*HEADER    METAL BINDING PROTEIN                   24-APR-17   5XHT              
*TITLE     THE PHD FINGER OF HUMAN KIAA1045 PROTEIN                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PHD FINGER PROTEIN 24;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 131-190;                                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    PHD FINGER, ZINC FINGER, METAL BINDING PROTEIN                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.MIYAMOTO                                                            
*REVDAT   1   02-MAY-18 5XHT    0                                                
# Restraints file 1: KIAA1045.upl
 8 VAL  HA     9 TRP  HN      3.22           
 30 ARG  HA     33 GLY  HN      4.01            
 2 MET  HA     3 CYSS HN      3.54               
 13 SER  HA     13 LEU  HN      3.02      
 40 ALA  HA     41 ALA  HN      3.01          
 42 GLU  HA     43 VAL  HN      3.23          
 9 TRP  HA     10 THR  HN      2.82           
 7 GLU  HA     8 VAL  HN      3.87           
 29 LEU  HA     35 ILE  HN      4.80          
 35 ILE  HA     35 ILE  QG2     3.33      
 57 TYR  HA     57 TYR  QD      3.78           
 35 ILE  HA     35 ILE  QD1     4.45        
 33 VAL  HA     33 VAL  QG2     4.29          
 10 THR  HA     10 THR  QG2     3.65           
 3 CYSS HA     24 PHE  HA      4.01            
 7 GLU  HA     7 GLU  HG2     3.66         
 19 VAL  HA     19 VAL  QG1     3.23           
 49 THR  HA     49 THR  QG2     3.12            
 5 VAL  HA     5 VAL  QG2     3.38            
 3 CYSS HA     23 VAL  QG2     4.01  
 8 VAL  HA     8 VAL  QG2     3.56  
 41 ALA  HA     43 VAL  QG2     4.29  
 43 VAL  HA     44 THR  HB      4.38 
 15 VAL  HA     32 MET  QE      5.01 
 2 MET  HA     2 MET  QE      4.34 
 15 PHE  HA     15 PHE  QD      4.67 
 3 CYSS HA     15 VAL  HN      4.77
 47 ALA  HA     53 TRP  HB2     5.38      
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLU   1           HN       GLU   1   1.791   5.233   3.744
    2    HA   GLU   1           HA       GLU   1   0.453   3.073   2.548
    3    HB2  GLU   1          2HB       GLU   1   2.641   3.157   1.043
    4    HB3  GLU   1          3HB       GLU   1   1.398   4.396   0.944
    5    HG2  GLU   1          2HG       GLU   1   2.666   5.921   2.204
    6    HG3  GLU   1          3HG       GLU   1   3.783   4.669   2.742
    7    H    MET   2           HN       MET   2   0.618   1.507   4.322
    8    HA   MET   2           HA       MET   2   3.204   0.102   4.362
    9    HB2  MET   2          2HB       MET   2   0.982   0.306   6.377
   10    HB3  MET   2          3HB       MET   2   2.144  -1.012   6.443
   11    HG2  MET   2          2HG       MET   2   3.741   1.210   6.203
   12    HG3  MET   2          3HG       MET   2   2.424   1.767   7.233
   13    HE1  MET   2          1HE       MET   2   5.406   1.644   8.844
   14    HE2  MET   2          2HE       MET   2   6.066   0.023   8.628
   15    HE3  MET   2          3HE       MET   2   5.627   0.991   7.219
   16    H    CYS   3           HN       CYS   3   3.292  -1.653   3.140
   17    HA   CYS   3           HA       CYS   3   1.220  -2.823   1.760
   18    HB2  CYS   3          2HB       CYS   3   3.613  -3.233   1.300
   19    HB3  CYS   3          3HB       CYS   3   3.715  -4.212   2.761
   20    H    ASP   4           HN       ASP   4  -0.533  -3.864   2.405
   21    HA   ASP   4           HA       ASP   4  -0.982  -4.697   5.057
   22    HB2  ASP   4          2HB       ASP   4  -2.678  -4.114   3.176
   23    HB3  ASP   4          3HB       ASP   4  -2.521  -5.810   2.729
   24    H    VAL   5           HN       VAL   5   0.888  -6.106   2.692
   25    HA   VAL   5           HA       VAL   5   0.491  -8.822   3.749
   26    HB   VAL   5           HB       VAL   5   1.942  -7.949   1.246
   27   HG11  VAL   5          1HG1      VAL   5   1.816 -10.430   0.744
   28   HG12  VAL   5          2HG1      VAL   5   2.963  -9.943   1.994
   29   HG13  VAL   5          3HG1      VAL   5   1.414 -10.655   2.447
   30   HG21  VAL   5          1HG2      VAL   5  -0.824  -8.964   1.760
   31   HG22  VAL   5          2HG2      VAL   5  -0.294  -7.630   0.736
   32   HG23  VAL   5          3HG2      VAL   5  -0.027  -9.296   0.221
   33    H    CYS   6           HN       CYS   6   2.543  -6.150   3.928
   34    HA   CYS   6           HA       CYS   6   4.606  -7.791   5.224
   35    HB2  CYS   6          2HB       CYS   6   5.147  -5.480   3.346
   36    HB3  CYS   6          3HB       CYS   6   6.364  -6.364   4.260
   37    H    GLU   7           HN       GLU   7   3.635  -4.405   4.650
   38    HA   GLU   7           HA       GLU   7   3.113  -2.764   6.178
   39    HB2  GLU   7          2HB       GLU   7   4.104  -4.457   8.447
   40    HB3  GLU   7          3HB       GLU   7   2.865  -3.210   8.456
   41    HG2  GLU   7          2HG       GLU   7   2.001  -5.242   6.694
   42    HG3  GLU   7          3HG       GLU   7   2.571  -6.021   8.168
   43    H    VAL   8           HN       VAL   8   5.223  -2.306   4.835
   44    HA   VAL   8           HA       VAL   8   7.023  -0.996   6.632
   45    HB   VAL   8           HB       VAL   8   8.904  -2.365   5.108
   46   HG11  VAL   8          1HG1      VAL   8   8.174  -3.132   7.917
   47   HG12  VAL   8          2HG1      VAL   8   9.773  -3.047   7.174
   48   HG13  VAL   8          3HG1      VAL   8   8.887  -1.564   7.539
   49   HG21  VAL   8          1HG2      VAL   8   8.486  -4.716   5.494
   50   HG22  VAL   8          2HG2      VAL   8   6.947  -4.345   6.273
   51   HG23  VAL   8          3HG2      VAL   8   7.164  -4.026   4.551
   52    H    TRP   9           HN       TRP   9   7.098   0.917   5.657
   53    HA   TRP   9           HA       TRP   9   7.265   1.021   2.727
   54    HB2  TRP   9          2HB       TRP   9   5.542   2.443   3.208
   55    HB3  TRP   9          3HB       TRP   9   6.159   2.821   4.813
   56    HD1  TRP   9          1HD       TRP   9   7.748   4.917   5.054
   57    HE1  TRP   9          1HE       TRP   9   8.368   6.842   3.462
   58    HE3  TRP   9          3HE       TRP   9   5.960   2.961   0.683
   59    HZ2  TRP   9          2HZ       TRP   9   8.129   7.451   0.716
   60    HZ3  TRP   9          3HZ       TRP   9   6.195   4.279  -1.382
   61    HH2  TRP   9          2HH       TRP   9   7.258   6.477  -1.364
   62    H    THR  10           HN       THR  10   8.628   2.803   1.821
   63    HA   THR  10           HA       THR  10  10.963   3.461   3.456
   64    HB   THR  10           HB       THR  10  12.152   2.889   1.046
   65    HG1  THR  10          1HG       THR  10  11.080   1.339   0.098
   66   HG21  THR  10          1HG2      THR  10  11.944   1.481   3.668
   67   HG22  THR  10          2HG2      THR  10  13.336   2.259   2.915
   68   HG23  THR  10          3HG2      THR  10  12.787   0.685   2.340
   69    H    ALA  11           HN       ALA  11  10.766   3.658  -0.040
   70    HA   ALA  11           HA       ALA  11   9.641   6.101  -0.488
   71    HB1  ALA  11          1HB       ALA  11  12.363   6.354   0.672
   72    HB2  ALA  11          2HB       ALA  11  11.908   7.455  -0.630
   73    HB3  ALA  11          3HB       ALA  11  10.952   7.399   0.851
   74    H    GLU  12           HN       GLU  12  12.298   3.950  -1.198
   75    HA   GLU  12           HA       GLU  12  13.337   4.666  -3.544
   76    HB2  GLU  12          2HB       GLU  12  12.166   1.915  -3.458
   77    HB3  GLU  12          3HB       GLU  12  13.747   2.435  -4.025
   78    HG2  GLU  12          2HG       GLU  12  14.106   3.039  -1.501
   79    HG3  GLU  12          3HG       GLU  12  12.817   1.861  -1.260
   80    H    SER  13           HN       SER  13  10.195   2.989  -3.355
   81    HA   SER  13           HA       SER  13   8.675   4.513  -4.975
   82    HB2  SER  13          2HB       SER  13  10.729   3.118  -6.555
   83    HB3  SER  13          3HB       SER  13   9.085   2.924  -7.166
   84    HG   SER  13           HG       SER  13  10.671   5.201  -7.002
   85    H    LEU  14           HN       LEU  14   7.657   3.208  -3.153
   86    HA   LEU  14           HA       LEU  14   7.085   0.485  -3.391
   87    HB2  LEU  14          2HB       LEU  14   6.705   1.996  -1.400
   88    HB3  LEU  14          3HB       LEU  14   5.235   2.540  -2.206
   89    HG   LEU  14           HG       LEU  14   4.282   0.328  -2.057
   90   HD11  LEU  14          1HD1      LEU  14   7.041  -0.406  -1.222
   91   HD12  LEU  14          2HD1      LEU  14   5.924  -1.243  -2.299
   92   HD13  LEU  14          3HD1      LEU  14   5.683  -1.311  -0.553
   93   HD21  LEU  14          1HD2      LEU  14   5.491   1.016   0.615
   94   HD22  LEU  14          2HD2      LEU  14   3.964   0.191   0.302
   95   HD23  LEU  14          3HD2      LEU  14   4.146   1.897  -0.111
   96    H    PHE  15           HN       PHE  15   4.840  -0.413  -3.747
   97    HA   PHE  15           HA       PHE  15   3.340   0.993  -5.824
   98    HB2  PHE  15          2HB       PHE  15   3.551  -1.799  -6.525
   99    HB3  PHE  15          3HB       PHE  15   3.916  -0.378  -7.498
  100    HD1  PHE  15          1HD       PHE  15   6.066  -0.111  -8.248
  101    HD2  PHE  15          2HD       PHE  15   5.384  -2.359  -4.698
  102    HE1  PHE  15          1HE       PHE  15   8.465  -0.647  -8.130
  103    HE2  PHE  15          2HE       PHE  15   7.782  -2.898  -4.574
  104    HZ   PHE  15           HZ       PHE  15   9.325  -2.041  -6.292
  105    HA   PRO  16           HA       PRO  16   1.720   0.109  -7.327
  106    HB2  PRO  16          2HB       PRO  16  -0.772   1.187  -7.361
  107    HB3  PRO  16          3HB       PRO  16  -0.463  -0.529  -7.653
  108    HG2  PRO  16          2HG       PRO  16  -1.373   0.831  -5.147
  109    HG3  PRO  16          3HG       PRO  16  -1.947  -0.682  -5.869
  110    HD2  PRO  16          2HD       PRO  16  -0.214  -0.626  -3.790
  111    HD3  PRO  16          3HD       PRO  16  -0.183  -1.902  -5.023
  112    H    CYS  17           HN       CYS  17   0.140   1.942  -4.701
  113    HA   CYS  17           HA       CYS  17   1.938   4.175  -5.171
  114    HB2  CYS  17          2HB       CYS  17   0.252   5.805  -5.580
  115    HB3  CYS  17          3HB       CYS  17  -0.059   4.481  -6.697
  116    H    ARG  18           HN       ARG  18   0.065   5.955  -3.700
  117    HA   ARG  18           HA       ARG  18  -0.035   4.692  -1.066
  118    HB2  ARG  18          2HB       ARG  18   1.348   6.202   0.003
  119    HB3  ARG  18          3HB       ARG  18   2.174   6.011  -1.538
  120    HG2  ARG  18          2HG       ARG  18   0.239   8.239  -0.955
  121    HG3  ARG  18          3HG       ARG  18   1.983   8.362  -0.710
  122    HD2  ARG  18          2HD       ARG  18   1.320   7.329  -3.337
  123    HD3  ARG  18          3HD       ARG  18   0.594   8.909  -3.046
  124    HE   ARG  18           HE       ARG  18   3.305   8.402  -3.588
  125   HH11  ARG  18          1HH1      ARG  18   1.288  10.326  -1.502
  126   HH12  ARG  18          2HH1      ARG  18   2.451  11.599  -1.334
  127   HH21  ARG  18          1HH2      ARG  18   4.845  10.072  -3.373
  128   HH22  ARG  18          2HH2      ARG  18   4.474  11.454  -2.399
  129    H    VAL  19           HN       VAL  19  -0.819   7.445  -3.122
  130    HA   VAL  19           HA       VAL  19  -2.537   8.836  -1.441
  131    HB   VAL  19           HB       VAL  19  -2.561   8.510  -4.437
  132   HG11  VAL  19          1HG1      VAL  19  -4.334  10.223  -2.706
  133   HG12  VAL  19          2HG1      VAL  19  -4.087  10.505  -4.429
  134   HG13  VAL  19          3HG1      VAL  19  -4.823   9.000  -3.879
  135   HG21  VAL  19          1HG2      VAL  19  -2.033  11.127  -3.837
  136   HG22  VAL  19          2HG2      VAL  19  -1.243  10.272  -2.512
  137   HG23  VAL  19          3HG2      VAL  19  -0.819   9.895  -4.182
  138    H    CYS  20           HN       CYS  20  -3.191   6.069  -3.544
  139    HA   CYS  20           HA       CYS  20  -5.903   5.900  -3.516
  140    HB2  CYS  20          2HB       CYS  20  -3.725   3.885  -3.521
  141    HB3  CYS  20          3HB       CYS  20  -5.342   3.293  -3.157
  142    H    THR  21           HN       THR  21  -4.269   3.693  -1.307
  143    HA   THR  21           HA       THR  21  -5.293   4.756   1.097
  144    HB   THR  21           HB       THR  21  -7.476   4.167   0.617
  145    HG1  THR  21          1HG       THR  21  -7.876   2.222   1.811
  146   HG21  THR  21          1HG2      THR  21  -7.828   3.030  -1.274
  147   HG22  THR  21          2HG2      THR  21  -7.586   1.557  -0.333
  148   HG23  THR  21          3HG2      THR  21  -6.232   2.282  -1.199
  149    H    ARG  22           HN       ARG  22  -4.510   1.737  -0.600
  150    HA   ARG  22           HA       ARG  22  -2.733   1.044   1.638
  151    HB2  ARG  22          2HB       ARG  22  -4.770  -0.690   0.271
  152    HB3  ARG  22          3HB       ARG  22  -3.352  -1.399   1.034
  153    HG2  ARG  22          2HG       ARG  22  -4.315   0.280   2.981
  154    HG3  ARG  22          3HG       ARG  22  -5.784  -0.339   2.223
  155    HD2  ARG  22          2HD       ARG  22  -5.258  -2.553   2.732
  156    HD3  ARG  22          3HD       ARG  22  -3.554  -2.185   2.996
  157    HE   ARG  22           HE       ARG  22  -5.693  -1.964   4.906
  158   HH11  ARG  22          1HH1      ARG  22  -2.511  -0.862   4.025
  159   HH12  ARG  22          2HH1      ARG  22  -2.079  -0.406   5.639
  160   HH21  ARG  22          1HH2      ARG  22  -5.137  -1.368   7.036
  161   HH22  ARG  22          2HH2      ARG  22  -3.573  -0.695   7.352
  162    H    VAL  23           HN       VAL  23  -1.072  -0.592   1.008
  163    HA   VAL  23           HA       VAL  23  -0.279  -0.234  -1.810
  164    HB   VAL  23           HB       VAL  23   2.070  -0.364  -1.067
  165   HG11  VAL  23          1HG1      VAL  23   0.428   1.794  -1.028
  166   HG12  VAL  23          2HG1      VAL  23   1.092   1.842   0.606
  167   HG13  VAL  23          3HG1      VAL  23   2.173   1.864  -0.787
  168   HG21  VAL  23          1HG2      VAL  23   0.767  -0.871   1.520
  169   HG22  VAL  23          2HG2      VAL  23   2.340  -1.395   0.919
  170   HG23  VAL  23          3HG2      VAL  23   2.143   0.233   1.569
  171    H    PHE  24           HN       PHE  24   0.744  -1.969  -2.849
  172    HA   PHE  24           HA       PHE  24   0.847  -4.524  -1.429
  173    HB2  PHE  24          2HB       PHE  24  -0.238  -4.900  -4.090
  174    HB3  PHE  24          3HB       PHE  24  -0.844  -5.485  -2.543
  175    HD1  PHE  24          1HD       PHE  24  -1.979  -3.586  -1.063
  176    HD2  PHE  24          2HD       PHE  24  -1.587  -3.501  -5.300
  177    HE1  PHE  24          1HE       PHE  24  -3.862  -2.008  -1.203
  178    HE2  PHE  24          2HE       PHE  24  -3.467  -1.922  -5.447
  179    HZ   PHE  24           HZ       PHE  24  -4.607  -1.173  -3.397
  180    H    HIS  25           HN       HIS  25   2.879  -5.161  -1.680
  181    HA   HIS  25           HA       HIS  25   4.684  -4.261  -3.587
  182    HB2  HIS  25          2HB       HIS  25   4.687  -6.877  -2.069
  183    HB3  HIS  25          3HB       HIS  25   6.067  -6.226  -2.948
  184    HD2  HIS  25          2HD       HIS  25   4.776  -3.190  -1.379
  185    HE1  HIS  25          1HE       HIS  25   7.106  -4.982   1.681
  186    HE2  HIS  25          2HE       HIS  25   5.874  -2.912   0.947
  187    H    ASP  26           HN       ASP  26   4.844  -4.596  -5.695
  188    HA   ASP  26           HA       ASP  26   3.158  -6.026  -7.280
  189    HB2  ASP  26          2HB       ASP  26   4.971  -4.401  -8.003
  190    HB3  ASP  26          3HB       ASP  26   6.097  -5.752  -7.916
  191    H    GLY  27           HN       GLY  27   5.685  -7.277  -5.298
