG       LEU  50   1.909   6.058  -6.090
  395   HD11  LEU  50          2HD1      LEU  50   3.214   3.978  -6.398
  396   HD12  LEU  50          1HD1      LEU  50   4.475   4.657  -5.367
  397   HD13  LEU  50          3HD1      LEU  50   4.082   5.428  -6.901
  398   HD21  LEU  50          3HD2      LEU  50   1.476   4.077  -4.733
  399   HD22  LEU  50          2HD2      LEU  50   1.153   5.560  -3.834
  400   HD23  LEU  50          1HD2      LEU  50   2.634   4.648  -3.530
  401    H    THR  51           H        THR  51   3.369   9.753  -6.953
  402    HA   THR  51           HA       THR  51   4.797  11.740  -5.372
  403    HB   THR  51           HB       THR  51   4.148  13.336  -7.106
  404    HG1  THR  51           HG1      THR  51   2.735  11.126  -8.256
  405   HG21  THR  51          3HG2      THR  51   5.317  12.332  -9.021
  406   HG22  THR  51          1HG2      THR  51   5.170  10.741  -8.270
  407   HG23  THR  51          2HG2      THR  51   6.149  11.993  -7.504
  408    H    GLU  52           H        GLU  52   3.607  13.750  -4.744
  409    HA   GLU  52           HA       GLU  52   1.426  13.199  -3.106
  410    HB2  GLU  52           HB2      GLU  52   2.960  15.237  -3.077
  411    HB3  GLU  52           HB3      GLU  52   1.947  15.897  -4.352
  412    HG2  GLU  52           HG2      GLU  52   1.230  16.825  -2.283
  413    HG3  GLU  52           HG3      GLU  52  -0.005  15.690  -2.826
  414    H    LYS  53           H        LYS  53   1.575  13.976  -6.484
  415    HA   LYS  53           HA       LYS  53  -1.111  14.643  -6.976
  416    HB2  LYS  53           HB2      LYS  53   0.717  13.105  -8.831
  417    HB3  LYS  53           HB3      LYS  53  -0.655  14.106  -9.283
  418    HG2  LYS  53           HG2      LYS  53   1.851  15.144  -7.981
  419    HG3  LYS  53           HG3      LYS  53   1.547  15.146  -9.718
  420    HD2  LYS  53           HD2      LYS  53  -0.403  16.573  -9.383
  421    HD3  LYS  53           HD3      LYS  53  -0.130  16.548  -7.638
  422    HE2  LYS  53           HE2      LYS  53   0.727  18.604  -8.650
  423    HE3  LYS  53           HE3      LYS  53   2.023  17.642  -7.944
  424    HZ1  LYS  53           HZ1      LYS  53   2.585  18.561 -10.142
  425    HZ2  LYS  53           HZ2      LYS  53   1.329  17.666 -10.835
  426    HZ3  LYS  53           HZ3      LYS  53   2.641  16.867 -10.121
  427    H    ASP  54           H        ASP  54   0.579  11.527  -7.241
  428    HA   ASP  54           HA       ASP  54  -1.725   9.963  -7.793
  429    HB2  ASP  54           HB2      ASP  54   0.871   9.050  -6.522
  430    HB3  ASP  54           HB3      ASP  54  -0.312   8.029  -7.325
  431    H    VAL  55           H        VAL  55   0.062  10.736  -4.887
  432    HA   VAL  55           HA       VAL  55  -1.200   8.947  -3.131
  433    HB   VAL  55           HB       VAL  55   0.214  11.558  -2.553
  434   HG11  VAL  55          2HG1      VAL  55  -1.149  10.874  -0.658
  435   HG12  VAL  55          1HG1      VAL  55   0.570  10.675  -0.311
  436   HG13  VAL  55          3HG1      VAL  55  -0.419   9.269  -0.705
  437   HG21  VAL  55          3HG2      VAL  55   2.157  10.157  -2.097
  438   HG22  VAL  55          2HG2      VAL  55   1.594   9.939  -3.753
  439   HG23  VAL  55          1HG2      VAL  55   1.232   8.719  -2.531
  440    H    ASN  56           H        ASN  56  -2.056  12.204  -4.170
  441    HA   ASN  56           HA       ASN  56  -4.109  12.508  -2.168
  442    HB2  ASN  56           HB2      ASN  56  -3.265  14.124  -4.550
  443    HB3  ASN  56           HB3      ASN  56  -4.802  14.455  -3.761
  444   HD21  ASN  56          1HD2      ASN  56  -1.943  13.343  -2.087
  445   HD22  ASN  56          2HD2      ASN  56  -1.658  14.803  -1.209
  446    H    ILE  57           H        ILE  57  -3.890  10.918  -5.161
  447    HA   ILE  57           HA       ILE  57  -6.677  11.100  -5.858
  448    HB   ILE  57           HB       ILE  57  -4.525   9.212  -6.840
  449   HG12  ILE  57          2HG1      ILE  57  -5.760  11.651  -8.140
  450   HG13  ILE  57          3HG1      ILE  57  -4.164  11.596  -7.397
  451   HG21  ILE  57          2HG2      ILE  57  -7.308   9.670  -7.908
  452   HG22  ILE  57          1HG2      ILE  57  -6.730   8.213  -7.101
  453   HG23  ILE  57          3HG2      ILE  57  -6.067   8.675  -8.668
  454   HD11  ILE  57          3HD1      ILE  57  -4.045  11.442  -9.825
  455   HD12  ILE  57          2HD1      ILE  57  -5.041   9.985  -9.783
  456   HD13  ILE  57          1HD1      ILE  57  -3.434   9.976  -9.054
  457    H    GLY  58           H        GLY  58  -4.566   8.645  -4.404
  458    HA2  GLY  58           HA1      GLY  58  -6.460   6.633  -4.036
  459    HA3  GLY  58           HA2      GLY  58  -5.010   6.845  -3.069
  460    H    GLU  59           H        GLU  59  -7.779   6.025  -2.409
  461    HA   GLU  59           HA       GLU  59  -8.920   8.112  -0.791
  462    HB2  GLU  59           HB2      GLU  59  -9.517   5.146  -0.767
  463    HB3  GLU  59           HB3      GLU  59 -10.550   6.434  -0.169
  464    HG2  GLU  59           HG2      GLU  59  -9.754   6.454  -3.030
  465    HG3  GLU  59           HG3      GLU  59 -10.974   5.303  -2.493
  466    H    VAL  60           H        VAL  60  -7.418   4.960  -0.140
  467    HA   VAL  60           HA       VAL  60  -6.614   5.937   2.516
  468    HB   VAL  60           HB       VAL  60  -6.779   3.584   3.322
  469   HG11  VAL  60          2HG1      VAL  60  -9.228   3.551   3.536
  470   HG12  VAL  60          1HG1      VAL  60  -9.339   4.800   2.294
  471   HG13  VAL  60          3HG1      VAL  60  -8.550   5.151   3.832
  472   HG21  VAL  60          3HG2      VAL  60  -8.132   1.983   2.031
  473   HG22  VAL  60          2HG2      VAL  60  -6.640   2.420   1.196
  474   HG23  VAL  60          1HG2      VAL  60  -8.175   3.123   0.684
  475    H    VAL  61           H        VAL  61  -4.630   5.041   3.335
  476    HA   VAL  61           HA       VAL  61  -2.820   4.186   1.176
  477    HB   VAL  61           HB       VAL  61  -2.057   5.482   3.794
  478   HG11  VAL  61          2HG1      VAL  61   0.096   5.838   2.706
  479   HG12  VAL  61          1HG1      VAL  61  -0.497   5.022   1.258
  480   HG13  VAL  61          3HG1      VAL  61  -0.316   4.124   2.765
  481   HG21  VAL  61          3HG2      VAL  61  -1.691   7.541   2.507
  482   HG22  VAL  61          2HG2      VAL  61  -3.385   7.048   2.482
  483   HG23  VAL  61          1HG2      VAL  61  -2.361   6.759   1.076
  484    H    ILE  62           H        ILE  62  -2.123   2.164   1.270
  485    HA   ILE  62           HA       ILE  62  -2.235   0.751   3.849
  486    HB   ILE  62           HB       ILE  62  -2.044  -0.398   1.054
  487   HG12  ILE  62          2HG1      ILE  62  -4.351  -0.382   3.018
  488   HG13  ILE  62          3HG1      ILE  62  -4.243   0.612   1.568
  489   HG21  ILE  62          2HG2      ILE  62  -2.423  -2.570   2.147
  490   HG22  ILE  62          1HG2      ILE  62  -2.342  -1.780   3.722
  491   HG23  ILE  62          3HG2      ILE  62  -0.920  -1.815   2.678
  492   HD11  ILE  62          3HD1      ILE  62  -4.293  -1.372   0.179
  493   HD12  ILE  62          2HD1      ILE  62  -5.687  -1.334   1.258
  494   HD13  ILE  62          1HD1      ILE  62  -4.324  -2.397   1.613
  495    H    PHE  63           H        PHE  63  -0.339   0.781   4.884
  496    HA   PHE  63           HA       PHE  63   2.120   0.767   3.285
  497    HB2  PHE  63           HB2      PHE  63   1.337   2.089   5.749
  498    HB3  PHE  63           HB3      PHE  63   2.838   1.187   5.944
  499    HD1  PHE  63           HD2      PHE  63   1.174   3.811   3.962
  500    HD2  PHE  63           HD1      PHE  63   4.849   1.951   5.011
  501    HE1  PHE  63           HE2      PHE  63   2.404   5.625   2.850
  502    HE2  PHE  63           HE1      PHE  63   6.087   3.759   3.902
  503    HZ   PHE  63           HZ       PHE  63   4.865   5.598   2.815
  504    H    ALA  64           H        ALA  64   2.396  -1.386   2.859
  505    HA   ALA  64           HA       ALA  64   2.614  -3.181   5.158
  506    HB1  ALA  64           HB1      ALA  64   2.870  -4.966   3.494
  507    HB2  ALA  64           HB2      ALA  64   1.395  -4.037   3.224
  508    HB3  ALA  64           HB3      ALA  64   2.808  -3.767   2.203
  509    H    VAL  65           H        VAL  65   4.470  -2.466   6.126
  510    HA   VAL  65           HA       VAL  65   6.946  -2.755   4.596
  511    HB   VAL  65           HB       VAL  65   7.854  -0.649   5.518
  512   HG11  VAL  65          2HG1      VAL  65   5.345  -0.291   3.886
  513   HG12  VAL  65          1HG1      VAL  65   6.951  -0.669   3.261
  514   HG13  VAL  65          3HG1      VAL  65   6.651   0.886   4.039
  515   HG21  VAL  65          3HG2      VAL  65   5.025  -0.167   6.447
  516   HG22  VAL  65          2HG2      VAL  65   6.314   1.037   6.446
  517   HG23  VAL  65          1HG2      VAL  65   6.444  -0.393   7.470
  518    H    ASP  66           H        ASP  66   8.602  -3.556   5.715
  519    HA   ASP  66           HA       ASP  66   8.302  -3.787   8.640
  520    HB2  ASP  66           HB2      ASP  66   8.907  -5.799   6.617
  521    HB3  ASP  66           HB3      ASP  66  10.126  -5.745   7.886
  522    H    THR  67           H        THR  67   9.927  -2.273   6.234
  523    HA   THR  67           HA       THR  67  12.304  -1.880   7.913
  524    HB   THR  67           HB       THR  67  13.629  -1.650   5.782
  525    HG1  THR  67           HG1      THR  67  12.519  -1.747   3.985
  526   HG21  THR  67          3HG2      THR  67  12.411  -4.350   6.375
  527   HG22  THR  67          1HG2      THR  67  13.813  -3.640   7.176
  528   HG23  THR  67          2HG2      THR  67  13.899  -4.076   5.470
  529    H    LYS  68           H        LYS  68  13.541  -0.089   6.119
  530    HA   LYS  68           HA       LYS  68  12.241   2.317   6.941
  531    HB2  LYS  68           HB2      LYS  68  14.697   2.021   6.933
  532    HB3  LYS  68           HB3      LYS  68  14.663   1.915   5.179
  533    HG2  LYS  68           HG2      LYS  68  13.663   4.219   5.170
  534    HG3  LYS  68           HG3      LYS  68  14.025   4.292   6.896
  535    HD2  LYS  68           HD2      LYS  68  16.403   3.825   6.363
  536    HD3  LYS  68           HD3      LYS  68  15.997   3.906   4.648
  537    HE2  LYS  68           HE2      LYS  68  16.894   6.025   5.329
  538    HE3  LYS  68           HE3      LYS  68  15.169   6.212   5.007
  539    HZ1  LYS  68           HZ1      LYS  68  14.693   6.263   7.305
  540    HZ2  LYS  68           HZ2      LYS  68  16.018   7.303   7.080
  541    HZ3  LYS  68           HZ3      LYS  68  16.256   5.754   7.724
  542    H    VAL  69           H        VAL  69  11.264   3.877   5.718
  543    HA   VAL  69           HA       VAL  69  11.124   3.569   2.820
  544    HB   VAL  69           HB       VAL  69   9.116   2.442   3.458
  545   HG11  VAL  69          2HG1      VAL  69   7.414   3.446   4.918
  546   HG12  VAL  69          1HG1      VAL  69   8.496   4.804   5.229
  547   HG13  VAL  69          3HG1      VAL  69   8.940   3.182   5.763
  548   HG21  VAL  69          3HG2      VAL  69   8.881   3.986   1.586
  549   HG22  VAL  69          2HG2      VAL  69   8.427   5.278   2.698
  550   HG23  VAL  69          1HG2      VAL  69   7.379   3.874   2.503
  551    H    ARG  70           H        ARG  70  11.625   5.471   1.920
  552    HA   ARG  70           HA       ARG  70  11.710   7.800   3.661
  553    HB2  ARG  70           HB2      ARG  70  13.117   8.827   1.983
  554    HB3  ARG  70           HB3      ARG  70  13.700   7.205   2.320
  555    HG2  ARG  70           HG2      ARG  70  12.740   6.379   0.274
  556    HG3  ARG  70           HG3      ARG  70  11.979   7.940  -0.037
  557    HD2  ARG  70           HD2      ARG  70  14.948   7.424   0.103
  558    HD3  ARG  70           HD3      ARG  70  14.011   7.631  -1.374
  559    HE   ARG  70           HE       ARG  70  13.954   9.819   0.570
  560   HH11  ARG  70          2HH1      ARG  70  15.138   8.555  -2.487
  561   HH12  ARG  70          1HH1      ARG  70  15.734  10.093  -3.031
  562   HH21  ARG  70          2HH2      ARG  70  14.715  11.843  -0.169
  563   HH22  ARG  70          1HH2      ARG  70  15.461  11.965  -1.736
  564    H    ASN  71           H        ASN  71   9.822   6.617   1.009
  565    HA   ASN  71           HA       ASN  71   8.934   9.238   0.205
  566    HB2  ASN  71           HB2      ASN  71   8.996   6.788  -1.070
  567    HB3  ASN  71           HB3      ASN  71   7.280   7.043  -0.744
  568   HD21  ASN  71          1HD2      ASN  71   6.851   7.310  -2.941
  569   HD22  ASN  71          2HD2      ASN  71   7.278   8.783  -3.772
  570    H    LYS  72           H        LYS  72   8.209   7.254   2.730
  571    HA   LYS  72           HA       LYS  72   5.441   7.395   3.060
  572    HB2  LYS  72           HB2      LYS  72   6.978   6.074   4.505
  573    HB3  LYS  72           HB3      LYS  72   7.557   7.571   5.222
  574    HG2  LYS  72           HG2      LYS  72   5.342   8.024   6.118
  575    HG3  LYS  72           HG3      LYS  72   4.723   6.562   5.347
  576    HD2  LYS  72           HD2      LYS  72   6.210   5.196   6.707
  577    HD3  LYS  72           HD3      LYS  72   6.880   6.647   7.456
  578    HE2  LYS  72           HE2      LYS  72   4.692   7.183   8.393
  579    HE3  LYS  72           HE3      LYS  72   3.999   5.765   7.610
  580    HZ1  LYS  72           HZ1      LYS  72   4.553   5.465   9.998
  581    HZ2  LYS  72           HZ2      LYS  72   6.194   5.626   9.604
  582    HZ3  LYS  72           HZ3      LYS  72   5.289   4.335   8.977
  583    H    GLU  73           H        GLU  73   7.919   9.727   3.351
  584    HA   GLU  73           HA       GLU  73   7.017  11.888   4.657
  585    HB2  GLU  73           HB2      GLU  73   9.056  11.658   3.212
  586    HB3  GLU  73           HB3      GLU  73   8.034  11.926   1.811
  587    HG2  GLU  73           HG2      GLU  73   9.098  13.962   2.292
  588    HG3  GLU  73           HG3      GLU  73   7.418  14.133   2.802
  589    H    ARG  74           H        ARG  74   5.753  10.705   1.559
  590    HA   ARG  74           HA       ARG  74   4.072  12.946   1.047
  591    HB2  ARG  74           HB2      ARG  74   4.579  10.327  -0.165
  592    HB3  ARG  74           HB3      ARG  74   2.911  10.860  -0.313
  593    HG2  ARG  74           HG2      ARG  74   3.505  12.077  -2.051
  594    HG3  ARG  74           HG3      ARG  74   4.483  13.076  -0.975
  595    HD2  ARG  74           HD2      ARG  74   5.416  10.548  -2.329
  596    HD3  ARG  74           HD3      ARG  74   5.755  12.179  -2.905
  597    HE   ARG  74           HE       ARG  74   6.751  11.053  -0.367
  598   HH11  ARG  74          2HH1      ARG  74   7.149  13.059  -3.202
  599   HH12  ARG  74          1HH1      ARG  74   8.650  13.745  -2.664
  600   HH21  ARG  74          2HH2      ARG  74   8.752  11.955   0.338
  601   HH22  ARG  74          1HH2      ARG  74   9.548  13.138  -0.649
  602    H    PHE  75           H        PHE  75   3.406   9.669   2.242
  603    HA   PHE  75           HA       PHE  75   0.590  10.192   2.462
  604    HB2  PHE  75           HB2      PHE  75   1.991   7.789   3.597
  605    HB3  PHE  75           HB3      PHE  75   0.370   7.909   2.928
  606    HD1  PHE  75           HD1      PHE  75   3.957   7.802   2.080
  607    HD2  PHE  75           HD2      PHE  75  -0.028   7.550   0.619
  608    HE1  PHE  75           HE1      PHE  75   4.803   6.970  -0.077
  609    HE2  PHE  75           HE2      PHE  75   0.811   6.715  -1.536
  610    HZ   PHE  75           HZ       PHE  75   3.231   6.426  -1.887
  611    H    ASP  76           H        ASP  76   2.942  11.285   4.360
  612    HA   ASP  76           HA       ASP  76   2.550  10.124   6.888
  613    HB2  ASP  76           HB2      ASP  76   4.534  11.491   6.225
  614    HB3  ASP  76           HB3      ASP  76   3.526  12.933   6.331
  615    H    GLY  77           H        GLY  77   1.056  12.930   5.361
  616    HA2  GLY  77           HA1      GLY  77  -0.574  13.393   7.748
  617    HA3  GLY  77           HA2      GLY  77  -0.467  14.446   6.347
  618    H    LYS  78           H        LYS  78  -0.854  11.146   5.597
  619    HA   LYS  78           HA       LYS  78  -3.696  11.637   5.018
  620    HB2  LYS  78           HB2      LYS  78  -1.545  10.296   3.481
  621    HB3  LYS  78           HB3      LYS  78  -3.129   9.533   3.427
  622    HG2  LYS  78           HG2      LYS  78  -2.950  11.006   1.569
  623    HG3  LYS  78           HG3      LYS  78  -4.089  11.708   2.715
  624    HD2  LYS  78           HD2      LYS  78  -2.839  13.559   2.206
  625    HD3  LYS  78           HD3      LYS  78  -1.924  12.941   3.584
  626    HE2  LYS  78           HE2      LYS  78  -0.297  11.960   2.174
  627    HE3  LYS  78           HE3      LYS  78  -1.274  12.239   0.735
  628    HZ1  LYS  78           HZ1      LYS  78   0.444  13.877   0.823
  629    HZ2  LYS  78           HZ2      LYS  78   0.045  14.302   2.420
  630    HZ3  LYS  78           HZ3      LYS  78  -1.030  14.651   1.156
  631    H    VAL  79           H        VAL  79  -4.744   9.269   4.637
  632    HA   VAL  79           HA       VAL  79  -4.713   8.178   7.318
  633    HB   VAL  79           HB       VAL  79  -6.889   8.597   6.429
  634   HG11  VAL  79          2HG1      VAL  79  -6.367   8.549   4.062
  635   HG12  VAL  79          1HG1      VAL  79  -7.746   7.506   4.411
  636   HG13  VAL  79          3HG1      VAL  79  -6.155   6.802   4.127
  637   HG21  VAL  79          3HG2      VAL  79  -7.937   6.374   6.571
  638   HG22  VAL  79          2HG2      VAL  79  -6.734   6.631   7.835
  639   HG23  VAL  79          1HG2      VAL  79  -6.343   5.631   6.437
  640    H    VAL  80           H        VAL  80  -3.102   6.825   7.709
  641    HA   VAL  80           HA       VAL  80  -2.363   4.873   5.636
  642    HB   VAL  80           HB       VAL  80  -0.653   6.069   7.821
  643   HG11  VAL  80          2HG1      VAL  80   0.081   4.100   5.658
  644   HG12  VAL  80          1HG1      VAL  80  -0.032   3.752   7.383
  645   HG13  VAL  80          3HG1      VAL  80   1.205   4.860   6.786
  646   HG21  VAL  80          3HG2      VAL  80   0.591   7.082   5.964
  647   HG22  VAL  80          2HG2      VAL  80  -1.084   7.632   6.017
  648   HG23  VAL  80          1HG2      VAL  80  -0.589   6.426   4.829
  649    H    LEU  81           H        LEU  81  -2.728   2.816   6.062
  650    HA   LEU  81           HA       LEU  81  -2.835   1.919   8.859
  651    HB2  LEU  81           HB2      LEU  81  -4.701   1.220   7.413
  652    HB3  LEU  81           HB3      LEU  81  -3.561   0.452   6.323
  653    HG   LEU  81           HG       LEU  81  -2.853  -0.895   8.442
  654   HD11  LEU  81          2HD1      LEU  81  -5.652  -0.064   9.187
  655   HD12  LEU  81          1HD1      LEU  81  -4.173   0.397  10.031
  656   HD13  LEU  81          3HD1      LEU  81  -4.681  -1.292  10.001
  657   HD21  LEU  81          3HD2      LEU  81  -3.787  -1.911   6.493
  658   HD22  LEU  81          2HD2      LEU  81  -5.408  -1.365   6.930
  659   HD23  LEU  81          1HD2      LEU  81  -4.585  -2.569   7.921
  660    H    GLU  82           H        GLU  82  -0.992   1.114   9.679
  661    HA   GLU  82           HA       GLU  82   1.101   0.342   7.778
  662    HB2  GLU  82           HB2      GLU  82   1.470   2.059   9.648
  663    HB3  GLU  82           HB3      GLU  82   1.476   0.683  10.743
  664    HG2  GLU  82           HG2      GLU  82   3.385  -0.261   9.655
  665    HG3  GLU  82           HG3      GLU  82   3.315   0.954   8.378
  666    H    VAL  83           H        VAL  83   0.894  -1.667   7.211
  667    HA   VAL  83           HA       VAL  83   0.378  -3.731   9.243
  668    HB   VAL  83           HB       VAL  83  -1.286  -4.392   7.891
  669   HG11  VAL  83          2HG1      VAL  83  -1.383  -2.135   6.978
  670   HG12  VAL  83          1HG1      VAL  83  -1.766  -3.330   5.737
  671   HG13  VAL  83          3HG1      VAL  83  -0.175  -2.564   5.764
  672   HG21  VAL  83          3HG2      VAL  83   0.313  -6.025   7.071
  673   HG22  VAL  83          2HG2      VAL  83   0.849  -4.899   5.825
  674   HG23  VAL  83          1HG2      VAL  83  -0.794  -5.539   5.786
  675    HA   PRO  84           HA       PRO  84   4.442  -5.482   8.540
  676    HB2  PRO  84           HB2      PRO  84   3.012  -8.085   8.743
  677    HB3  PRO  84           HB3      PRO  84   4.417  -7.501   9.643
  678    HG2  PRO  84           HG2      PRO  84   2.027  -7.615  10.803
  679    HG3  PRO  84           HG3      PRO  84   3.121  -6.254  11.113
  680    HD2  PRO  84           HD2      PRO  84   0.700  -6.379   9.356
  681    HD3  PRO  84           HD3      PRO  84   1.262  -5.065  10.411
  682    H    VAL  85           H        VAL  85   5.591  -6.375   6.839
  683    HA   VAL  85           HA       VAL  85   4.365  -6.067   4.322
  684    HB   VAL  85           HB       VAL  85   6.787  -5.692   4.839
  685   HG11  VAL  85          2HG1      VAL  85   8.331  -7.585   4.664
  686   HG12  VAL  85          1HG1      VAL  85   6.957  -8.690   4.613
  687   HG13  VAL  85          3HG1      VAL  85   7.261  -7.729   6.060
  688   HG21  VAL  85          3HG2      VAL  85   6.165  -7.440   2.467
  689   HG22  VAL  85          2HG2      VAL  85   7.598  -6.427   2.643
  690   HG23  VAL  85          1HG2      VAL  85   6.000  -5.687   2.552
  691    H    SER  86           H        SER  86   4.653  -8.863   6.333
  692    HA   SER  86           HA       SER  86   4.383 -10.813   4.253
  693    HB2  SER  86           HB2      SER  86   3.850 -11.067   7.220
  694    HB3  SER  86           HB3      SER  86   4.031 -12.402   6.082
  695    HG   SER  86           HG       SER  86   5.984 -10.522   6.925
  696    H    ALA  87           H        ALA  87   2.126  -8.857   6.036
  697    HA   ALA  87           HA       ALA  87  -0.047 -10.624   6.126
  698    HB1  ALA  87           HB1      ALA  87  -0.166  -7.617   6.122
  699    HB2  ALA  87           HB2      ALA  87  -1.412  -8.722   6.698
  700    HB3  ALA  87           HB3      ALA  87   0.138  -8.632   7.531
  701    HA   PRO  88           HA       PRO  88  -1.921  -8.339   2.258
  702    HB2  PRO  88           HB2      PRO  88  -0.131  -7.341   0.455
  703    HB3  PRO  88           HB3      PRO  88  -0.874  -6.378   1.737
  704    HG2  PRO  88           HG2      PRO  88   1.811  -7.705   1.678
  705    HG3  PRO  88           HG3      PRO  88   1.385  -6.070   2.221
  706    HD2  PRO  88           HD2      PRO  88   1.781  -8.053   3.973
  707    HD3  PRO  88           HD3      PRO  88   0.517  -6.833   4.237
  708    H    ILE  89           H        ILE  89   0.658 -10.522   2.389
  709    HA   ILE  89           HA       ILE  89   0.404 -11.451  -0.337
  710    HB   ILE  89           HB       ILE  89   1.838 -12.724   1.999
  711   HG12  ILE  89          2HG1      ILE  89   2.873 -10.976  -0.244
  712   HG13  ILE  89          3HG1      ILE  89   2.699 -10.489   1.438
  713   HG21  ILE  89          2HG2      ILE  89   3.040 -14.008   0.302
  714   HG22  ILE  89          1HG2      ILE  89   2.060 -13.266  -0.962
  715   HG23  ILE  89          3HG2      ILE  89   1.307 -14.326   0.228
  716   HD11  ILE  89          3HD1      ILE  89   5.000 -11.001   0.924
  717   HD12  ILE  89          2HD1      ILE  89   4.545 -12.617   0.384
  718   HD13  ILE  89          1HD1      ILE  89   4.359 -12.169   2.080
  719    H    LYS  90           H        LYS  90  -0.723 -12.403   2.865
  720    HA   LYS  90           HA       LYS  90  -2.116 -14.710   1.728
  721    HB2  LYS  90           HB2      LYS  90  -1.700 -13.803   4.575
  722    HB3  LYS  90           HB3      LYS  90  -2.692 -15.185   4.135
  723    HG2  LYS  90           HG2      LYS  90  -0.728 -16.262   3.139
  724    HG3  LYS  90           HG3      LYS  90   0.260 -14.878   3.616
  725    HD2  LYS  90           HD2      LYS  90  -0.198 -15.305   5.948
  726    HD3  LYS  90           HD3      LYS  90  -1.306 -16.611   5.526
  727    HE2  LYS  90           HE2      LYS  90   0.876 -17.461   6.250
  728    HE3  LYS  90           HE3      LYS  90   0.527 -17.893   4.578
  729    HZ1  LYS  90           HZ1      LYS  90   1.997 -16.216   3.799
  730    HZ2  LYS  90           HZ2      LYS  90   2.832 -17.093   4.989
  731    HZ3  LYS  90           HZ3      LYS  90   2.195 -15.563   5.355
  732    H    ASP  91           H        ASP  91  -2.758 -11.604   3.243
  733    HA   ASP  91           HA       ASP  91  -5.648 -12.102   2.939
  734    HB2  ASP  91           HB2      ASP  91  -4.205 -10.681   5.175
  735    HB3  ASP  91           HB3      ASP  91  -5.950 -10.642   4.958
  736    H    ALA  92           H        ALA  92  -4.229 -10.887   0.893
  737    HA   ALA  92           HA       ALA  92  -3.928  -8.128   0.987
  738    HB1  ALA  92           HB1      ALA  92  -4.793  -9.792  -1.379
  739    HB2  ALA  92           HB2      ALA  92  -4.133  -8.157  -1.448
  740    HB3  ALA  92           HB3      ALA  92  -3.132  -9.489  -0.871
  741    H    GLU  93           H        GLU  93  -6.870  -9.954   0.035
  742    HA   GLU  93           HA       GLU  93  -8.424  -7.639  -0.453
  743    HB2  GLU  93           HB2      GLU  93  -9.455 -10.321   0.489
  744    HB3  GLU  93           HB3      GLU  93 -10.367  -9.082  -0.358
  745    HG2  GLU  93           HG2      GLU  93  -9.945 -10.452  -2.100
  746    HG3  GLU  93           HG3      GLU  93  -8.479  -9.474  -2.177
  747    H    LYS  94           H        LYS  94  -7.602  -9.363   2.439
  748    HA   LYS  94           HA       LYS  94  -9.678  -8.242   4.071
  749    HB2  LYS  94           HB2      LYS  94  -8.664 -10.446   4.539
  750    HB3  LYS  94           HB3      LYS  94  -7.126  -9.662   4.858
  751    HG2  LYS  94           HG2      LYS  94  -8.133  -8.482   6.757
  752    HG3  LYS  94           HG3      LYS  94  -9.662  -9.305   6.442
  753    HD2  LYS  94           HD2      LYS  94  -7.055 -10.690   7.070
  754    HD3  LYS  94           HD3      LYS  94  -8.334 -10.370   8.244
  755    HE2  LYS  94           HE2      LYS  94  -9.855 -11.799   7.089
  756    HE3  LYS  94           HE3      LYS  94  -8.761 -11.951   5.714
  757    HZ1  LYS  94           HZ1      LYS  94  -8.747 -13.903   7.192
  758    HZ2  LYS  94           HZ2      LYS  94  -8.162 -12.931   8.454
  759    HZ3  LYS  94           HZ3      LYS  94  -7.222 -13.170   7.062
  760    H    VAL  95           H        VAL  95  -6.280  -7.604   3.449
  761    HA   VAL  95           HA       VAL  95  -5.903  -5.629   5.436
  762    HB   VAL  95           HB       VAL  95  -4.170  -6.932   4.050
  763   HG11  VAL  95          2HG1      VAL  95  -3.226  -5.774   2.132
  764   HG12  VAL  95          1HG1      VAL  95  -4.567  -4.629   2.183
  765   HG13  VAL  95          3HG1      VAL  95  -4.876  -6.336   1.850
  766   HG21  VAL  95          3HG2      VAL  95  -2.474  -5.204   4.371
  767   HG22  VAL  95          2HG2      VAL  95  -3.566  -5.315   5.752
  768   HG23  VAL  95          1HG2      VAL  95  -3.748  -4.003   4.585
  769    H    ILE  96           H        ILE  96  -6.948  -5.542   2.105
  770    HA   ILE  96           HA       ILE  96  -7.162  -2.754   1.776
  771    HB   ILE  96           HB       ILE  96  -8.744  -5.002   0.515
  772   HG12  ILE  96          2HG1      ILE  96  -6.493  -3.270  -0.533
  773   HG13  ILE  96          3HG1      ILE  96  -6.331  -4.937   0.011
  774   HG21  ILE  96          2HG2      ILE  96 -10.088  -2.978   0.441
  775   HG22  ILE  96          1HG2      ILE  96  -9.468  -3.361  -1.166
  776   HG23  ILE  96          3HG2      ILE  96  -8.723  -2.075  -0.216
  777   HD11  ILE  96          3HD1      ILE  96  -7.946  -3.987  -2.342
  778   HD12  ILE  96          2HD1      ILE  96  -7.817  -5.659  -1.792
  779   HD13  ILE  96          1HD1      ILE  96  -6.392  -4.819  -2.402
  780    H    ASN  97           H        ASN  97  -9.573  -5.141   2.848
  781    HA   ASN  97           HA       ASN  97 -11.629  -3.294   3.386
  782    HB2  ASN  97           HB2      ASN  97 -11.077  -6.094   4.306
  783    HB3  ASN  97           HB3      ASN  97 -12.397  -5.179   5.022
  784   HD21  ASN  97          1HD2      ASN  97 -11.228  -6.791   2.189
  785   HD22  ASN  97          2HD2      ASN  97 -12.719  -6.747   1.307
  786    H    ALA  98           H        ALA  98  -8.938  -4.443   5.324
  787    HA   ALA  98           HA       ALA  98  -9.726  -3.392   7.806
  788    HB1  ALA  98           HB1      ALA  98  -7.906  -4.991   7.600
  789    HB2  ALA  98           HB2      ALA  98  -6.946  -3.806   6.715
  790    HB3  ALA  98           HB3      ALA  98  -7.350  -3.526   8.409
  791    H    ALA  99           H        ALA  99  -7.791  -1.972   5.181
  792    HA   ALA  99           HA       ALA  99  -7.366   0.528   6.454
  793    HB1  ALA  99           HB1      ALA  99  -7.391  -0.140   3.509
  794    HB2  ALA  99           HB2      ALA  99  -6.733   1.330   4.228
  795    HB3  ALA  99           HB3      ALA  99  -5.995  -0.232   4.582
  796    H    LEU 100           H        LEU 100  -9.941  -0.757   4.451
  797    HA   LEU 100           HA       LEU 100 -11.315   1.671   4.013
  798    HB2  LEU 100           HB2      LEU 100 -12.354  -1.160   4.116
  799    HB3  LEU 100           HB3      LEU 100 -13.298   0.219   3.588
  800    HG   LEU 100           HG       LEU 100 -10.796  -0.808   2.245
  801   HD11  LEU 100          2HD1      LEU 100 -12.678  -2.314   1.951
  802   HD12  LEU 100          1HD1      LEU 100 -12.323  -1.468   0.445
  803   HD13  LEU 100          3HD1      LEU 100 -13.695  -0.971   1.434
  804   HD21  LEU 100          3HD2      LEU 100 -12.696   1.397   1.447
  805   HD22  LEU 100          2HD2      LEU 100 -11.352   0.792   0.480
  806   HD23  LEU 100          1HD2      LEU 100 -11.037   1.607   2.011
  807    H    ALA 101           H        ALA 101 -11.186  -0.513   6.721
  808    HA   ALA 101           HA       ALA 101 -13.566   0.215   8.018
  809    HB1  ALA 101           HB1      ALA 101 -12.558  -0.726  10.027
  810    HB2  ALA 101           HB2      ALA 101 -12.275  -1.760   8.627
  811    HB3  ALA 101           HB3      ALA 101 -10.981  -0.731   9.241
  812    H    LEU 102           H        LEU 102 -10.578   1.897   7.684
  813    HA   LEU 102           HA       LEU 102 -10.709   3.499  10.004
  814    HB2  LEU 102           HB2      LEU 102  -9.253   3.699   7.400
  815    HB3  LEU 102           HB3      LEU 102  -9.249   5.068   8.494
  816    HG   LEU 102           HG       LEU 102  -7.242   3.792   8.818
  817   HD11  LEU 102          2HD1      LEU 102  -8.239   4.789  10.799
  818   HD12  LEU 102          1HD1      LEU 102  -7.393   3.292  11.190
  819   HD13  LEU 102          3HD1      LEU 102  -9.154   3.309  11.091
  820   HD21  LEU 102          3HD2      LEU 102  -7.286   1.460   9.572
  821   HD22  LEU 102          2HD2      LEU 102  -7.961   1.648   7.954
  822   HD23  LEU 102          1HD2      LEU 102  -9.034   1.426   9.335
  823    H    ILE 103           H        ILE 103 -12.026   3.932   6.746
  824    HA   ILE 103           HA       ILE 103 -13.273   6.428   7.694
  825    HB   ILE 103           HB       ILE 103 -13.425   7.105   5.289
  826   HG12  ILE 103          2HG1      ILE 103 -11.453   4.844   4.869
  827   HG13  ILE 103          3HG1      ILE 103 -13.131   4.819   4.336
  828   HG21  ILE 103          2HG2      ILE 103 -11.075   7.810   5.144
  829   HG22  ILE 103          1HG2      ILE 103 -10.670   6.676   6.432
  830   HG23  ILE 103          3HG2      ILE 103 -11.742   8.035   6.762
  831   HD11  ILE 103          3HD1      ILE 103 -11.629   5.362   2.510
  832   HD12  ILE 103          2HD1      ILE 103 -11.015   6.748   3.411
  833   HD13  ILE 103          1HD1      ILE 103 -12.696   6.718   2.875
  834    H    ASP 104           H        ASP 104 -13.805   3.594   5.620
  835    HA   ASP 104           HA       ASP 104 -16.631   4.185   5.367
  836    HB2  ASP 104           HB2      ASP 104 -14.806   2.051   4.302
  837    HB3  ASP 104           HB3      ASP 104 -16.548   1.810   4.258
  838    H    GLU 105           H        GLU 105 -14.532   1.898   6.993
  839    HA   GLU 105           HA       GLU 105 -14.834   0.372   8.635
  840    HB2  GLU 105           HB2      GLU 105 -15.635   2.342   9.894
  841    HB3  GLU 105           HB3      GLU 105 -17.270   2.026   9.329
  842    HG2  GLU 105           HG2      GLU 105 -17.276  -0.106  10.496
  843    HG3  GLU 105           HG3      GLU 105 -15.624   0.180  11.039
  844    H    LYS 106           H        LYS 106 -15.220  -1.270   7.097
  845    HA   LYS 106           HA       LYS 106 -18.027  -2.151   7.006
  846    HB2  LYS 106           HB2      LYS 106 -15.908  -2.650   4.902
  847    HB3  LYS 106           HB3      LYS 106 -17.587  -3.162   4.833
  848    HG2  LYS 106           HG2      LYS 106 -16.618  -0.310   4.825
  849    HG3  LYS 106           HG3      LYS 106 -17.181  -1.219   3.424
  850    HD2  LYS 106           HD2      LYS 106 -18.842  -0.592   5.863
  851    HD3  LYS 106           HD3      LYS 106 -18.901   0.302   4.344
  852    HE2  LYS 106           HE2      LYS 106 -19.583  -1.760   3.185
  853    HE3  LYS 106           HE3      LYS 106 -19.572  -2.614   4.729
  854    HZ1  LYS 106           HZ1      LYS 106 -21.267  -0.251   4.131
  855    HZ2  LYS 106           HZ2      LYS 106 -21.325  -1.216   5.528
  856    HZ3  LYS 106           HZ3      LYS 106 -21.797  -1.861   4.031
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1 -16.785  -1.239  -7.207
    2    H2   MET   1           H2       MET   1 -16.917   0.163  -8.145
    3    H3   MET   1           H3       MET   1 -18.134  -0.226  -7.036
    4    HA   MET   1           HA       MET   1 -16.793   1.527  -6.149
    5    HB2  MET   1           HB2      MET   1 -16.205  -1.129  -4.819
    6    HB3  MET   1           HB3      MET   1 -16.031   0.445  -4.059
    7    HG2  MET   1           HG2      MET   1 -18.615  -0.709  -5.081
    8    HG3  MET   1           HG3      MET   1 -18.085  -0.718  -3.400
    9    HE1  MET   1           HE1      MET   1 -20.994   1.904  -3.422
   10    HE2  MET   1           HE2      MET   1 -20.882   0.395  -4.326
   11    HE3  MET   1           HE3      MET   1 -20.357   0.457  -2.641
   12    H    LYS   2           H        LYS   2 -15.094   2.484  -7.118
   13    HA   LYS   2           HA       LYS   2 -12.594   0.956  -7.332
   14    HB2  LYS   2           HB2      LYS   2 -13.510   3.477  -8.709
   15    HB3  LYS   2           HB3      LYS   2 -11.853   2.893  -8.786
   16    HG2  LYS   2           HG2      LYS   2 -12.689   0.785  -9.772
   17    HG3  LYS   2           HG3      LYS   2 -14.313   1.479  -9.787
   18    HD2  LYS   2           HD2      LYS   2 -13.598   3.235 -11.277
   19    HD3  LYS   2           HD3      LYS   2 -11.922   2.687 -11.173
   20    HE2  LYS   2           HE2      LYS   2 -12.582   0.551 -12.199
   21    HE3  LYS   2           HE3      LYS   2 -14.236   1.145 -12.340
   22    HZ1  LYS   2           HZ1      LYS   2 -11.894   2.469 -13.596
   23    HZ2  LYS   2           HZ2      LYS   2 -13.530   2.829 -13.849
   24    HZ3  LYS   2           HZ3      LYS   2 -12.891   1.355 -14.394
   25    H    ARG   3           H        ARG   3 -12.121   1.144  -5.092
   26    HA   ARG   3           HA       ARG   3 -11.670   3.744  -3.960
   27    HB2  ARG   3           HB2      ARG   3 -12.276   1.722  -2.612
   28    HB3  ARG   3           HB3      ARG   3 -10.687   1.061  -2.971
   29    HG2  ARG   3           HG2      ARG   3 -10.692   2.052  -0.777
   30    HG3  ARG   3           HG3      ARG   3  -9.655   2.990  -1.853
   31    HD2  ARG   3           HD2      ARG   3 -11.008   4.469  -0.485
   32    HD3  ARG   3           HD3      ARG   3 -11.468   4.602  -2.181
   33    HE   ARG   3           HE       ARG   3 -13.113   2.697  -0.906
   34   HH11  ARG   3          2HH1      ARG   3 -12.577   6.160  -1.102
   35   HH12  ARG   3          1HH1      ARG   3 -14.209   6.550  -0.638
   36   HH21  ARG   3          2HH2      ARG   3 -15.245   3.223  -0.291
   37   HH22  ARG   3          1HH2      ARG   3 -15.723   4.891  -0.177
   38    H    LYS   4           H        LYS   4  -9.966   4.958  -4.297
   39    HA   LYS   4           HA       LYS   4  -7.675   3.889  -5.703
   40    HB2  LYS   4           HB2      LYS   4  -6.912   6.344  -5.584
   41    HB3  LYS   4           HB3      LYS   4  -8.281   5.946  -6.608
   42    HG2  LYS   4           HG2      LYS   4  -8.622   6.969  -3.809
   43    HG3  LYS   4           HG3      LYS   4  -8.439   8.047  -5.192
   44    HD2  LYS   4           HD2      LYS   4 -10.600   5.967  -4.832
   45    HD3  LYS   4           HD3      LYS   4 -10.795   7.708  -4.636
   46    HE2  LYS   4           HE2      LYS   4 -10.281   8.056  -6.981
   47    HE3  LYS   4           HE3      LYS   4  -9.983   6.332  -7.195
   48    HZ1  LYS   4           HZ1      LYS   4 -12.584   7.546  -6.426
   49    HZ2  LYS   4           HZ2      LYS   4 -12.296   5.896  -6.665
   50    HZ3  LYS   4           HZ3      LYS   4 -12.190   6.970  -7.973
   51    H    ILE   5           H        ILE   5  -5.989   3.111  -4.731
   52    HA   ILE   5           HA       ILE   5  -5.504   3.873  -1.925
   53    HB   ILE   5           HB       ILE   5  -5.227   1.085  -3.061
   54   HG12  ILE   5          2HG1      ILE   5  -7.408   2.215  -1.288
   55   HG13  ILE   5          3HG1      ILE   5  -7.592   1.808  -2.992
   56   HG21  ILE   5          2HG2      ILE   5  -3.736   1.564  -1.191
   57   HG22  ILE   5          1HG2      ILE   5  -4.987   0.415  -0.718
   58   HG23  ILE   5          3HG2      ILE   5  -5.108   2.103  -0.222
   59   HD11  ILE   5          3HD1      ILE   5  -7.137  -0.536  -2.475
   60   HD12  ILE   5          2HD1      ILE   5  -8.525   0.079  -1.577
   61   HD13  ILE   5          1HD1      ILE   5  -6.970  -0.123  -0.768
   62    H    ILE   6           H        ILE   6  -3.457   4.411  -1.466
   63    HA   ILE   6           HA       ILE   6  -1.363   3.581  -3.349
   64    HB   ILE   6           HB       ILE   6   0.084   5.310  -2.401
   65   HG12  ILE   6          2HG1      ILE   6  -1.112   5.364  -0.138
   66   HG13  ILE   6          3HG1      ILE   6  -0.569   6.905  -0.788
   67   HG21  ILE   6          2HG2      ILE   6  -1.097   7.272  -3.327
   68   HG22  ILE   6          1HG2      ILE   6  -2.575   6.312  -3.392
   69   HG23  ILE   6          3HG2      ILE   6  -1.178   5.848  -4.366
   70   HD11  ILE   6          3HD1      ILE   6  -3.382   5.837  -0.873
   71   HD12  ILE   6          2HD1      ILE   6  -2.845   7.381  -1.533
   72   HD13  ILE   6          1HD1      ILE   6  -2.769   7.091   0.205
   73    H    ALA   7           H        ALA   7   0.055   2.103  -2.724
   74    HA   ALA   7           HA       ALA   7   0.222   1.477   0.146
   75    HB1  ALA   7           HB1      ALA   7   0.152  -0.912  -0.374
   76    HB2  ALA   7           HB2      ALA   7  -1.328  -0.099  -0.883
   77    HB3  ALA   7           HB3      ALA   7  -0.106  -0.536  -2.078
   78    H    VAL   8           H        VAL   8   2.242   1.313   0.861
   79    HA   VAL   8           HA       VAL   8   4.366   0.999  -1.151
   80    HB   VAL   8           HB       VAL   8   4.576   2.285   1.577
   81   HG11  VAL   8          2HG1      VAL   8   6.819   2.962   0.837