  192    HA2  GLY  27          1HA       GLY  27   5.719  -9.851  -6.673
  193    HA3  GLY  27          2HA       GLY  27   6.727  -9.385  -5.312
  194    H    CYS  28           HN       CYS  28   4.474  -8.411  -3.727
  195    HA   CYS  28           HA       CYS  28   3.871 -10.748  -2.313
  196    HB2  CYS  28          2HB       CYS  28   2.990  -7.924  -2.241
  197    HB3  CYS  28          3HB       CYS  28   1.884  -9.088  -1.518
  198    H    LEU  29           HN       LEU  29   1.775  -8.813  -4.449
  199    HA   LEU  29           HA       LEU  29  -0.512 -10.351  -4.324
  200    HB2  LEU  29          2HB       LEU  29   0.571  -8.958  -6.767
  201    HB3  LEU  29          3HB       LEU  29  -1.105  -9.429  -6.492
  202    HG   LEU  29           HG       LEU  29   0.255  -7.511  -4.635
  203   HD11  LEU  29          1HD1      LEU  29  -0.777  -5.702  -6.070
  204   HD12  LEU  29          2HD1      LEU  29  -0.908  -6.916  -7.342
  205   HD13  LEU  29          3HD1      LEU  29   0.676  -6.471  -6.708
  206   HD21  LEU  29          1HD2      LEU  29  -1.891  -8.414  -3.959
  207   HD22  LEU  29          2HD2      LEU  29  -2.604  -7.936  -5.499
  208   HD23  LEU  29          3HD2      LEU  29  -2.053  -6.705  -4.362
  209    H    ARG  30           HN       ARG  30   2.452 -10.945  -6.070
  210    HA   ARG  30           HA       ARG  30   1.301 -13.198  -7.509
  211    HB2  ARG  30          2HB       ARG  30   4.030 -11.916  -7.522
  212    HB3  ARG  30          3HB       ARG  30   3.685 -13.409  -8.384
  213    HG2  ARG  30          2HG       ARG  30   2.299 -12.364  -9.911
  214    HG3  ARG  30          3HG       ARG  30   2.006 -10.983  -8.850
  215    HD2  ARG  30          2HD       ARG  30   3.441 -10.164 -10.512
  216    HD3  ARG  30          3HD       ARG  30   4.486 -10.462  -9.124
  217    HE   ARG  30           HE       ARG  30   4.689 -12.762 -10.501
  218   HH11  ARG  30          1HH1      ARG  30   4.982  -9.425 -11.448
  219   HH12  ARG  30          2HH1      ARG  30   6.118  -9.748 -12.715
  220   HH21  ARG  30          1HH2      ARG  30   6.183 -13.201 -12.168
  221   HH22  ARG  30          2HH2      ARG  30   6.799 -11.897 -13.124
  222    H    ARG  31           HN       ARG  31   3.281 -12.538  -4.729
  223    HA   ARG  31           HA       ARG  31   4.214 -15.251  -4.448
  224    HB2  ARG  31          2HB       ARG  31   5.244 -12.950  -3.590
  225    HB3  ARG  31          3HB       ARG  31   4.285 -13.336  -2.167
  226    HG2  ARG  31          2HG       ARG  31   5.461 -15.377  -1.832
  227    HG3  ARG  31          3HG       ARG  31   6.275 -15.230  -3.390
  228    HD2  ARG  31          2HD       ARG  31   7.892 -14.539  -1.867
  229    HD3  ARG  31          3HD       ARG  31   7.208 -13.023  -2.453
  230    HE   ARG  31           HE       ARG  31   5.758 -13.677  -0.208
  231   HH11  ARG  31          1HH1      ARG  31   9.099 -13.056  -0.963
  232   HH12  ARG  31          2HH1      ARG  31   9.472 -12.423   0.607
  233   HH21  ARG  31          1HH2      ARG  31   6.236 -12.846   1.862
  234   HH22  ARG  31          2HH2      ARG  31   7.842 -12.306   2.213
  235    H    MET  32           HN       MET  32   1.409 -13.500  -3.604
  236    HA   MET  32           HA       MET  32   0.676 -15.409  -1.507
  237    HB2  MET  32          2HB       MET  32  -0.712 -12.879  -2.408
  238    HB3  MET  32          3HB       MET  32  -1.206 -13.888  -1.055
  239    HG2  MET  32          2HG       MET  32   1.553 -12.764  -1.115
  240    HG3  MET  32          3HG       MET  32   0.199 -11.731  -0.662
  241    HE1  MET  32          1HE       MET  32  -1.774 -13.486   1.092
  242    HE2  MET  32          2HE       MET  32  -1.046 -13.083   2.646
  243    HE3  MET  32          3HE       MET  32  -1.146 -11.862   1.377
  244    H    GLY  33           HN       GLY  33  -0.028 -14.531  -4.786
  245    HA2  GLY  33          1HA       GLY  33  -1.049 -16.050  -6.302
  246    HA3  GLY  33          2HA       GLY  33  -1.878 -16.801  -4.946
  247    H    TYR  34           HN       TYR  34  -1.904 -13.384  -4.965
  248    HA   TYR  34           HA       TYR  34  -4.731 -13.276  -5.143
  249    HB2  TYR  34          2HB       TYR  34  -2.539 -11.241  -5.006
  250    HB3  TYR  34          3HB       TYR  34  -4.171 -10.721  -5.415
  251    HD1  TYR  34          1HD       TYR  34  -5.987 -11.996  -3.756
  252    HD2  TYR  34          2HD       TYR  34  -1.987 -10.904  -2.802
  253    HE1  TYR  34          1HE       TYR  34  -6.575 -11.951  -1.367
  254    HE2  TYR  34          2HE       TYR  34  -2.564 -10.858  -0.411
  255    HH   TYR  34           HH       TYR  34  -5.295 -10.517   0.815
  256    H    ILE  35           HN       ILE  35  -2.528 -11.399  -7.199
  257    HA   ILE  35           HA       ILE  35  -4.425 -11.552  -9.384
  258    HB   ILE  35           HB       ILE  35  -2.953 -10.002 -10.548
  259   HG12  ILE  35          2HG1      ILE  35  -0.995  -9.122  -8.988
  260   HG13  ILE  35          3HG1      ILE  35  -1.080 -10.760  -8.351
  261   HG21  ILE  35          1HG2      ILE  35  -4.520  -9.390  -8.504
  262   HG22  ILE  35          2HG2      ILE  35  -2.986  -8.882  -7.800
  263   HG23  ILE  35          3HG2      ILE  35  -3.537  -8.173  -9.318
  264   HD11  ILE  35          1HD1      ILE  35  -1.080 -11.045 -11.123
  265   HD12  ILE  35          2HD1      ILE  35   0.120  -9.802 -10.771
  266   HD13  ILE  35          3HD1      ILE  35   0.240 -11.386 -10.006
  267    H    GLN  36           HN       GLN  36  -3.869 -12.252 -11.516
  268    HA   GLN  36           HA       GLN  36  -1.492 -13.899 -11.824
  269    HB2  GLN  36          2HB       GLN  36  -4.253 -14.964 -11.616
  270    HB3  GLN  36          3HB       GLN  36  -3.233 -15.650 -12.874
  271    HG2  GLN  36          2HG       GLN  36  -1.708 -16.507 -11.346
  272    HG3  GLN  36          3HG       GLN  36  -2.261 -15.443 -10.054
  273   HE21  GLN  36          1HE2      GLN  36  -2.207 -18.531 -10.967
  274   HE22  GLN  36          2HE2      GLN  36  -3.661 -19.109 -10.234
  275    H    GLY  37           HN       GLY  37  -1.454 -11.753 -13.154
  276    HA2  GLY  37          1HA       GLY  37  -1.255 -12.241 -15.798
  277    HA3  GLY  37          2HA       GLY  37  -2.959 -11.850 -15.624
  278    H    ASP  38           HN       ASP  38  -2.040 -10.169 -17.218
  279    HA   ASP  38           HA       ASP  38  -0.573  -7.986 -16.063
  280    HB2  ASP  38          2HB       ASP  38  -2.131  -7.626 -18.577
  281    HB3  ASP  38          3HB       ASP  38  -0.497  -7.102 -18.183
  282    H    SER  39           HN       SER  39  -1.805  -7.321 -14.287
  283    HA   SER  39           HA       SER  39  -4.446  -6.181 -14.883
  284    HB2  SER  39          2HB       SER  39  -3.860  -7.866 -12.898
  285    HB3  SER  39          3HB       SER  39  -3.436  -6.360 -12.084
  286    HG   SER  39           HG       SER  39  -5.933  -7.122 -13.176
  287    H    ALA  40           HN       ALA  40  -2.289  -4.750 -15.833
  288    HA   ALA  40           HA       ALA  40  -2.751  -2.198 -14.752
  289    HB1  ALA  40          1HB       ALA  40  -1.244  -3.356 -12.985
  290    HB2  ALA  40          2HB       ALA  40   0.051  -3.047 -14.143
  291    HB3  ALA  40          3HB       ALA  40  -0.883  -1.704 -13.484
  292    H    ALA  41           HN       ALA  41  -0.511  -0.811 -15.422
  293    HA   ALA  41           HA       ALA  41  -0.354  -1.297 -18.309
  294    HB1  ALA  41          1HB       ALA  41  -0.814   1.012 -16.835
  295    HB2  ALA  41          2HB       ALA  41   0.839   1.182 -17.427
  296    HB3  ALA  41          3HB       ALA  41  -0.480   0.907 -18.565
  297    H    GLU  42           HN       GLU  42   1.482  -1.605 -15.476
  298    HA   GLU  42           HA       GLU  42   3.756  -1.726 -15.065
  299    HB2  GLU  42          2HB       GLU  42   4.023  -3.459 -17.456
  300    HB3  GLU  42          3HB       GLU  42   4.489  -3.762 -15.788
  301    HG2  GLU  42          2HG       GLU  42   2.235  -4.281 -15.182
  302    HG3  GLU  42          3HG       GLU  42   1.645  -3.781 -16.766
  303    H    VAL  43           HN       VAL  43   3.120   0.519 -16.753
  304    HA   VAL  43           HA       VAL  43   5.364   0.582 -18.642
  305    HB   VAL  43           HB       VAL  43   3.197   1.288 -19.533
  306   HG11  VAL  43          1HG1      VAL  43   3.114   3.807 -18.026
  307   HG12  VAL  43          2HG1      VAL  43   1.802   2.744 -18.539
  308   HG13  VAL  43          3HG1      VAL  43   2.729   2.365 -17.087
  309   HG21  VAL  43          1HG2      VAL  43   3.905   3.586 -20.317
  310   HG22  VAL  43          2HG2      VAL  43   5.301   3.421 -19.253
  311   HG23  VAL  43          3HG2      VAL  43   5.068   2.287 -20.583
  312    H    THR  44           HN       THR  44   4.139   2.066 -15.718
  313    HA   THR  44           HA       THR  44   6.724   3.023 -14.995
  314    HB   THR  44           HB       THR  44   6.011   4.791 -16.621
  315    HG1  THR  44          1HG       THR  44   6.549   5.311 -13.902
  316   HG21  THR  44          1HG2      THR  44   4.141   5.917 -14.620
  317   HG22  THR  44          2HG2      THR  44   3.550   4.566 -15.587
  318   HG23  THR  44          3HG2      THR  44   4.122   6.033 -16.378
  319    H    GLU  45           HN       GLU  45   6.864   3.509 -12.826
  320    HA   GLU  45           HA       GLU  45   4.380   3.140 -11.289
  321    HB2  GLU  45          2HB       GLU  45   7.248   2.495 -10.609
  322    HB3  GLU  45          3HB       GLU  45   5.957   2.483  -9.417
  323    HG2  GLU  45          2HG       GLU  45   5.262   0.477 -10.052
  324    HG3  GLU  45          3HG       GLU  45   5.263   0.932 -11.756
  325    H    MET  46           HN       MET  46   7.387   4.263  -9.921
  326    HA   MET  46           HA       MET  46   7.969   6.177  -8.841
  327    HB2  MET  46          2HB       MET  46   6.041   7.435 -10.801
  328    HB3  MET  46          3HB       MET  46   7.183   8.319  -9.798
  329    HG2  MET  46          2HG       MET  46   8.996   6.939 -10.924
  330    HG3  MET  46          3HG       MET  46   7.755   6.464 -12.081
  331    HE1  MET  46          1HE       MET  46  10.397   9.410 -13.339
  332    HE2  MET  46          2HE       MET  46  10.656   8.234 -12.050
  333    HE3  MET  46          3HE       MET  46  10.042   7.705 -13.618
  334    H    ALA  47           HN       ALA  47   7.260   6.000  -6.792
  335    HA   ALA  47           HA       ALA  47   4.452   6.301  -6.147
  336    HB1  ALA  47          1HB       ALA  47   6.466   6.180  -3.985
  337    HB2  ALA  47          2HB       ALA  47   4.929   5.330  -4.158
  338    HB3  ALA  47          3HB       ALA  47   6.349   4.774  -5.045
  339    H    HIS  48           HN       HIS  48   6.149   8.566  -7.203
  340    HA   HIS  48           HA       HIS  48   5.183  10.555  -5.328
  341    HB2  HIS  48          2HB       HIS  48   7.350  10.237  -4.384
  342    HB3  HIS  48          3HB       HIS  48   8.112  10.218  -5.971
  343    HD1  HIS  48          1HD       HIS  48   9.445  12.272  -6.235
  344    HD2  HIS  48          2HD       HIS  48   5.880  13.004  -4.229
  345    HE1  HIS  48          1HE       HIS  48   9.412  14.750  -5.805
  346    H    THR  49           HN       THR  49   7.754  11.165  -7.610
  347    HA   THR  49           HA       THR  49   6.820  13.293  -8.907
  348    HB   THR  49           HB       THR  49   7.792  12.066 -11.095
  349    HG1  THR  49          1HG       THR  49   9.513  10.768  -9.488
  350   HG21  THR  49          1HG2      THR  49   8.687  14.008  -9.637
  351   HG22  THR  49          2HG2      THR  49   9.828  13.096 -10.624
  352   HG23  THR  49          3HG2      THR  49   9.704  12.773  -8.896
  353    H    GLU  50           HN       GLU  50   5.163  13.874 -10.165
  354    HA   GLU  50           HA       GLU  50   2.861  12.499 -10.506
  355    HB2  GLU  50          2HB       GLU  50   3.815  14.917 -11.395
  356    HB3  GLU  50          3HB       GLU  50   3.522  14.059 -12.901
  357    HG2  GLU  50          2HG       GLU  50   1.275  14.040 -12.621
  358    HG3  GLU  50          3HG       GLU  50   1.382  13.960 -10.864
  359    H    THR  51           HN       THR  51   1.932  11.128 -12.003
  360    HA   THR  51           HA       THR  51   3.055  10.311 -14.430
  361    HB   THR  51           HB       THR  51   3.456   7.847 -13.246
  362    HG1  THR  51          1HG       THR  51   3.551   9.333 -11.238
  363   HG21  THR  51          1HG2      THR  51   5.088   8.160 -14.749
  364   HG22  THR  51          2HG2      THR  51   5.991   8.926 -13.443
  365   HG23  THR  51          3HG2      THR  51   5.040   9.912 -14.553
  366    H    GLY  52           HN       GLY  52   2.246   7.745 -14.726
  367    HA2  GLY  52          1HA       GLY  52  -0.646   7.986 -14.278
  368    HA3  GLY  52          2HA       GLY  52   0.125   6.979 -15.494
  369    H    TRP  53           HN       TRP  53   0.286   7.317 -11.945
  370    HA   TRP  53           HA       TRP  53   0.771   4.536 -11.558
  371    HB2  TRP  53          2HB       TRP  53   0.307   5.113  -9.127
  372    HB3  TRP  53          3HB       TRP  53   1.617   6.004  -9.896
  373    HD1  TRP  53          1HD       TRP  53  -1.558   7.423 -11.077
  374    HE1  TRP  53          1HE       TRP  53  -2.136   9.575  -9.790
  375    HE3  TRP  53          3HE       TRP  53   1.786   6.992  -7.234
  376    HZ2  TRP  53          2HZ       TRP  53  -1.287  10.913  -7.453
  377    HZ3  TRP  53          3HZ       TRP  53   1.839   8.750  -5.514
  378    HH2  TRP  53          2HH       TRP  53   0.334  10.670  -5.624
  379    H    SER  54           HN       SER  54  -0.887   3.379 -12.534
  380    HA   SER  54           HA       SER  54  -3.636   3.868 -11.751
  381    HB2  SER  54          2HB       SER  54  -3.527   1.468 -13.192
  382    HB3  SER  54          3HB       SER  54  -3.958   3.059 -13.818
  383    HG   SER  54           HG       SER  54  -2.281   2.451 -15.056
  384    H    CYS  55           HN       CYS  55  -4.968   2.357 -10.687
  385    HA   CYS  55           HA       CYS  55  -3.785  -0.001  -9.499
  386    HB2  CYS  55          2HB       CYS  55  -5.018   1.883  -7.538
  387    HB3  CYS  55          3HB       CYS  55  -3.810   0.629  -7.279
  388    H    HIS  56           HN       HIS  56  -5.568  -0.783  -7.723
  389    HA   HIS  56           HA       HIS  56  -7.851  -1.434  -9.286
  390    HB2  HIS  56          2HB       HIS  56  -7.355  -1.855  -6.331
  391    HB3  HIS  56          3HB       HIS  56  -8.631  -2.620  -7.273
  392    HD1  HIS  56          1HD       HIS  56  -5.669  -2.521  -9.298
  393    HD2  HIS  56          2HD       HIS  56  -7.080  -4.956  -6.242
  394    HE1  HIS  56          1HE       HIS  56  -4.342  -4.650  -9.468
  395    H    TYR  57           HN       TYR  57  -7.325   0.696  -6.505
  396    HA   TYR  57           HA       TYR  57 -10.091   1.624  -6.665
  397    HB2  TYR  57          2HB       TYR  57  -7.900   2.219  -4.666
  398    HB3  TYR  57          3HB       TYR  57  -9.534   2.871  -4.582
  399    HD1  TYR  57          1HD       TYR  57 -11.465   1.229  -4.352
  400    HD2  TYR  57          2HD       TYR  57  -7.403   0.112  -3.760
  401    HE1  TYR  57          1HE       TYR  57 -12.200  -0.759  -3.103
  402    HE2  TYR  57          2HE       TYR  57  -8.125  -1.879  -2.511
  403    HH   TYR  57           HH       TYR  57 -11.068  -2.279  -1.233
  404    H    CYS  58           HN       CYS  58  -7.009   2.463  -7.781
  405    HA   CYS  58           HA       CYS  58  -6.974   5.230  -7.718
  406    HB2  CYS  58          2HB       CYS  58  -5.515   3.185  -9.009
  407    HB3  CYS  58          3HB       CYS  58  -6.005   4.316 -10.267
  408    H    ASP  59           HN       ASP  59  -7.774   3.463 -10.697