   82   HG12  VAL   8          1HG1      VAL   8   6.603   2.030  -0.644
   83   HG13  VAL   8          3HG1      VAL   8   6.653   1.208   0.916
   84   HG21  VAL   8          3HG2      VAL   8   4.881   4.381   0.338
   85   HG22  VAL   8          2HG2      VAL   8   3.300   3.664   0.028
   86   HG23  VAL   8          1HG2      VAL   8   4.582   3.524  -1.175
   87    H    THR   9           H        THR   9   5.367  -0.838  -1.154
   88    HA   THR   9           HA       THR   9   5.459  -2.482   1.278
   89    HB   THR   9           HB       THR   9   6.222  -4.291  -0.351
   90    HG1  THR   9           HG1      THR   9   5.991  -2.169  -2.061
   91   HG21  THR   9          3HG2      THR   9   3.954  -4.782  -1.108
   92   HG22  THR   9          1HG2      THR   9   3.469  -3.121  -0.765
   93   HG23  THR   9          2HG2      THR   9   3.944  -4.190   0.554
   94    H    ALA  10           H        ALA  10   7.332  -2.516   2.368
   95    HA   ALA  10           HA       ALA  10   9.863  -2.305   0.968
   96    HB1  ALA  10           HB1      ALA  10   9.063  -0.202   2.976
   97    HB2  ALA  10           HB2      ALA  10  10.648  -0.360   2.217
   98    HB3  ALA  10           HB3      ALA  10   9.237   0.042   1.238
   99    H    CYS  11           H        CYS  11  10.610  -4.195   1.810
  100    HA   CYS  11           HA       CYS  11  10.677  -4.414   4.747
  101    HB2  CYS  11           HB2      CYS  11   9.260  -6.133   3.738
  102    HB3  CYS  11           HB3      CYS  11  10.571  -6.615   2.669
  103    HG   CYS  11           HG       CYS  11   9.904  -7.591   5.759
  104    H    ALA  12           H        ALA  12  12.603  -4.959   5.736
  105    HA   ALA  12           HA       ALA  12  14.979  -4.900   4.005
  106    HB1  ALA  12           HB1      ALA  12  16.230  -4.307   6.012
  107    HB2  ALA  12           HB2      ALA  12  14.880  -3.200   5.767
  108    HB3  ALA  12           HB3      ALA  12  14.767  -4.470   6.985
  109    H    THR  13           H        THR  13  13.045  -6.951   5.844
  110    HA   THR  13           HA       THR  13  14.951  -8.864   6.705
  111    HB   THR  13           HB       THR  13  12.074  -9.432   5.992
  112    HG1  THR  13           HG1      THR  13  12.814  -7.572   7.647
  113   HG21  THR  13          3HG2      THR  13  12.264 -11.054   7.859
  114   HG22  THR  13          1HG2      THR  13  13.975 -10.647   8.001
  115   HG23  THR  13          2HG2      THR  13  13.366 -11.405   6.528
  116    H    GLY  14           H        GLY  14  12.646  -8.924   3.980
  117    HA2  GLY  14           HA1      GLY  14  14.594 -10.484   2.437
  118    HA3  GLY  14           HA2      GLY  14  12.980 -11.140   2.667
  119    H    VAL  15           H        VAL  15  14.794  -9.732   0.469
  120    HA   VAL  15           HA       VAL  15  13.321  -7.511  -0.457
  121    HB   VAL  15           HB       VAL  15  15.122  -9.336  -2.061
  122   HG11  VAL  15          2HG1      VAL  15  15.446  -7.382  -3.506
  123   HG12  VAL  15          1HG1      VAL  15  14.278  -6.478  -2.541
  124   HG13  VAL  15          3HG1      VAL  15  13.757  -7.888  -3.463
  125   HG21  VAL  15          3HG2      VAL  15  16.902  -7.735  -1.552
  126   HG22  VAL  15          2HG2      VAL  15  16.270  -8.487  -0.087
  127   HG23  VAL  15          1HG2      VAL  15  15.799  -6.839  -0.506
  128    H    ALA  16           H        ALA  16  13.254 -10.950  -1.316
  129    HA   ALA  16           HA       ALA  16  11.405 -10.755  -3.440
  130    HB1  ALA  16           HB1      ALA  16  12.769 -12.745  -3.050
  131    HB2  ALA  16           HB2      ALA  16  11.876 -13.071  -1.563
  132    HB3  ALA  16           HB3      ALA  16  11.054 -13.149  -3.122
  133    H    HIS  17           H        HIS  17  11.001 -10.856   0.021
  134    HA   HIS  17           HA       HIS  17   8.206 -11.416   0.023
  135    HB2  HIS  17           HB2      HIS  17  10.037 -10.215   2.104
  136    HB3  HIS  17           HB3      HIS  17   8.321 -10.478   2.388
  137    HD1  HIS  17           HD1      HIS  17   8.958 -12.127   4.313
  138    HD2  HIS  17           HD2      HIS  17  10.193 -13.306   0.517
  139    HE1  HIS  17           HE1      HIS  17   9.598 -14.552   4.525
  140    HE2  HIS  17           HE2      HIS  17  10.239 -15.277   2.197
  141    H    THR  18           H        THR  18  10.158  -8.485   0.112
  142    HA   THR  18           HA       THR  18   8.180  -6.566   0.435
  143    HB   THR  18           HB       THR  18  10.605  -6.328  -1.354
  144    HG1  THR  18           HG1      THR  18  11.802  -6.048   0.415
  145   HG21  THR  18          3HG2      THR  18   9.043  -4.460  -1.534
  146   HG22  THR  18          1HG2      THR  18  10.534  -3.962  -0.733
  147   HG23  THR  18          2HG2      THR  18   9.076  -4.253   0.217
  148    H    TYR  19           H        TYR  19   9.447  -8.029  -2.534
  149    HA   TYR  19           HA       TYR  19   7.832  -6.404  -4.230
  150    HB2  TYR  19           HB2      TYR  19  10.075  -7.372  -4.831
  151    HB3  TYR  19           HB3      TYR  19   9.285  -8.940  -4.977
  152    HD1  TYR  19           HD2      TYR  19   8.896  -5.440  -6.210
  153    HD2  TYR  19           HD1      TYR  19   8.571  -9.589  -7.076
  154    HE1  TYR  19           HE2      TYR  19   8.283  -4.899  -8.526
  155    HE2  TYR  19           HE1      TYR  19   7.957  -9.061  -9.398
  156    HH   TYR  19           HH       TYR  19   8.376  -6.014 -10.762
  157    H    MET  20           H        MET  20   7.629  -9.762  -3.098
  158    HA   MET  20           HA       MET  20   5.463 -10.474  -4.771
  159    HB2  MET  20           HB2      MET  20   6.903 -12.163  -3.743
  160    HB3  MET  20           HB3      MET  20   6.330 -11.695  -2.147
  161    HG2  MET  20           HG2      MET  20   4.138 -12.492  -2.610
  162    HG3  MET  20           HG3      MET  20   4.525 -12.736  -4.311
  163    HE1  MET  20           HE1      MET  20   5.419 -13.871  -0.650
  164    HE2  MET  20           HE2      MET  20   6.472 -15.253  -0.967
  165    HE3  MET  20           HE3      MET  20   6.999 -13.626  -1.394
  166    H    ALA  21           H        ALA  21   5.644  -8.898  -1.661
  167    HA   ALA  21           HA       ALA  21   2.971  -9.188  -0.854
  168    HB1  ALA  21           HB1      ALA  21   3.339  -7.243   0.549
  169    HB2  ALA  21           HB2      ALA  21   4.752  -8.298   0.597
  170    HB3  ALA  21           HB3      ALA  21   4.785  -6.826  -0.372
  171    H    ALA  22           H        ALA  22   4.546  -6.763  -2.885
  172    HA   ALA  22           HA       ALA  22   2.277  -5.144  -3.347
  173    HB1  ALA  22           HB1      ALA  22   4.703  -5.556  -5.101
  174    HB2  ALA  22           HB2      ALA  22   3.554  -4.220  -5.210
  175    HB3  ALA  22           HB3      ALA  22   4.571  -4.395  -3.779
  176    H    GLN  23           H        GLN  23   3.585  -7.964  -5.016
  177    HA   GLN  23           HA       GLN  23   1.920  -7.830  -7.293
  178    HB2  GLN  23           HB2      GLN  23   3.206 -10.271  -6.058
  179    HB3  GLN  23           HB3      GLN  23   2.584 -10.149  -7.696
  180    HG2  GLN  23           HG2      GLN  23   4.261  -8.410  -8.176
  181    HG3  GLN  23           HG3      GLN  23   4.912  -8.624  -6.551
  182   HE21  GLN  23          1HE2      GLN  23   4.637  -9.955  -9.729
  183   HE22  GLN  23          2HE2      GLN  23   5.784 -11.238  -9.518
  184    H    ALA  24           H        ALA  24   1.641  -9.715  -4.288
  185    HA   ALA  24           HA       ALA  24  -0.815 -10.953  -5.001
  186    HB1  ALA  24           HB1      ALA  24  -0.925 -11.646  -2.668
  187    HB2  ALA  24           HB2      ALA  24   0.698 -11.886  -3.314
  188    HB3  ALA  24           HB3      ALA  24   0.365 -10.515  -2.258
  189    H    LEU  25           H        LEU  25   0.012  -8.077  -3.126
  190    HA   LEU  25           HA       LEU  25  -2.573  -7.379  -2.288
  191    HB2  LEU  25           HB2      LEU  25  -0.465  -6.379  -1.454
  192    HB3  LEU  25           HB3      LEU  25  -0.273  -5.552  -2.986
  193    HG   LEU  25           HG       LEU  25  -2.342  -4.285  -2.549
  194   HD11  LEU  25          2HD1      LEU  25  -2.263  -5.650   0.139
  195   HD12  LEU  25          1HD1      LEU  25  -3.473  -5.906  -1.119
  196   HD13  LEU  25          3HD1      LEU  25  -3.345  -4.337  -0.324
  197   HD21  LEU  25          3HD2      LEU  25  -0.289  -4.123  -0.346
  198   HD22  LEU  25          2HD2      LEU  25  -1.408  -2.847  -0.824
  199   HD23  LEU  25          1HD2      LEU  25  -0.151  -3.383  -1.941
  200    H    LYS  26           H        LYS  26  -0.774  -6.535  -5.221
  201    HA   LYS  26           HA       LYS  26  -2.693  -4.905  -6.447
  202    HB2  LYS  26           HB2      LYS  26  -0.399  -5.117  -7.285
  203    HB3  LYS  26           HB3      LYS  26  -0.699  -6.795  -7.716
  204    HG2  LYS  26           HG2      LYS  26  -2.538  -5.901  -9.241
  205    HG3  LYS  26           HG3      LYS  26  -1.817  -4.313  -8.977
  206    HD2  LYS  26           HD2      LYS  26  -0.376  -6.726 -10.075
  207    HD3  LYS  26           HD3      LYS  26  -0.988  -5.378 -11.032
  208    HE2  LYS  26           HE2      LYS  26   0.510  -3.852  -9.869
  209    HE3  LYS  26           HE3      LYS  26   1.087  -5.173  -8.852
  210    HZ1  LYS  26           HZ1      LYS  26   1.362  -5.067 -11.809
  211    HZ2  LYS  26           HZ2      LYS  26   1.992  -6.261 -10.782
  212    HZ3  LYS  26           HZ3      LYS  26   2.594  -4.676 -10.711
  213    H    LYS  27           H        LYS  27  -2.186  -8.401  -6.586
  214    HA   LYS  27           HA       LYS  27  -4.159  -9.081  -8.426
  215    HB2  LYS  27           HB2      LYS  27  -2.460 -10.660  -7.631
  216    HB3  LYS  27           HB3      LYS  27  -3.169 -10.641  -6.024
  217    HG2  LYS  27           HG2      LYS  27  -3.817 -12.654  -7.157
  218    HG3  LYS  27           HG3      LYS  27  -5.234 -11.625  -6.949
  219    HD2  LYS  27           HD2      LYS  27  -5.279 -12.560  -9.162
  220    HD3  LYS  27           HD3      LYS  27  -4.936 -10.834  -9.286
  221    HE2  LYS  27           HE2      LYS  27  -3.523 -12.120 -10.803
  222    HE3  LYS  27           HE3      LYS  27  -2.561 -11.315  -9.565
  223    HZ1  LYS  27           HZ1      LYS  27  -1.964 -13.692 -10.066
  224    HZ2  LYS  27           HZ2      LYS  27  -3.417 -14.146  -9.322
  225    HZ3  LYS  27           HZ3      LYS  27  -2.225 -13.334  -8.430
  226    H    GLY  28           H        GLY  28  -4.382  -8.720  -4.902
  227    HA2  GLY  28           HA1      GLY  28  -7.092  -9.509  -4.683
  228    HA3  GLY  28           HA2      GLY  28  -6.196  -8.565  -3.502
  229    H    ALA  29           H        ALA  29  -5.584  -6.332  -5.129
  230    HA   ALA  29           HA       ALA  29  -7.989  -4.853  -4.808
  231    HB1  ALA  29           HB1      ALA  29  -5.465  -4.049  -6.250
  232    HB2  ALA  29           HB2      ALA  29  -6.740  -2.968  -5.686
  233    HB3  ALA  29           HB3      ALA  29  -5.759  -3.861  -4.521
  234    H    LYS  30           H        LYS  30  -6.244  -6.089  -7.617
  235    HA   LYS  30           HA       LYS  30  -7.943  -5.062  -9.615
  236    HB2  LYS  30           HB2      LYS  30  -5.694  -6.028 -10.013
  237    HB3  LYS  30           HB3      LYS  30  -6.326  -7.619  -9.614
  238    HG2  LYS  30           HG2      LYS  30  -7.884  -7.425 -11.530
  239    HG3  LYS  30           HG3      LYS  30  -7.099  -5.904 -11.963
  240    HD2  LYS  30           HD2      LYS  30  -4.941  -7.132 -12.117
  241    HD3  LYS  30           HD3      LYS  30  -5.823  -8.634 -11.826
  242    HE2  LYS  30           HE2      LYS  30  -7.177  -8.185 -13.840
  243    HE3  LYS  30           HE3      LYS  30  -6.207  -6.743 -14.142
  244    HZ1  LYS  30           HZ1      LYS  30  -4.233  -8.312 -14.137
  245    HZ2  LYS  30           HZ2      LYS  30  -5.279  -8.400 -15.470
  246    HZ3  LYS  30           HZ3      LYS  30  -5.363  -9.577 -14.250
  247    H    LYS  31           H        LYS  31  -8.004  -8.000  -7.701
  248    HA   LYS  31           HA       LYS  31 -10.088  -9.358  -9.008
  249    HB2  LYS  31           HB2      LYS  31  -8.482 -10.345  -7.390
  250    HB3  LYS  31           HB3      LYS  31  -9.281  -9.467  -6.095
  251    HG2  LYS  31           HG2      LYS  31 -11.351 -10.719  -6.567
  252    HG3  LYS  31           HG3      LYS  31 -10.479 -11.645  -7.794
  253    HD2  LYS  31           HD2      LYS  31  -8.926 -12.452  -6.099
  254    HD3  LYS  31           HD3      LYS  31  -9.749 -11.492  -4.870
  255    HE2  LYS  31           HE2      LYS  31 -11.802 -12.791  -5.268
  256    HE3  LYS  31           HE3      LYS  31 -10.932 -13.773  -6.447
  257    HZ1  LYS  31           HZ1      LYS  31 -10.282 -13.548  -3.555
  258    HZ2  LYS  31           HZ2      LYS  31  -9.421 -14.471  -4.688
  259    HZ3  LYS  31           HZ3      LYS  31 -11.020 -14.876  -4.312
  260    H    MET  32           H        MET  32 -10.086  -6.840  -6.588
  261    HA   MET  32           HA       MET  32 -12.954  -7.087  -6.148
  262    HB2  MET  32           HB2      MET  32 -10.879  -5.231  -4.984
  263    HB3  MET  32           HB3      MET  32 -12.587  -5.164  -4.576
  264    HG2  MET  32           HG2      MET  32 -10.806  -7.552  -4.152
  265    HG3  MET  32           HG3      MET  32 -11.232  -6.370  -2.914
  266    HE1  MET  32           HE1      MET  32 -12.216  -8.048  -1.238
  267    HE2  MET  32           HE2      MET  32 -13.348  -9.335  -1.657
  268    HE3  MET  32           HE3      MET  32 -11.704  -9.368  -2.293
  269    H    GLY  33           H        GLY  33 -10.790  -5.371  -8.139
  270    HA2  GLY  33           HA1      GLY  33 -11.378  -4.103 -10.001
  271    HA3  GLY  33           HA2      GLY  33 -13.015  -3.983  -9.378
  272    H    ASN  34           H        ASN  34 -10.098  -3.148  -7.588
  273    HA   ASN  34           HA       ASN  34 -11.128  -0.409  -7.364
  274    HB2  ASN  34           HB2      ASN  34  -9.066  -1.888  -5.721
  275    HB3  ASN  34           HB3      ASN  34  -9.453  -0.185  -5.504
  276   HD21  ASN  34          1HD2      ASN  34 -10.381  -3.415  -4.890
  277   HD22  ASN  34          2HD2      ASN  34 -11.775  -3.064  -3.925
  278    H    LEU  35           H        LEU  35  -9.088   1.136  -6.873
  279    HA   LEU  35           HA       LEU  35  -7.276   0.831  -9.174
  280    HB2  LEU  35           HB2      LEU  35  -8.353   3.385  -7.970
  281    HB3  LEU  35           HB3      LEU  35  -7.199   3.291  -9.285
  282    HG   LEU  35           HG       LEU  35 -10.056   2.317  -9.390
  283   HD11  LEU  35          2HD1      LEU  35 -10.419   4.179 -10.899
  284   HD12  LEU  35          1HD1      LEU  35  -8.738   4.680 -10.717
  285   HD13  LEU  35          3HD1      LEU  35  -9.837   4.762  -9.339
  286   HD21  LEU  35          3HD2      LEU  35  -8.553   0.974 -10.781
  287   HD22  LEU  35          2HD2      LEU  35  -7.953   2.444 -11.548
  288   HD23  LEU  35          1HD2      LEU  35  -9.636   1.963 -11.762
  289    H    ILE  36           H        ILE  36  -5.493   0.019  -8.201
  290    HA   ILE  36           HA       ILE  36  -4.583   1.339  -5.741
  291    HB   ILE  36           HB       ILE  36  -5.121  -1.065  -5.504
  292   HG12  ILE  36          2HG1      ILE  36  -2.180  -0.430  -5.217
  293   HG13  ILE  36          3HG1      ILE  36  -3.435   0.031  -4.072
  294   HG21  ILE  36          2HG2      ILE  36  -4.540  -1.808  -7.751
  295   HG22  ILE  36          1HG2      ILE  36  -3.681  -2.751  -6.534
  296   HG23  ILE  36          3HG2      ILE  36  -2.837  -1.487  -7.429
  297   HD11  ILE  36          3HD1      ILE  36  -3.895  -2.313  -3.626
  298   HD12  ILE  36          2HD1      ILE  36  -2.206  -1.919  -3.313
  299   HD13  ILE  36          1HD1      ILE  36  -2.651  -2.785  -4.785
  300    H    LYS  37           H        LYS  37  -2.609   2.188  -5.612
  301    HA   LYS  37           HA       LYS  37  -0.746   1.753  -7.854
  302    HB2  LYS  37           HB2      LYS  37  -1.728   4.062  -7.804
  303    HB3  LYS  37           HB3      LYS  37  -1.034   4.278  -6.206
  304    HG2  LYS  37           HG2      LYS  37   0.311   5.346  -7.931
  305    HG3  LYS  37           HG3      LYS  37   1.201   4.059  -7.118
  306    HD2  LYS  37           HD2      LYS  37   0.751   2.554  -8.990
  307    HD3  LYS  37           HD3      LYS  37  -0.176   3.820  -9.795
  308    HE2  LYS  37           HE2      LYS  37   2.727   4.100  -9.042
  309    HE3  LYS  37           HE3      LYS  37   2.176   3.533 -10.617
  310    HZ1  LYS  37           HZ1      LYS  37   1.311   5.590 -11.154
  311    HZ2  LYS  37           HZ2      LYS  37   2.717   6.016 -10.305
  312    HZ3  LYS  37           HZ3      LYS  37   1.205   6.111  -9.543
  313    H    VAL  38           H        VAL  38   0.626   0.304  -7.043
  314    HA   VAL  38           HA       VAL  38   1.363   0.540  -4.217
  315    HB   VAL  38           HB       VAL  38   0.363  -1.606  -4.941
  316   HG11  VAL  38          2HG1      VAL  38   1.172  -1.724  -7.211
  317   HG12  VAL  38          1HG1      VAL  38   1.683  -3.157  -6.320
  318   HG13  VAL  38          3HG1      VAL  38   2.836  -1.861  -6.644
  319   HG21  VAL  38          3HG2      VAL  38   1.824  -1.572  -3.014
  320   HG22  VAL  38          2HG2      VAL  38   3.237  -1.779  -4.050
  321   HG23  VAL  38          1HG2      VAL  38   2.047  -3.073  -3.913
  322    H    GLU  39           H        GLU  39   3.443   0.634  -3.561
  323    HA   GLU  39           HA       GLU  39   5.506   0.952  -5.645
  324    HB2  GLU  39           HB2      GLU  39   4.976   3.074  -4.515
  325    HB3  GLU  39           HB3      GLU  39   5.314   2.329  -2.958
  326    HG2  GLU  39           HG2      GLU  39   7.647   1.909  -3.789
  327    HG3  GLU  39           HG3      GLU  39   7.250   2.924  -5.174
  328    H    THR  40           H        THR  40   7.078  -0.548  -5.550
  329    HA   THR  40           HA       THR  40   7.596  -1.881  -2.995
  330    HB   THR  40           HB       THR  40   8.663  -2.516  -5.755
  331    HG1  THR  40           HG1      THR  40   6.510  -3.536  -4.215
  332   HG21  THR  40          3HG2      THR  40   9.394  -4.634  -4.746
  333   HG22  THR  40          1HG2      THR  40   8.858  -4.061  -3.167
  334   HG23  THR  40          2HG2      THR  40  10.187  -3.250  -3.995
  335    H    GLN  41           H        GLN  41   9.077  -0.960  -1.731
  336    HA   GLN  41           HA       GLN  41  11.367   0.369  -3.038
  337    HB2  GLN  41           HB2      GLN  41   9.840   1.918  -1.839
  338    HB3  GLN  41           HB3      GLN  41  10.138   1.028  -0.355
  339    HG2  GLN  41           HG2      GLN  41  12.453   1.665  -0.374
  340    HG3  GLN  41           HG3      GLN  41  12.266   2.431  -1.951
  341   HE21  GLN  41          1HE2      GLN  41   9.637   3.553  -1.270
  342   HE22  GLN  41          2HE2      GLN  41   9.962   4.869  -0.201
  343    H    GLY  42           H        GLY  42  12.875  -1.199  -3.011
  344    HA2  GLY  42           HA1      GLY  42  13.204  -2.896  -0.670
  345    HA3  GLY  42           HA2      GLY  42  14.098  -3.015  -2.180
  346    H    ALA  43           H        ALA  43  13.631  -0.646   0.425
  347    HA   ALA  43           HA       ALA  43  15.048   0.724   1.543
  348    HB1  ALA  43           HB1      ALA  43  16.016  -1.378   2.336
  349    HB2  ALA  43           HB2      ALA  43  17.103  -1.403   0.946
  350    HB3  ALA  43           HB3      ALA  43  17.249  -0.129   2.156
  351    H    THR  44           H        THR  44  14.931   2.407   0.098
  352    HA   THR  44           HA       THR  44  15.816   4.092  -1.137
  353    HB   THR  44           HB       THR  44  18.318   2.409  -1.406
  354    HG1  THR  44           HG1      THR  44  19.064   3.625   0.358
  355   HG21  THR  44          3HG2      THR  44  18.179   4.166  -3.094
  356   HG22  THR  44          1HG2      THR  44  19.410   4.560  -1.896
  357   HG23  THR  44          2HG2      THR  44  17.839   5.362  -1.843
  358    H    GLY  45           H        GLY  45  16.339   0.830  -2.410
  359    HA2  GLY  45           HA1      GLY  45  16.201   1.678  -5.157
  360    HA3  GLY  45           HA2      GLY  45  16.192   0.019  -4.572
  361    H    ILE  46           H        ILE  46  14.308   2.684  -5.606
  362    HA   ILE  46           HA       ILE  46  11.810   1.424  -4.770
  363    HB   ILE  46           HB       ILE  46  12.170   4.069  -6.182
  364   HG12  ILE  46          2HG1      ILE  46  11.886   3.519  -3.217
  365   HG13  ILE  46          3HG1      ILE  46  13.368   4.036  -4.014
  366   HG21  ILE  46          2HG2      ILE  46   9.928   4.526  -5.285
  367   HG22  ILE  46          1HG2      ILE  46   9.876   2.891  -4.624
  368   HG23  ILE  46          3HG2      ILE  46   9.944   3.135  -6.370
  369   HD11  ILE  46          3HD1      ILE  46  12.305   5.900  -2.914
  370   HD12  ILE  46          2HD1      ILE  46  10.812   5.611  -3.805
  371   HD13  ILE  46          1HD1      ILE  46  12.263   6.131  -4.662
  372    H    GLU  47           H        GLU  47  10.588   0.272  -6.117
  373    HA   GLU  47           HA       GLU  47  11.480  -0.129  -8.832
  374    HB2  GLU  47           HB2      GLU  47   9.143  -1.305  -7.321
  375    HB3  GLU  47           HB3      GLU  47   9.698  -1.838  -8.901
  376    HG2  GLU  47           HG2      GLU  47  11.349  -1.913  -6.393
  377    HG3  GLU  47           HG3      GLU  47  10.442  -3.279  -7.040
  378    H    ASN  48           H        ASN  48   8.672   1.281  -7.222
  379    HA   ASN  48           HA       ASN  48   7.503   1.934  -9.849
  380    HB2  ASN  48           HB2      ASN  48   6.098   1.842  -7.168
  381    HB3  ASN  48           HB3      ASN  48   5.348   2.004  -8.752
  382   HD21  ASN  48          1HD2      ASN  48   4.976   0.208  -9.968
  383   HD22  ASN  48          2HD2      ASN  48   5.293  -1.401  -9.424
  384    H    GLU  49           H        GLU  49   7.546   3.225  -6.546
  385    HA   GLU  49           HA       GLU  49   7.858   5.281  -5.677
  386    HB2  GLU  49           HB2      GLU  49   9.678   5.665  -7.274
  387    HB3  GLU  49           HB3      GLU  49   8.514   6.201  -8.478
  388    HG2  GLU  49           HG2      GLU  49   7.909   8.097  -7.115
  389    HG3  GLU  49           HG3      GLU  49   8.964   7.537  -5.819
  390    H    LEU  50           H        LEU  50   6.054   5.995  -4.906
  391    HA   LEU  50           HA       LEU  50   3.832   6.712  -6.635
  392    HB2  LEU  50           HB2      LEU  50   4.054   7.041  -3.644
  393    HB3  LEU  50           HB3      LEU  50   2.587   7.018  -4.603
  394    HG   LEU  50           HG       LEU  50   4.416   4.677  -4.074
  395   HD11  LEU  50          2HD1      LEU  50   2.465   3.752  -2.913
  396   HD12  LEU  50          1HD1      LEU  50   1.592   5.256  -3.204
  397   HD13  LEU  50          3HD1      LEU  50   3.024   5.254  -2.175
  398   HD21  LEU  50          3HD2      LEU  50   3.536   4.541  -6.329
  399   HD22  LEU  50          2HD2      LEU  50   1.903   4.824  -5.728
  400   HD23  LEU  50          1HD2      LEU  50   2.758   3.345  -5.292
  401    H    THR  51           H        THR  51   3.697   8.674  -7.516
  402    HA   THR  51           HA       THR  51   5.355  10.823  -6.522
  403    HB   THR  51           HB       THR  51   4.533  12.119  -8.420
  404    HG1  THR  51           HG1      THR  51   2.736   9.924  -8.695
  405   HG21  THR  51          3HG2      THR  51   6.364  10.534  -8.816
  406   HG22  THR  51          1HG2      THR  51   5.345  10.712 -10.245
  407   HG23  THR  51          2HG2      THR  51   5.191   9.283  -9.224
  408    H    GLU  52           H        GLU  52   4.349  13.031  -6.264
  409    HA   GLU  52           HA       GLU  52   2.580  13.044  -4.134
  410    HB2  GLU  52           HB2      GLU  52   4.094  14.912  -4.817
  411    HB3  GLU  52           HB3      GLU  52   2.961  15.299  -6.105
  412    HG2  GLU  52           HG2      GLU  52   1.211  15.656  -4.394
  413    HG3  GLU  52           HG3      GLU  52   2.428  15.396  -3.146
  414    H    LYS  53           H        LYS  53   1.883  13.178  -7.587
  415    HA   LYS  53           HA       LYS  53  -0.836  13.917  -7.329
  416    HB2  LYS  53           HB2      LYS  53   0.588  12.436  -9.540
  417    HB3  LYS  53           HB3      LYS  53  -1.079  12.985  -9.639
  418    HG2  LYS  53           HG2      LYS  53  -0.164  15.315  -9.149
  419    HG3  LYS  53           HG3      LYS  53   1.422  14.627  -9.502
  420    HD2  LYS  53           HD2      LYS  53   0.688  13.986 -11.718
  421    HD3  LYS  53           HD3      LYS  53  -0.944  14.560 -11.370
  422    HE2  LYS  53           HE2      LYS  53  -0.004  16.833 -11.025
  423    HE3  LYS  53           HE3      LYS  53   1.565  16.218 -11.541
  424    HZ1  LYS  53           HZ1      LYS  53   0.475  17.272 -13.378
  425    HZ2  LYS  53           HZ2      LYS  53  -0.916  16.333 -13.166
  426    HZ3  LYS  53           HZ3      LYS  53   0.526  15.602 -13.676
  427    H    ASP  54           H        ASP  54   0.774  10.758  -7.573
  428    HA   ASP  54           HA       ASP  54  -1.506   9.132  -7.488
  429    HB2  ASP  54           HB2      ASP  54   1.214   8.588  -6.263
  430    HB3  ASP  54           HB3      ASP  54  -0.032   7.380  -6.536
  431    H    VAL  55           H        VAL  55   0.416  10.576  -4.971
  432    HA   VAL  55           HA       VAL  55  -0.794   9.345  -2.759
  433    HB   VAL  55           HB       VAL  55   0.657  11.985  -2.944
  434   HG11  VAL  55          2HG1      VAL  55   1.088  11.699  -0.565
  435   HG12  VAL  55          1HG1      VAL  55   0.109  10.232  -0.561
  436   HG13  VAL  55          3HG1      VAL  55  -0.644  11.794  -0.896
  437   HG21  VAL  55          3HG2      VAL  55   1.658   9.219  -2.291
  438   HG22  VAL  55          2HG2      VAL  55   2.615  10.700  -2.249
  439   HG23  VAL  55          1HG2      VAL  55   1.966  10.111  -3.780
  440    H    ASN  56           H        ASN  56  -1.552  12.316  -4.501
  441    HA   ASN  56           HA       ASN  56  -3.481  13.148  -2.532
  442    HB2  ASN  56           HB2      ASN  56  -2.555  14.254  -5.153
  443    HB3  ASN  56           HB3      ASN  56  -4.069  14.827  -4.460
  444   HD21  ASN  56          1HD2      ASN  56  -0.613  14.660  -4.060
  445   HD22  ASN  56          2HD2      ASN  56  -0.505  15.883  -2.839
  446    H    ILE  57           H        ILE  57  -3.500  11.155  -5.319
  447    HA   ILE  57           HA       ILE  57  -6.370  11.312  -5.666
  448    HB   ILE  57           HB       ILE  57  -4.335   9.443  -6.897
  449   HG12  ILE  57          2HG1      ILE  57  -4.117  11.759  -7.653
  450   HG13  ILE  57          3HG1      ILE  57  -4.747  10.748  -8.948
  451   HG21  ILE  57          2HG2      ILE  57  -7.273   9.738  -7.501
  452   HG22  ILE  57          1HG2      ILE  57  -6.488   8.336  -6.774
  453   HG23  ILE  57          3HG2      ILE  57  -6.129   8.783  -8.442
  454   HD11  ILE  57          3HD1      ILE  57  -6.340  12.618  -7.211
  455   HD12  ILE  57          2HD1      ILE  57  -7.005  11.579  -8.470
  456   HD13  ILE  57          1HD1      ILE  57  -5.887  12.875  -8.895
  457    H    GLY  58           H        GLY  58  -4.072   8.730  -4.758
  458    HA2  GLY  58           HA1      GLY  58  -5.935   6.921  -3.751
  459    HA3  GLY  58           HA2      GLY  58  -4.248   7.007  -3.267
  460    H    GLU  59           H        GLU  59  -7.088   6.785  -1.954
  461    HA   GLU  59           HA       GLU  59  -7.041   9.066  -0.165
  462    HB2  GLU  59           HB2      GLU  59  -8.895   6.679  -0.236
  463    HB3  GLU  59           HB3      GLU  59  -9.124   8.133   0.730
  464    HG2  GLU  59           HG2      GLU  59  -9.302   9.462  -1.304
  465    HG3  GLU  59           HG3      GLU  59  -9.065   8.010  -2.276
  466    H    VAL  60           H        VAL  60  -7.075   5.530   0.254
  467    HA   VAL  60           HA       VAL  60  -6.030   5.890   2.954
  468    HB   VAL  60           HB       VAL  60  -6.454   3.442   3.214
  469   HG11  VAL  60          2HG1      VAL  60  -8.913   3.634   3.262
  470   HG12  VAL  60          1HG1      VAL  60  -8.794   5.128   2.332
  471   HG13  VAL  60          3HG1      VAL  60  -8.110   5.042   3.955
  472   HG21  VAL  60          3HG2      VAL  60  -7.677   3.706   0.467
  473   HG22  VAL  60          2HG2      VAL  60  -7.840   2.305   1.527
  474   HG23  VAL  60          1HG2      VAL  60  -6.256   2.752   0.893
  475    H    VAL  61           H        VAL  61  -4.098   5.090   3.648
  476    HA   VAL  61           HA       VAL  61  -2.226   4.297   1.512
  477    HB   VAL  61           HB       VAL  61  -1.497   5.444   4.207
  478   HG11  VAL  61          2HG1      VAL  61   0.649   5.913   3.127
  479   HG12  VAL  61          1HG1      VAL  61   0.059   5.177   1.637
  480   HG13  VAL  61          3HG1      VAL  61   0.264   4.193   3.086
  481   HG21  VAL  61          3HG2      VAL  61  -1.854   6.914   1.597
  482   HG22  VAL  61          2HG2      VAL  61  -1.146   7.594   3.063
  483   HG23  VAL  61          1HG2      VAL  61  -2.839   7.097   3.048
  484    H    ILE  62           H        ILE  62  -1.834   2.180   1.525
  485    HA   ILE  62           HA       ILE  62  -1.944   0.712   4.052
  486    HB   ILE  62           HB       ILE  62  -1.647  -0.293   1.215
  487   HG12  ILE  62          2HG1      ILE  62  -3.961  -0.411   3.165
  488   HG13  ILE  62          3HG1      ILE  62  -3.876   0.588   1.720
  489   HG21  ILE  62          2HG2      ILE  62  -1.909  -1.835   3.794
  490   HG22  ILE  62          1HG2      ILE  62  -0.485  -1.769   2.754
  491   HG23  ILE  62          3HG2      ILE  62  -1.966  -2.534   2.177
  492   HD11  ILE  62          3HD1      ILE  62  -3.931  -2.418   1.791
  493   HD12  ILE  62          2HD1      ILE  62  -3.814  -1.427   0.336
  494   HD13  ILE  62          1HD1      ILE  62  -5.263  -1.353   1.339
  495    H    PHE  63           H        PHE  63  -0.148   0.636   5.201
  496    HA   PHE  63           HA       PHE  63   2.413   0.632   3.771
  497    HB2  PHE  63           HB2      PHE  63   1.602   1.634   6.460
  498    HB3  PHE  63           HB3      PHE  63   3.253   1.067   6.238
  499    HD1  PHE  63           HD1      PHE  63   3.387   1.969   3.281
  500    HD2  PHE  63           HD2      PHE  63   2.214   3.910   6.878
  501    HE1  PHE  63           HE1      PHE  63   4.024   4.140   2.316
  502    HE2  PHE  63           HE2      PHE  63   2.842   6.085   5.917
  503    HZ   PHE  63           HZ       PHE  63   3.750   6.199   3.632
  504    H    ALA  64           H        ALA  64   2.820  -1.430   3.317
  505    HA   ALA  64           HA       ALA  64   3.016  -3.283   5.595
  506    HB1  ALA  64           HB1      ALA  64   1.685  -4.135   3.722
  507    HB2  ALA  64           HB2      ALA  64   3.046  -3.875   2.631
  508    HB3  ALA  64           HB3      ALA  64   3.166  -5.071   3.922
  509    H    VAL  65           H        VAL  65   4.951  -2.589   6.461
  510    HA   VAL  65           HA       VAL  65   7.279  -2.728   4.691
  511    HB   VAL  65           HB       VAL  65   8.172  -0.612   5.684
  512   HG11  VAL  65          2HG1      VAL  65   7.257  -0.607   3.443
  513   HG12  VAL  65          1HG1      VAL  65   6.804   0.885   4.271
  514   HG13  VAL  65          3HG1      VAL  65   5.624  -0.412   4.081
  515   HG21  VAL  65          3HG2      VAL  65   5.330  -0.243   6.623
  516   HG22  VAL  65          2HG2      VAL  65   6.627   0.947   6.728
  517   HG23  VAL  65          1HG2      VAL  65   6.722  -0.546   7.664
  518    H    ASP  66           H        ASP  66   9.288  -2.703   5.760
  519    HA   ASP  66           HA       ASP  66   9.314  -3.482   8.589
  520    HB2  ASP  66           HB2      ASP  66   9.340  -5.573   7.394
  521    HB3  ASP  66           HB3      ASP  66  10.528  -4.970   6.248
  522    H    THR  67           H        THR  67  10.295  -1.463   6.234
  523    HA   THR  67           HA       THR  67  12.737  -0.708   7.633
  524    HB   THR  67           HB       THR  67  13.301  -2.249   5.696
  525    HG1  THR  67           HG1      THR  67  14.838  -0.804   6.539
  526   HG21  THR  67          3HG2      THR  67  11.653  -1.446   4.085
  527   HG22  THR  67          1HG2      THR  67  13.288  -1.285   3.447
  528   HG23  THR  67          2HG2      THR  67  12.435   0.134   4.056
  529    H    LYS  68           H        LYS  68  13.551   1.385   6.015
  530    HA   LYS  68           HA       LYS  68  11.587   3.348   6.702
  531    HB2  LYS  68           HB2      LYS  68  14.053   3.753   5.010
  532    HB3  LYS  68           HB3      LYS  68  13.143   4.990   5.860
  533    HG2  LYS  68           HG2      LYS  68  13.785   3.813   7.999
  534    HG3  LYS  68           HG3      LYS  68  14.900   2.854   7.024
  535    HD2  LYS  68           HD2      LYS  68  14.915   5.836   7.453
  536    HD3  LYS  68           HD3      LYS  68  16.150   4.670   7.923
  537    HE2  LYS  68           HE2      LYS  68  15.386   5.357   5.083
  538    HE3  LYS  68           HE3      LYS  68  16.788   5.995   5.938
  539    HZ1  LYS  68           HZ1      LYS  68  17.432   4.171   4.529
  540    HZ2  LYS  68           HZ2      LYS  68  16.291   3.147   5.249
  541    HZ3  LYS  68           HZ3      LYS  68  17.611   3.706   6.152
  542    H    VAL  69           H        VAL  69  10.594   4.855   5.303
  543    HA   VAL  69           HA       VAL  69  10.471   4.108   2.458
  544    HB   VAL  69           HB       VAL  69   8.140   5.133   4.096
  545   HG11  VAL  69          2HG1      VAL  69   8.321   4.274   1.210
  546   HG12  VAL  69          1HG1      VAL  69   8.067   5.916   1.806
  547   HG13  VAL  69          3HG1      VAL  69   6.830   4.683   2.058
  548   HG21  VAL  69          3HG2      VAL  69   7.139   2.932   3.750
  549   HG22  VAL  69          2HG2      VAL  69   8.650   2.813   4.650
  550   HG23  VAL  69          1HG2      VAL  69   8.607   2.389   2.938
  551    H    ARG  70           H        ARG  70  11.152   5.744   1.212
  552    HA   ARG  70           HA       ARG  70  11.798   8.267   2.384
  553    HB2  ARG  70           HB2      ARG  70  11.922   7.413  -0.511
  554    HB3  ARG  70           HB3      ARG  70  12.687   8.840   0.175
  555    HG2  ARG  70           HG2      ARG  70  14.055   7.377   1.613
  556    HG3  ARG  70           HG3      ARG  70  13.332   5.974   0.823
  557    HD2  ARG  70           HD2      ARG  70  15.439   6.391  -0.211
  558    HD3  ARG  70           HD3      ARG  70  14.175   6.854  -1.349
  559    HE   ARG  70           HE       ARG  70  15.530   8.866   0.333
  560   HH11  ARG  70          2HH1      ARG  70  14.502   7.684  -2.798
  561   HH12  ARG  70          1HH1      ARG  70  15.067   9.076  -3.667
  562   HH21  ARG  70          2HH2      ARG  70  16.300  10.701  -0.798
  563   HH22  ARG  70          1HH2      ARG  70  16.104  10.795  -2.526
  564    H    ASN  71           H        ASN  71   9.257   7.114   0.249
  565    HA   ASN  71           HA       ASN  71   8.263   9.778  -0.249
  566    HB2  ASN  71           HB2      ASN  71   7.273   7.037  -1.024
  567    HB3  ASN  71           HB3      ASN  71   6.315   8.489  -1.324
  568   HD21  ASN  71          1HD2      ASN  71   7.593   6.565  -3.183
  569   HD22  ASN  71          2HD2      ASN  71   8.604   7.542  -4.198
  570    H    LYS  72           H        LYS  72   8.093   7.760   2.344
  571    HA   LYS  72           HA       LYS  72   5.423   7.629   3.094
  572    HB2  LYS  72           HB2      LYS  72   7.239   6.387   4.193
  573    HB3  LYS  72           HB3      LYS  72   7.842   7.888   4.883
  574    HG2  LYS  72           HG2      LYS  72   5.709   8.130   6.113
  575    HG3  LYS  72           HG3      LYS  72   5.203   6.562   5.480
  576    HD2  LYS  72           HD2      LYS  72   6.095   6.312   7.724
  577    HD3  LYS  72           HD3      LYS  72   7.156   5.521   6.557
  578    HE2  LYS  72           HE2      LYS  72   8.661   7.431   6.602
  579    HE3  LYS  72           HE3      LYS  72   7.584   8.272   7.715
  580    HZ1  LYS  72           HZ1      LYS  72   8.984   5.712   8.291
  581    HZ2  LYS  72           HZ2      LYS  72   7.991   6.574   9.367
  582    HZ3  LYS  72           HZ3      LYS  72   9.460   7.238   8.851
  583    H    GLU  73           H        GLU  73   7.651  10.275   3.269
  584    HA   GLU  73           HA       GLU  73   6.684  11.820   5.315
  585    HB2  GLU  73           HB2      GLU  73   7.661  13.738   4.179
  586    HB3  GLU  73           HB3      GLU  73   8.710  12.332   4.039
  587    HG2  GLU  73           HG2      GLU  73   7.953  11.956   1.770
  588    HG3  GLU  73           HG3      GLU  73   6.825  13.305   1.903
  589    H    ARG  74           H        ARG  74   5.229  11.461   2.121
  590    HA   ARG  74           HA       ARG  74   3.553  13.790   2.524
  591    HB2  ARG  74           HB2      ARG  74   2.709  13.300   0.268
  592    HB3  ARG  74           HB3      ARG  74   4.462  13.423   0.323
  593    HG2  ARG  74           HG2      ARG  74   4.182  10.772   0.658
  594    HG3  ARG  74           HG3      ARG  74   2.738  11.117  -0.301
  595    HD2  ARG  74           HD2      ARG  74   4.515  10.613  -1.819
  596    HD3  ARG  74           HD3      ARG  74   4.206  12.344  -1.901
  597    HE   ARG  74           HE       ARG  74   6.372  11.368  -0.194
  598   HH11  ARG  74          2HH1      ARG  74   5.331  13.136  -3.023
  599   HH12  ARG  74          1HH1      ARG  74   6.877  13.877  -3.298
  600   HH21  ARG  74          2HH2      ARG  74   8.423  12.363  -0.544
  601   HH22  ARG  74          1HH2      ARG  74   8.627  13.444  -1.885
  602    H    PHE  75           H        PHE  75   3.310  10.425   3.124
  603    HA   PHE  75           HA       PHE  75   0.412  10.440   3.183
  604    HB2  PHE  75           HB2      PHE  75   2.303   8.304   4.180
  605    HB3  PHE  75           HB3      PHE  75   0.600   8.129   3.790
  606    HD1  PHE  75           HD2      PHE  75  -0.034   8.715   1.299
  607    HD2  PHE  75           HD1      PHE  75   3.860   7.660   2.634
  608    HE1  PHE  75           HE2      PHE  75   0.572   8.045  -0.991
  609    HE2  PHE  75           HE1      PHE  75   4.476   6.991   0.350
  610    HZ   PHE  75           HZ       PHE  75   2.827   7.184  -1.466
  611    H    ASP  76           H        ASP  76   2.621  11.805   5.036
  612    HA   ASP  76           HA       ASP  76   2.335  10.895   7.642
  613    HB2  ASP  76           HB2      ASP  76   4.056  12.493   6.921
  614    HB3  ASP  76           HB3      ASP  76   2.821  13.721   6.675
  615    H    GLY  77           H        GLY  77   0.561  13.541   6.030
  616    HA2  GLY  77           HA1      GLY  77  -1.337  13.577   8.266
  617    HA3  GLY  77           HA2      GLY  77  -1.208  14.786   6.999
  618    H    LYS  78           H        LYS  78  -1.406  11.299   6.526
  619    HA   LYS  78           HA       LYS  78  -4.118  11.637   5.447
  620    HB2  LYS  78           HB2      LYS  78  -1.758  10.289   4.152
  621    HB3  LYS  78           HB3      LYS  78  -3.407   9.859   3.716
  622    HG2  LYS  78           HG2      LYS  78  -3.850  12.124   3.002
  623    HG3  LYS  78           HG3      LYS  78  -2.253  12.638   3.543
  624    HD2  LYS  78           HD2      LYS  78  -2.401  12.298   1.091
  625    HD3  LYS  78           HD3      LYS  78  -1.190  11.277   1.865