  409    HA   ASP  59           HA       ASP  59  -9.531   3.722 -12.160
  410    HB2  ASP  59          2HB       ASP  59 -10.630   4.751  -9.866
  411    HB3  ASP  59          3HB       ASP  59 -10.704   6.132 -10.958
  412    H    ASN  60           HN       ASN  60  -8.917   7.032 -10.987
  413    HA   ASN  60           HA       ASN  60  -8.449   8.944 -12.161
  414    HB2  ASN  60          2HB       ASN  60  -6.301   7.057 -12.371
  415    HB3  ASN  60          3HB       ASN  60  -6.374   8.007 -13.853
  416   HD21  ASN  60          1HD2      ASN  60  -5.536   7.963 -10.555
  417   HD22  ASN  60          2HD2      ASN  60  -5.002   9.601 -10.428
  Start of MODEL    2
    1    H1   GLU   1           HN       GLU   1   3.024   4.547   6.930
    2    HA   GLU   1           HA       GLU   1   1.009   2.646   5.942
    3    HB2  GLU   1          2HB       GLU   1   2.159   5.176   4.865
    4    HB3  GLU   1          3HB       GLU   1   1.662   3.943   3.714
    5    HG2  GLU   1          2HG       GLU   1   0.046   5.868   4.737
    6    HG3  GLU   1          3HG       GLU   1  -0.505   4.349   4.033
    7    H    MET   2           HN       MET   2   2.058   0.714   5.908
    8    HA   MET   2           HA       MET   2   4.307   0.501   4.039
    9    HB2  MET   2          2HB       MET   2   4.437  -1.292   6.383
   10    HB3  MET   2          3HB       MET   2   5.732  -0.496   5.499
   11    HG2  MET   2          2HG       MET   2   5.432   1.522   6.683
   12    HG3  MET   2          3HG       MET   2   3.896   0.980   7.356
   13    HE1  MET   2          1HE       MET   2   8.114   0.135   8.767
   14    HE2  MET   2          2HE       MET   2   7.656  -0.867   7.390
   15    HE3  MET   2          3HE       MET   2   7.587   0.891   7.262
   16    H    CYS   3           HN       CYS   3   4.409  -1.420   2.887
   17    HA   CYS   3           HA       CYS   3   2.224  -2.658   1.990
   18    HB2  CYS   3          2HB       CYS   3   4.535  -3.111   1.195
   19    HB3  CYS   3          3HB       CYS   3   4.787  -4.146   2.597
   20    H    ASP   4           HN       ASP   4   0.566  -3.667   2.887
   21    HA   ASP   4           HA       ASP   4   0.562  -4.555   5.577
   22    HB2  ASP   4          2HB       ASP   4  -1.425  -3.753   4.160
   23    HB3  ASP   4          3HB       ASP   4  -1.457  -5.387   3.502
   24    H    VAL   5           HN       VAL   5   1.952  -5.928   2.930
   25    HA   VAL   5           HA       VAL   5   1.519  -8.677   3.894
   26    HB   VAL   5           HB       VAL   5   2.553  -7.739   1.214
   27   HG11  VAL   5          1HG1      VAL   5   2.254 -10.179   0.625
   28   HG12  VAL   5          2HG1      VAL   5   3.612  -9.803   1.687
   29   HG13  VAL   5          3HG1      VAL   5   2.131 -10.491   2.355
   30   HG21  VAL   5          1HG2      VAL   5   0.298  -7.341   1.062
   31   HG22  VAL   5          2HG2      VAL   5   0.361  -9.029   0.554
   32   HG23  VAL   5          3HG2      VAL   5  -0.117  -8.622   2.202
   33    H    CYS   6           HN       CYS   6   3.893  -6.201   3.322
   34    HA   CYS   6           HA       CYS   6   6.009  -8.033   4.246
   35    HB2  CYS   6          2HB       CYS   6   6.218  -5.551   2.531
   36    HB3  CYS   6          3HB       CYS   6   7.601  -6.442   3.160
   37    H    GLU   7           HN       GLU   7   4.807  -4.700   4.451
   38    HA   GLU   7           HA       GLU   7   4.727  -3.272   6.239
   39    HB2  GLU   7          2HB       GLU   7   6.257  -5.249   7.909
   40    HB3  GLU   7          3HB       GLU   7   5.117  -4.018   8.435
   41    HG2  GLU   7          2HG       GLU   7   3.306  -5.305   8.000
   42    HG3  GLU   7          3HG       GLU   7   4.079  -6.135   6.651
   43    H    VAL   8           HN       VAL   8   6.540  -2.757   4.396
   44    HA   VAL   8           HA       VAL   8   8.803  -1.741   5.944
   45    HB   VAL   8           HB       VAL   8  10.011  -2.374   3.549
   46   HG11  VAL   8          1HG1      VAL   8  10.876  -2.532   5.899
   47   HG12  VAL   8          2HG1      VAL   8  10.075  -4.099   6.018
   48   HG13  VAL   8          3HG1      VAL   8  11.363  -3.853   4.838
   49   HG21  VAL   8          1HG2      VAL   8   8.017  -3.802   3.036
   50   HG22  VAL   8          2HG2      VAL   8   9.558  -4.661   3.043
   51   HG23  VAL   8          3HG2      VAL   8   8.461  -4.808   4.415
   52    H    TRP   9           HN       TRP   9   8.673   0.386   5.686
   53    HA   TRP   9           HA       TRP   9   7.869   1.449   3.064
   54    HB2  TRP   9          2HB       TRP   9   6.363   2.404   4.519
   55    HB3  TRP   9          3HB       TRP   9   7.500   2.402   5.865
   56    HD1  TRP   9          1HD       TRP   9   8.672   4.637   6.393
   57    HE1  TRP   9          1HE       TRP   9   8.791   6.944   5.259
   58    HE3  TRP   9          3HE       TRP   9   6.347   3.494   1.986
   59    HZ2  TRP   9          2HZ       TRP   9   8.002   8.124   2.818
   60    HZ3  TRP   9          3HZ       TRP   9   6.069   5.269   0.304
   61    HH2  TRP   9          2HH       TRP   9   6.879   7.536   0.714
   62    H    THR  10           HN       THR  10   8.981   3.299   2.226
   63    HA   THR  10           HA       THR  10  11.642   3.795   3.363
   64    HB   THR  10           HB       THR  10  12.183   3.927   0.691
   65    HG1  THR  10          1HG       THR  10  10.800   2.721  -0.345
   66   HG21  THR  10          1HG2      THR  10  13.835   2.704   1.554
   67   HG22  THR  10          2HG2      THR  10  12.791   1.289   1.419
   68   HG23  THR  10          3HG2      THR  10  12.827   2.219   2.916
   69    H    ALA  11           HN       ALA  11  10.479   4.813   0.211
   70    HA   ALA  11           HA       ALA  11   9.308   7.244   0.836
   71    HB1  ALA  11          1HB       ALA  11  12.243   7.276   1.009
   72    HB2  ALA  11          2HB       ALA  11  11.531   8.574   0.051
   73    HB3  ALA  11          3HB       ALA  11  11.048   8.354   1.732
   74    H    GLU  12           HN       GLU  12  11.468   5.520  -1.338
   75    HA   GLU  12           HA       GLU  12  11.315   6.913  -3.664
   76    HB2  GLU  12          2HB       GLU  12  11.307   3.976  -3.093
   77    HB3  GLU  12          3HB       GLU  12  11.108   4.527  -4.750
   78    HG2  GLU  12          2HG       GLU  12  13.429   5.126  -2.932
   79    HG3  GLU  12          3HG       GLU  12  13.423   4.025  -4.308
   80    H    SER  13           HN       SER  13   9.293   4.070  -3.756
   81    HA   SER  13           HA       SER  13   6.835   5.569  -3.985
   82    HB2  SER  13          2HB       SER  13   8.160   5.541  -6.277
   83    HB3  SER  13          3HB       SER  13   7.478   3.919  -6.394
   84    HG   SER  13           HG       SER  13   5.450   5.264  -5.717
   85    H    LEU  14           HN       LEU  14   5.401   4.384  -2.928
   86    HA   LEU  14           HA       LEU  14   5.706   1.462  -2.909
   87    HB2  LEU  14          2HB       LEU  14   5.759   2.501  -0.722
   88    HB3  LEU  14          3HB       LEU  14   4.223   3.305  -1.039
   89    HG   LEU  14           HG       LEU  14   3.156   1.044  -1.141
   90   HD11  LEU  14          1HD1      LEU  14   5.663   0.076  -1.385
   91   HD12  LEU  14          2HD1      LEU  14   4.286  -0.875  -0.829
   92   HD13  LEU  14          3HD1      LEU  14   5.393  -0.159   0.342
   93   HD21  LEU  14          1HD2      LEU  14   4.295   2.358   1.228
   94   HD22  LEU  14          2HD2      LEU  14   3.773   0.691   1.472
   95   HD23  LEU  14          3HD2      LEU  14   2.631   1.896   0.873
   96    H    PHE  15           HN       PHE  15   3.922   0.110  -3.265
   97    HA   PHE  15           HA       PHE  15   1.816   1.346  -4.887
   98    HB2  PHE  15          2HB       PHE  15   2.884  -1.468  -4.715
   99    HB3  PHE  15          3HB       PHE  15   1.379  -1.089  -5.548
  100    HD1  PHE  15          1HD       PHE  15   4.978  -0.155  -5.456
  101    HD2  PHE  15          2HD       PHE  15   1.422  -0.466  -7.775
  102    HE1  PHE  15          1HE       PHE  15   6.253   0.417  -7.481
  103    HE2  PHE  15          2HE       PHE  15   2.691   0.105  -9.804
  104    HZ   PHE  15           HZ       PHE  15   5.110   0.547  -9.659
  105    HA   PRO  16           HA       PRO  16  -0.092   0.283  -5.831
  106    HB2  PRO  16          2HB       PRO  16  -2.493   1.546  -5.721
  107    HB3  PRO  16          3HB       PRO  16  -2.327  -0.210  -5.621
  108    HG2  PRO  16          2HG       PRO  16  -2.695   1.787  -3.422
  109    HG3  PRO  16          3HG       PRO  16  -3.465   0.204  -3.636
  110    HD2  PRO  16          2HD       PRO  16  -1.380   0.595  -1.953
  111    HD3  PRO  16          3HD       PRO  16  -1.637  -0.936  -2.814
  112    H    CYS  17           HN       CYS  17  -1.098   2.832  -3.539
  113    HA   CYS  17           HA       CYS  17   0.740   4.705  -4.752
  114    HB2  CYS  17          2HB       CYS  17  -2.167   5.489  -4.693
  115    HB3  CYS  17          3HB       CYS  17  -0.833   6.294  -5.511
  116    H    ARG  18           HN       ARG  18  -2.256   5.035  -2.852
  117    HA   ARG  18           HA       ARG  18  -1.372   5.129  -0.315
  118    HB2  ARG  18          2HB       ARG  18   0.305   6.690  -0.507
  119    HB3  ARG  18          3HB       ARG  18  -0.514   7.571  -1.788
  120    HG2  ARG  18          2HG       ARG  18  -0.367   8.850   0.302
  121    HG3  ARG  18          3HG       ARG  18  -2.034   8.557  -0.196
  122    HD2  ARG  18          2HD       ARG  18  -2.368   7.819   1.884
  123    HD3  ARG  18          3HD       ARG  18  -1.469   6.384   1.391
  124    HE   ARG  18           HE       ARG  18  -0.537   8.528   3.100
  125   HH11  ARG  18          1HH1      ARG  18   0.304   5.768   1.151
  126   HH12  ARG  18          2HH1      ARG  18   1.822   5.507   1.945
  127   HH21  ARG  18          1HH2      ARG  18   1.459   8.194   4.153
  128   HH22  ARG  18          2HH2      ARG  18   2.477   6.887   3.652
  129    H    VAL  19           HN       VAL  19  -3.333   6.564  -2.766
  130    HA   VAL  19           HA       VAL  19  -5.301   7.490  -0.801
  131    HB   VAL  19           HB       VAL  19  -5.302   9.186  -2.291
  132   HG11  VAL  19          1HG1      VAL  19  -4.524   7.260  -4.479
  133   HG12  VAL  19          2HG1      VAL  19  -4.621   9.015  -4.631
  134   HG13  VAL  19          3HG1      VAL  19  -3.420   8.287  -3.563
  135   HG21  VAL  19          1HG2      VAL  19  -7.132   9.099  -3.753
  136   HG22  VAL  19          2HG2      VAL  19  -6.912   7.377  -4.068
  137   HG23  VAL  19          3HG2      VAL  19  -7.511   7.917  -2.500
  138    H    CYS  20           HN       CYS  20  -5.287   5.634  -3.852
  139    HA   CYS  20           HA       CYS  20  -7.743   4.634  -4.032
  140    HB2  CYS  20          2HB       CYS  20  -6.417   2.304  -4.436
  141    HB3  CYS  20          3HB       CYS  20  -6.487   3.610  -5.614
  142    H    THR  21           HN       THR  21  -5.638   2.219  -2.632
  143    HA   THR  21           HA       THR  21  -7.456   1.976  -0.329
  144    HB   THR  21           HB       THR  21  -7.846  -0.250  -0.631
  145    HG1  THR  21          1HG       THR  21  -6.351  -1.657  -1.621
  146   HG21  THR  21          1HG2      THR  21  -8.571   1.010  -2.701
  147   HG22  THR  21          2HG2      THR  21  -8.373  -0.731  -2.898
  148   HG23  THR  21          3HG2      THR  21  -7.131   0.372  -3.491
  149    H    ARG  22           HN       ARG  22  -6.118  -0.345   0.695
  150    HA   ARG  22           HA       ARG  22  -4.202   0.806   2.329
  151    HB2  ARG  22          2HB       ARG  22  -5.362  -1.733   2.022
  152    HB3  ARG  22          3HB       ARG  22  -3.625  -1.993   1.918
  153    HG2  ARG  22          2HG       ARG  22  -3.251  -1.207   4.071
  154    HG3  ARG  22          3HG       ARG  22  -4.795  -0.354   4.130
  155    HD2  ARG  22          2HD       ARG  22  -6.007  -2.353   4.402
  156    HD3  ARG  22          3HD       ARG  22  -4.633  -3.346   3.917
  157    HE   ARG  22           HE       ARG  22  -3.743  -2.096   6.146
  158   HH11  ARG  22          1HH1      ARG  22  -6.588  -3.966   5.417
  159   HH12  ARG  22          2HH1      ARG  22  -6.757  -4.579   7.030
  160   HH21  ARG  22          1HH2      ARG  22  -3.955  -2.896   8.273
  161   HH22  ARG  22          2HH2      ARG  22  -5.259  -3.968   8.653
  162    H    VAL  23           HN       VAL  23  -1.936  -0.720   2.344
  163    HA   VAL  23           HA       VAL  23  -0.629   0.068  -0.177
  164    HB   VAL  23           HB       VAL  23   1.469   0.225   1.123
  165   HG11  VAL  23          1HG1      VAL  23  -0.722   1.925   2.304
  166   HG12  VAL  23          2HG1      VAL  23   0.991   2.330   2.172
  167   HG13  VAL  23          3HG1      VAL  23   0.001   2.192   0.718
  168   HG21  VAL  23          1HG2      VAL  23   1.315   0.283   3.599
  169   HG22  VAL  23          2HG2      VAL  23  -0.344  -0.303   3.476
  170   HG23  VAL  23          3HG2      VAL  23   0.991  -1.310   2.917
  171    H    PHE  24           HN       PHE  24   0.205  -1.492  -1.393
  172    HA   PHE  24           HA       PHE  24   1.236  -3.924  -0.181
  173    HB2  PHE  24          2HB       PHE  24  -0.160  -5.082  -2.194
  174    HB3  PHE  24          3HB       PHE  24  -0.737  -4.985  -0.534
  175    HD1  PHE  24          1HD       PHE  24  -1.127  -3.736  -3.932
  176    HD2  PHE  24          2HD       PHE  24  -2.463  -3.393   0.094
  177    HE1  PHE  24          1HE       PHE  24  -3.104  -2.488  -4.699
  178    HE2  PHE  24          2HE       PHE  24  -4.443  -2.146  -0.666
  179    HZ   PHE  24           HZ       PHE  24  -4.766  -1.692  -3.065
  180    H    HIS  25           HN       HIS  25   2.447  -5.253  -1.712
  181    HA   HIS  25           HA       HIS  25   3.791  -3.575  -3.675
  182    HB2  HIS  25          2HB       HIS  25   4.438  -6.316  -2.578
  183    HB3  HIS  25          3HB       HIS  25   5.409  -5.488  -3.791
  184    HD2  HIS  25          2HD       HIS  25   4.514  -2.750  -1.501
  185    HE1  HIS  25          1HE       HIS  25   7.934  -4.516   0.282
  186    HE2  HIS  25          2HE       HIS  25   6.354  -2.556   0.306
  187    H    ASP  26           HN       ASP  26   3.592  -3.777  -5.819
  188    HA   ASP  26           HA       ASP  26   1.510  -5.023  -7.068
  189    HB2  ASP  26          2HB       ASP  26   3.037  -4.984  -9.151
  190    HB3  ASP  26          3HB       ASP  26   2.674  -3.453  -8.357
  191    H    GLY  27           HN       GLY  27   4.465  -6.455  -5.969
  192    HA2  GLY  27          1HA       GLY  27   4.018  -8.900  -7.502
  193    HA3  GLY  27          2HA       GLY  27   5.401  -8.555  -6.475
  194    H    CYS  28           HN       CYS  28   3.648  -7.687  -4.251
  195    HA   CYS  28           HA       CYS  28   3.412 -10.196  -2.953
  196    HB2  CYS  28          2HB       CYS  28   2.750  -7.369  -2.262
  197    HB3  CYS  28          3HB       CYS  28   2.050  -8.652  -1.280
  198    H    LEU  29           HN       LEU  29   1.085  -8.019  -4.463
  199    HA   LEU  29           HA       LEU  29  -1.291  -9.158  -3.615
  200    HB2  LEU  29          2HB       LEU  29  -0.649  -7.995  -6.322
  201    HB3  LEU  29          3HB       LEU  29  -2.272  -8.284  -5.697
  202    HG   LEU  29           HG       LEU  29  -0.348  -6.448  -4.300
  203   HD11  LEU  29          1HD1      LEU  29  -1.053  -5.992  -6.863
  204   HD12  LEU  29          2HD1      LEU  29  -0.771  -4.720  -5.675
  205   HD13  LEU  29          3HD1      LEU  29  -2.415  -5.255  -6.020
  206   HD21  LEU  29          1HD2      LEU  29  -2.159  -5.741  -3.090
  207   HD22  LEU  29          2HD2      LEU  29  -2.598  -7.428  -3.356
  208   HD23  LEU  29          3HD2      LEU  29  -3.311  -6.162  -4.357