  626    HE2  LYS  78           HE2      LYS  78  -2.469  10.045   0.191
  627    HE3  LYS  78           HE3      LYS  78  -2.716   9.387   1.803
  628    HZ1  LYS  78           HZ1      LYS  78  -4.779   9.563   0.507
  629    HZ2  LYS  78           HZ2      LYS  78  -4.589  11.242   0.415
  630    HZ3  LYS  78           HZ3      LYS  78  -4.844  10.497   1.918
  631    H    VAL  79           H        VAL  79  -5.052   9.281   5.017
  632    HA   VAL  79           HA       VAL  79  -4.978   8.079   7.645
  633    HB   VAL  79           HB       VAL  79  -7.158   8.391   6.718
  634   HG11  VAL  79          2HG1      VAL  79  -6.605   8.408   4.364
  635   HG12  VAL  79          1HG1      VAL  79  -7.908   7.261   4.681
  636   HG13  VAL  79          3HG1      VAL  79  -6.265   6.679   4.411
  637   HG21  VAL  79          3HG2      VAL  79  -6.913   6.430   8.108
  638   HG22  VAL  79          2HG2      VAL  79  -6.414   5.468   6.717
  639   HG23  VAL  79          1HG2      VAL  79  -8.059   6.097   6.808
  640    H    VAL  80           H        VAL  80  -3.786   6.418   8.211
  641    HA   VAL  80           HA       VAL  80  -2.481   4.858   6.085
  642    HB   VAL  80           HB       VAL  80  -1.436   5.614   8.817
  643   HG11  VAL  80          2HG1      VAL  80  -0.117   3.967   6.664
  644   HG12  VAL  80          1HG1      VAL  80  -0.708   3.368   8.212
  645   HG13  VAL  80          3HG1      VAL  80   0.638   4.505   8.166
  646   HG21  VAL  80          3HG2      VAL  80  -0.528   6.411   6.055
  647   HG22  VAL  80          2HG2      VAL  80   0.253   6.870   7.570
  648   HG23  VAL  80          1HG2      VAL  80  -1.376   7.441   7.206
  649    H    LEU  81           H        LEU  81  -2.620   2.722   6.103
  650    HA   LEU  81           HA       LEU  81  -3.732   1.368   8.475
  651    HB2  LEU  81           HB2      LEU  81  -5.070   1.242   6.361
  652    HB3  LEU  81           HB3      LEU  81  -3.720   0.445   5.590
  653    HG   LEU  81           HG       LEU  81  -5.674  -1.000   6.369
  654   HD11  LEU  81          2HD1      LEU  81  -2.894  -1.702   7.283
  655   HD12  LEU  81          1HD1      LEU  81  -3.558  -1.950   5.667
  656   HD13  LEU  81          3HD1      LEU  81  -4.219  -2.840   7.039
  657   HD21  LEU  81          3HD2      LEU  81  -5.999  -0.018   8.555
  658   HD22  LEU  81          2HD2      LEU  81  -4.372  -0.498   9.037
  659   HD23  LEU  81          1HD2      LEU  81  -5.592  -1.727   8.707
  660    H    GLU  82           H        GLU  82  -2.253   0.298   9.612
  661    HA   GLU  82           HA       GLU  82   0.387  -0.161   8.423
  662    HB2  GLU  82           HB2      GLU  82   0.152   1.139  10.540
  663    HB3  GLU  82           HB3      GLU  82  -0.473  -0.310  11.314
  664    HG2  GLU  82           HG2      GLU  82   1.681  -0.530  11.938
  665    HG3  GLU  82           HG3      GLU  82   1.809  -1.297  10.356
  666    H    VAL  83           H        VAL  83   0.877  -2.124   7.722
  667    HA   VAL  83           HA       VAL  83   0.145  -4.428   9.370
  668    HB   VAL  83           HB       VAL  83  -0.231  -5.778   7.245
  669   HG11  VAL  83          2HG1      VAL  83  -2.590  -5.195   7.098
  670   HG12  VAL  83          1HG1      VAL  83  -2.275  -3.665   7.916
  671   HG13  VAL  83          3HG1      VAL  83  -2.043  -5.188   8.774
  672   HG21  VAL  83          3HG2      VAL  83  -1.045  -4.539   5.286
  673   HG22  VAL  83          2HG2      VAL  83   0.647  -4.185   5.639
  674   HG23  VAL  83          1HG2      VAL  83  -0.608  -3.023   6.074
  675    HA   PRO  84           HA       PRO  84   4.348  -5.650   8.451
  676    HB2  PRO  84           HB2      PRO  84   3.461  -8.452   8.493
  677    HB3  PRO  84           HB3      PRO  84   4.581  -7.620   9.574
  678    HG2  PRO  84           HG2      PRO  84   2.138  -8.387  10.386
  679    HG3  PRO  84           HG3      PRO  84   2.904  -6.901  10.979
  680    HD2  PRO  84           HD2      PRO  84   0.786  -7.229   8.881
  681    HD3  PRO  84           HD3      PRO  84   0.912  -6.016  10.174
  682    H    VAL  85           H        VAL  85   5.567  -6.470   6.707
  683    HA   VAL  85           HA       VAL  85   4.313  -6.300   4.186
  684    HB   VAL  85           HB       VAL  85   6.719  -5.791   4.649
  685   HG11  VAL  85          2HG1      VAL  85   7.025  -8.790   4.609
  686   HG12  VAL  85          1HG1      VAL  85   7.264  -7.734   6.001
  687   HG13  VAL  85          3HG1      VAL  85   8.344  -7.618   4.612
  688   HG21  VAL  85          3HG2      VAL  85   5.934  -5.981   2.364
  689   HG22  VAL  85          2HG2      VAL  85   6.182  -7.726   2.400
  690   HG23  VAL  85          1HG2      VAL  85   7.565  -6.637   2.503
  691    H    SER  86           H        SER  86   4.808  -8.948   6.320
  692    HA   SER  86           HA       SER  86   4.612 -11.048   4.408
  693    HB2  SER  86           HB2      SER  86   4.118 -11.123   7.392
  694    HB3  SER  86           HB3      SER  86   4.465 -12.505   6.352
  695    HG   SER  86           HG       SER  86   6.260 -11.402   7.627
  696    H    ALA  87           H        ALA  87   2.301  -8.977   5.854
  697    HA   ALA  87           HA       ALA  87   0.155 -10.841   6.063
  698    HB1  ALA  87           HB1      ALA  87  -1.243  -8.933   6.568
  699    HB2  ALA  87           HB2      ALA  87   0.279  -8.833   7.454
  700    HB3  ALA  87           HB3      ALA  87   0.024  -7.834   6.024
  701    HA   PRO  88           HA       PRO  88  -1.666  -8.592   2.151
  702    HB2  PRO  88           HB2      PRO  88   0.755  -7.591   0.779
  703    HB3  PRO  88           HB3      PRO  88  -0.805  -6.802   1.029
  704    HG2  PRO  88           HG2      PRO  88   1.345  -6.027   2.393
  705    HG3  PRO  88           HG3      PRO  88  -0.252  -6.092   3.166
  706    HD2  PRO  88           HD2      PRO  88   2.018  -8.041   3.341
  707    HD3  PRO  88           HD3      PRO  88   0.969  -7.417   4.632
  708    H    ILE  89           H        ILE  89   1.229 -10.466   2.207
  709    HA   ILE  89           HA       ILE  89   1.054 -11.420  -0.480
  710    HB   ILE  89           HB       ILE  89   2.445 -12.693   1.882
  711   HG12  ILE  89          2HG1      ILE  89   3.492 -10.808  -0.241
  712   HG13  ILE  89          3HG1      ILE  89   3.273 -10.429   1.461
  713   HG21  ILE  89          2HG2      ILE  89   2.749 -13.145  -1.083
  714   HG22  ILE  89          1HG2      ILE  89   2.102 -14.285   0.099
  715   HG23  ILE  89          3HG2      ILE  89   3.803 -13.822   0.157
  716   HD11  ILE  89          3HD1      ILE  89   5.597 -10.834   1.002
  717   HD12  ILE  89          2HD1      ILE  89   5.217 -12.406   0.297
  718   HD13  ILE  89          1HD1      ILE  89   4.967 -12.130   2.021
  719    H    LYS  90           H        LYS  90   0.006 -12.657   2.673
  720    HA   LYS  90           HA       LYS  90  -1.283 -14.919   1.346
  721    HB2  LYS  90           HB2      LYS  90  -1.601 -15.826   3.608
  722    HB3  LYS  90           HB3      LYS  90   0.085 -15.457   3.280
  723    HG2  LYS  90           HG2      LYS  90  -0.094 -13.409   4.586
  724    HG3  LYS  90           HG3      LYS  90  -1.801 -13.742   4.886
  725    HD2  LYS  90           HD2      LYS  90  -0.592 -14.431   6.822
  726    HD3  LYS  90           HD3      LYS  90  -1.095 -15.891   5.970
  727    HE2  LYS  90           HE2      LYS  90   1.179 -16.153   6.708
  728    HE3  LYS  90           HE3      LYS  90   1.159 -16.014   4.951
  729    HZ1  LYS  90           HZ1      LYS  90   1.847 -13.729   5.129
  730    HZ2  LYS  90           HZ2      LYS  90   2.933 -14.700   5.991
  731    HZ3  LYS  90           HZ3      LYS  90   1.769 -13.785   6.821
  732    H    ASP  91           H        ASP  91  -2.054 -11.955   3.004
  733    HA   ASP  91           HA       ASP  91  -4.921 -12.610   2.838
  734    HB2  ASP  91           HB2      ASP  91  -3.352 -11.341   5.060
  735    HB3  ASP  91           HB3      ASP  91  -5.063 -10.994   4.871
  736    H    ALA  92           H        ALA  92  -3.631 -11.285   0.755
  737    HA   ALA  92           HA       ALA  92  -3.458  -8.531   0.837
  738    HB1  ALA  92           HB1      ALA  92  -4.461 -10.169  -1.485
  739    HB2  ALA  92           HB2      ALA  92  -3.758  -8.554  -1.562
  740    HB3  ALA  92           HB3      ALA  92  -2.764  -9.925  -1.067
  741    H    GLU  93           H        GLU  93  -6.336 -10.439  -0.083
  742    HA   GLU  93           HA       GLU  93  -8.046  -8.247  -0.474
  743    HB2  GLU  93           HB2      GLU  93  -8.603 -11.131   0.216
  744    HB3  GLU  93           HB3      GLU  93  -9.881  -9.970  -0.115
  745    HG2  GLU  93           HG2      GLU  93  -9.247  -9.726  -2.349
  746    HG3  GLU  93           HG3      GLU  93  -7.660 -10.438  -2.070
  747    H    LYS  94           H        LYS  94  -7.027  -9.859   2.431
  748    HA   LYS  94           HA       LYS  94  -9.102  -8.854   4.134
  749    HB2  LYS  94           HB2      LYS  94  -6.321  -9.749   4.920
  750    HB3  LYS  94           HB3      LYS  94  -7.728  -9.637   5.964
  751    HG2  LYS  94           HG2      LYS  94  -7.690 -11.463   3.594
  752    HG3  LYS  94           HG3      LYS  94  -7.002 -11.943   5.146
  753    HD2  LYS  94           HD2      LYS  94  -9.192 -11.457   6.207
  754    HD3  LYS  94           HD3      LYS  94  -9.854 -11.124   4.603
  755    HE2  LYS  94           HE2      LYS  94 -10.333 -13.422   5.388
  756    HE3  LYS  94           HE3      LYS  94  -9.394 -13.384   3.896
  757    HZ1  LYS  94           HZ1      LYS  94  -8.314 -13.846   6.627
  758    HZ2  LYS  94           HZ2      LYS  94  -7.382 -13.763   5.213
  759    HZ3  LYS  94           HZ3      LYS  94  -8.503 -15.021   5.416
  760    H    VAL  95           H        VAL  95  -5.758  -7.956   3.436
  761    HA   VAL  95           HA       VAL  95  -5.530  -5.773   5.176
  762    HB   VAL  95           HB       VAL  95  -4.141  -6.216   2.527
  763   HG11  VAL  95          2HG1      VAL  95  -3.356  -4.471   4.859
  764   HG12  VAL  95          1HG1      VAL  95  -3.923  -3.907   3.286
  765   HG13  VAL  95          3HG1      VAL  95  -2.385  -4.763   3.415
  766   HG21  VAL  95          3HG2      VAL  95  -3.842  -8.090   4.049
  767   HG22  VAL  95          2HG2      VAL  95  -3.326  -6.987   5.325
  768   HG23  VAL  95          1HG2      VAL  95  -2.337  -7.184   3.878
  769    H    ILE  96           H        ILE  96  -6.636  -5.973   1.829
  770    HA   ILE  96           HA       ILE  96  -6.937  -3.228   1.342
  771    HB   ILE  96           HB       ILE  96  -8.506  -5.546   0.208
  772   HG12  ILE  96          2HG1      ILE  96  -6.149  -4.043  -0.942
  773   HG13  ILE  96          3HG1      ILE  96  -6.024  -5.592  -0.113
  774   HG21  ILE  96          2HG2      ILE  96  -9.699  -3.443  -0.114
  775   HG22  ILE  96          1HG2      ILE  96  -9.056  -4.042  -1.645
  776   HG23  ILE  96          3HG2      ILE  96  -8.248  -2.716  -0.807
  777   HD11  ILE  96          3HD1      ILE  96  -5.992  -5.864  -2.520
  778   HD12  ILE  96          2HD1      ILE  96  -7.557  -5.063  -2.645
  779   HD13  ILE  96          1HD1      ILE  96  -7.425  -6.616  -1.819
  780    H    ASN  97           H        ASN  97  -9.279  -5.628   2.521
  781    HA   ASN  97           HA       ASN  97 -11.399  -3.789   2.852
  782    HB2  ASN  97           HB2      ASN  97 -10.861  -6.561   3.842
  783    HB3  ASN  97           HB3      ASN  97 -12.200  -5.646   4.528
  784   HD21  ASN  97          1HD2      ASN  97 -10.985  -7.314   1.756
  785   HD22  ASN  97          2HD2      ASN  97 -12.441  -7.240   0.823
  786    H    ALA  98           H        ALA  98  -8.701  -4.687   4.873
  787    HA   ALA  98           HA       ALA  98  -9.646  -3.663   7.317
  788    HB1  ALA  98           HB1      ALA  98  -6.800  -3.837   6.325
  789    HB2  ALA  98           HB2      ALA  98  -7.300  -3.612   8.001
  790    HB3  ALA  98           HB3      ALA  98  -7.683  -5.115   7.161
  791    H    ALA  99           H        ALA  99  -7.902  -2.151   4.633
  792    HA   ALA  99           HA       ALA  99  -7.546   0.387   5.788
  793    HB1  ALA  99           HB1      ALA  99  -6.389  -0.305   3.756
  794    HB2  ALA  99           HB2      ALA  99  -7.919  -0.326   2.878
  795    HB3  ALA  99           HB3      ALA  99  -7.275   1.197   3.493
  796    H    LEU 100           H        LEU 100 -10.195  -0.983   3.886
  797    HA   LEU 100           HA       LEU 100 -11.819   1.336   3.865
  798    HB2  LEU 100           HB2      LEU 100 -12.306  -1.575   3.396
  799    HB3  LEU 100           HB3      LEU 100 -13.670  -0.492   3.534
  800    HG   LEU 100           HG       LEU 100 -12.757   0.808   1.651
  801   HD11  LEU 100          2HD1      LEU 100 -11.022  -0.177   0.232
  802   HD12  LEU 100          1HD1      LEU 100 -10.756  -1.422   1.453
  803   HD13  LEU 100          3HD1      LEU 100 -10.411   0.266   1.826
  804   HD21  LEU 100          3HD2      LEU 100 -13.245  -2.109   1.115
  805   HD22  LEU 100          2HD2      LEU 100 -13.332  -0.825  -0.091
  806   HD23  LEU 100          1HD2      LEU 100 -14.470  -0.848   1.255
  807    H    ALA 101           H        ALA 101 -11.346  -1.250   6.155
  808    HA   ALA 101           HA       ALA 101 -13.653  -0.717   7.743
  809    HB1  ALA 101           HB1      ALA 101 -12.559  -2.893   7.781
  810    HB2  ALA 101           HB2      ALA 101 -11.105  -2.164   8.463
  811    HB3  ALA 101           HB3      ALA 101 -12.602  -2.183   9.394
  812    H    LEU 102           H        LEU 102 -10.519   0.715   7.513
  813    HA   LEU 102           HA       LEU 102 -10.613   1.909  10.137
  814    HB2  LEU 102           HB2      LEU 102  -8.716   1.818   7.895
  815    HB3  LEU 102           HB3      LEU 102  -8.716   3.329   8.782
  816    HG   LEU 102           HG       LEU 102  -7.010   1.766   9.614
  817   HD11  LEU 102          2HD1      LEU 102  -9.252   2.254  11.570
  818   HD12  LEU 102          1HD1      LEU 102  -7.992   3.408  11.133
  819   HD13  LEU 102          3HD1      LEU 102  -7.571   1.920  11.981
  820   HD21  LEU 102          3HD2      LEU 102  -9.349   0.025  10.381
  821   HD22  LEU 102          2HD2      LEU 102  -7.662  -0.257  10.806
  822   HD23  LEU 102          1HD2      LEU 102  -8.171  -0.330   9.118
  823    H    ILE 103           H        ILE 103 -11.752   2.736   6.981
  824    HA   ILE 103           HA       ILE 103 -12.082   5.528   7.804
  825    HB   ILE 103           HB       ILE 103 -12.692   5.970   5.422
  826   HG12  ILE 103          2HG1      ILE 103 -11.704   3.137   4.990
  827   HG13  ILE 103          3HG1      ILE 103 -13.382   3.652   4.842
  828   HG21  ILE 103          2HG2      ILE 103  -9.982   4.751   5.945
  829   HG22  ILE 103          1HG2      ILE 103 -10.463   6.417   6.268
  830   HG23  ILE 103          3HG2      ILE 103 -10.378   5.830   4.608
  831   HD11  ILE 103          3HD1      ILE 103 -12.757   5.128   2.997
  832   HD12  ILE 103          2HD1      ILE 103 -12.330   3.449   2.669
  833   HD13  ILE 103          1HD1      ILE 103 -11.081   4.599   3.146
  834    H    ASP 104           H        ASP 104 -13.993   2.755   6.683
  835    HA   ASP 104           HA       ASP 104 -16.407   4.289   7.410
  836    HB2  ASP 104           HB2      ASP 104 -16.074   2.262   5.195
  837    HB3  ASP 104           HB3      ASP 104 -17.632   2.878   5.731
  838    H    GLU 105           H        GLU 105 -14.638   1.364   7.764
  839    HA   GLU 105           HA       GLU 105 -14.929  -0.542   8.955
  840    HB2  GLU 105           HB2      GLU 105 -17.244   0.886  10.283
  841    HB3  GLU 105           HB3      GLU 105 -16.461  -0.579  10.858
  842    HG2  GLU 105           HG2      GLU 105 -14.381   0.673  11.182
  843    HG3  GLU 105           HG3      GLU 105 -15.193   2.141  10.640
  844    H    LYS 106           H        LYS 106 -15.472  -1.802   7.223
  845    HA   LYS 106           HA       LYS 106 -18.286  -1.968   6.437
  846    HB2  LYS 106           HB2      LYS 106 -16.478  -1.642   4.710
  847    HB3  LYS 106           HB3      LYS 106 -15.890  -3.248   5.113
  848    HG2  LYS 106           HG2      LYS 106 -18.132  -4.145   4.492
  849    HG3  LYS 106           HG3      LYS 106 -18.551  -2.532   3.913
  850    HD2  LYS 106           HD2      LYS 106 -16.583  -2.630   2.396
  851    HD3  LYS 106           HD3      LYS 106 -16.330  -4.302   2.901
  852    HE2  LYS 106           HE2      LYS 106 -17.529  -4.363   0.852
  853    HE3  LYS 106           HE3      LYS 106 -18.666  -4.787   2.131
  854    HZ1  LYS 106           HZ1      LYS 106 -18.408  -2.118   0.845
  855    HZ2  LYS 106           HZ2      LYS 106 -19.496  -2.505   2.083
  856    HZ3  LYS 106           HZ3      LYS 106 -19.650  -3.239   0.565
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1 -15.820   5.368  -6.398
    2    H2   MET   1           H2       MET   1 -16.972   5.837  -7.553
    3    H3   MET   1           H3       MET   1 -15.331   5.769  -7.967
    4    HA   MET   1           HA       MET   1 -16.929   3.432  -7.127
    5    HB2  MET   1           HB2      MET   1 -17.791   4.257  -9.250
    6    HB3  MET   1           HB3      MET   1 -16.163   4.340  -9.909
    7    HG2  MET   1           HG2      MET   1 -17.388   2.387 -10.718
    8    HG3  MET   1           HG3      MET   1 -15.959   1.930  -9.790
    9    HE1  MET   1           HE1      MET   1 -17.979  -0.271 -10.393
   10    HE2  MET   1           HE2      MET   1 -16.644  -0.521  -9.269
   11    HE3  MET   1           HE3      MET   1 -18.278  -0.998  -8.813
   12    H    LYS   2           H        LYS   2 -14.191   4.235  -9.258
   13    HA   LYS   2           HA       LYS   2 -12.817   1.852  -8.347
   14    HB2  LYS   2           HB2      LYS   2 -11.885   3.928 -10.340
   15    HB3  LYS   2           HB3      LYS   2 -11.199   2.327 -10.092
   16    HG2  LYS   2           HG2      LYS   2 -13.363   1.346 -10.807
   17    HG3  LYS   2           HG3      LYS   2 -13.933   2.975 -11.175
   18    HD2  LYS   2           HD2      LYS   2 -13.180   2.020 -13.217
   19    HD3  LYS   2           HD3      LYS   2 -11.968   3.203 -12.722
   20    HE2  LYS   2           HE2      LYS   2 -10.910   1.163 -13.523
   21    HE3  LYS   2           HE3      LYS   2 -10.583   1.406 -11.808
   22    HZ1  LYS   2           HZ1      LYS   2 -12.325  -0.195 -11.292
   23    HZ2  LYS   2           HZ2      LYS   2 -11.139  -0.892 -12.278
   24    HZ3  LYS   2           HZ3      LYS   2 -12.628  -0.429 -12.945
   25    H    ARG   3           H        ARG   3 -12.151   2.154  -6.315
   26    HA   ARG   3           HA       ARG   3 -11.248   4.637  -5.280
   27    HB2  ARG   3           HB2      ARG   3 -12.358   2.785  -3.982
   28    HB3  ARG   3           HB3      ARG   3 -10.852   1.885  -4.097
   29    HG2  ARG   3           HG2      ARG   3 -10.888   2.917  -1.972
   30    HG3  ARG   3           HG3      ARG   3  -9.724   3.809  -2.956
   31    HD2  ARG   3           HD2      ARG   3 -11.015   5.421  -1.800
   32    HD3  ARG   3           HD3      ARG   3 -11.564   5.436  -3.474
   33    HE   ARG   3           HE       ARG   3 -13.209   3.666  -2.091
   34   HH11  ARG   3          2HH1      ARG   3 -12.447   7.097  -2.065
   35   HH12  ARG   3          1HH1      ARG   3 -13.997   7.559  -1.440
   36   HH21  ARG   3          2HH2      ARG   3 -15.243   4.277  -1.268
   37   HH22  ARG   3          1HH2      ARG   3 -15.587   5.951  -0.974
   38    H    LYS   4           H        LYS   4  -9.276   5.526  -5.339
   39    HA   LYS   4           HA       LYS   4  -6.995   3.981  -6.237
   40    HB2  LYS   4           HB2      LYS   4  -7.285   6.880  -5.444
   41    HB3  LYS   4           HB3      LYS   4  -5.772   6.155  -5.974
   42    HG2  LYS   4           HG2      LYS   4  -8.294   6.256  -7.607
   43    HG3  LYS   4           HG3      LYS   4  -6.950   7.391  -7.754
   44    HD2  LYS   4           HD2      LYS   4  -6.816   4.409  -8.215
   45    HD3  LYS   4           HD3      LYS   4  -6.842   5.647  -9.469
   46    HE2  LYS   4           HE2      LYS   4  -4.706   5.370  -7.359
   47    HE3  LYS   4           HE3      LYS   4  -4.576   4.758  -9.007
   48    HZ1  LYS   4           HZ1      LYS   4  -4.860   7.063  -9.797
   49    HZ2  LYS   4           HZ2      LYS   4  -3.465   6.863  -8.852
   50    HZ3  LYS   4           HZ3      LYS   4  -4.842   7.598  -8.191
   51    H    ILE   5           H        ILE   5  -5.647   2.965  -4.956
   52    HA   ILE   5           HA       ILE   5  -5.334   3.901  -2.175
   53    HB   ILE   5           HB       ILE   5  -5.244   1.030  -3.140
   54   HG12  ILE   5          2HG1      ILE   5  -7.222   2.413  -1.309
   55   HG13  ILE   5          3HG1      ILE   5  -7.537   1.919  -2.969
   56   HG21  ILE   5          2HG2      ILE   5  -3.614   1.444  -1.381
   57   HG22  ILE   5          1HG2      ILE   5  -4.936   0.442  -0.781
   58   HG23  ILE   5          3HG2      ILE   5  -4.869   2.155  -0.367
   59   HD11  ILE   5          3HD1      ILE   5  -6.887   0.057  -0.690
   60   HD12  ILE   5          2HD1      ILE   5  -7.263  -0.414  -2.348
   61   HD13  ILE   5          1HD1      ILE   5  -8.493   0.362  -1.351
   62    H    ILE   6           H        ILE   6  -3.271   4.355  -1.612
   63    HA   ILE   6           HA       ILE   6  -1.147   3.434  -3.413
   64    HB   ILE   6           HB       ILE   6   0.330   5.095  -2.314
   65   HG12  ILE   6          2HG1      ILE   6  -1.106   5.254  -0.187
   66   HG13  ILE   6          3HG1      ILE   6  -0.417   6.747  -0.807
   67   HG21  ILE   6          2HG2      ILE   6  -0.735   5.600  -4.418
   68   HG22  ILE   6          1HG2      ILE   6  -0.620   7.056  -3.430
   69   HG23  ILE   6          3HG2      ILE   6  -2.162   6.213  -3.580
   70   HD11  ILE   6          3HD1      ILE   6  -2.713   7.044  -0.057
   71   HD12  ILE   6          2HD1      ILE   6  -3.256   5.827  -1.210
   72   HD13  ILE   6          1HD1      ILE   6  -2.561   7.340  -1.789
   73    H    ALA   7           H        ALA   7   0.253   1.945  -2.765
   74    HA   ALA   7           HA       ALA   7   0.318   1.249   0.094
   75    HB1  ALA   7           HB1      ALA   7   0.223  -1.115  -0.452
   76    HB2  ALA   7           HB2      ALA   7  -1.204  -0.285  -1.074
   77    HB3  ALA   7           HB3      ALA   7   0.102  -0.734  -2.170
   78    H    VAL   8           H        VAL   8   2.336   1.573   0.735
   79    HA   VAL   8           HA       VAL   8   4.528   1.111  -1.146
   80    HB   VAL   8           HB       VAL   8   4.605   2.399   1.590
   81   HG11  VAL   8          2HG1      VAL   8   6.846   3.141   0.932
   82   HG12  VAL   8          1HG1      VAL   8   6.703   2.226  -0.570
   83   HG13  VAL   8          3HG1      VAL   8   6.730   1.382   0.979
   84   HG21  VAL   8          3HG2      VAL   8   3.328   3.726  -0.013
   85   HG22  VAL   8          2HG2      VAL   8   4.663   3.641  -1.161
   86   HG23  VAL   8          1HG2      VAL   8   4.865   4.506   0.363
   87    H    THR   9           H        THR   9   5.541  -0.730  -1.113
   88    HA   THR   9           HA       THR   9   5.482  -2.380   1.319
   89    HB   THR   9           HB       THR   9   6.157  -4.245  -0.266
   90    HG1  THR   9           HG1      THR   9   5.964  -2.111  -2.042
   91   HG21  THR   9          3HG2      THR   9   3.879  -4.550  -1.166
   92   HG22  THR   9          1HG2      THR   9   3.506  -2.879  -0.741
   93   HG23  THR   9          2HG2      THR   9   3.866  -4.051   0.525
   94    H    ALA  10           H        ALA  10   7.374  -2.939   2.311
   95    HA   ALA  10           HA       ALA  10   9.907  -2.547   0.950
   96    HB1  ALA  10           HB1      ALA  10   9.252  -0.954   3.426
   97    HB2  ALA  10           HB2      ALA  10  10.801  -0.985   2.584
   98    HB3  ALA  10           HB3      ALA  10   9.380  -0.300   1.793
   99    H    CYS  11           H        CYS  11  11.678  -3.494   2.039
  100    HA   CYS  11           HA       CYS  11  11.411  -4.590   4.663
  101    HB2  CYS  11           HB2      CYS  11  10.191  -6.292   3.296
  102    HB3  CYS  11           HB3      CYS  11  11.669  -6.557   2.377
  103    HG   CYS  11           HG       CYS  11  12.132  -6.856   5.667
  104    H    ALA  12           H        ALA  12  13.405  -5.084   5.546
  105    HA   ALA  12           HA       ALA  12  15.664  -4.124   3.988
  106    HB1  ALA  12           HB1      ALA  12  15.336  -3.316   6.278
  107    HB2  ALA  12           HB2      ALA  12  15.521  -4.963   6.883
  108    HB3  ALA  12           HB3      ALA  12  16.877  -4.156   6.096
  109    H    THR  13           H        THR  13  14.463  -7.120   5.370
  110    HA   THR  13           HA       THR  13  16.914  -8.483   4.514
  111    HB   THR  13           HB       THR  13  15.932 -10.407   5.920
  112    HG1  THR  13           HG1      THR  13  14.173 -10.004   7.054
  113   HG21  THR  13          3HG2      THR  13  16.811  -7.845   7.260
  114   HG22  THR  13          1HG2      THR  13  17.871  -9.099   6.617
  115   HG23  THR  13          2HG2      THR  13  16.831  -9.447   7.998
  116    H    GLY  14           H        GLY  14  13.505  -9.499   4.811
  117    HA2  GLY  14           HA1      GLY  14  13.874 -11.302   2.566
  118    HA3  GLY  14           HA2      GLY  14  12.464 -11.206   3.608
  119    H    VAL  15           H        VAL  15  14.185  -9.334   1.138
  120    HA   VAL  15           HA       VAL  15  12.025  -7.666   0.464
  121    HB   VAL  15           HB       VAL  15  13.318  -7.212  -1.625
  122   HG11  VAL  15          2HG1      VAL  15  14.858  -7.086   0.961
  123   HG12  VAL  15          1HG1      VAL  15  13.675  -5.906   0.395
  124   HG13  VAL  15          3HG1      VAL  15  15.191  -6.123  -0.480
  125   HG21  VAL  15          3HG2      VAL  15  15.580  -8.143  -1.822
  126   HG22  VAL  15          2HG2      VAL  15  14.345  -9.397  -1.933
  127   HG23  VAL  15          1HG2      VAL  15  15.260  -9.190  -0.440
  128    H    ALA  16           H        ALA  16  12.752 -10.926  -0.380
  129    HA   ALA  16           HA       ALA  16  11.323 -11.223  -2.762
  130    HB1  ALA  16           HB1      ALA  16  11.563 -13.197  -0.492
  131    HB2  ALA  16           HB2      ALA  16  11.093 -13.574  -2.149
  132    HB3  ALA  16           HB3      ALA  16  12.722 -12.992  -1.806
  133    H    HIS  17           H        HIS  17  10.249 -10.943   0.551
  134    HA   HIS  17           HA       HIS  17   7.545 -11.739   0.058
  135    HB2  HIS  17           HB2      HIS  17   8.920 -10.362   2.359
  136    HB3  HIS  17           HB3      HIS  17   7.172 -10.569   2.328
  137    HD1  HIS  17           HD1      HIS  17   7.781 -12.034   4.569
  138    HD2  HIS  17           HD2      HIS  17   8.854 -13.632   0.877
  139    HE1  HIS  17           HE1      HIS  17   8.117 -14.498   4.961
  140    HE2  HIS  17           HE2      HIS  17   8.887 -15.422   2.744
  141    H    THR  18           H        THR  18   9.339  -8.766  -0.057
  142    HA   THR  18           HA       THR  18   7.235  -6.915  -0.027
  143    HB   THR  18           HB       THR  18   9.841  -6.679  -1.541
  144    HG1  THR  18           HG1      THR  18   9.233  -6.213   1.208
  145   HG21  THR  18          3HG2      THR  18   9.592  -4.282  -1.063
  146   HG22  THR  18          1HG2      THR  18   8.034  -4.599  -0.305
  147   HG23  THR  18          2HG2      THR  18   8.253  -4.898  -2.030
  148    H    TYR  19           H        TYR  19   8.876  -8.532  -2.738
  149    HA   TYR  19           HA       TYR  19   7.325  -7.224  -4.730
  150    HB2  TYR  19           HB2      TYR  19   9.118  -9.648  -4.826
  151    HB3  TYR  19           HB3      TYR  19   8.299  -9.008  -6.248
  152    HD1  TYR  19           HD1      TYR  19  10.849  -8.296  -3.683
  153    HD2  TYR  19           HD2      TYR  19   9.073  -7.023  -7.329
  154    HE1  TYR  19           HE1      TYR  19  12.674  -6.681  -3.999
  155    HE2  TYR  19           HE2      TYR  19  10.893  -5.403  -7.658
  156    HH   TYR  19           HH       TYR  19  13.754  -5.451  -5.746
  157    H    MET  20           H        MET  20   6.991 -10.265  -3.002
  158    HA   MET  20           HA       MET  20   4.891 -11.296  -4.616
  159    HB2  MET  20           HB2      MET  20   6.171 -12.761  -3.143
  160    HB3  MET  20           HB3      MET  20   5.578 -11.887  -1.734
  161    HG2  MET  20           HG2      MET  20   4.339 -13.917  -1.945
  162    HG3  MET  20           HG3      MET  20   3.274 -12.562  -2.337
  163    HE1  MET  20           HE1      MET  20   2.559 -15.568  -3.034
  164    HE2  MET  20           HE2      MET  20   1.522 -14.206  -3.456
  165    HE3  MET  20           HE3      MET  20   1.948 -15.403  -4.678
  166    H    ALA  21           H        ALA  21   4.953  -9.449  -1.594
  167    HA   ALA  21           HA       ALA  21   2.191  -9.379  -1.135
  168    HB1  ALA  21           HB1      ALA  21   3.862  -8.718   0.537
  169    HB2  ALA  21           HB2      ALA  21   4.242  -7.285  -0.420
  170    HB3  ALA  21           HB3      ALA  21   2.642  -7.468   0.298
  171    H    ALA  22           H        ALA  22   4.291  -7.325  -3.072
  172    HA   ALA  22           HA       ALA  22   2.490  -5.312  -3.752
  173    HB1  ALA  22           HB1      ALA  22   3.926  -4.914  -5.683
  174    HB2  ALA  22           HB2      ALA  22   4.888  -5.231  -4.240
  175    HB3  ALA  22           HB3      ALA  22   4.685  -6.491  -5.456
  176    H    GLN  23           H        GLN  23   3.141  -8.403  -5.370
  177    HA   GLN  23           HA       GLN  23   1.276  -8.017  -7.464
  178    HB2  GLN  23           HB2      GLN  23   2.595 -10.485  -6.351
  179    HB3  GLN  23           HB3      GLN  23   1.485 -10.543  -7.714
  180    HG2  GLN  23           HG2      GLN  23   4.042  -8.960  -7.608
  181    HG3  GLN  23           HG3      GLN  23   3.827 -10.512  -8.419
  182   HE21  GLN  23          1HE2      GLN  23   4.606  -7.933  -9.522
  183   HE22  GLN  23          2HE2      GLN  23   3.445  -7.567 -10.746
  184    H    ALA  24           H        ALA  24   1.033  -9.584  -4.306
  185    HA   ALA  24           HA       ALA  24  -1.544 -10.690  -4.777
  186    HB1  ALA  24           HB1      ALA  24  -1.583 -11.123  -2.370
  187    HB2  ALA  24           HB2      ALA  24  -0.044 -11.599  -3.087
  188    HB3  ALA  24           HB3      ALA  24  -0.159 -10.102  -2.161
  189    H    LEU  25           H        LEU  25  -0.456  -7.779  -3.045
  190    HA   LEU  25           HA       LEU  25  -2.998  -6.834  -2.299
  191    HB2  LEU  25           HB2      LEU  25  -0.427  -5.384  -2.900
  192    HB3  LEU  25           HB3      LEU  25  -1.864  -4.555  -2.335
  193    HG   LEU  25           HG       LEU  25  -0.432  -6.739  -0.821
  194   HD11  LEU  25          2HD1      LEU  25   0.350  -4.954   0.637
  195   HD12  LEU  25          1HD1      LEU  25  -0.428  -3.754  -0.395
  196   HD13  LEU  25          3HD1      LEU  25   0.920  -4.709  -1.015
  197   HD21  LEU  25          3HD2      LEU  25  -2.825  -6.603  -0.324
  198   HD22  LEU  25          2HD2      LEU  25  -2.661  -4.878   0.003
  199   HD23  LEU  25          1HD2      LEU  25  -1.853  -6.053   1.042
  200    H    LYS  26           H        LYS  26  -1.058  -6.196  -5.186
  201    HA   LYS  26           HA       LYS  26  -2.821  -4.392  -6.409
  202    HB2  LYS  26           HB2      LYS  26  -0.444  -4.804  -7.057
  203    HB3  LYS  26           HB3      LYS  26  -0.944  -6.332  -7.766
  204    HG2  LYS  26           HG2      LYS  26  -2.392  -5.119  -9.331
  205    HG3  LYS  26           HG3      LYS  26  -1.842  -3.593  -8.631
  206    HD2  LYS  26           HD2      LYS  26   0.481  -4.205  -9.246
  207    HD3  LYS  26           HD3      LYS  26  -0.145  -5.646 -10.050
  208    HE2  LYS  26           HE2      LYS  26  -1.486  -4.208 -11.528
  209    HE3  LYS  26           HE3      LYS  26  -0.802  -2.786 -10.738
  210    HZ1  LYS  26           HZ1      LYS  26   1.388  -3.468 -11.482
  211    HZ2  LYS  26           HZ2      LYS  26   0.343  -3.292 -12.803
  212    HZ3  LYS  26           HZ3      LYS  26   0.740  -4.839 -12.236
  213    H    LYS  27           H        LYS  27  -2.532  -7.898  -6.618
  214    HA   LYS  27           HA       LYS  27  -4.383  -8.340  -8.667
  215    HB2  LYS  27           HB2      LYS  27  -2.662  -9.929  -7.645
  216    HB3  LYS  27           HB3      LYS  27  -3.839 -10.214  -6.375
  217    HG2  LYS  27           HG2      LYS  27  -5.361 -11.216  -7.856
  218    HG3  LYS  27           HG3      LYS  27  -4.483 -10.636  -9.273
  219    HD2  LYS  27           HD2      LYS  27  -3.177 -12.458  -7.288
  220    HD3  LYS  27           HD3      LYS  27  -4.214 -13.106  -8.560
  221    HE2  LYS  27           HE2      LYS  27  -1.919 -13.187  -9.290
  222    HE3  LYS  27           HE3      LYS  27  -2.782 -11.985 -10.240
  223    HZ1  LYS  27           HZ1      LYS  27  -1.765 -10.236  -9.013
  224    HZ2  LYS  27           HZ2      LYS  27  -0.532 -11.298  -9.487
  225    HZ3  LYS  27           HZ3      LYS  27  -1.096 -11.319  -7.889
  226    H    GLY  28           H        GLY  28  -4.779  -8.397  -5.143
  227    HA2  GLY  28           HA1      GLY  28  -7.487  -9.132  -5.070
  228    HA3  GLY  28           HA2      GLY  28  -6.630  -8.261  -3.807
  229    H    ALA  29           H        ALA  29  -6.012  -5.899  -4.894
  230    HA   ALA  29           HA       ALA  29  -8.414  -4.459  -4.777
  231    HB1  ALA  29           HB1      ALA  29  -6.242  -3.485  -4.228
  232    HB2  ALA  29           HB2      ALA  29  -5.776  -3.564  -5.927
  233    HB3  ALA  29           HB3      ALA  29  -7.103  -2.517  -5.424
  234    H    LYS  30           H        LYS  30  -6.430  -5.408  -7.571
  235    HA   LYS  30           HA       LYS  30  -7.986  -4.139  -9.547
  236    HB2  LYS  30           HB2      LYS  30  -6.092  -6.472  -9.602
  237    HB3  LYS  30           HB3      LYS  30  -6.964  -5.981 -11.047
  238    HG2  LYS  30           HG2      LYS  30  -5.214  -4.129  -9.451
  239    HG3  LYS  30           HG3      LYS  30  -4.655  -5.061 -10.841
  240    HD2  LYS  30           HD2      LYS  30  -6.334  -3.973 -12.247
  241    HD3  LYS  30           HD3      LYS  30  -6.899  -3.045 -10.858
  242    HE2  LYS  30           HE2      LYS  30  -4.775  -1.920 -10.690
  243    HE3  LYS  30           HE3      LYS  30  -4.100  -2.929 -11.969
  244    HZ1  LYS  30           HZ1      LYS  30  -5.598  -1.953 -13.542
  245    HZ2  LYS  30           HZ2      LYS  30  -4.785  -0.703 -12.737
  246    HZ3  LYS  30           HZ3      LYS  30  -6.385  -1.070 -12.334
  247    H    LYS  31           H        LYS  31  -8.253  -7.267  -7.992
  248    HA   LYS  31           HA       LYS  31 -10.236  -8.350  -9.702
  249    HB2  LYS  31           HB2      LYS  31  -8.849  -9.712  -8.201
  250    HB3  LYS  31           HB3      LYS  31  -9.604  -8.954  -6.808
  251    HG2  LYS  31           HG2      LYS  31 -11.777  -9.897  -7.539
  252    HG3  LYS  31           HG3      LYS  31 -10.922 -10.760  -8.822
  253    HD2  LYS  31           HD2      LYS  31 -11.264 -12.217  -6.902
  254    HD3  LYS  31           HD3      LYS  31  -9.543 -11.885  -7.123
  255    HE2  LYS  31           HE2      LYS  31  -9.692 -10.134  -5.400
  256    HE3  LYS  31           HE3      LYS  31 -11.388 -10.546  -5.150
  257    HZ1  LYS  31           HZ1      LYS  31 -10.052 -11.609  -3.493
  258    HZ2  LYS  31           HZ2      LYS  31  -9.048 -12.307  -4.669
  259    HZ3  LYS  31           HZ3      LYS  31 -10.665 -12.803  -4.539
  260    H    MET  32           H        MET  32 -10.335  -6.376  -6.798
  261    HA   MET  32           HA       MET  32 -13.213  -6.567  -6.570
  262    HB2  MET  32           HB2      MET  32 -11.159  -4.977  -5.026
  263    HB3  MET  32           HB3      MET  32 -12.881  -4.951  -4.675
  264    HG2  MET  32           HG2      MET  32 -11.131  -7.399  -4.591
  265    HG3  MET  32           HG3      MET  32 -11.627  -6.449  -3.192
  266    HE1  MET  32           HE1      MET  32 -12.597  -8.565  -1.976
  267    HE2  MET  32           HE2      MET  32 -13.729  -9.695  -2.720
  268    HE3  MET  32           HE3      MET  32 -12.078  -9.573  -3.326
  269    H    GLY  33           H        GLY  33 -11.322  -4.934  -8.647
  270    HA2  GLY  33           HA1      GLY  33 -12.093  -3.433 -10.254
  271    HA3  GLY  33           HA2      GLY  33 -13.489  -3.102  -9.242
  272    H    ASN  34           H        ASN  34 -10.502  -2.917  -7.625
  273    HA   ASN  34           HA       ASN  34 -10.784  -0.006  -7.495
  274    HB2  ASN  34           HB2      ASN  34  -9.267  -1.936  -5.724
  275    HB3  ASN  34           HB3      ASN  34  -9.274  -0.190  -5.510
  276   HD21  ASN  34          1HD2      ASN  34 -11.037  -3.121  -5.137
  277   HD22  ASN  34          2HD2      ASN  34 -12.366  -2.459  -4.258
  278    H    LEU  35           H        LEU  35  -8.629   1.165  -7.162
  279    HA   LEU  35           HA       LEU  35  -6.680   0.145  -9.123
  280    HB2  LEU  35           HB2      LEU  35  -7.559   2.999  -8.685
  281    HB3  LEU  35           HB3      LEU  35  -6.275   2.497  -9.769
  282    HG   LEU  35           HG       LEU  35  -9.166   1.683 -10.060
  283   HD11  LEU  35          2HD1      LEU  35  -9.227   3.270 -11.912
  284   HD12  LEU  35          1HD1      LEU  35  -7.585   3.786 -11.529
  285   HD13  LEU  35          3HD1      LEU  35  -8.893   4.083 -10.383
  286   HD21  LEU  35          3HD2      LEU  35  -6.801   1.397 -11.911
  287   HD22  LEU  35          2HD2      LEU  35  -8.466   0.957 -12.291
  288   HD23  LEU  35          1HD2      LEU  35  -7.591   0.090 -11.028
  289    H    ILE  36           H        ILE  36  -5.099  -0.569  -7.799
  290    HA   ILE  36           HA       ILE  36  -4.232   1.186  -5.617
  291    HB   ILE  36           HB       ILE  36  -4.907  -1.115  -4.984
  292   HG12  ILE  36          2HG1      ILE  36  -1.958  -0.542  -4.618
  293   HG13  ILE  36          3HG1      ILE  36  -3.258   0.147  -3.651
  294   HG21  ILE  36          2HG2      ILE  36  -4.262  -2.305  -6.984
  295   HG22  ILE  36          1HG2      ILE  36  -3.443  -2.997  -5.584
  296   HG23  ILE  36          3HG2      ILE  36  -2.562  -1.940  -6.685
  297   HD11  ILE  36          3HD1      ILE  36  -3.852  -2.104  -2.876
  298   HD12  ILE  36          2HD1      ILE  36  -2.190  -1.669  -2.470
  299   HD13  ILE  36          1HD1      ILE  36  -2.511  -2.763  -3.814
  300    H    LYS  37           H        LYS  37  -2.181   1.937  -5.547
  301    HA   LYS  37           HA       LYS  37  -0.390   1.122  -7.739
  302    HB2  LYS  37           HB2      LYS  37  -1.285   3.703  -7.029
  303    HB3  LYS  37           HB3      LYS  37   0.389   3.610  -6.497
  304    HG2  LYS  37           HG2      LYS  37  -0.608   3.040  -9.284
  305    HG3  LYS  37           HG3      LYS  37   0.206   4.513  -8.757
  306    HD2  LYS  37           HD2      LYS  37   2.204   3.202  -8.200
  307    HD3  LYS  37           HD3      LYS  37   1.388   1.732  -8.738
  308    HE2  LYS  37           HE2      LYS  37   1.205   2.644 -10.990
  309    HE3  LYS  37           HE3      LYS  37   1.967   4.140 -10.461
  310    HZ1  LYS  37           HZ1      LYS  37   3.255   1.461 -10.439
  311    HZ2  LYS  37           HZ2      LYS  37   3.986   2.920  -9.989
  312    HZ3  LYS  37           HZ3      LYS  37   3.520   2.671 -11.595