  209    H    ARG  30           HN       ARG  30   0.884 -10.178  -6.194
  210    HA   ARG  30           HA       ARG  30  -0.866 -12.245  -7.146
  211    HB2  ARG  30          2HB       ARG  30   2.065 -11.706  -7.653
  212    HB3  ARG  30          3HB       ARG  30   1.132 -12.955  -8.466
  213    HG2  ARG  30          2HG       ARG  30  -0.148 -11.406  -9.642
  214    HG3  ARG  30          3HG       ARG  30   0.275 -10.088  -8.547
  215    HD2  ARG  30          2HD       ARG  30   1.459  -9.798 -10.622
  216    HD3  ARG  30          3HD       ARG  30   2.610 -10.226  -9.357
  217    HE   ARG  30           HE       ARG  30   1.907 -12.600 -10.545
  218   HH11  ARG  30          1HH1      ARG  30   3.323  -9.593 -11.579
  219   HH12  ARG  30          2HH1      ARG  30   4.251 -10.317 -12.850
  220   HH21  ARG  30          1HH2      ARG  30   3.124 -13.565 -12.216
  221   HH22  ARG  30          2HH2      ARG  30   4.136 -12.576 -13.214
  222    H    ARG  31           HN       ARG  31   1.973 -12.086  -5.047
  223    HA   ARG  31           HA       ARG  31   2.358 -14.846  -4.716
  224    HB2  ARG  31          2HB       ARG  31   3.529 -12.494  -3.743
  225    HB3  ARG  31          3HB       ARG  31   2.987 -13.363  -2.313
  226    HG2  ARG  31          2HG       ARG  31   4.842 -14.373  -4.456
  227    HG3  ARG  31          3HG       ARG  31   5.248 -13.980  -2.784
  228    HD2  ARG  31          2HD       ARG  31   3.101 -15.972  -3.210
  229    HD3  ARG  31          3HD       ARG  31   4.741 -16.471  -3.622
  230    HE   ARG  31           HE       ARG  31   4.581 -15.253  -1.041
  231   HH11  ARG  31          1HH1      ARG  31   4.097 -18.220  -2.797
  232   HH12  ARG  31          2HH1      ARG  31   4.340 -19.232  -1.412
  233   HH21  ARG  31          1HH2      ARG  31   4.903 -16.575   0.790
  234   HH22  ARG  31          2HH2      ARG  31   4.797 -18.295   0.628
  235    H    MET  32           HN       MET  32   0.220 -12.569  -3.113
  236    HA   MET  32           HA       MET  32  -0.669 -14.580  -1.207
  237    HB2  MET  32          2HB       MET  32  -1.412 -11.684  -1.620
  238    HB3  MET  32          3HB       MET  32  -2.187 -12.716  -0.426
  239    HG2  MET  32          2HG       MET  32   0.783 -12.391  -0.457
  240    HG3  MET  32          3HG       MET  32  -0.250 -11.178   0.295
  241    HE1  MET  32          1HE       MET  32  -1.674 -11.434   2.189
  242    HE2  MET  32          2HE       MET  32  -2.594 -12.906   1.875
  243    HE3  MET  32          3HE       MET  32  -1.669 -12.745   3.369
  244    H    GLY  33           HN       GLY  33  -1.328 -13.875  -4.355
  245    HA2  GLY  33          1HA       GLY  33  -2.984 -14.622  -5.769
  246    HA3  GLY  33          2HA       GLY  33  -3.668 -15.495  -4.405
  247    H    TYR  34           HN       TYR  34  -3.175 -12.111  -4.026
  248    HA   TYR  34           HA       TYR  34  -5.938 -11.645  -3.565
  249    HB2  TYR  34          2HB       TYR  34  -3.500  -9.902  -3.695
  250    HB3  TYR  34          3HB       TYR  34  -5.101  -9.172  -3.613
  251    HD1  TYR  34          1HD       TYR  34  -2.435  -9.822  -1.657
  252    HD2  TYR  34          2HD       TYR  34  -6.604 -10.665  -1.749
  253    HE1  TYR  34          1HE       TYR  34  -2.427 -10.095   0.787
  254    HE2  TYR  34          2HE       TYR  34  -6.608 -10.940   0.695
  255    HH   TYR  34           HH       TYR  34  -3.995  -9.990   2.656
  256    H    ILE  35           HN       ILE  35  -3.794 -11.120  -6.291
  257    HA   ILE  35           HA       ILE  35  -6.136 -10.440  -7.925
  258    HB   ILE  35           HB       ILE  35  -4.972  -8.716  -9.112
  259   HG12  ILE  35          2HG1      ILE  35  -2.653  -8.075  -7.875
  260   HG13  ILE  35          3HG1      ILE  35  -2.629  -9.823  -7.682
  261   HG21  ILE  35          1HG2      ILE  35  -5.271  -7.091  -7.570
  262   HG22  ILE  35          2HG2      ILE  35  -5.901  -8.430  -6.611
  263   HG23  ILE  35          3HG2      ILE  35  -4.241  -7.883  -6.377
  264   HD11  ILE  35          1HD1      ILE  35  -1.866 -10.016  -9.742
  265   HD12  ILE  35          2HD1      ILE  35  -3.349  -9.284 -10.355
  266   HD13  ILE  35          3HD1      ILE  35  -1.963  -8.268  -9.960
  267    H    GLN  36           HN       GLN  36  -5.631 -10.631 -10.302
  268    HA   GLN  36           HA       GLN  36  -3.533 -12.594 -10.871
  269    HB2  GLN  36          2HB       GLN  36  -6.435 -12.912 -11.655
  270    HB3  GLN  36          3HB       GLN  36  -5.120 -13.938 -12.214
  271    HG2  GLN  36          2HG       GLN  36  -5.668 -15.250 -10.503
  272    HG3  GLN  36          3HG       GLN  36  -4.820 -14.068  -9.509
  273   HE21  GLN  36          1HE2      GLN  36  -8.007 -14.313 -11.061
  274   HE22  GLN  36          2HE2      GLN  36  -8.912 -13.870  -9.658
  275    H    GLY  37           HN       GLY  37  -2.698 -10.461 -11.705
  276    HA2  GLY  37          1HA       GLY  37  -3.120 -10.378 -14.553
  277    HA3  GLY  37          2HA       GLY  37  -3.709  -8.944 -13.725
  278    H    ASP  38           HN       ASP  38  -1.847  -8.480 -15.535
  279    HA   ASP  38           HA       ASP  38   0.627  -8.100 -13.978
  280    HB2  ASP  38          2HB       ASP  38   1.084  -9.652 -15.762
  281    HB3  ASP  38          3HB       ASP  38   0.301  -8.602 -16.940
  282    H    SER  39           HN       SER  39   1.558  -6.098 -13.970
  283    HA   SER  39           HA       SER  39   0.025  -3.961 -15.297
  284    HB2  SER  39          2HB       SER  39  -0.144  -3.720 -12.915
  285    HB3  SER  39          3HB       SER  39   1.594  -3.945 -12.712
  286    HG   SER  39           HG       SER  39   0.634  -1.698 -12.724
  287    H    ALA  40           HN       ALA  40   1.238  -2.074 -15.998
  288    HA   ALA  40           HA       ALA  40   4.012  -2.737 -16.748
  289    HB1  ALA  40          1HB       ALA  40   2.171  -2.684 -18.576
  290    HB2  ALA  40          2HB       ALA  40   2.311  -0.932 -18.418
  291    HB3  ALA  40          3HB       ALA  40   3.717  -1.892 -18.880
  292    H    ALA  41           HN       ALA  41   4.492  -0.190 -17.958
  293    HA   ALA  41           HA       ALA  41   5.429   1.807 -17.379
  294    HB1  ALA  41          1HB       ALA  41   3.833   3.290 -16.918
  295    HB2  ALA  41          2HB       ALA  41   2.728   1.919 -16.815
  296    HB3  ALA  41          3HB       ALA  41   3.487   2.552 -15.354
  297    H    GLU  42           HN       GLU  42   7.314   1.351 -16.348
  298    HA   GLU  42           HA       GLU  42   7.389   1.763 -13.499
  299    HB2  GLU  42          2HB       GLU  42   8.107  -0.906 -14.700
  300    HB3  GLU  42          3HB       GLU  42   8.736  -0.374 -13.147
  301    HG2  GLU  42          2HG       GLU  42   6.186   0.027 -12.633
  302    HG3  GLU  42          3HG       GLU  42   5.980  -1.174 -13.907
  303    H    VAL  43           HN       VAL  43   8.556   3.592 -14.405
  304    HA   VAL  43           HA       VAL  43  11.382   2.924 -14.858
  305    HB   VAL  43           HB       VAL  43  10.737   3.474 -17.040
  306   HG11  VAL  43          1HG1      VAL  43   8.522   4.241 -16.753
  307   HG12  VAL  43          2HG1      VAL  43   9.045   5.628 -15.797
  308   HG13  VAL  43          3HG1      VAL  43   9.394   5.564 -17.525
  309   HG21  VAL  43          1HG2      VAL  43  12.577   4.960 -15.812
  310   HG22  VAL  43          2HG2      VAL  43  12.154   5.191 -17.509
  311   HG23  VAL  43          3HG2      VAL  43  11.461   6.244 -16.276
  312    H    THR  44           HN       THR  44  11.935   3.487 -12.766
  313    HA   THR  44           HA       THR  44  12.559   4.844 -11.047
  314    HB   THR  44           HB       THR  44  12.363   7.002 -13.158
  315    HG1  THR  44          1HG       THR  44  13.913   5.101 -13.321
  316   HG21  THR  44          1HG2      THR  44  14.097   8.085 -11.582
  317   HG22  THR  44          2HG2      THR  44  13.447   6.993 -10.360
  318   HG23  THR  44          3HG2      THR  44  12.393   8.173 -11.137
  319    H    GLU  45           HN       GLU  45  11.112   5.019  -9.463
  320    HA   GLU  45           HA       GLU  45   8.802   6.800  -9.874
  321    HB2  GLU  45          2HB       GLU  45   8.972   4.448  -7.986
  322    HB3  GLU  45          3HB       GLU  45   7.556   5.440  -8.300
  323    HG2  GLU  45          2HG       GLU  45   7.367   4.605 -10.520
  324    HG3  GLU  45          3HG       GLU  45   8.923   3.787 -10.405
  325    H    MET  46           HN       MET  46   8.193   8.183  -8.192
  326    HA   MET  46           HA       MET  46  10.002   8.363  -5.893
  327    HB2  MET  46          2HB       MET  46   9.226  10.762  -7.557
  328    HB3  MET  46          3HB       MET  46  10.307  10.741  -6.169
  329    HG2  MET  46          2HG       MET  46  11.281   8.886  -8.086
  330    HG3  MET  46          3HG       MET  46  10.934  10.407  -8.905
  331    HE1  MET  46          1HE       MET  46  11.753  12.520  -8.438
  332    HE2  MET  46          2HE       MET  46  11.946  12.830  -6.713
  333    HE3  MET  46          3HE       MET  46  13.350  12.877  -7.781
  334    H    ALA  47           HN       ALA  47   7.400   7.328  -5.945
  335    HA   ALA  47           HA       ALA  47   5.480   7.418  -4.722
  336    HB1  ALA  47          1HB       ALA  47   7.301   8.858  -3.236
  337    HB2  ALA  47          2HB       ALA  47   5.921   9.949  -3.365
  338    HB3  ALA  47          3HB       ALA  47   5.707   8.330  -2.700
  339    H    HIS  48           HN       HIS  48   6.074  10.910  -5.003
  340    HA   HIS  48           HA       HIS  48   3.802  11.099  -6.856
  341    HB2  HIS  48          2HB       HIS  48   3.069  11.646  -4.533
  342    HB3  HIS  48          3HB       HIS  48   4.246  12.956  -4.509
  343    HD1  HIS  48          1HD       HIS  48   1.731  14.141  -4.037
  344    HD2  HIS  48          2HD       HIS  48   2.748  13.060  -7.917
  345    HE1  HIS  48          1HE       HIS  48   0.223  15.493  -5.528
  346    H    THR  49           HN       THR  49   5.673  11.226  -8.352
  347    HA   THR  49           HA       THR  49   6.145  13.902  -9.132
  348    HB   THR  49           HB       THR  49   8.797  12.761  -8.588
  349    HG1  THR  49          1HG       THR  49   8.532  12.501  -6.513
  350   HG21  THR  49          1HG2      THR  49   8.108  15.096  -9.464
  351   HG22  THR  49          2HG2      THR  49   9.398  14.991  -8.266
  352   HG23  THR  49          3HG2      THR  49   7.770  15.459  -7.772
  353    H    GLU  50           HN       GLU  50   7.210  10.542  -9.290
  354    HA   GLU  50           HA       GLU  50   8.470  10.657 -11.800
  355    HB2  GLU  50          2HB       GLU  50   8.398   8.278 -11.796
  356    HB3  GLU  50          3HB       GLU  50   8.619   8.780 -10.125
  357    HG2  GLU  50          2HG       GLU  50   6.836   7.626  -9.528
  358    HG3  GLU  50          3HG       GLU  50   5.834   8.584 -10.619
  359    H    THR  51           HN       THR  51   7.199   8.621 -13.273
  360    HA   THR  51           HA       THR  51   5.533  10.039 -14.952
  361    HB   THR  51           HB       THR  51   4.696   7.766 -15.729
  362    HG1  THR  51          1HG       THR  51   5.522   5.975 -14.760
  363   HG21  THR  51          1HG2      THR  51   6.620   8.876 -16.756
  364   HG22  THR  51          2HG2      THR  51   6.864   7.129 -16.682
  365   HG23  THR  51          3HG2      THR  51   7.680   8.184 -15.528
  366    H    GLY  52           HN       GLY  52   4.574   7.755 -12.388
  367    HA2  GLY  52          1HA       GLY  52   2.512   9.036 -11.250
  368    HA3  GLY  52          2HA       GLY  52   1.777   8.454 -12.736
  369    H    TRP  53           HN       TRP  53   1.985   7.790  -9.592
  370    HA   TRP  53           HA       TRP  53   2.556   4.999  -9.577
  371    HB2  TRP  53          2HB       TRP  53   1.346   5.137  -7.306
  372    HB3  TRP  53          3HB       TRP  53   2.831   6.062  -7.503
  373    HD1  TRP  53          1HD       TRP  53  -0.035   7.704  -9.218
  374    HE1  TRP  53          1HE       TRP  53  -0.874   9.700  -7.827
  375    HE3  TRP  53          3HE       TRP  53   2.483   6.778  -4.866
  376    HZ2  TRP  53          2HZ       TRP  53  -0.515  10.745  -5.229
  377    HZ3  TRP  53          3HZ       TRP  53   2.181   8.323  -2.977
  378    HH2  TRP  53          2HH       TRP  53   0.713  10.266  -3.156
  379    H    SER  54           HN       SER  54   1.340   3.761 -10.899
  380    HA   SER  54           HA       SER  54  -1.583   4.042 -10.773
  381    HB2  SER  54          2HB       SER  54  -1.365   2.414 -12.822
  382    HB3  SER  54          3HB       SER  54  -1.037   4.134 -13.027
  383    HG   SER  54           HG       SER  54   0.557   2.442 -13.822
  384    H    CYS  55           HN       CYS  55  -2.907   2.210 -10.488
  385    HA   CYS  55           HA       CYS  55  -1.620  -0.276  -9.660
  386    HB2  CYS  55          2HB       CYS  55  -2.804  -0.386  -7.555
  387    HB3  CYS  55          3HB       CYS  55  -1.883   1.114  -7.611
  388    H    HIS  56           HN       HIS  56  -3.170  -2.060  -9.419
  389    HA   HIS  56           HA       HIS  56  -4.745  -2.525 -11.560
  390    HB2  HIS  56          2HB       HIS  56  -4.146  -4.052  -9.533
  391    HB3  HIS  56          3HB       HIS  56  -5.693  -3.511  -8.890
  392    HD1  HIS  56          1HD       HIS  56  -7.828  -4.360 -10.065
  393    HD2  HIS  56          2HD       HIS  56  -4.300  -5.795 -11.722
  394    HE1  HIS  56          1HE       HIS  56  -8.518  -6.232 -11.595
  395    H    TYR  57           HN       TYR  57  -5.877  -1.105  -8.503
  396    HA   TYR  57           HA       TYR  57  -8.263  -0.145  -9.944
  397    HB2  TYR  57          2HB       TYR  57  -9.010  -0.064  -7.320
  398    HB3  TYR  57          3HB       TYR  57  -9.380  -1.385  -8.423
  399    HD1  TYR  57          1HD       TYR  57  -6.318  -0.378  -6.519
  400    HD2  TYR  57          2HD       TYR  57  -9.166  -3.422  -7.373
  401    HE1  TYR  57          1HE       TYR  57  -5.087  -1.931  -5.062
  402    HE2  TYR  57          2HE       TYR  57  -7.943  -4.982  -5.917
  403    HH   TYR  57           HH       TYR  57  -6.358  -4.802  -3.944
  404    H    CYS  58           HN       CYS  58  -6.632   1.624 -10.427
  405    HA   CYS  58           HA       CYS  58  -6.109   3.450  -8.233
  406    HB2  CYS  58          2HB       CYS  58  -4.940   2.937 -10.772
  407    HB3  CYS  58          3HB       CYS  58  -5.495   4.607 -10.774
  408    H    ASP  59           HN       ASP  59  -7.391   4.080 -11.492
  409    HA   ASP  59           HA       ASP  59  -9.258   6.007 -10.291
  410    HB2  ASP  59          2HB       ASP  59  -7.729   5.924 -12.814
  411    HB3  ASP  59          3HB       ASP  59  -9.383   6.514 -12.962
  412    H    ASN  60           HN       ASN  60  -9.357   2.921 -10.987
  413    HA   ASN  60           HA       ASN  60 -12.013   3.031 -12.261
  414    HB2  ASN  60          2HB       ASN  60  -9.891   1.725 -13.271
  415    HB3  ASN  60          3HB       ASN  60 -10.519   0.465 -12.213
  416   HD21  ASN  60          1HD2      ASN  60 -11.128  -0.851 -13.904
  417   HD22  ASN  60          2HD2      ASN  60 -12.468  -0.488 -14.932
  Start of MODEL    3
    1    H1   GLU   1           HN       GLU   1   2.518   4.344   5.182
    2    HA   GLU   1           HA       GLU   1   0.694   2.639   3.625
    3    HB2  GLU   1          2HB       GLU   1   3.010   4.383   2.854
    4    HB3  GLU   1          3HB       GLU   1   2.533   3.042   1.820
    5    HG2  GLU   1          2HG       GLU   1   1.318   4.714   0.879
    6    HG3  GLU   1          3HG       GLU   1   0.153   4.127   2.064
    7    H    MET   2           HN       MET   2   1.473   1.174   5.564
    8    HA   MET   2           HA       MET   2   4.009  -0.134   4.923
    9    HB2  MET   2          2HB       MET   2   2.239  -0.949   7.198
   10    HB3  MET   2          3HB       MET   2   3.990  -1.043   7.065
   11    HG2  MET   2          2HG       MET   2   3.313   1.683   6.898
   12    HG3  MET   2          3HG       MET   2   2.370   1.001   8.222
   13    HE1  MET   2          1HE       MET   2   5.717   1.097   6.521
   14    HE2  MET   2          2HE       MET   2   6.917   1.135   7.813
   15    HE3  MET   2          3HE       MET   2   6.179  -0.396   7.338
   16    H    CYS   3           HN       CYS   3   3.884  -1.650   3.402
   17    HA   CYS   3           HA       CYS   3   1.792  -2.898   2.283
   18    HB2  CYS   3          2HB       CYS   3   4.167  -3.235   1.630
   19    HB3  CYS   3          3HB       CYS   3   4.363  -4.324   2.998
   20    H    ASP   4           HN       ASP   4   0.263  -4.340   2.792
   21    HA   ASP   4           HA       ASP   4  -0.012  -5.201   5.509
   22    HB2  ASP   4          2HB       ASP   4  -1.827  -4.621   3.654
   23    HB3  ASP   4          3HB       ASP   4  -1.714  -6.351   3.348
   24    H    VAL   5           HN       VAL   5   1.984  -6.309   3.249
   25    HA   VAL   5           HA       VAL   5   1.777  -9.090   4.196
   26    HB   VAL   5           HB       VAL   5   2.585  -8.198   1.425
   27   HG11  VAL   5          1HG1      VAL   5   2.442 -10.787   1.107
   28   HG12  VAL   5          2HG1      VAL   5   3.909 -10.054   1.759
   29   HG13  VAL   5          3HG1      VAL   5   2.746 -10.819   2.844
   30   HG21  VAL   5          1HG2      VAL   5   0.183  -9.756   2.377
   31   HG22  VAL   5          2HG2      VAL   5   0.176  -8.096   1.783
   32   HG23  VAL   5          3HG2      VAL   5   0.591  -9.420   0.694
   33    H    CYS   6           HN       CYS   6   3.580  -6.324   4.174
   34    HA   CYS   6           HA       CYS   6   5.990  -7.800   4.928
   35    HB2  CYS   6          2HB       CYS   6   6.017  -5.466   3.002
   36    HB3  CYS   6          3HB       CYS   6   7.431  -6.311   3.625
   37    H    GLU   7           HN       GLU   7   4.229  -4.747   4.847
   38    HA   GLU   7           HA       GLU   7   4.041  -3.067   6.372
   39    HB2  GLU   7          2HB       GLU   7   5.593  -4.842   8.258
   40    HB3  GLU   7          3HB       GLU   7   4.554  -3.492   8.686
   41    HG2  GLU   7          2HG       GLU   7   2.607  -4.670   8.171
   42    HG3  GLU   7          3HG       GLU   7   3.482  -5.884   7.239
   43    H    VAL   8           HN       VAL   8   5.760  -2.385   4.628
   44    HA   VAL   8           HA       VAL   8   7.768  -0.910   6.051
   45    HB   VAL   8           HB       VAL   8   9.494  -1.897   4.229
   46   HG11  VAL   8          1HG1      VAL   8   9.064  -2.109   7.048
   47   HG12  VAL   8          2HG1      VAL   8   9.736  -3.624   6.441
   48   HG13  VAL   8          3HG1      VAL   8  10.583  -2.104   6.153
   49   HG21  VAL   8          1HG2      VAL   8   7.793  -4.247   5.059
   50   HG22  VAL   8          2HG2      VAL   8   7.907  -3.581   3.430
   51   HG23  VAL   8          3HG2      VAL   8   9.318  -4.331   4.176
   52    H    TRP   9           HN       TRP   9   7.632   1.032   5.163
   53    HA   TRP   9           HA       TRP   9   6.890   1.268   2.337
   54    HB2  TRP   9          2HB       TRP   9   5.457   2.698   3.389
   55    HB3  TRP   9          3HB       TRP   9   6.553   2.970   4.741
   56    HD1  TRP   9          1HD       TRP   9   8.230   5.011   4.573
   57    HE1  TRP   9          1HE       TRP   9   8.381   7.023   2.975
   58    HE3  TRP   9          3HE       TRP   9   5.059   3.378   0.910
   59    HZ2  TRP   9          2HZ       TRP   9   7.298   7.814   0.492
   60    HZ3  TRP   9          3HZ       TRP   9   4.670   4.823  -1.043
   61    HH2  TRP   9          2HH       TRP   9   5.767   6.995  -1.246
   62    H    THR  10           HN       THR  10   7.925   3.103   1.126
   63    HA   THR  10           HA       THR  10  10.698   3.602   1.923
   64    HB   THR  10           HB       THR  10  11.204   3.222  -0.645
   65    HG1  THR  10          1HG       THR  10   8.742   2.388  -0.539
   66   HG21  THR  10          1HG2      THR  10  12.331   1.332  -0.026
   67   HG22  THR  10          2HG2      THR  10  10.962   0.679   0.873
   68   HG23  THR  10          3HG2      THR  10  11.945   1.964   1.573
   69    H    ALA  11           HN       ALA  11   9.482   4.121  -1.303
   70    HA   ALA  11           HA       ALA  11   8.267   6.536  -1.255
   71    HB1  ALA  11          1HB       ALA  11   9.704   7.944  -0.287
   72    HB2  ALA  11          2HB       ALA  11  11.052   6.816  -0.445
   73    HB3  ALA  11          3HB       ALA  11  10.612   7.860  -1.798
   74    H    GLU  12           HN       GLU  12  10.955   4.802  -2.740
   75    HA   GLU  12           HA       GLU  12  11.251   5.818  -5.190
   76    HB2  GLU  12          2HB       GLU  12  10.649   2.884  -5.013
   77    HB3  GLU  12          3HB       GLU  12  11.863   3.707  -5.982
   78    HG2  GLU  12          2HG       GLU  12  12.775   4.344  -3.564
   79    HG3  GLU  12          3HG       GLU  12  11.952   2.839  -3.158
   80    H    SER  13           HN       SER  13   8.803   3.265  -4.762
   81    HA   SER  13           HA       SER  13   6.683   4.735  -5.915
   82    HB2  SER  13          2HB       SER  13   8.067   4.461  -7.957
   83    HB3  SER  13          3HB       SER  13   7.978   2.711  -7.758
   84    HG   SER  13           HG       SER  13   6.176   2.834  -8.814
   85    H    LEU  14           HN       LEU  14   6.115   3.639  -3.822
   86    HA   LEU  14           HA       LEU  14   5.586   0.798  -3.964
   87    HB2  LEU  14          2HB       LEU  14   5.973   2.670  -1.915
   88    HB3  LEU  14          3HB       LEU  14   4.303   2.129  -1.757
   89    HG   LEU  14           HG       LEU  14   6.676   0.269  -1.846
   90   HD11  LEU  14          1HD1      LEU  14   6.852   1.661   0.121
   91   HD12  LEU  14          2HD1      LEU  14   6.333   0.040   0.583
   92   HD13  LEU  14          3HD1      LEU  14   5.162   1.357   0.524
   93   HD21  LEU  14          1HD2      LEU  14   4.993  -1.155  -2.308
   94   HD22  LEU  14          2HD2      LEU  14   3.753  -0.058  -1.700
   95   HD23  LEU  14          3HD2      LEU  14   4.690  -1.042  -0.574
   96    H    PHE  15           HN       PHE  15   3.715  -0.141  -4.498
   97    HA   PHE  15           HA       PHE  15   1.535   1.530  -5.411
   98    HB2  PHE  15          2HB       PHE  15   2.037  -1.445  -5.505
   99    HB3  PHE  15          3HB       PHE  15   0.534  -0.717  -6.061
  100    HD1  PHE  15          1HD       PHE  15   4.205  -0.190  -6.494
  101    HD2  PHE  15          2HD       PHE  15   0.358  -0.338  -8.311
  102    HE1  PHE  15          1HE       PHE  15   5.229   0.232  -8.691
  103    HE2  PHE  15          2HE       PHE  15   1.376   0.083 -10.509
  104    HZ   PHE  15           HZ       PHE  15   3.815   0.367 -10.703
  105    HA   PRO  16           HA       PRO  16  -0.684   0.880  -5.978
  106    HB2  PRO  16          2HB       PRO  16  -2.741   2.541  -5.360
  107    HB3  PRO  16          3HB       PRO  16  -2.887   0.779  -5.336
  108    HG2  PRO  16          2HG       PRO  16  -2.449   2.673  -3.061
  109    HG3  PRO  16          3HG       PRO  16  -3.525   1.268  -3.154
  110    HD2  PRO  16          2HD       PRO  16  -1.120   1.181  -1.914
  111    HD3  PRO  16          3HD       PRO  16  -1.817  -0.225  -2.744
  112    H    CYS  17           HN       CYS  17  -0.736   3.424  -3.471
  113    HA   CYS  17           HA       CYS  17   1.296   4.970  -4.648
  114    HB2  CYS  17          2HB       CYS  17  -0.134   6.900  -5.402
  115    HB3  CYS  17          3HB       CYS  17  -0.224   5.471  -6.426
  116    H    ARG  18           HN       ARG  18  -1.791   5.312  -2.907
  117    HA   ARG  18           HA       ARG  18  -0.919   5.739  -0.396
  118    HB2  ARG  18          2HB       ARG  18   0.382   7.571  -0.486
  119    HB3  ARG  18          3HB       ARG  18  -0.207   8.014  -2.083
  120    HG2  ARG  18          2HG       ARG  18  -0.666   9.728  -0.383
  121    HG3  ARG  18          3HG       ARG  18  -2.136   9.090  -1.121
  122    HD2  ARG  18          2HD       ARG  18  -2.889   8.714   0.939
  123    HD3  ARG  18          3HD       ARG  18  -1.682   7.435   1.060
  124    HE   ARG  18           HE       ARG  18  -0.437   8.775   2.448
  125   HH11  ARG  18          1HH1      ARG  18  -2.933  10.668   0.930
  126   HH12  ARG  18          2HH1      ARG  18  -2.663  12.060   1.924
  127   HH21  ARG  18          1HH2      ARG  18  -0.072  10.603   3.764
  128   HH22  ARG  18          2HH2      ARG  18  -1.035  12.022   3.535
  129    H    VAL  19           HN       VAL  19  -2.890   7.614  -2.700
  130    HA   VAL  19           HA       VAL  19  -5.020   7.988  -0.822
  131    HB   VAL  19           HB       VAL  19  -5.109   8.350  -3.820
  132   HG11  VAL  19          1HG1      VAL  19  -6.881   9.192  -1.557
  133   HG12  VAL  19          2HG1      VAL  19  -6.833  10.116  -3.058
  134   HG13  VAL  19          3HG1      VAL  19  -7.310   8.418  -3.082
  135   HG21  VAL  19          1HG2      VAL  19  -4.036  10.078  -1.633
  136   HG22  VAL  19          2HG2      VAL  19  -3.388   9.773  -3.245
  137   HG23  VAL  19          3HG2      VAL  19  -4.789  10.825  -3.043
  138    H    CYS  20           HN       CYS  20  -4.593   5.981  -3.727
  139    HA   CYS  20           HA       CYS  20  -6.940   4.780  -4.105
  140    HB2  CYS  20          2HB       CYS  20  -4.159   3.775  -4.186
  141    HB3  CYS  20          3HB       CYS  20  -5.415   2.542  -4.162
  142    H    THR  21           HN       THR  21  -4.683   3.056  -1.972
  143    HA   THR  21           HA       THR  21  -6.313   2.962   0.299
  144    HB   THR  21           HB       THR  21  -7.803   1.658  -1.248
  145    HG1  THR  21          1HG       THR  21  -8.151   0.011   0.331
  146   HG21  THR  21          1HG2      THR  21  -5.364   0.290  -1.786
  147   HG22  THR  21          2HG2      THR  21  -6.950   0.038  -2.514
  148   HG23  THR  21          3HG2      THR  21  -6.494  -0.854  -1.063
  149    H    ARG  22           HN       ARG  22  -5.777   0.164   0.950
  150    HA   ARG  22           HA       ARG  22  -3.437   0.300   2.306
  151    HB2  ARG  22          2HB       ARG  22  -4.957  -1.980   1.136
  152    HB3  ARG  22          3HB       ARG  22  -3.354  -2.305   1.783
  153    HG2  ARG  22          2HG       ARG  22  -4.440  -0.859   3.801
  154    HG3  ARG  22          3HG       ARG  22  -5.862  -1.689   3.169
  155    HD2  ARG  22          2HD       ARG  22  -5.128  -3.728   3.824
  156    HD3  ARG  22          3HD       ARG  22  -3.438  -3.336   3.509
  157    HE   ARG  22           HE       ARG  22  -3.228  -2.837   5.717
  158   HH11  ARG  22          1HH1      ARG  22  -6.579  -2.498   4.832
  159   HH12  ARG  22          2HH1      ARG  22  -7.102  -2.134   6.444
  160   HH21  ARG  22          1HH2      ARG  22  -3.905  -2.359   7.842
  161   HH22  ARG  22          2HH2      ARG  22  -5.580  -2.055   8.155
  162    H    VAL  23           HN       VAL  23  -1.364  -0.903   1.933
  163    HA   VAL  23           HA       VAL  23  -0.399  -0.327  -0.783
  164    HB   VAL  23           HB       VAL  23   0.989   0.883   0.592
  165   HG11  VAL  23          1HG1      VAL  23   0.519  -1.291   2.590
  166   HG12  VAL  23          2HG1      VAL  23   1.895  -0.200   2.774
  167   HG13  VAL  23          3HG1      VAL  23   0.253   0.446   2.739
  168   HG21  VAL  23          1HG2      VAL  23   3.074  -0.027   0.343
  169   HG22  VAL  23          2HG2      VAL  23   2.570  -1.619   0.913
  170   HG23  VAL  23          3HG2      VAL  23   2.151  -1.091  -0.717
  171    H    PHE  24           HN       PHE  24   0.444  -1.881  -2.052
  172    HA   PHE  24           HA       PHE  24   0.972  -4.522  -0.885
  173    HB2  PHE  24          2HB       PHE  24  -0.195  -4.702  -3.548
  174    HB3  PHE  24          3HB       PHE  24  -0.611  -5.579  -2.079
  175    HD1  PHE  24          1HD       PHE  24  -1.378  -2.723  -4.199
  176    HD2  PHE  24          2HD       PHE  24  -2.305  -4.716  -0.554
  177    HE1  PHE  24          1HE       PHE  24  -3.458  -1.421  -4.020
  178    HE2  PHE  24          2HE       PHE  24  -4.386  -3.418  -0.369
  179    HZ   PHE  24           HZ       PHE  24  -4.966  -1.768  -2.103
  180    H    HIS  25           HN       HIS  25   2.503  -5.778  -1.987
  181    HA   HIS  25           HA       HIS  25   4.283  -4.216  -3.703
  182    HB2  HIS  25          2HB       HIS  25   4.695  -6.810  -2.206
  183    HB3  HIS  25          3HB       HIS  25   5.906  -6.076  -3.253
  184    HD2  HIS  25          2HD       HIS  25   4.296  -3.275  -1.355
  185    HE1  HIS  25          1HE       HIS  25   7.577  -4.521   1.029
  186    HE2  HIS  25          2HE       HIS  25   5.787  -2.780   0.700
  187    H    ASP  26           HN       ASP  26   4.426  -4.558  -5.818
  188    HA   ASP  26           HA       ASP  26   2.763  -5.955  -7.389
  189    HB2  ASP  26          2HB       ASP  26   4.427  -4.491  -8.347
  190    HB3  ASP  26          3HB       ASP  26   5.727  -5.565  -7.838
  191    H    GLY  27           HN       GLY  27   5.365  -7.311  -5.511
  192    HA2  GLY  27          1HA       GLY  27   5.126  -9.914  -6.801
  193    HA3  GLY  27          2HA       GLY  27   6.258  -9.480  -5.528
  194    H    CYS  28           HN       CYS  28   4.414  -8.422  -3.672
  195    HA   CYS  28           HA       CYS  28   3.666 -10.716  -2.279
  196    HB2  CYS  28          2HB       CYS  28   2.920  -7.819  -2.045
  197    HB3  CYS  28          3HB       CYS  28   2.124  -9.016  -1.030
  198    H    LEU  29           HN       LEU  29   1.533  -8.400  -3.959
  199    HA   LEU  29           HA       LEU  29  -0.878  -9.649  -3.631
  200    HB2  LEU  29          2HB       LEU  29   0.078  -8.322  -6.162
  201    HB3  LEU  29          3HB       LEU  29  -1.602  -8.585  -5.695
  202    HG   LEU  29           HG       LEU  29   0.239  -6.901  -4.024
  203   HD11  LEU  29          1HD1      LEU  29   0.367  -5.389  -5.642
  204   HD12  LEU  29          2HD1      LEU  29  -1.381  -5.191  -5.511
  205   HD13  LEU  29          3HD1      LEU  29  -0.707  -6.324  -6.684
  206   HD21  LEU  29          1HD2      LEU  29  -2.681  -7.427  -4.212
  207   HD22  LEU  29          2HD2      LEU  29  -2.150  -5.818  -3.721
  208   HD23  LEU  29          3HD2      LEU  29  -1.654  -7.234  -2.792
  209    H    ARG  30           HN       ARG  30   1.528 -10.311  -6.157
  210    HA   ARG  30           HA       ARG  30   0.029 -12.315  -7.469
  211    HB2  ARG  30          2HB       ARG  30   2.880 -11.442  -7.478
  212    HB3  ARG  30          3HB       ARG  30   2.492 -13.009  -8.174
  213    HG2  ARG  30          2HG       ARG  30   1.410 -12.111  -9.949
  214    HG3  ARG  30          3HG       ARG  30   0.828 -10.720  -9.031
  215    HD2  ARG  30          2HD       ARG  30   2.500  -9.473  -9.793
  216    HD3  ARG  30          3HD       ARG  30   3.681 -10.628  -9.181
  217    HE   ARG  30           HE       ARG  30   2.946 -10.249 -11.882
  218   HH11  ARG  30          1HH1      ARG  30   3.744 -12.749  -9.595
  219   HH12  ARG  30          2HH1      ARG  30   4.357 -13.835 -10.797
  220   HH21  ARG  30          1HH2      ARG  30   3.750 -11.670 -13.475
  221   HH22  ARG  30          2HH2      ARG  30   4.360 -13.220 -13.004
  222    H    ARG  31           HN       ARG  31   2.699 -12.535  -5.123
  223    HA   ARG  31           HA       ARG  31   2.534 -15.376  -4.912
  224    HB2  ARG  31          2HB       ARG  31   4.127 -13.217  -3.721
  225    HB3  ARG  31          3HB       ARG  31   3.826 -14.564  -2.632
  226    HG2  ARG  31          2HG       ARG  31   4.937 -14.904  -5.404