  313    H    VAL  38           H        VAL  38   0.946  -0.322  -6.909
  314    HA   VAL  38           HA       VAL  38   1.710  -0.130  -4.107
  315    HB   VAL  38           HB       VAL  38   2.395  -2.315  -6.078
  316   HG11  VAL  38          2HG1      VAL  38   3.867  -2.245  -4.150
  317   HG12  VAL  38          1HG1      VAL  38   2.802  -3.646  -4.054
  318   HG13  VAL  38          3HG1      VAL  38   2.478  -2.223  -3.064
  319   HG21  VAL  38          3HG2      VAL  38  -0.027  -2.108  -5.848
  320   HG22  VAL  38          2HG2      VAL  38   0.124  -2.177  -4.091
  321   HG23  VAL  38          1HG2      VAL  38   0.555  -3.579  -5.071
  322    H    GLU  39           H        GLU  39   3.474   0.800  -3.498
  323    HA   GLU  39           HA       GLU  39   5.634   1.314  -5.396
  324    HB2  GLU  39           HB2      GLU  39   4.731   3.194  -4.066
  325    HB3  GLU  39           HB3      GLU  39   5.167   2.350  -2.589
  326    HG2  GLU  39           HG2      GLU  39   7.495   2.565  -3.079
  327    HG3  GLU  39           HG3      GLU  39   7.146   3.215  -4.682
  328    H    THR  40           H        THR  40   7.689   0.499  -5.099
  329    HA   THR  40           HA       THR  40   7.918  -1.558  -3.010
  330    HB   THR  40           HB       THR  40   9.200  -1.637  -5.745
  331    HG1  THR  40           HG1      THR  40   6.841  -2.886  -4.724
  332   HG21  THR  40          3HG2      THR  40   8.948  -3.701  -3.551
  333   HG22  THR  40          1HG2      THR  40  10.431  -2.905  -4.078
  334   HG23  THR  40          2HG2      THR  40   9.592  -4.015  -5.163
  335    H    GLN  41           H        GLN  41   9.270  -0.906  -1.496
  336    HA   GLN  41           HA       GLN  41  11.740   0.489  -2.309
  337    HB2  GLN  41           HB2      GLN  41  10.227   1.816  -0.851
  338    HB3  GLN  41           HB3      GLN  41  10.312   0.548   0.362
  339    HG2  GLN  41           HG2      GLN  41  12.809   0.947   0.412
  340    HG3  GLN  41           HG3      GLN  41  12.496   2.397  -0.544
  341   HE21  GLN  41          1HE2      GLN  41  13.193   3.779   1.073
  342   HE22  GLN  41          2HE2      GLN  41  12.306   4.016   2.537
  343    H    GLY  42           H        GLY  42  13.652  -0.479  -1.792
  344    HA2  GLY  42           HA1      GLY  42  13.472  -2.986  -0.243
  345    HA3  GLY  42           HA2      GLY  42  14.709  -2.635  -1.444
  346    H    ALA  43           H        ALA  43  16.360  -1.172  -0.948
  347    HA   ALA  43           HA       ALA  43  16.567  -0.310   1.846
  348    HB1  ALA  43           HB1      ALA  43  18.748  -1.836   0.418
  349    HB2  ALA  43           HB2      ALA  43  18.858  -1.126   2.029
  350    HB3  ALA  43           HB3      ALA  43  17.745  -2.460   1.727
  351    H    THR  44           H        THR  44  16.676   1.807   1.627
  352    HA   THR  44           HA       THR  44  17.043   3.883   0.824
  353    HB   THR  44           HB       THR  44  19.418   4.357   0.010
  354    HG1  THR  44           HG1      THR  44  19.581   1.810  -0.303
  355   HG21  THR  44          3HG2      THR  44  19.012   3.070   2.704
  356   HG22  THR  44          1HG2      THR  44  18.701   4.757   2.294
  357   HG23  THR  44          2HG2      THR  44  20.350   4.131   2.268
  358    H    GLY  45           H        GLY  45  15.932   1.887  -1.046
  359    HA2  GLY  45           HA1      GLY  45  16.348   3.426  -3.496
  360    HA3  GLY  45           HA2      GLY  45  16.635   1.691  -3.567
  361    H    ILE  46           H        ILE  46  14.493   3.820  -4.489
  362    HA   ILE  46           HA       ILE  46  12.158   2.170  -3.768
  363    HB   ILE  46           HB       ILE  46  12.207   5.127  -4.425
  364   HG12  ILE  46          2HG1      ILE  46  11.596   3.706  -1.822
  365   HG13  ILE  46          3HG1      ILE  46  13.094   4.558  -2.181
  366   HG21  ILE  46          2HG2      ILE  46   9.815   5.075  -3.820
  367   HG22  ILE  46          1HG2      ILE  46   9.907   3.318  -3.689
  368   HG23  ILE  46          3HG2      ILE  46  10.175   4.102  -5.246
  369   HD11  ILE  46          3HD1      ILE  46  11.638   5.911  -0.804
  370   HD12  ILE  46          2HD1      ILE  46  10.354   5.785  -2.007
  371   HD13  ILE  46          1HD1      ILE  46  11.842   6.647  -2.393
  372    H    GLU  47           H        GLU  47  11.228   1.136  -5.420
  373    HA   GLU  47           HA       GLU  47  12.243   1.658  -8.090
  374    HB2  GLU  47           HB2      GLU  47  10.461  -0.557  -7.067
  375    HB3  GLU  47           HB3      GLU  47  11.152  -0.468  -8.682
  376    HG2  GLU  47           HG2      GLU  47  12.745  -0.614  -6.134
  377    HG3  GLU  47           HG3      GLU  47  12.384  -1.984  -7.182
  378    H    ASN  48           H        ASN  48   8.952   0.875  -6.923
  379    HA   ASN  48           HA       ASN  48   7.835   2.293  -9.191
  380    HB2  ASN  48           HB2      ASN  48   6.427   0.855  -6.929
  381    HB3  ASN  48           HB3      ASN  48   5.648   1.514  -8.361
  382   HD21  ASN  48          1HD2      ASN  48   5.586  -1.172  -7.447
  383   HD22  ASN  48          2HD2      ASN  48   6.315  -2.152  -8.673
  384    H    GLU  49           H        GLU  49   8.922   4.271  -8.216
  385    HA   GLU  49           HA       GLU  49   8.021   5.562  -5.922
  386    HB2  GLU  49           HB2      GLU  49  10.021   6.192  -7.200
  387    HB3  GLU  49           HB3      GLU  49   9.007   6.764  -8.513
  388    HG2  GLU  49           HG2      GLU  49   8.133   8.531  -7.119
  389    HG3  GLU  49           HG3      GLU  49   9.042   7.919  -5.735
  390    H    LEU  50           H        LEU  50   6.028   6.135  -5.403
  391    HA   LEU  50           HA       LEU  50   3.935   6.412  -7.324
  392    HB2  LEU  50           HB2      LEU  50   3.968   7.182  -4.406
  393    HB3  LEU  50           HB3      LEU  50   2.538   7.004  -5.407
  394    HG   LEU  50           HG       LEU  50   4.440   4.788  -4.638
  395   HD11  LEU  50          2HD1      LEU  50   3.077   5.554  -2.772
  396   HD12  LEU  50          1HD1      LEU  50   2.573   3.952  -3.310
  397   HD13  LEU  50          3HD1      LEU  50   1.620   5.369  -3.748
  398   HD21  LEU  50          3HD2      LEU  50   1.867   4.703  -6.208
  399   HD22  LEU  50          2HD2      LEU  50   2.800   3.304  -5.675
  400   HD23  LEU  50          1HD2      LEU  50   3.489   4.428  -6.847
  401    H    THR  51           H        THR  51   2.894   8.220  -8.076
  402    HA   THR  51           HA       THR  51   4.421  10.659  -8.078
  403    HB   THR  51           HB       THR  51   2.776  11.511  -9.633
  404    HG1  THR  51           HG1      THR  51   1.227   9.171  -9.603
  405   HG21  THR  51          3HG2      THR  51   4.432   9.988 -10.563
  406   HG22  THR  51          1HG2      THR  51   2.890   9.799 -11.398
  407   HG23  THR  51          2HG2      THR  51   3.395   8.609 -10.199
  408    H    GLU  52           H        GLU  52   3.459  12.756  -7.567
  409    HA   GLU  52           HA       GLU  52   2.339  12.902  -4.998
  410    HB2  GLU  52           HB2      GLU  52   3.606  14.741  -6.020
  411    HB3  GLU  52           HB3      GLU  52   2.337  14.961  -7.216
  412    HG2  GLU  52           HG2      GLU  52   0.784  15.425  -5.263
  413    HG3  GLU  52           HG3      GLU  52   2.241  15.535  -4.275
  414    H    LYS  53           H        LYS  53   0.933  13.001  -8.205
  415    HA   LYS  53           HA       LYS  53  -1.685  13.729  -7.504
  416    HB2  LYS  53           HB2      LYS  53  -0.738  12.054  -9.836
  417    HB3  LYS  53           HB3      LYS  53  -2.315  12.823  -9.704
  418    HG2  LYS  53           HG2      LYS  53  -1.312  15.007  -9.758
  419    HG3  LYS  53           HG3      LYS  53   0.306  14.306  -9.719
  420    HD2  LYS  53           HD2      LYS  53  -1.724  13.966 -11.923
  421    HD3  LYS  53           HD3      LYS  53  -0.300  15.006 -11.978
  422    HE2  LYS  53           HE2      LYS  53   1.106  12.976 -11.637
  423    HE3  LYS  53           HE3      LYS  53  -0.353  11.999 -11.768
  424    HZ1  LYS  53           HZ1      LYS  53  -0.689  12.967 -14.003
  425    HZ2  LYS  53           HZ2      LYS  53   0.731  12.050 -13.875
  426    HZ3  LYS  53           HZ3      LYS  53   0.816  13.745 -13.866
  427    H    ASP  54           H        ASP  54  -0.235  10.505  -8.013
  428    HA   ASP  54           HA       ASP  54  -2.560   9.028  -7.496
  429    HB2  ASP  54           HB2      ASP  54   0.361   8.354  -7.272
  430    HB3  ASP  54           HB3      ASP  54  -0.872   7.195  -6.788
  431    H    VAL  55           H        VAL  55  -0.100  10.288  -5.346
  432    HA   VAL  55           HA       VAL  55  -0.979   9.009  -2.997
  433    HB   VAL  55           HB       VAL  55   0.517  11.609  -3.350
  434   HG11  VAL  55          2HG1      VAL  55  -0.562  11.586  -1.186
  435   HG12  VAL  55          1HG1      VAL  55   1.174  11.338  -0.996
  436   HG13  VAL  55          3HG1      VAL  55   0.067   9.971  -0.862
  437   HG21  VAL  55          3HG2      VAL  55   2.483  10.272  -2.778
  438   HG22  VAL  55          2HG2      VAL  55   1.685   9.652  -4.225
  439   HG23  VAL  55          1HG2      VAL  55   1.476   8.828  -2.679
  440    H    ASN  56           H        ASN  56  -1.835  12.130  -4.448
  441    HA   ASN  56           HA       ASN  56  -3.455  12.937  -2.234
  442    HB2  ASN  56           HB2      ASN  56  -2.962  14.027  -4.977
  443    HB3  ASN  56           HB3      ASN  56  -4.325  14.630  -4.039
  444   HD21  ASN  56          1HD2      ASN  56  -0.858  14.446  -4.274
  445   HD22  ASN  56          2HD2      ASN  56  -0.524  15.656  -3.083
  446    H    ILE  57           H        ILE  57  -4.082  11.303  -5.285
  447    HA   ILE  57           HA       ILE  57  -6.941  11.468  -4.995
  448    HB   ILE  57           HB       ILE  57  -5.348   9.620  -6.784
  449   HG12  ILE  57          2HG1      ILE  57  -4.795  11.945  -7.267
  450   HG13  ILE  57          3HG1      ILE  57  -5.796  11.291  -8.557
  451   HG21  ILE  57          2HG2      ILE  57  -7.418   9.534  -8.115
  452   HG22  ILE  57          1HG2      ILE  57  -8.234  10.493  -6.878
  453   HG23  ILE  57          3HG2      ILE  57  -7.635   8.878  -6.492
  454   HD11  ILE  57          3HD1      ILE  57  -7.738  12.431  -7.639
  455   HD12  ILE  57          2HD1      ILE  57  -6.433  13.567  -7.977
  456   HD13  ILE  57          1HD1      ILE  57  -6.754  13.060  -6.319
  457    H    GLY  58           H        GLY  58  -4.440   9.099  -4.268
  458    HA2  GLY  58           HA1      GLY  58  -6.134   6.984  -3.480
  459    HA3  GLY  58           HA2      GLY  58  -4.471   7.221  -2.959
  460    H    GLU  59           H        GLU  59  -7.255   6.597  -1.680
  461    HA   GLU  59           HA       GLU  59  -7.610   8.754   0.202
  462    HB2  GLU  59           HB2      GLU  59  -8.762   6.020   0.624
  463    HB3  GLU  59           HB3      GLU  59  -9.465   7.589   0.979
  464    HG2  GLU  59           HG2      GLU  59  -9.008   6.663  -1.829
  465    HG3  GLU  59           HG3      GLU  59 -10.453   6.228  -0.925
  466    H    VAL  60           H        VAL  60  -6.907   5.301   0.666
  467    HA   VAL  60           HA       VAL  60  -5.588   5.968   3.192
  468    HB   VAL  60           HB       VAL  60  -5.828   3.550   3.724
  469   HG11  VAL  60          2HG1      VAL  60  -8.222   3.622   4.151
  470   HG12  VAL  60          1HG1      VAL  60  -8.404   4.931   2.983
  471   HG13  VAL  60          3HG1      VAL  60  -7.487   5.194   4.466
  472   HG21  VAL  60          3HG2      VAL  60  -7.331   2.176   2.348
  473   HG22  VAL  60          2HG2      VAL  60  -5.879   2.649   1.465
  474   HG23  VAL  60          1HG2      VAL  60  -7.409   3.472   1.153
  475    H    VAL  61           H        VAL  61  -3.613   5.080   3.744
  476    HA   VAL  61           HA       VAL  61  -1.939   4.277   1.451
  477    HB   VAL  61           HB       VAL  61  -0.990   5.403   4.087
  478   HG11  VAL  61          2HG1      VAL  61   1.074   5.848   2.839
  479   HG12  VAL  61          1HG1      VAL  61   0.365   5.088   1.413
  480   HG13  VAL  61          3HG1      VAL  61   0.669   4.131   2.863
  481   HG21  VAL  61          3HG2      VAL  61  -1.514   6.879   1.511
  482   HG22  VAL  61          2HG2      VAL  61  -0.700   7.548   2.924
  483   HG23  VAL  61          1HG2      VAL  61  -2.394   7.069   3.027
  484    H    ILE  62           H        ILE  62  -1.539   2.161   1.429
  485    HA   ILE  62           HA       ILE  62  -1.593   0.655   3.928
  486    HB   ILE  62           HB       ILE  62  -1.339  -0.296   1.070
  487   HG12  ILE  62          2HG1      ILE  62  -3.638  -0.451   3.034
  488   HG13  ILE  62          3HG1      ILE  62  -3.557   0.609   1.632
  489   HG21  ILE  62          2HG2      ILE  62  -1.680  -2.550   1.993
  490   HG22  ILE  62          1HG2      ILE  62  -1.589  -1.881   3.623
  491   HG23  ILE  62          3HG2      ILE  62  -0.181  -1.814   2.561
  492   HD11  ILE  62          3HD1      ILE  62  -3.553  -1.331   0.159
  493   HD12  ILE  62          2HD1      ILE  62  -4.966  -1.329   1.213
  494   HD13  ILE  62          1HD1      ILE  62  -3.609  -2.401   1.561
  495    H    PHE  63           H        PHE  63   0.240   0.517   5.039
  496    HA   PHE  63           HA       PHE  63   2.778   0.484   3.561
  497    HB2  PHE  63           HB2      PHE  63   2.075   1.256   6.372
  498    HB3  PHE  63           HB3      PHE  63   3.716   0.754   5.982
  499    HD1  PHE  63           HD2      PHE  63   3.639   1.989   3.136
  500    HD2  PHE  63           HD1      PHE  63   2.681   3.477   7.003
  501    HE1  PHE  63           HE2      PHE  63   4.171   4.270   2.386
  502    HE2  PHE  63           HE1      PHE  63   3.214   5.762   6.261
  503    HZ   PHE  63           HZ       PHE  63   3.958   6.158   3.950
  504    H    ALA  64           H        ALA  64   2.863  -1.635   2.939
  505    HA   ALA  64           HA       ALA  64   3.025  -3.635   5.077
  506    HB1  ALA  64           HB1      ALA  64   3.147  -3.952   2.073
  507    HB2  ALA  64           HB2      ALA  64   3.218  -5.270   3.243
  508    HB3  ALA  64           HB3      ALA  64   1.755  -4.296   3.101
  509    H    VAL  65           H        VAL  65   4.945  -3.122   6.080
  510    HA   VAL  65           HA       VAL  65   7.311  -2.981   4.349
  511    HB   VAL  65           HB       VAL  65   8.185  -1.107   5.745
  512   HG11  VAL  65          2HG1      VAL  65   5.625  -0.557   4.244
  513   HG12  VAL  65          1HG1      VAL  65   7.233  -0.707   3.534
  514   HG13  VAL  65          3HG1      VAL  65   6.871   0.630   4.627
  515   HG21  VAL  65          3HG2      VAL  65   5.350  -1.036   6.776
  516   HG22  VAL  65          2HG2      VAL  65   6.549   0.233   7.023
  517   HG23  VAL  65          1HG2      VAL  65   6.805  -1.369   7.715
  518    H    ASP  66           H        ASP  66   9.152  -2.347   6.198
  519    HA   ASP  66           HA       ASP  66   9.202  -4.270   8.329
  520    HB2  ASP  66           HB2      ASP  66   9.634  -5.780   6.481
  521    HB3  ASP  66           HB3      ASP  66  10.838  -4.685   5.813
  522    H    THR  67           H        THR  67  10.856  -2.068   6.175
  523    HA   THR  67           HA       THR  67  12.316  -0.976   8.483
  524    HB   THR  67           HB       THR  67  13.784  -1.861   6.656
  525    HG1  THR  67           HG1      THR  67  14.573  -0.191   7.956
  526   HG21  THR  67          3HG2      THR  67  12.345  -1.352   4.744
  527   HG22  THR  67          1HG2      THR  67  13.941  -0.629   4.549
  528   HG23  THR  67          2HG2      THR  67  12.572   0.374   5.026
  529    H    LYS  68           H        LYS  68  12.855   1.542   7.670
  530    HA   LYS  68           HA       LYS  68  10.231   2.740   7.688
  531    HB2  LYS  68           HB2      LYS  68  11.332   4.815   8.103
  532    HB3  LYS  68           HB3      LYS  68  12.174   3.595   9.049
  533    HG2  LYS  68           HG2      LYS  68  13.970   3.515   7.457
  534    HG3  LYS  68           HG3      LYS  68  13.091   4.588   6.363
  535    HD2  LYS  68           HD2      LYS  68  13.227   6.390   7.991
  536    HD3  LYS  68           HD3      LYS  68  14.058   5.322   9.128
  537    HE2  LYS  68           HE2      LYS  68  15.079   6.095   6.395
  538    HE3  LYS  68           HE3      LYS  68  15.599   6.824   7.916
  539    HZ1  LYS  68           HZ1      LYS  68  17.172   5.174   7.275
  540    HZ2  LYS  68           HZ2      LYS  68  15.963   4.000   7.069
  541    HZ3  LYS  68           HZ3      LYS  68  16.326   4.582   8.621
  542    H    VAL  69           H        VAL  69   9.603   4.444   6.221
  543    HA   VAL  69           HA       VAL  69  10.675   4.047   3.509
  544    HB   VAL  69           HB       VAL  69   8.508   4.698   2.623
  545   HG11  VAL  69          2HG1      VAL  69   8.844   2.341   3.059
  546   HG12  VAL  69          1HG1      VAL  69   7.163   2.781   3.360
  547   HG13  VAL  69          3HG1      VAL  69   8.268   2.542   4.714
  548   HG21  VAL  69          3HG2      VAL  69   6.579   5.066   4.052
  549   HG22  VAL  69          2HG2      VAL  69   7.848   6.241   4.396
  550   HG23  VAL  69          1HG2      VAL  69   7.590   4.878   5.485
  551    H    ARG  70           H        ARG  70  10.710   5.942   2.126
  552    HA   ARG  70           HA       ARG  70  11.363   8.350   3.644
  553    HB2  ARG  70           HB2      ARG  70  12.945   7.549   1.924
  554    HB3  ARG  70           HB3      ARG  70  11.698   7.749   0.699
  555    HG2  ARG  70           HG2      ARG  70  11.626  10.172   1.262
  556    HG3  ARG  70           HG3      ARG  70  13.010   9.914   2.324
  557    HD2  ARG  70           HD2      ARG  70  14.276   9.045   0.369
  558    HD3  ARG  70           HD3      ARG  70  12.901   9.462  -0.656
  559    HE   ARG  70           HE       ARG  70  14.150  11.564   0.956
  560   HH11  ARG  70          2HH1      ARG  70  13.458  10.181  -2.198
  561   HH12  ARG  70          1HH1      ARG  70  13.999  11.584  -3.065
  562   HH21  ARG  70          2HH2      ARG  70  14.854  13.390  -0.168
  563   HH22  ARG  70          1HH2      ARG  70  14.804  13.409  -1.912
  564    H    ASN  71           H        ASN  71   9.147   7.186   1.207
  565    HA   ASN  71           HA       ASN  71   8.166   9.711   0.411
  566    HB2  ASN  71           HB2      ASN  71   7.256   6.887  -0.040
  567    HB3  ASN  71           HB3      ASN  71   6.317   8.257  -0.633
  568   HD21  ASN  71          1HD2      ASN  71   6.817   7.256  -2.734
  569   HD22  ASN  71          2HD2      ASN  71   8.308   7.671  -3.497
  570    H    LYS  72           H        LYS  72   7.621   8.039   3.241
  571    HA   LYS  72           HA       LYS  72   4.981   8.431   3.903
  572    HB2  LYS  72           HB2      LYS  72   5.695   8.644   6.237
  573    HB3  LYS  72           HB3      LYS  72   6.548   7.346   5.416
  574    HG2  LYS  72           HG2      LYS  72   8.528   8.700   5.223
  575    HG3  LYS  72           HG3      LYS  72   7.678  10.099   5.882
  576    HD2  LYS  72           HD2      LYS  72   7.349   8.889   7.995
  577    HD3  LYS  72           HD3      LYS  72   8.225   7.508   7.333
  578    HE2  LYS  72           HE2      LYS  72   9.626   8.912   8.796
  579    HE3  LYS  72           HE3      LYS  72  10.240   8.830   7.146
  580    HZ1  LYS  72           HZ1      LYS  72   8.522  11.059   8.071
  581    HZ2  LYS  72           HZ2      LYS  72   9.526  10.999   6.704
  582    HZ3  LYS  72           HZ3      LYS  72  10.206  11.089   8.250
  583    H    GLU  73           H        GLU  73   7.396  10.816   3.354
  584    HA   GLU  73           HA       GLU  73   6.659  13.103   4.613