  227    HG3  ARG  31          3HG       ARG  31   5.941 -14.699  -3.968
  228    HD2  ARG  31          2HD       ARG  31   4.267 -16.675  -3.160
  229    HD3  ARG  31          3HD       ARG  31   4.395 -17.024  -4.884
  230    HE   ARG  31           HE       ARG  31   6.963 -16.577  -3.817
  231   HH11  ARG  31          1HH1      ARG  31   4.384 -18.916  -3.776
  232   HH12  ARG  31          2HH1      ARG  31   5.435 -20.263  -3.483
  233   HH21  ARG  31          1HH2      ARG  31   8.356 -18.341  -3.431
  234   HH22  ARG  31          2HH2      ARG  31   7.694 -19.934  -3.286
  235    H    MET  32           HN       MET  32   0.412 -13.095  -3.951
  236    HA   MET  32           HA       MET  32  -0.434 -14.653  -1.596
  237    HB2  MET  32          2HB       MET  32  -0.662 -11.705  -2.171
  238    HB3  MET  32          3HB       MET  32  -1.646 -12.495  -0.947
  239    HG2  MET  32          2HG       MET  32   1.355 -12.310  -1.008
  240    HG3  MET  32          3HG       MET  32   0.260 -11.470   0.087
  241    HE1  MET  32          1HE       MET  32  -0.855 -12.161   1.787
  242    HE2  MET  32          2HE       MET  32  -1.383 -13.811   2.114
  243    HE3  MET  32          3HE       MET  32   0.039 -13.162   2.933
  244    H    GLY  33           HN       GLY  33  -1.218 -13.596  -4.735
  245    HA2  GLY  33          1HA       GLY  33  -3.011 -14.200  -6.064
  246    HA3  GLY  33          2HA       GLY  33  -3.702 -15.040  -4.682
  247    H    TYR  34           HN       TYR  34  -2.903 -11.910  -3.823
  248    HA   TYR  34           HA       TYR  34  -5.508 -11.112  -3.289
  249    HB2  TYR  34          2HB       TYR  34  -2.862  -9.852  -3.297
  250    HB3  TYR  34          3HB       TYR  34  -4.177  -8.724  -3.606
  251    HD1  TYR  34          1HD       TYR  34  -6.283  -9.155  -1.949
  252    HD2  TYR  34          2HD       TYR  34  -2.217 -10.075  -1.100
  253    HE1  TYR  34          1HE       TYR  34  -6.771  -9.057   0.459
  254    HE2  TYR  34          2HE       TYR  34  -2.693  -9.980   1.310
  255    HH   TYR  34           HH       TYR  34  -4.351  -8.942   2.819
  256    H    ILE  35           HN       ILE  35  -3.633 -10.843  -6.211
  257    HA   ILE  35           HA       ILE  35  -5.668  -9.147  -7.456
  258    HB   ILE  35           HB       ILE  35  -4.119  -8.996  -9.361
  259   HG12  ILE  35          2HG1      ILE  35  -1.970 -10.320  -7.765
  260   HG13  ILE  35          3HG1      ILE  35  -3.103 -11.339  -8.647
  261   HG21  ILE  35          1HG2      ILE  35  -3.363  -8.199  -6.612
  262   HG22  ILE  35          2HG2      ILE  35  -2.143  -8.005  -7.870
  263   HG23  ILE  35          3HG2      ILE  35  -3.707  -7.206  -8.029
  264   HD11  ILE  35          1HD1      ILE  35  -1.143 -10.962  -9.979
  265   HD12  ILE  35          2HD1      ILE  35  -2.515 -10.134 -10.715
  266   HD13  ILE  35          3HD1      ILE  35  -1.316  -9.215  -9.806
  267    H    GLN  36           HN       GLN  36  -6.101  -9.751  -9.845
  268    HA   GLN  36           HA       GLN  36  -6.778 -12.614  -9.922
  269    HB2  GLN  36          2HB       GLN  36  -8.732 -11.149  -9.900
  270    HB3  GLN  36          3HB       GLN  36  -8.114 -10.276 -11.297
  271    HG2  GLN  36          2HG       GLN  36  -8.192 -12.526 -12.506
  272    HG3  GLN  36          3HG       GLN  36  -9.196 -13.064 -11.160
  273   HE21  GLN  36          1HE2      GLN  36  -9.112 -11.442 -14.119
  274   HE22  GLN  36          2HE2      GLN  36 -10.740 -10.862 -14.130
  275    H    GLY  37           HN       GLY  37  -5.696  -9.891 -11.928
  276    HA2  GLY  37          1HA       GLY  37  -3.647 -10.854 -13.275
  277    HA3  GLY  37          2HA       GLY  37  -4.941 -11.748 -14.059
  278    H    ASP  38           HN       ASP  38  -5.074  -8.416 -12.903
  279    HA   ASP  38           HA       ASP  38  -5.186  -7.502 -15.698
  280    HB2  ASP  38          2HB       ASP  38  -6.863  -5.955 -13.865
  281    HB3  ASP  38          3HB       ASP  38  -7.230  -6.583 -15.470
  282    H    SER  39           HN       SER  39  -3.054  -6.758 -15.543
  283    HA   SER  39           HA       SER  39  -2.804  -4.194 -14.181
  284    HB2  SER  39          2HB       SER  39  -0.953  -4.712 -12.886
  285    HB3  SER  39          3HB       SER  39  -1.870  -6.214 -12.772
  286    HG   SER  39           HG       SER  39   0.585  -5.922 -13.632
  287    H    ALA  40           HN       ALA  40  -2.011  -2.765 -15.563
  288    HA   ALA  40           HA       ALA  40  -0.034  -3.633 -17.551
  289    HB1  ALA  40          1HB       ALA  40  -2.224  -1.757 -18.356
  290    HB2  ALA  40          2HB       ALA  40  -1.159  -2.730 -19.371
  291    HB3  ALA  40          3HB       ALA  40  -2.449  -3.504 -18.450
  292    H    ALA  41           HN       ALA  41  -0.111  -1.049 -18.880
  293    HA   ALA  41           HA       ALA  41   0.925   0.975 -18.783
  294    HB1  ALA  41          1HB       ALA  41  -0.513   0.819 -16.191
  295    HB2  ALA  41          2HB       ALA  41   0.679   2.103 -16.400
  296    HB3  ALA  41          3HB       ALA  41  -0.680   1.974 -17.515
  297    H    GLU  42           HN       GLU  42   3.067   0.839 -18.989
  298    HA   GLU  42           HA       GLU  42   4.645   0.121 -16.606
  299    HB2  GLU  42          2HB       GLU  42   5.859  -0.194 -19.295
  300    HB3  GLU  42          3HB       GLU  42   6.072  -1.163 -17.844
  301    HG2  GLU  42          2HG       GLU  42   3.527  -1.767 -18.395
  302    HG3  GLU  42          3HG       GLU  42   4.101  -1.415 -20.024
  303    H    VAL  43           HN       VAL  43   3.708   2.762 -17.447
  304    HA   VAL  43           HA       VAL  43   5.637   4.290 -18.740
  305    HB   VAL  43           HB       VAL  43   3.644   4.996 -16.600
  306   HG11  VAL  43          1HG1      VAL  43   5.597   6.828 -17.984
  307   HG12  VAL  43          2HG1      VAL  43   4.167   7.382 -17.111
  308   HG13  VAL  43          3HG1      VAL  43   5.451   6.530 -16.252
  309   HG21  VAL  43          1HG2      VAL  43   2.258   5.502 -18.288
  310   HG22  VAL  43          2HG2      VAL  43   3.532   6.274 -19.232
  311   HG23  VAL  43          3HG2      VAL  43   3.345   4.520 -19.271
  312    H    THR  44           HN       THR  44   5.171   4.115 -15.205
  313    HA   THR  44           HA       THR  44   7.705   3.496 -14.404
  314    HB   THR  44           HB       THR  44   7.532   6.310 -15.316
  315    HG1  THR  44          1HG       THR  44   9.416   4.228 -15.171
  316   HG21  THR  44          1HG2      THR  44   9.373   6.864 -13.608
  317   HG22  THR  44          2HG2      THR  44   8.738   5.502 -12.685
  318   HG23  THR  44          3HG2      THR  44   7.701   6.881 -13.050
  319    H    GLU  45           HN       GLU  45   5.278   6.027 -13.790
  320    HA   GLU  45           HA       GLU  45   4.083   6.568 -11.932
  321    HB2  GLU  45          2HB       GLU  45   4.882   3.786 -11.059
  322    HB3  GLU  45          3HB       GLU  45   3.680   4.784 -10.254
  323    HG2  GLU  45          2HG       GLU  45   2.802   4.786 -12.845
  324    HG3  GLU  45          3HG       GLU  45   3.462   3.162 -12.663
  325    H    MET  46           HN       MET  46   4.352   7.460  -9.865
  326    HA   MET  46           HA       MET  46   6.909   7.098  -8.521
  327    HB2  MET  46          2HB       MET  46   5.991   9.691  -9.740
  328    HB3  MET  46          3HB       MET  46   7.103   9.661  -8.379
  329    HG2  MET  46          2HG       MET  46   8.133   7.854 -10.255
  330    HG3  MET  46          3HG       MET  46   7.626   9.274 -11.167
  331    HE1  MET  46          1HE       MET  46  11.571   8.829  -9.430
  332    HE2  MET  46          2HE       MET  46  10.303   7.623  -9.215
  333    HE3  MET  46          3HE       MET  46  10.723   8.183 -10.834
  334    H    ALA  47           HN       ALA  47   4.356   6.299  -7.725
  335    HA   ALA  47           HA       ALA  47   2.912   6.369  -5.966
  336    HB1  ALA  47          1HB       ALA  47   5.327   7.755  -4.867
  337    HB2  ALA  47          2HB       ALA  47   3.866   7.578  -3.893
  338    HB3  ALA  47          3HB       ALA  47   4.698   6.147  -4.502
  339    H    HIS  48           HN       HIS  48   4.287   9.542  -5.269
  340    HA   HIS  48           HA       HIS  48   1.883  10.850  -6.297
  341    HB2  HIS  48          2HB       HIS  48   1.970  10.229  -3.667
  342    HB3  HIS  48          3HB       HIS  48   2.771  11.797  -3.636
  343    HD1  HIS  48          1HD       HIS  48  -0.386  10.412  -5.270
  344    HD2  HIS  48          2HD       HIS  48   0.977  13.759  -3.221
  345    HE1  HIS  48          1HE       HIS  48  -2.375  11.939  -5.079
  346    H    THR  49           HN       THR  49   4.011  11.127  -7.718
  347    HA   THR  49           HA       THR  49   4.961  13.830  -7.120
  348    HB   THR  49           HB       THR  49   6.693  11.420  -7.466
  349    HG1  THR  49          1HG       THR  49   7.439  13.725  -6.071
  350   HG21  THR  49          1HG2      THR  49   7.443  12.658  -9.338
  351   HG22  THR  49          2HG2      THR  49   8.576  13.028  -8.039
  352   HG23  THR  49          3HG2      THR  49   7.320  14.188  -8.470
  353    H    GLU  50           HN       GLU  50   4.812  11.173  -9.463
  354    HA   GLU  50           HA       GLU  50   4.862  13.156 -11.635
  355    HB2  GLU  50          2HB       GLU  50   6.556  11.247 -11.585
  356    HB3  GLU  50          3HB       GLU  50   5.207  10.179 -11.944
  357    HG2  GLU  50          2HG       GLU  50   6.372  10.719 -13.971
  358    HG3  GLU  50          3HG       GLU  50   4.770  11.454 -13.999
  359    H    THR  51           HN       THR  51   3.026  13.597 -12.647
  360    HA   THR  51           HA       THR  51   0.555  12.520 -11.968
  361    HB   THR  51           HB       THR  51   1.196  13.793 -14.632
  362    HG1  THR  51          1HG       THR  51   0.669  14.974 -12.093
  363   HG21  THR  51          1HG2      THR  51  -0.993  13.233 -14.876
  364   HG22  THR  51          2HG2      THR  51  -1.229  14.713 -13.947
  365   HG23  THR  51          3HG2      THR  51  -1.276  13.148 -13.137
  366    H    GLY  52           HN       GLY  52  -0.861  11.089 -13.011
  367    HA2  GLY  52          1HA       GLY  52  -1.490   9.410 -14.501
  368    HA3  GLY  52          2HA       GLY  52   0.072   9.561 -15.293
  369    H    TRP  53           HN       TRP  53  -1.531   8.291 -12.405
  370    HA   TRP  53           HA       TRP  53   0.535   6.192 -12.305
  371    HB2  TRP  53          2HB       TRP  53  -0.285   6.206  -9.752
  372    HB3  TRP  53          3HB       TRP  53   1.051   7.200 -10.327
  373    HD1  TRP  53          1HD       TRP  53  -2.810   7.678 -10.122
  374    HE1  TRP  53          1HE       TRP  53  -3.256  10.057  -9.246
  375    HE3  TRP  53          3HE       TRP  53   2.020   9.276  -9.616
  376    HZ2  TRP  53          2HZ       TRP  53  -1.759  12.311  -8.447
  377    HZ3  TRP  53          3HZ       TRP  53   2.426  11.558  -8.791
  378    HH2  TRP  53          2HH       TRP  53   0.575  13.043  -8.219
  379    H    SER  54           HN       SER  54  -0.183   4.154 -12.365
  380    HA   SER  54           HA       SER  54  -3.088   3.728 -12.194
  381    HB2  SER  54          2HB       SER  54  -1.991   3.173 -14.364
  382    HB3  SER  54          3HB       SER  54  -1.016   1.967 -13.523
  383    HG   SER  54           HG       SER  54  -3.117   1.329 -14.599
  384    H    CYS  55           HN       CYS  55  -3.906   1.910 -11.087
  385    HA   CYS  55           HA       CYS  55  -2.129   0.263  -9.515
  386    HB2  CYS  55          2HB       CYS  55  -4.138   1.955  -8.031
  387    HB3  CYS  55          3HB       CYS  55  -2.873   0.933  -7.356
  388    H    HIS  56           HN       HIS  56  -4.309  -0.287  -7.583
  389    HA   HIS  56           HA       HIS  56  -5.710  -2.235  -9.192
  390    HB2  HIS  56          2HB       HIS  56  -4.764  -2.441  -6.734
  391    HB3  HIS  56          3HB       HIS  56  -6.341  -1.785  -6.304
  392    HD1  HIS  56          1HD       HIS  56  -7.802  -3.398  -8.695
  393    HD2  HIS  56          2HD       HIS  56  -5.383  -4.961  -5.701
  394    HE1  HIS  56          1HE       HIS  56  -8.464  -5.815  -8.490
  395    H    TYR  57           HN       TYR  57  -6.260   0.942  -8.196
  396    HA   TYR  57           HA       TYR  57  -8.916   0.921  -9.297
  397    HB2  TYR  57          2HB       TYR  57  -8.685   1.863  -6.446
  398    HB3  TYR  57          3HB       TYR  57 -10.145   1.574  -7.386
  399    HD1  TYR  57          1HD       TYR  57 -10.888  -0.744  -7.836
  400    HD2  TYR  57          2HD       TYR  57  -7.592   0.088  -5.277
  401    HE1  TYR  57          1HE       TYR  57 -11.037  -3.019  -6.912
  402    HE2  TYR  57          2HE       TYR  57  -7.732  -2.185  -4.347
  403    HH   TYR  57           HH       TYR  57  -8.663  -4.217  -4.586
  404    H    CYS  58           HN       CYS  58  -6.280   2.206  -9.681
  405    HA   CYS  58           HA       CYS  58  -6.567   4.960  -8.933
  406    HB2  CYS  58          2HB       CYS  58  -4.503   3.312  -9.955
  407    HB3  CYS  58          3HB       CYS  58  -4.737   4.614 -11.115
  408    H    ASP  59           HN       ASP  59  -8.014   3.071 -11.266
  409    HA   ASP  59           HA       ASP  59  -9.324   3.517 -13.072
  410    HB2  ASP  59          2HB       ASP  59  -9.326   6.047 -11.539
  411    HB3  ASP  59          3HB       ASP  59  -9.827   6.174 -13.223
  412    H    ASN  60           HN       ASN  60  -7.961   6.724 -13.291
  413    HA   ASN  60           HA       ASN  60  -7.001   7.721 -15.138
  414    HB2  ASN  60          2HB       ASN  60  -5.182   5.987 -13.728
  415    HB3  ASN  60          3HB       ASN  60  -4.726   6.080 -15.426
  416   HD21  ASN  60          1HD2      ASN  60  -5.554   8.674 -15.984
  417   HD22  ASN  60          2HD2      ASN  60  -4.547   9.775 -15.113
  Start of MODEL    4
    1    H1   GLU   1           HN       GLU   1   0.407   4.742   4.423
    2    HA   GLU   1           HA       GLU   1   0.434   3.134   2.803
    3    HB2  GLU   1          2HB       GLU   1   2.688   4.972   2.106
    4    HB3  GLU   1          3HB       GLU   1   2.443   3.518   1.148
    5    HG2  GLU   1          2HG       GLU   1   1.363   5.519   0.195
    6    HG3  GLU   1          3HG       GLU   1   0.233   4.212   0.545
    7    H    MET   2           HN       MET   2   0.781   1.327   4.126
    8    HA   MET   2           HA       MET   2   3.501   0.217   3.942
    9    HB2  MET   2          2HB       MET   2   1.823  -0.619   6.237
   10    HB3  MET   2          3HB       MET   2   3.563  -0.385   6.140
   11    HG2  MET   2          2HG       MET   2   2.991   2.123   5.998
   12    HG3  MET   2          3HG       MET   2   1.416   1.636   6.617
   13    HE1  MET   2          1HE       MET   2   5.208   2.479   7.943
   14    HE2  MET   2          2HE       MET   2   5.420   0.885   8.667
   15    HE3  MET   2          3HE       MET   2   5.087   1.032   6.941
   16    H    CYS   3           HN       CYS   3   3.430  -1.449   2.591
   17    HA   CYS   3           HA       CYS   3   1.402  -2.746   1.449
   18    HB2  CYS   3          2HB       CYS   3   3.765  -3.256   0.990
   19    HB3  CYS   3          3HB       CYS   3   3.872  -4.131   2.515
   20    H    ASP   4           HN       ASP   4  -0.397  -3.643   2.178
   21    HA   ASP   4           HA       ASP   4  -0.863  -4.346   4.853
   22    HB2  ASP   4          2HB       ASP   4  -2.623  -3.763   3.174
   23    HB3  ASP   4          3HB       ASP   4  -2.378  -5.344   2.435
   24    H    VAL   5           HN       VAL   5   0.922  -5.952   2.527
   25    HA   VAL   5           HA       VAL   5   0.445  -8.593   3.722
   26    HB   VAL   5           HB       VAL   5   1.954  -7.865   1.206