  585    HB2  GLU  73           HB2      GLU  73   7.153  12.964   1.636
  586    HB3  GLU  73           HB3      GLU  73   7.427  14.342   2.689
  587    HG2  GLU  73           HG2      GLU  73   9.285  13.302   3.713
  588    HG3  GLU  73           HG3      GLU  73   8.914  11.750   2.963
  589    H    ARG  74           H        ARG  74   5.141  11.790   1.697
  590    HA   ARG  74           HA       ARG  74   3.279  13.994   1.566
  591    HB2  ARG  74           HB2      ARG  74   2.521  12.910  -0.516
  592    HB3  ARG  74           HB3      ARG  74   4.253  13.199  -0.493
  593    HG2  ARG  74           HG2      ARG  74   4.117  10.664   0.487
  594    HG3  ARG  74           HG3      ARG  74   2.754  10.688  -0.635
  595    HD2  ARG  74           HD2      ARG  74   4.684   9.957  -1.843
  596    HD3  ARG  74           HD3      ARG  74   4.310  11.596  -2.368
  597    HE   ARG  74           HE       ARG  74   6.168  11.779  -0.303
  598   HH11  ARG  74          2HH1      ARG  74   6.006  10.592  -3.587
  599   HH12  ARG  74          1HH1      ARG  74   7.700  10.790  -3.879
  600   HH21  ARG  74          2HH2      ARG  74   8.427  12.060  -0.686
  601   HH22  ARG  74          1HH2      ARG  74   9.076  11.613  -2.239
  602    H    PHE  75           H        PHE  75   3.291  10.712   2.681
  603    HA   PHE  75           HA       PHE  75   0.436  10.472   2.764
  604    HB2  PHE  75           HB2      PHE  75   2.516   8.772   4.149
  605    HB3  PHE  75           HB3      PHE  75   0.844   8.344   3.823
  606    HD1  PHE  75           HD2      PHE  75   0.322   8.861   1.121
  607    HD2  PHE  75           HD1      PHE  75   3.979   7.577   2.869
  608    HE1  PHE  75           HE2      PHE  75   1.000   7.875  -1.028
  609    HE2  PHE  75           HE1      PHE  75   4.664   6.590   0.724
  610    HZ   PHE  75           HZ       PHE  75   3.172   6.738  -1.228
  611    H    ASP  76           H        ASP  76   2.674  12.123   4.619
  612    HA   ASP  76           HA       ASP  76   1.686  11.769   7.234
  613    HB2  ASP  76           HB2      ASP  76   3.835  12.888   6.725
  614    HB3  ASP  76           HB3      ASP  76   2.952  14.236   6.020
  615    H    GLY  77           H        GLY  77  -0.233  12.295   8.053
  616    HA2  GLY  77           HA1      GLY  77  -1.994  13.822   8.510
  617    HA3  GLY  77           HA2      GLY  77  -1.644  14.640   6.993
  618    H    LYS  78           H        LYS  78  -1.426  11.679   5.987
  619    HA   LYS  78           HA       LYS  78  -4.216  11.559   5.148
  620    HB2  LYS  78           HB2      LYS  78  -1.743  10.113   4.185
  621    HB3  LYS  78           HB3      LYS  78  -3.358   9.812   3.558
  622    HG2  LYS  78           HG2      LYS  78  -3.504  12.140   2.819
  623    HG3  LYS  78           HG3      LYS  78  -1.878  12.431   3.437
  624    HD2  LYS  78           HD2      LYS  78  -1.935  12.045   0.994
  625    HD3  LYS  78           HD3      LYS  78  -0.948  10.863   1.856
  626    HE2  LYS  78           HE2      LYS  78  -2.370   9.863   0.097
  627    HE3  LYS  78           HE3      LYS  78  -2.687   9.218   1.700
  628    HZ1  LYS  78           HZ1      LYS  78  -4.312  11.349   0.403
  629    HZ2  LYS  78           HZ2      LYS  78  -4.670  10.534   1.850
  630    HZ3  LYS  78           HZ3      LYS  78  -4.710   9.703   0.375
  631    H    VAL  79           H        VAL  79  -5.019   9.189   4.839
  632    HA   VAL  79           HA       VAL  79  -4.977   8.026   7.503
  633    HB   VAL  79           HB       VAL  79  -6.557   7.086   5.108
  634   HG11  VAL  79          2HG1      VAL  79  -8.046   6.145   6.821
  635   HG12  VAL  79          1HG1      VAL  79  -6.932   6.699   8.071
  636   HG13  VAL  79          3HG1      VAL  79  -6.415   5.476   6.910
  637   HG21  VAL  79          3HG2      VAL  79  -7.374   9.074   7.224
  638   HG22  VAL  79          2HG2      VAL  79  -8.411   8.428   5.954
  639   HG23  VAL  79          1HG2      VAL  79  -7.033   9.447   5.534
  640    H    VAL  80           H        VAL  80  -3.656   6.390   8.040
  641    HA   VAL  80           HA       VAL  80  -2.393   4.877   5.846
  642    HB   VAL  80           HB       VAL  80  -1.142   5.705   8.473
  643   HG11  VAL  80          2HG1      VAL  80   0.942   4.837   7.509
  644   HG12  VAL  80          1HG1      VAL  80   0.042   4.265   6.105
  645   HG13  VAL  80          3HG1      VAL  80  -0.275   3.574   7.697
  646   HG21  VAL  80          3HG2      VAL  80  -1.414   7.606   6.977
  647   HG22  VAL  80          2HG2      VAL  80  -0.647   6.706   5.670
  648   HG23  VAL  80          1HG2      VAL  80   0.288   7.155   7.097
  649    H    LEU  81           H        LEU  81  -2.191   2.710   6.036
  650    HA   LEU  81           HA       LEU  81  -2.988   1.423   8.568
  651    HB2  LEU  81           HB2      LEU  81  -4.702   1.219   6.735
  652    HB3  LEU  81           HB3      LEU  81  -3.507   0.382   5.771
  653    HG   LEU  81           HG       LEU  81  -5.276  -1.021   6.970
  654   HD11  LEU  81          2HD1      LEU  81  -3.324  -2.018   5.939
  655   HD12  LEU  81          1HD1      LEU  81  -3.703  -2.827   7.461
  656   HD13  LEU  81          3HD1      LEU  81  -2.366  -1.678   7.381
  657   HD21  LEU  81          3HD2      LEU  81  -5.165   0.098   9.132
  658   HD22  LEU  81          2HD2      LEU  81  -3.492  -0.431   9.326
  659   HD23  LEU  81          1HD2      LEU  81  -4.793  -1.621   9.280
  660    H    GLU  82           H        GLU  82  -1.278   0.378   9.415
  661    HA   GLU  82           HA       GLU  82   0.945  -0.289   7.607
  662    HB2  GLU  82           HB2      GLU  82   0.980   0.399  10.547
  663    HB3  GLU  82           HB3      GLU  82   2.392  -0.071   9.610
  664    HG2  GLU  82           HG2      GLU  82   2.167   1.882   8.215
  665    HG3  GLU  82           HG3      GLU  82   0.678   2.332   9.042
  666    H    VAL  83           H        VAL  83   1.483  -2.327   7.344
  667    HA   VAL  83           HA       VAL  83   1.014  -4.272   9.490
  668    HB   VAL  83           HB       VAL  83   0.291  -5.961   7.765
  669   HG11  VAL  83          2HG1      VAL  83  -2.034  -5.226   7.693
  670   HG12  VAL  83          1HG1      VAL  83  -1.538  -3.590   8.128
  671   HG13  VAL  83          3HG1      VAL  83  -1.319  -4.913   9.275
  672   HG21  VAL  83          3HG2      VAL  83  -0.632  -5.144   5.652
  673   HG22  VAL  83          2HG2      VAL  83   1.093  -4.791   5.777
  674   HG23  VAL  83          1HG2      VAL  83  -0.090  -3.510   6.044
  675    HA   PRO  84           HA       PRO  84   5.061  -5.832   8.368
  676    HB2  PRO  84           HB2      PRO  84   3.910  -8.561   8.526
  677    HB3  PRO  84           HB3      PRO  84   5.264  -7.860   9.420
  678    HG2  PRO  84           HG2      PRO  84   2.925  -8.297  10.623
  679    HG3  PRO  84           HG3      PRO  84   3.882  -6.847  10.983
  680    HD2  PRO  84           HD2      PRO  84   1.462  -7.133   9.239
  681    HD3  PRO  84           HD3      PRO  84   1.871  -5.849  10.396
  682    H    VAL  85           H        VAL  85   6.088  -6.394   6.504
  683    HA   VAL  85           HA       VAL  85   4.658  -6.321   4.105
  684    HB   VAL  85           HB       VAL  85   7.003  -5.613   4.315
  685   HG11  VAL  85          2HG1      VAL  85   8.814  -7.250   4.299
  686   HG12  VAL  85          1HG1      VAL  85   7.638  -8.559   4.438
  687   HG13  VAL  85          3HG1      VAL  85   7.827  -7.397   5.753
  688   HG21  VAL  85          3HG2      VAL  85   6.108  -6.045   2.106
  689   HG22  VAL  85          2HG2      VAL  85   6.552  -7.747   2.236
  690   HG23  VAL  85          1HG2      VAL  85   7.808  -6.510   2.176
  691    H    SER  86           H        SER  86   5.617  -9.045   6.050
  692    HA   SER  86           HA       SER  86   5.312 -11.008   4.003
  693    HB2  SER  86           HB2      SER  86   5.284 -11.353   7.004
  694    HB3  SER  86           HB3      SER  86   5.541 -12.625   5.807
  695    HG   SER  86           HG       SER  86   7.226 -10.479   6.531
  696    H    ALA  87           H        ALA  87   3.074  -9.288   5.935
  697    HA   ALA  87           HA       ALA  87   1.119 -11.317   6.267
  698    HB1  ALA  87           HB1      ALA  87  -0.366  -9.550   6.998
  699    HB2  ALA  87           HB2      ALA  87   1.232  -9.351   7.717
  700    HB3  ALA  87           HB3      ALA  87   0.740  -8.332   6.364
  701    HA   PRO  88           HA       PRO  88  -1.306  -8.999   2.691
  702    HB2  PRO  88           HB2      PRO  88   0.975  -7.988   1.084
  703    HB3  PRO  88           HB3      PRO  88  -0.590  -7.238   1.424
  704    HG2  PRO  88           HG2      PRO  88   1.598  -6.366   2.634
  705    HG3  PRO  88           HG3      PRO  88   0.073  -6.510   3.529
  706    HD2  PRO  88           HD2      PRO  88   2.452  -8.329   3.534
  707    HD3  PRO  88           HD3      PRO  88   1.453  -7.778   4.896
  708    H    ILE  89           H        ILE  89   1.587 -10.858   2.336
  709    HA   ILE  89           HA       ILE  89   1.248 -11.812  -0.279
  710    HB   ILE  89           HB       ILE  89   2.420 -13.209   2.130
  711   HG12  ILE  89          2HG1      ILE  89   3.660 -11.672  -0.163
  712   HG13  ILE  89          3HG1      ILE  89   3.604 -11.175   1.525
  713   HG21  ILE  89          2HG2      ILE  89   3.473 -14.747   0.554
  714   HG22  ILE  89          1HG2      ILE  89   2.637 -13.961  -0.784
  715   HG23  ILE  89          3HG2      ILE  89   1.716 -14.836   0.439
  716   HD11  ILE  89          3HD1      ILE  89   5.046 -13.057   2.116
  717   HD12  ILE  89          2HD1      ILE  89   5.800 -11.995   0.925
  718   HD13  ILE  89          1HD1      ILE  89   5.105 -13.534   0.419
  719    H    LYS  90           H        LYS  90   0.120 -13.166   2.812
  720    HA   LYS  90           HA       LYS  90  -1.725 -14.894   1.344
  721    HB2  LYS  90           HB2      LYS  90  -0.950 -14.810   4.259
  722    HB3  LYS  90           HB3      LYS  90  -2.181 -15.878   3.608
  723    HG2  LYS  90           HG2      LYS  90   0.752 -15.878   2.943
  724    HG3  LYS  90           HG3      LYS  90  -0.131 -17.092   3.867
  725    HD2  LYS  90           HD2      LYS  90  -0.430 -16.451   0.937
  726    HD3  LYS  90           HD3      LYS  90   0.239 -17.919   1.645
  727    HE2  LYS  90           HE2      LYS  90  -2.622 -16.979   1.826
  728    HE3  LYS  90           HE3      LYS  90  -2.019 -18.309   0.844
  729    HZ1  LYS  90           HZ1      LYS  90  -2.978 -19.241   2.770
  730    HZ2  LYS  90           HZ2      LYS  90  -2.176 -18.167   3.799
  731    HZ3  LYS  90           HZ3      LYS  90  -1.299 -19.370   2.984
  732    H    ASP  91           H        ASP  91  -1.670 -12.175   3.557
  733    HA   ASP  91           HA       ASP  91  -4.581 -12.280   3.849
  734    HB2  ASP  91           HB2      ASP  91  -2.431 -10.742   5.310
  735    HB3  ASP  91           HB3      ASP  91  -4.149 -10.472   5.574
  736    H    ALA  92           H        ALA  92  -3.430 -11.412   1.316
  737    HA   ALA  92           HA       ALA  92  -3.263  -8.663   0.982
  738    HB1  ALA  92           HB1      ALA  92  -4.446 -10.642  -0.961
  739    HB2  ALA  92           HB2      ALA  92  -3.848  -9.030  -1.353
  740    HB3  ALA  92           HB3      ALA  92  -2.731 -10.273  -0.786
  741    H    GLU  93           H        GLU  93  -6.158 -10.718   0.721
  742    HA   GLU  93           HA       GLU  93  -7.965  -8.612   0.187
  743    HB2  GLU  93           HB2      GLU  93  -8.533 -11.288   1.484
  744    HB3  GLU  93           HB3      GLU  93  -9.712 -10.238   0.714
  745    HG2  GLU  93           HG2      GLU  93  -7.400 -11.549  -0.695
  746    HG3  GLU  93           HG3      GLU  93  -9.055 -12.155  -0.680
  747    H    LYS  94           H        LYS  94  -6.677  -9.991   3.107
  748    HA   LYS  94           HA       LYS  94  -8.565  -8.899   4.930
  749    HB2  LYS  94           HB2      LYS  94  -7.147 -10.838   5.461
  750    HB3  LYS  94           HB3      LYS  94  -5.715  -9.829   5.354
  751    HG2  LYS  94           HG2      LYS  94  -6.251 -10.203   7.656
  752    HG3  LYS  94           HG3      LYS  94  -6.542  -8.509   7.263
  753    HD2  LYS  94           HD2      LYS  94  -8.906  -8.866   7.171
  754    HD3  LYS  94           HD3      LYS  94  -8.697 -10.615   7.298
  755    HE2  LYS  94           HE2      LYS  94  -9.403  -9.647   9.428
  756    HE3  LYS  94           HE3      LYS  94  -7.797 -10.361   9.547
  757    HZ1  LYS  94           HZ1      LYS  94  -8.437  -7.470   9.295
  758    HZ2  LYS  94           HZ2      LYS  94  -6.864  -8.110   9.270
  759    HZ3  LYS  94           HZ3      LYS  94  -7.818  -8.257  10.663
  760    H    VAL  95           H        VAL  95  -5.437  -7.881   3.682
  761    HA   VAL  95           HA       VAL  95  -5.162  -5.585   5.339
  762    HB   VAL  95           HB       VAL  95  -3.858  -6.222   2.684
  763   HG11  VAL  95          2HG1      VAL  95  -3.710  -3.846   3.211
  764   HG12  VAL  95          1HG1      VAL  95  -2.136  -4.627   3.355
  765   HG13  VAL  95          3HG1      VAL  95  -3.060  -4.231   4.804
  766   HG21  VAL  95          3HG2      VAL  95  -1.964  -6.967   4.061
  767   HG22  VAL  95          2HG2      VAL  95  -3.417  -7.929   4.341
  768   HG23  VAL  95          1HG2      VAL  95  -2.931  -6.700   5.512
  769    H    ILE  96           H        ILE  96  -6.300  -6.075   2.014
  770    HA   ILE  96           HA       ILE  96  -6.722  -3.352   1.384
  771    HB   ILE  96           HB       ILE  96  -8.090  -5.813   0.270
  772   HG12  ILE  96          2HG1      ILE  96  -5.773  -4.199  -0.812
  773   HG13  ILE  96          3HG1      ILE  96  -5.602  -5.717   0.062
  774   HG21  ILE  96          2HG2      ILE  96  -8.650  -4.418  -1.659
  775   HG22  ILE  96          1HG2      ILE  96  -7.962  -3.012  -0.846
  776   HG23  ILE  96          3HG2      ILE  96  -9.396  -3.800  -0.185
  777   HD11  ILE  96          3HD1      ILE  96  -6.892  -6.845  -1.698
  778   HD12  ILE  96          2HD1      ILE  96  -5.420  -6.088  -2.309
  779   HD13  ILE  96          1HD1      ILE  96  -6.983  -5.320  -2.579
  780    H    ASN  97           H        ASN  97  -8.909  -5.833   2.704
  781    HA   ASN  97           HA       ASN  97 -11.174  -4.132   2.817
  782    HB2  ASN  97           HB2      ASN  97 -10.482  -6.758   4.072
  783    HB3  ASN  97           HB3      ASN  97 -11.887  -5.869   4.652
  784   HD21  ASN  97          1HD2      ASN  97 -10.516  -7.683   2.049
  785   HD22  ASN  97          2HD2      ASN  97 -11.960  -7.802   1.102
  786    H    ALA  98           H        ALA  98  -8.617  -4.880   5.140
  787    HA   ALA  98           HA       ALA  98  -9.748  -3.567   7.355
  788    HB1  ALA  98           HB1      ALA  98  -6.828  -3.946   6.703
  789    HB2  ALA  98           HB2      ALA  98  -7.497  -3.556   8.287
  790    HB3  ALA  98           HB3      ALA  98  -7.854  -5.112   7.536
  791    H    ALA  99           H        ALA  99  -7.609  -2.418   4.777
  792    HA   ALA  99           HA       ALA  99  -7.208   0.182   5.758
  793    HB1  ALA  99           HB1      ALA  99  -6.532   0.752   3.491
  794    HB2  ALA  99           HB2      ALA  99  -5.858  -0.806   3.970
  795    HB3  ALA  99           HB3      ALA  99  -7.250  -0.743   2.889
  796    H    LEU 100           H        LEU 100  -9.742  -1.182   3.717
  797    HA   LEU 100           HA       LEU 100 -11.043   1.329   3.284
  798    HB2  LEU 100           HB2      LEU 100 -12.038  -1.499   2.931
  799    HB3  LEU 100           HB3      LEU 100 -12.904  -0.065   2.411
  800    HG   LEU 100           HG       LEU 100 -10.205  -0.946   1.377
  801   HD11  LEU 100          2HD1      LEU 100 -12.925  -1.027   0.080
  802   HD12  LEU 100          1HD1      LEU 100 -12.001  -2.420   0.644
  803   HD13  LEU 100          3HD1      LEU 100 -11.395  -1.443  -0.692
  804   HD21  LEU 100          3HD2      LEU 100 -12.005   1.312   0.500
  805   HD22  LEU 100          2HD2      LEU 100 -10.494   0.830  -0.270
  806   HD23  LEU 100          1HD2      LEU 100 -10.479   1.484   1.369
  807    H    ALA 101           H        ALA 101 -11.222  -1.173   5.697
  808    HA   ALA 101           HA       ALA 101 -13.795  -0.576   6.700
  809    HB1  ALA 101           HB1      ALA 101 -11.500  -1.881   8.149
  810    HB2  ALA 101           HB2      ALA 101 -13.207  -1.967   8.584
  811    HB3  ALA 101           HB3      ALA 101 -12.639  -2.709   7.088
  812    H    LEU 102           H        LEU 102 -10.587   0.653   7.542
  813    HA   LEU 102           HA       LEU 102 -11.502   1.926   9.909
  814    HB2  LEU 102           HB2      LEU 102  -9.255   3.045   9.882
  815    HB3  LEU 102           HB3      LEU 102  -9.266   1.296   9.954
  816    HG   LEU 102           HG       LEU 102  -8.855   1.290   7.473
  817   HD11  LEU 102          2HD1      LEU 102  -9.648   3.631   7.174
  818   HD12  LEU 102          1HD1      LEU 102  -8.100   3.265   6.403
  819   HD13  LEU 102          3HD1      LEU 102  -8.143   4.172   7.916
  820   HD21  LEU 102          3HD2      LEU 102  -6.468   1.767   7.711
  821   HD22  LEU 102          2HD2      LEU 102  -7.082   0.866   9.094
  822   HD23  LEU 102          1HD2      LEU 102  -6.784   2.598   9.235
  823    H    ILE 103           H        ILE 103 -11.951   2.764   6.716
  824    HA   ILE 103           HA       ILE 103 -12.511   5.535   7.539
  825    HB   ILE 103           HB       ILE 103 -12.668   6.068   5.090
  826   HG12  ILE 103          2HG1      ILE 103 -11.313   3.383   4.767
  827   HG13  ILE 103          3HG1      ILE 103 -12.966   3.745   4.285
  828   HG21  ILE 103          2HG2      ILE 103 -10.728   6.693   6.384
  829   HG22  ILE 103          1HG2      ILE 103 -10.232   6.190   4.768
  830   HG23  ILE 103          3HG2      ILE 103 -10.013   5.100   6.137
  831   HD11  ILE 103          3HD1      ILE 103 -12.141   5.376   2.672
  832   HD12  ILE 103          2HD1      ILE 103 -11.458   3.775   2.384
  833   HD13  ILE 103          1HD1      ILE 103 -10.485   5.023   3.163
  834    H    ASP 104           H        ASP 104 -13.811   2.632   6.091
  835    HA   ASP 104           HA       ASP 104 -16.493   3.471   6.780
  836    HB2  ASP 104           HB2      ASP 104 -16.421   4.390   4.566
  837    HB3  ASP 104           HB3      ASP 104 -15.662   2.943   3.919
  838    H    GLU 105           H        GLU 105 -15.374   1.074   4.463
  839    HA   GLU 105           HA       GLU 105 -15.102  -1.152   6.073
  840    HB2  GLU 105           HB2      GLU 105 -17.512  -0.811   6.612
  841    HB3  GLU 105           HB3      GLU 105 -17.892  -0.965   4.902
  842    HG2  GLU 105           HG2      GLU 105 -17.209  -3.243   4.873
  843    HG3  GLU 105           HG3      GLU 105 -16.541  -3.121   6.500
  844    H    LYS 106           H        LYS 106 -16.572  -0.015   3.079
  845    HA   LYS 106           HA       LYS 106 -14.477  -1.082   1.492
  846    HB2  LYS 106           HB2      LYS 106 -15.905  -3.145   1.959
  847    HB3  LYS 106           HB3      LYS 106 -17.176  -2.372   1.023
  848    HG2  LYS 106           HG2      LYS 106 -15.852  -2.412  -0.956
  849    HG3  LYS 106           HG3      LYS 106 -14.425  -2.924  -0.058
  850    HD2  LYS 106           HD2      LYS 106 -15.110  -4.922  -0.967
  851    HD3  LYS 106           HD3      LYS 106 -15.925  -4.966   0.595
  852    HE2  LYS 106           HE2      LYS 106 -17.208  -4.011  -1.962
  853    HE3  LYS 106           HE3      LYS 106 -17.336  -5.657  -1.352
  854    HZ1  LYS 106           HZ1      LYS 106 -18.315  -4.666   0.709
  855    HZ2  LYS 106           HZ2      LYS 106 -19.265  -4.505  -0.687
  856    HZ3  LYS 106           HZ3      LYS 106 -18.386  -3.177  -0.109