   27   HG11  VAL   5          1HG1      VAL   5   1.529 -10.477   0.947
   28   HG12  VAL   5          2HG1      VAL   5   2.968  -9.832   1.738
   29   HG13  VAL   5          3HG1      VAL   5   1.607 -10.399   2.706
   30   HG21  VAL   5          1HG2      VAL   5  -0.611  -7.633   1.296
   31   HG22  VAL   5          2HG2      VAL   5   0.103  -8.552  -0.030
   32   HG23  VAL   5          3HG2      VAL   5  -0.619  -9.397   1.339
   33    H    CYS   6           HN       CYS   6   2.609  -5.987   3.773
   34    HA   CYS   6           HA       CYS   6   4.595  -7.641   5.175
   35    HB2  CYS   6          2HB       CYS   6   5.242  -5.366   3.290
   36    HB3  CYS   6          3HB       CYS   6   6.406  -6.328   4.195
   37    H    GLU   7           HN       GLU   7   3.728  -4.244   4.506
   38    HA   GLU   7           HA       GLU   7   3.221  -2.555   5.987
   39    HB2  GLU   7          2HB       GLU   7   4.127  -4.218   8.312
   40    HB3  GLU   7          3HB       GLU   7   2.920  -2.942   8.269
   41    HG2  GLU   7          2HG       GLU   7   1.929  -4.880   6.555
   42    HG3  GLU   7          3HG       GLU   7   2.614  -5.788   7.901
   43    H    VAL   8           HN       VAL   8   5.493  -2.451   4.634
   44    HA   VAL   8           HA       VAL   8   7.277  -1.086   6.463
   45    HB   VAL   8           HB       VAL   8   9.140  -2.476   4.987
   46   HG11  VAL   8          1HG1      VAL   8   9.931  -3.174   7.028
   47   HG12  VAL   8          2HG1      VAL   8   8.874  -1.848   7.519
   48   HG13  VAL   8          3HG1      VAL   8   8.319  -3.517   7.658
   49   HG21  VAL   8          1HG2      VAL   8   7.372  -4.622   6.067
   50   HG22  VAL   8          2HG2      VAL   8   7.062  -3.981   4.453
   51   HG23  VAL   8          3HG2      VAL   8   8.622  -4.712   4.827
   52    H    TRP   9           HN       TRP   9   6.863   0.801   5.362
   53    HA   TRP   9           HA       TRP   9   6.806   1.113   2.580
   54    HB2  TRP   9          2HB       TRP   9   6.016   3.059   3.374
   55    HB3  TRP   9          3HB       TRP   9   6.833   2.845   4.920
   56    HD1  TRP   9          1HD       TRP   9   9.469   3.691   4.993
   57    HE1  TRP   9          1HE       TRP   9  10.578   5.662   3.764
   58    HE3  TRP   9          3HE       TRP   9   5.992   4.414   1.316
   59    HZ2  TRP   9          2HZ       TRP   9  10.050   7.305   1.531
   60    HZ3  TRP   9          3HZ       TRP   9   6.368   6.207  -0.328
   61    HH2  TRP   9          2HH       TRP   9   8.356   7.622  -0.220
   62    H    THR  10           HN       THR  10   8.333   1.740   1.078
   63    HA   THR  10           HA       THR  10  11.114   1.244   1.865
   64    HB   THR  10           HB       THR  10  11.355   1.325  -0.766
   65    HG1  THR  10          1HG       THR  10   8.902   0.140  -0.931
   66   HG21  THR  10          1HG2      THR  10  10.063  -1.008   0.655
   67   HG22  THR  10          2HG2      THR  10  11.785  -0.630   0.674
   68   HG23  THR  10          3HG2      THR  10  10.997  -1.082  -0.838
   69    H    ALA  11           HN       ALA  11  10.266   3.028  -1.002
   70    HA   ALA  11           HA       ALA  11  10.298   5.636  -0.307
   71    HB1  ALA  11          1HB       ALA  11  12.204   5.929   0.832
   72    HB2  ALA  11          2HB       ALA  11  12.919   4.440   0.211
   73    HB3  ALA  11          3HB       ALA  11  12.972   5.914  -0.757
   74    H    GLU  12           HN       GLU  12  12.171   3.431  -2.370
   75    HA   GLU  12           HA       GLU  12  12.567   5.045  -4.568
   76    HB2  GLU  12          2HB       GLU  12  13.038   3.116  -5.775
   77    HB3  GLU  12          3HB       GLU  12  13.304   2.598  -4.116
   78    HG2  GLU  12          2HG       GLU  12  11.045   1.619  -4.089
   79    HG3  GLU  12          3HG       GLU  12  10.850   2.078  -5.780
   80    H    SER  13           HN       SER  13   9.725   3.070  -3.794
   81    HA   SER  13           HA       SER  13   7.751   4.681  -4.670
   82    HB2  SER  13          2HB       SER  13   8.188   4.994  -6.871
   83    HB3  SER  13          3HB       SER  13   9.239   3.582  -6.962
   84    HG   SER  13           HG       SER  13   6.923   3.717  -7.996
   85    H    LEU  14           HN       LEU  14   6.683   3.506  -3.097
   86    HA   LEU  14           HA       LEU  14   6.448   0.736  -2.948
   87    HB2  LEU  14          2HB       LEU  14   5.304   3.012  -1.672
   88    HB3  LEU  14          3HB       LEU  14   4.012   1.879  -2.063
   89    HG   LEU  14           HG       LEU  14   6.478   1.005  -0.590
   90   HD11  LEU  14          1HD1      LEU  14   4.313   2.710   0.365
   91   HD12  LEU  14          2HD1      LEU  14   5.881   2.352   1.088
   92   HD13  LEU  14          3HD1      LEU  14   4.530   1.243   1.319
   93   HD21  LEU  14          1HD2      LEU  14   3.737  -0.085  -1.090
   94   HD22  LEU  14          2HD2      LEU  14   4.660  -0.599   0.322
   95   HD23  LEU  14          3HD2      LEU  14   5.306  -0.863  -1.297
   96    H    PHE  15           HN       PHE  15   4.131  -0.316  -3.089
   97    HA   PHE  15           HA       PHE  15   2.816   0.451  -5.592
   98    HB2  PHE  15          2HB       PHE  15   4.131  -2.174  -4.989
   99    HB3  PHE  15          3HB       PHE  15   2.722  -2.126  -6.043
  100    HD1  PHE  15          1HD       PHE  15   6.080  -0.591  -5.595
  101    HD2  PHE  15          2HD       PHE  15   2.991  -1.708  -8.301
  102    HE1  PHE  15          1HE       PHE  15   7.528   0.011  -7.493
  103    HE2  PHE  15          2HE       PHE  15   4.434  -1.111 -10.202
  104    HZ   PHE  15           HZ       PHE  15   6.706  -0.250  -9.799
  105    HA   PRO  16           HA       PRO  16   1.283  -0.823  -6.893
  106    HB2  PRO  16          2HB       PRO  16  -1.155   0.228  -7.462
  107    HB3  PRO  16          3HB       PRO  16  -0.892  -1.500  -7.198
  108    HG2  PRO  16          2HG       PRO  16  -1.939   0.568  -5.303
  109    HG3  PRO  16          3HG       PRO  16  -2.514  -1.085  -5.585
  110    HD2  PRO  16          2HD       PRO  16  -0.947  -0.426  -3.477
  111    HD3  PRO  16          3HD       PRO  16  -0.870  -2.016  -4.264
  112    H    CYS  17           HN       CYS  17  -0.413   1.740  -5.076
  113    HA   CYS  17           HA       CYS  17   1.175   3.723  -6.569
  114    HB2  CYS  17          2HB       CYS  17  -0.942   5.115  -5.460
  115    HB3  CYS  17          3HB       CYS  17  -0.823   4.578  -7.132
  116    H    ARG  18           HN       ARG  18   0.766   5.947  -5.073
  117    HA   ARG  18           HA       ARG  18   1.970   5.235  -2.479
  118    HB2  ARG  18          2HB       ARG  18   3.374   7.106  -2.600
  119    HB3  ARG  18          3HB       ARG  18   3.391   6.462  -4.236
  120    HG2  ARG  18          2HG       ARG  18   3.166   8.744  -4.556
  121    HG3  ARG  18          3HG       ARG  18   1.509   8.151  -4.696
  122    HD2  ARG  18          2HD       ARG  18   0.840   9.198  -2.813
  123    HD3  ARG  18          3HD       ARG  18   2.361   8.886  -1.978
  124    HE   ARG  18           HE       ARG  18   2.606  10.841  -4.057
  125   HH11  ARG  18          1HH1      ARG  18   1.701  10.328  -0.734
  126   HH12  ARG  18          2HH1      ARG  18   2.017  11.963  -0.260
  127   HH21  ARG  18          1HH2      ARG  18   3.026  12.997  -3.444
  128   HH22  ARG  18          2HH2      ARG  18   2.770  13.481  -1.801
  129    H    VAL  19           HN       VAL  19  -0.734   6.518  -3.942
  130    HA   VAL  19           HA       VAL  19  -1.369   8.311  -1.712
  131    HB   VAL  19           HB       VAL  19  -2.817   7.866  -4.327
  132   HG11  VAL  19          1HG1      VAL  19  -4.427   8.474  -2.671
  133   HG12  VAL  19          2HG1      VAL  19  -3.380   9.748  -2.042
  134   HG13  VAL  19          3HG1      VAL  19  -4.095   9.905  -3.646
  135   HG21  VAL  19          1HG2      VAL  19  -0.711   9.009  -4.645
  136   HG22  VAL  19          2HG2      VAL  19  -2.038  10.154  -4.842
  137   HG23  VAL  19          3HG2      VAL  19  -1.097  10.144  -3.352
  138    H    CYS  20           HN       CYS  20  -3.071   5.813  -3.616
  139    HA   CYS  20           HA       CYS  20  -5.227   5.371  -2.006
  140    HB2  CYS  20          2HB       CYS  20  -3.595   3.403  -3.609
  141    HB3  CYS  20          3HB       CYS  20  -5.103   2.959  -2.816
  142    H    THR  21           HN       THR  21  -5.288   5.118   0.123
  143    HA   THR  21           HA       THR  21  -3.418   4.567   1.936
  144    HB   THR  21           HB       THR  21  -5.232   3.221   3.229
  145    HG1  THR  21          1HG       THR  21  -6.895   4.347   1.221
  146   HG21  THR  21          1HG2      THR  21  -6.594   5.401   3.472
  147   HG22  THR  21          2HG2      THR  21  -5.416   6.086   2.352
  148   HG23  THR  21          3HG2      THR  21  -4.884   5.430   3.900
  149    H    ARG  22           HN       ARG  22  -5.507   1.787   1.589
  150    HA   ARG  22           HA       ARG  22  -3.737  -0.148   2.279
  151    HB2  ARG  22          2HB       ARG  22  -5.948  -0.340   0.228
  152    HB3  ARG  22          3HB       ARG  22  -5.113  -1.731   0.907
  153    HG2  ARG  22          2HG       ARG  22  -6.339   0.212   2.788
  154    HG3  ARG  22          3HG       ARG  22  -7.404  -0.864   1.882
  155    HD2  ARG  22          2HD       ARG  22  -6.023  -2.782   2.687
  156    HD3  ARG  22          3HD       ARG  22  -5.141  -1.650   3.711
  157    HE   ARG  22           HE       ARG  22  -6.869  -1.755   5.187
  158   HH11  ARG  22          1HH1      ARG  22  -8.055  -2.662   2.042
  159   HH12  ARG  22          2HH1      ARG  22  -9.646  -3.047   2.610
  160   HH21  ARG  22          1HH2      ARG  22  -8.960  -2.260   5.947
  161   HH22  ARG  22          2HH2      ARG  22 -10.160  -2.818   4.830
  162    H    VAL  23           HN       VAL  23  -1.736  -0.447   1.549
  163    HA   VAL  23           HA       VAL  23  -1.241  -0.264  -1.347
  164    HB   VAL  23           HB       VAL  23   1.167  -0.069  -0.721
  165   HG11  VAL  23          1HG1      VAL  23  -0.707   1.854  -0.873
  166   HG12  VAL  23          2HG1      VAL  23  -0.106   2.140   0.762
  167   HG13  VAL  23          3HG1      VAL  23   1.005   2.180  -0.608
  168   HG21  VAL  23          1HG2      VAL  23   0.400  -1.030   1.703
  169   HG22  VAL  23          2HG2      VAL  23   1.922  -0.192   1.394
  170   HG23  VAL  23          3HG2      VAL  23   0.542   0.695   2.043
  171    H    PHE  24           HN       PHE  24  -0.013  -1.865  -2.392
  172    HA   PHE  24           HA       PHE  24   0.675  -4.279  -0.928
  173    HB2  PHE  24          2HB       PHE  24  -0.674  -5.265  -3.186
  174    HB3  PHE  24          3HB       PHE  24  -1.168  -5.409  -1.503
  175    HD1  PHE  24          1HD       PHE  24  -2.582  -3.529  -0.521
  176    HD2  PHE  24          2HD       PHE  24  -1.954  -4.051  -4.698
  177    HE1  PHE  24          1HE       PHE  24  -4.576  -2.164  -0.988
  178    HE2  PHE  24          2HE       PHE  24  -3.946  -2.685  -5.172
  179    HZ   PHE  24           HZ       PHE  24  -5.259  -1.740  -3.316
  180    H    HIS  25           HN       HIS  25   2.597  -4.926  -1.615
  181    HA   HIS  25           HA       HIS  25   3.930  -3.781  -3.807
  182    HB2  HIS  25          2HB       HIS  25   4.541  -6.333  -2.303
  183    HB3  HIS  25          3HB       HIS  25   5.646  -5.530  -3.414
  184    HD2  HIS  25          2HD       HIS  25   4.392  -2.590  -1.742
  185    HE1  HIS  25          1HE       HIS  25   7.222  -4.103   1.033
  186    HE2  HIS  25          2HE       HIS  25   5.766  -2.146   0.404
  187    H    ASP  26           HN       ASP  26   3.661  -4.132  -5.899
  188    HA   ASP  26           HA       ASP  26   1.940  -5.919  -7.068
  189    HB2  ASP  26          2HB       ASP  26   2.850  -4.065  -8.321
  190    HB3  ASP  26          3HB       ASP  26   4.476  -4.732  -8.208
  191    H    GLY  27           HN       GLY  27   5.021  -6.560  -5.716
  192    HA2  GLY  27          1HA       GLY  27   5.350  -9.067  -7.178
  193    HA3  GLY  27          2HA       GLY  27   6.484  -8.378  -6.026
  194    H    CYS  28           HN       CYS  28   4.233  -7.931  -4.091
  195    HA   CYS  28           HA       CYS  28   4.515 -10.362  -2.661
  196    HB2  CYS  28          2HB       CYS  28   3.150  -7.771  -2.252
  197    HB3  CYS  28          3HB       CYS  28   2.455  -9.140  -1.391
  198    H    LEU  29           HN       LEU  29   1.528  -8.819  -3.858
  199    HA   LEU  29           HA       LEU  29  -0.278 -10.787  -3.464
  200    HB2  LEU  29          2HB       LEU  29  -0.269  -9.487  -6.147
  201    HB3  LEU  29          3HB       LEU  29  -1.620  -9.810  -5.063
  202    HG   LEU  29           HG       LEU  29  -0.211  -7.986  -3.621
  203   HD11  LEU  29          1HD1      LEU  29   1.268  -7.801  -5.733
  204   HD12  LEU  29          2HD1      LEU  29   0.718  -6.325  -4.940
  205   HD13  LEU  29          3HD1      LEU  29  -0.087  -6.893  -6.402
  206   HD21  LEU  29          1HD2      LEU  29  -2.092  -6.887  -5.621
  207   HD22  LEU  29          2HD2      LEU  29  -2.065  -6.707  -3.867
  208   HD23  LEU  29          3HD2      LEU  29  -2.692  -8.188  -4.593
  209    H    ARG  30           HN       ARG  30   2.018 -10.629  -6.157
  210    HA   ARG  30           HA       ARG  30   1.129 -12.847  -7.593
  211    HB2  ARG  30          2HB       ARG  30   3.715 -11.387  -7.364
  212    HB3  ARG  30          3HB       ARG  30   3.730 -12.960  -8.149
  213    HG2  ARG  30          2HG       ARG  30   1.680 -11.897  -9.458
  214    HG3  ARG  30          3HG       ARG  30   2.525 -10.406  -9.033
  215    HD2  ARG  30          2HD       ARG  30   3.978 -10.748 -10.675
  216    HD3  ARG  30          3HD       ARG  30   4.446 -12.287  -9.953
  217    HE   ARG  30           HE       ARG  30   2.061 -12.674 -11.353
  218   HH11  ARG  30          1HH1      ARG  30   5.396 -11.897 -11.981
  219   HH12  ARG  30          2HH1      ARG  30   5.403 -12.619 -13.556
  220   HH21  ARG  30          1HH2      ARG  30   2.057 -13.628 -13.425
  221   HH22  ARG  30          2HH2      ARG  30   3.503 -13.603 -14.378
  222    H    ARG  31           HN       ARG  31   3.484 -12.645  -4.948
  223    HA   ARG  31           HA       ARG  31   3.723 -15.553  -4.901
  224    HB2  ARG  31          2HB       ARG  31   5.484 -13.445  -4.324
  225    HB3  ARG  31          3HB       ARG  31   5.136 -14.200  -2.775
  226    HG2  ARG  31          2HG       ARG  31   5.669 -16.412  -3.960
  227    HG3  ARG  31          3HG       ARG  31   6.400 -15.401  -5.208
  228    HD2  ARG  31          2HD       ARG  31   7.785 -14.336  -3.426
  229    HD3  ARG  31          3HD       ARG  31   7.143 -15.520  -2.290
  230    HE   ARG  31           HE       ARG  31   8.377 -16.637  -4.651
  231   HH11  ARG  31          1HH1      ARG  31   8.815 -15.596  -1.358
  232   HH12  ARG  31          2HH1      ARG  31  10.230 -16.564  -1.103
  233   HH21  ARG  31          1HH2      ARG  31  10.237 -17.916  -4.328
  234   HH22  ARG  31          2HH2      ARG  31  11.038 -17.883  -2.794
  235    H    MET  32           HN       MET  32   1.498 -13.529  -3.817
  236    HA   MET  32           HA       MET  32   1.215 -14.792  -1.178
  237    HB2  MET  32          2HB       MET  32   0.942 -12.625  -0.604
  238    HB3  MET  32          3HB       MET  32   0.560 -12.136  -2.250
  239    HG2  MET  32          2HG       MET  32  -1.337 -11.701  -0.880
  240    HG3  MET  32          3HG       MET  32  -1.720 -13.059  -1.937
  241    HE1  MET  32          1HE       MET  32  -0.388 -12.629   2.099
  242    HE2  MET  32          2HE       MET  32  -1.478 -11.534   1.248
  243    HE3  MET  32          3HE       MET  32  -2.124 -12.697   2.406
  244    H    GLY  33           HN       GLY  33  -0.319 -14.329  -4.285
  245    HA2  GLY  33          1HA       GLY  33  -1.890 -15.755  -5.263
  246    HA3  GLY  33          2HA       GLY  33  -2.135 -16.520  -3.699
  247    H    TYR  34           HN       TYR  34  -2.328 -13.066  -4.383
  248    HA   TYR  34           HA       TYR  34  -5.241 -13.150  -4.204
  249    HB2  TYR  34          2HB       TYR  34  -5.398 -12.266  -2.154
  250    HB3  TYR  34          3HB       TYR  34  -3.674 -12.561  -1.964
  251    HD1  TYR  34          1HD       TYR  34  -6.251 -10.060  -2.386
  252    HD2  TYR  34          2HD       TYR  34  -2.051 -10.734  -2.468
  253    HE1  TYR  34          1HE       TYR  34  -5.866  -7.638  -2.194
  254    HE2  TYR  34          2HE       TYR  34  -1.654  -8.314  -2.275
  255    HH   TYR  34           HH       TYR  34  -3.292  -6.259  -1.207
  256    H    ILE  35           HN       ILE  35  -2.746 -12.250  -5.927
  257    HA   ILE  35           HA       ILE  35  -3.094  -9.475  -6.372
  258    HB   ILE  35           HB       ILE  35  -1.130 -11.039  -7.069
  259   HG12  ILE  35          2HG1      ILE  35  -1.969  -9.010  -9.129
  260   HG13  ILE  35          3HG1      ILE  35  -1.505  -8.522  -7.502
  261   HG21  ILE  35          1HG2      ILE  35  -1.187 -11.873  -9.304
  262   HG22  ILE  35          2HG2      ILE  35  -2.611 -12.486  -8.467
  263   HG23  ILE  35          3HG2      ILE  35  -2.764 -11.141  -9.597
  264   HD11  ILE  35          1HD1      ILE  35   0.163  -9.747  -9.653
  265   HD12  ILE  35          2HD1      ILE  35   0.452  -8.289  -8.701
  266   HD13  ILE  35          3HD1      ILE  35   0.639  -9.878  -7.960
  267    H    GLN  36           HN       GLN  36  -3.984  -8.437  -8.250
  268    HA   GLN  36           HA       GLN  36  -6.194  -9.951  -9.479
  269    HB2  GLN  36          2HB       GLN  36  -6.142  -7.053  -8.624
  270    HB3  GLN  36          3HB       GLN  36  -7.432  -7.783  -9.570
  271    HG2  GLN  36          2HG       GLN  36  -8.407  -8.594  -7.757
  272    HG3  GLN  36          3HG       GLN  36  -6.903  -9.323  -7.196
  273   HE21  GLN  36          1HE2      GLN  36  -5.378  -7.865  -6.102
  274   HE22  GLN  36          2HE2      GLN  36  -6.017  -6.606  -5.106
  275    H    GLY  37           HN       GLY  37  -4.571  -6.808  -9.985
  276    HA2  GLY  37          1HA       GLY  37  -4.117  -7.624 -12.787
  277    HA3  GLY  37          2HA       GLY  37  -4.757  -6.035 -12.391
  278    H    ASP  38           HN       ASP  38  -2.454  -6.353 -13.902
  279    HA   ASP  38           HA       ASP  38  -0.298  -5.622 -12.039
  280    HB2  ASP  38          2HB       ASP  38   0.542  -7.377 -13.311
  281    HB3  ASP  38          3HB       ASP  38  -0.310  -6.864 -14.765
  282    H    SER  39           HN       SER  39   0.845  -3.725 -12.304
  283    HA   SER  39           HA       SER  39  -0.566  -1.537 -13.416
  284    HB2  SER  39          2HB       SER  39   0.791  -1.014 -11.565
  285    HB3  SER  39          3HB       SER  39   2.188  -1.854 -12.238
  286    HG   SER  39           HG       SER  39   1.068   0.393 -13.527
  287    H    ALA  40           HN       ALA  40  -0.026  -0.193 -15.165
  288    HA   ALA  40           HA       ALA  40   1.924  -1.242 -17.087
  289    HB1  ALA  40          1HB       ALA  40  -0.424  -2.059 -17.596
  290    HB2  ALA  40          2HB       ALA  40  -0.815  -0.381 -17.974
  291    HB3  ALA  40          3HB       ALA  40   0.424  -1.227 -18.901
  292    H    ALA  41           HN       ALA  41   1.307   0.536 -19.165
  293    HA   ALA  41           HA       ALA  41   1.422   2.738 -19.834
  294    HB1  ALA  41          1HB       ALA  41   1.792   3.897 -17.156
  295    HB2  ALA  41          2HB       ALA  41   0.722   4.385 -18.470
  296    HB3  ALA  41          3HB       ALA  41   0.266   3.051 -17.411
  297    H    GLU  42           HN       GLU  42   3.583   1.088 -17.823
  298    HA   GLU  42           HA       GLU  42   5.805   1.416 -17.265
  299    HB2  GLU  42          2HB       GLU  42   6.249   2.153 -20.119
  300    HB3  GLU  42          3HB       GLU  42   7.109   0.996 -19.114
  301    HG2  GLU  42          2HG       GLU  42   4.647  -0.144 -19.260
  302    HG3  GLU  42          3HG       GLU  42   4.778   0.627 -20.839
  303    H    VAL  43           HN       VAL  43   4.308   3.805 -16.834
  304    HA   VAL  43           HA       VAL  43   5.373   6.116 -17.945
  305    HB   VAL  43           HB       VAL  43   4.177   5.560 -15.247
  306   HG11  VAL  43          1HG1      VAL  43   5.651   7.961 -16.134
  307   HG12  VAL  43          2HG1      VAL  43   4.110   8.238 -15.319
  308   HG13  VAL  43          3HG1      VAL  43   5.387   7.326 -14.511
  309   HG21  VAL  43          1HG2      VAL  43   2.932   7.565 -16.926
  310   HG22  VAL  43          2HG2      VAL  43   3.108   6.024 -17.766
  311   HG23  VAL  43          3HG2      VAL  43   2.247   6.096 -16.229
  312    H    THR  44           HN       THR  44   6.118   5.269 -14.588
  313    HA   THR  44           HA       THR  44   8.881   4.971 -14.836
  314    HB   THR  44           HB       THR  44   7.979   7.751 -14.883
  315    HG1  THR  44          1HG       THR  44  10.666   7.058 -15.085
  316   HG21  THR  44          1HG2      THR  44   9.924   6.841 -12.770
  317   HG22  THR  44          2HG2      THR  44   8.483   7.839 -12.569
  318   HG23  THR  44          3HG2      THR  44   9.898   8.490 -13.395
  319    H    GLU  45           HN       GLU  45   6.314   6.365 -12.838
  320    HA   GLU  45           HA       GLU  45   5.814   6.167 -10.627
  321    HB2  GLU  45          2HB       GLU  45   7.272   3.718 -10.080
  322    HB3  GLU  45          3HB       GLU  45   5.540   4.020 -10.054
  323    HG2  GLU  45          2HG       GLU  45   5.793   3.914 -12.658
  324    HG3  GLU  45          3HG       GLU  45   7.255   3.011 -12.264
  325    H    MET  46           HN       MET  46   6.761   7.595  -9.328
  326    HA   MET  46           HA       MET  46   9.408   6.955  -8.252
  327    HB2  MET  46          2HB       MET  46   8.624   9.647  -9.382
  328    HB3  MET  46          3HB       MET  46  10.087   9.337  -8.458
  329    HG2  MET  46          2HG       MET  46   9.910   7.467 -10.611
  330    HG3  MET  46          3HG       MET  46   9.700   9.105 -11.228
  331    HE1  MET  46          1HE       MET  46  11.935   6.827 -11.672
  332    HE2  MET  46          2HE       MET  46  12.230   8.289 -12.612
  333    HE3  MET  46          3HE       MET  46  13.508   7.622 -11.595
  334    H    ALA  47           HN       ALA  47   6.457   7.073  -7.414
  335    HA   ALA  47           HA       ALA  47   5.279   7.531  -5.520
  336    HB1  ALA  47          1HB       ALA  47   6.415   7.068  -3.657
  337    HB2  ALA  47          2HB       ALA  47   7.835   6.924  -4.694
  338    HB3  ALA  47          3HB       ALA  47   7.494   8.447  -3.872
  339    H    HIS  48           HN       HIS  48   6.519   9.771  -7.384
  340    HA   HIS  48           HA       HIS  48   5.229  11.939  -5.930
  341    HB2  HIS  48          2HB       HIS  48   7.925  11.749  -5.706
  342    HB3  HIS  48          3HB       HIS  48   7.795  12.727  -7.166
  343    HD1  HIS  48          1HD       HIS  48   7.329  12.847  -3.490
  344    HD2  HIS  48          2HD       HIS  48   6.623  15.285  -6.780
  345    HE1  HIS  48          1HE       HIS  48   6.867  15.133  -2.548
  346    H    THR  49           HN       THR  49   6.923  10.937  -8.878
  347    HA   THR  49           HA       THR  49   6.213  12.901 -10.636
  348    HB   THR  49           HB       THR  49   5.945  10.872 -12.318
  349    HG1  THR  49          1HG       THR  49   6.865   8.995 -11.529
  350   HG21  THR  49          1HG2      THR  49   8.312  10.876 -12.636
  351   HG22  THR  49          2HG2      THR  49   8.596  11.364 -10.965
  352   HG23  THR  49          3HG2      THR  49   7.856  12.492 -12.101
  353    H    GLU  50           HN       GLU  50   4.545  12.883 -12.364
  354    HA   GLU  50           HA       GLU  50   1.930  12.405 -11.170
  355    HB2  GLU  50          2HB       GLU  50   2.517  14.604 -12.224
  356    HB3  GLU  50          3HB       GLU  50   2.585  13.784 -13.776
  357    HG2  GLU  50          2HG       GLU  50   0.469  14.858 -13.587
  358    HG3  GLU  50          3HG       GLU  50   0.216  13.117 -13.469
  359    H    THR  51           HN       THR  51   0.192  11.466 -12.462
  360    HA   THR  51           HA       THR  51  -0.586   9.489 -13.364
  361    HB   THR  51           HB       THR  51   0.895   9.961 -15.869
  362    HG1  THR  51          1HG       THR  51  -0.815  11.967 -14.775
  363   HG21  THR  51          1HG2      THR  51  -2.064  10.026 -15.288
  364   HG22  THR  51          2HG2      THR  51  -1.160   8.541 -15.585
  365   HG23  THR  51          3HG2      THR  51  -1.277   9.769 -16.845
  366    H    GLY  52           HN       GLY  52   1.937   9.146 -11.952
  367    HA2  GLY  52          1HA       GLY  52   3.238   7.073 -13.593
  368    HA3  GLY  52          2HA       GLY  52   3.970   7.877 -12.212
  369    H    TRP  53           HN       TRP  53   1.371   7.574 -10.717
  370    HA   TRP  53           HA       TRP  53   1.802   4.776  -9.923
  371    HB2  TRP  53          2HB       TRP  53   0.263   6.069  -7.956
  372    HB3  TRP  53          3HB       TRP  53   1.961   5.613  -7.856
  373    HD1  TRP  53          1HD       TRP  53   3.780   7.549  -8.392
  374    HE1  TRP  53          1HE       TRP  53   3.611  10.112  -8.222
  375    HE3  TRP  53          3HE       TRP  53  -1.308   8.016  -8.229
  376    HZ2  TRP  53          2HZ       TRP  53   1.588  12.071  -8.042
  377    HZ3  TRP  53          3HZ       TRP  53  -2.280  10.270  -8.057
  378    HH2  TRP  53          2HH       TRP  53  -0.861  12.254  -7.965
  379    H    SER  54           HN       SER  54   0.333   3.426 -10.713
  380    HA   SER  54           HA       SER  54  -2.487   4.268 -10.701
  381    HB2  SER  54          2HB       SER  54  -2.390   2.460 -12.761
  382    HB3  SER  54          3HB       SER  54  -2.372   4.211 -12.958
  383    HG   SER  54           HG       SER  54  -0.611   3.534 -14.043
  384    H    CYS  55           HN       CYS  55  -4.020   2.623 -10.333
  385    HA   CYS  55           HA       CYS  55  -3.068  -0.045  -9.679
  386    HB2  CYS  55          2HB       CYS  55  -3.899  -0.052  -7.429
  387    HB3  CYS  55          3HB       CYS  55  -2.823   1.331  -7.594
  388    H    HIS  56           HN       HIS  56  -5.267  -1.072  -8.456
  389    HA   HIS  56           HA       HIS  56  -7.098  -1.301 -10.631
  390    HB2  HIS  56          2HB       HIS  56  -6.399  -2.960  -8.619
  391    HB3  HIS  56          3HB       HIS  56  -7.906  -2.320  -7.968
  392    HD1  HIS  56          1HD       HIS  56 -10.088  -2.828  -9.340
  393    HD2  HIS  56          2HD       HIS  56  -6.672  -4.767 -10.693
  394    HE1  HIS  56          1HE       HIS  56 -10.908  -4.636 -10.883
  395    H    TYR  57           HN       TYR  57  -7.566  -0.222  -7.261
  396    HA   TYR  57           HA       TYR  57 -10.080   1.030  -7.974
  397    HB2  TYR  57          2HB       TYR  57  -8.772   1.327  -5.293
  398    HB3  TYR  57          3HB       TYR  57 -10.484   1.243  -5.690
  399    HD1  TYR  57          1HD       TYR  57 -11.150  -1.094  -6.869
  400    HD2  TYR  57          2HD       TYR  57  -7.872  -0.499  -4.223
  401    HE1  TYR  57          1HE       TYR  57 -11.160  -3.493  -6.327
  402    HE2  TYR  57          2HE       TYR  57  -7.873  -2.896  -3.673
  403    HH   TYR  57           HH       TYR  57 -10.420  -4.968  -4.490
  404    H    CYS  58           HN       CYS  58  -7.534   2.040  -9.086
  405    HA   CYS  58           HA       CYS  58  -6.925   4.518  -7.809
  406    HB2  CYS  58          2HB       CYS  58  -5.846   2.967  -9.913
  407    HB3  CYS  58          3HB       CYS  58  -6.236   4.540 -10.599
  408    H    ASP  59           HN       ASP  59  -8.237   4.013 -11.083
  409    HA   ASP  59           HA       ASP  59 -10.463   5.750 -10.648
  410    HB2  ASP  59          2HB       ASP  59  -8.350   7.256 -10.932
  411    HB3  ASP  59          3HB       ASP  59  -8.494   6.833 -12.636
  412    H    ASN  60           HN       ASN  60  -8.272   4.608 -13.218
  413    HA   ASN  60           HA       ASN  60 -10.162   2.882 -14.379
  414    HB2  ASN  60          2HB       ASN  60 -10.802   4.072 -16.373
  415    HB3  ASN  60          3HB       ASN  60 -11.230   5.065 -14.982
  416   HD21  ASN  60          1HD2      ASN  60 -10.973   7.106 -15.516
  417   HD22  ASN  60          2HD2      ASN  60  -9.611   7.778 -16.340
  Start of MODEL    5
    1    H1   GLU   1           HN       GLU   1   1.283   4.775   5.785
    2    HA   GLU   1           HA       GLU   1   0.604   2.899   4.690
    3    HB2  GLU   1          2HB       GLU   1   2.079   4.342   2.508
    4    HB3  GLU   1          3HB       GLU   1   1.401   2.744   2.227
    5    HG2  GLU   1          2HG       GLU   1  -0.288   4.106   1.488
    6    HG3  GLU   1          3HG       GLU   1  -0.785   3.795   3.150
    7    H    MET   2           HN       MET   2   1.240   0.811   4.688
    8    HA   MET   2           HA       MET   2   4.021   0.125   4.189
    9    HB2  MET   2          2HB       MET   2   2.848  -0.941   6.719
   10    HB3  MET   2          3HB       MET   2   4.536  -0.717   6.277
   11    HG2  MET   2          2HG       MET   2   4.031   1.790   6.392
   12    HG3  MET   2          3HG       MET   2   2.565   1.315   7.246
   13    HE1  MET   2          1HE       MET   2   6.851   1.357   8.435
   14    HE2  MET   2          2HE       MET   2   6.492  -0.329   8.065
   15    HE3  MET   2          3HE       MET   2   6.193   0.921   6.857
   16    H    CYS   3           HN       CYS   3   3.923  -1.509   2.806
   17    HA   CYS   3           HA       CYS   3   1.871  -2.948   1.904
   18    HB2  CYS   3          2HB       CYS   3   4.150  -3.226   1.056
   19    HB3  CYS   3          3HB       CYS   3   4.601  -4.099   2.517
   20    H    ASP   4           HN       ASP   4   0.264  -3.951   2.905
   21    HA   ASP   4           HA       ASP   4   0.304  -4.845   5.555
   22    HB2  ASP   4          2HB       ASP   4  -1.657  -4.422   3.760
   23    HB3  ASP   4          3HB       ASP   4  -1.573  -6.180   3.687
   24    H    VAL   5           HN       VAL   5   1.744  -6.200   2.848
   25    HA   VAL   5           HA       VAL   5   1.662  -8.922   3.946
   26    HB   VAL   5           HB       VAL   5   2.649  -7.963   1.256
   27   HG11  VAL   5          1HG1      VAL   5   2.445 -10.716   2.459
   28   HG12  VAL   5          2HG1      VAL   5   2.622 -10.423   0.728
   29   HG13  VAL   5          3HG1      VAL   5   3.885  -9.905   1.844
   30   HG21  VAL   5          1HG2      VAL   5   0.313  -7.761   1.222
   31   HG22  VAL   5          2HG2      VAL   5   0.632  -9.332   0.486
   32   HG23  VAL   5          3HG2      VAL   5   0.083  -9.237   2.159
   33    H    CYS   6           HN       CYS   6   3.583  -6.178   3.932
   34    HA   CYS   6           HA       CYS   6   5.887  -7.737   4.855
   35    HB2  CYS   6          2HB       CYS   6   6.013  -5.478   2.847
   36    HB3  CYS   6          3HB       CYS   6   7.416  -6.183   3.643
   37    H    GLU   7           HN       GLU   7   4.799  -4.369   4.388
   38    HA   GLU   7           HA       GLU   7   4.461  -2.718   5.956
   39    HB2  GLU   7          2HB       GLU   7   5.763  -4.328   8.115
   40    HB3  GLU   7          3HB       GLU   7   4.460  -3.154   8.233
   41    HG2  GLU   7          2HG       GLU   7   3.473  -5.229   6.636
   42    HG3  GLU   7          3HG       GLU   7   4.327  -6.004   7.968
   43    H    VAL   8           HN       VAL   8   6.185  -1.875   4.525
   44    HA   VAL   8           HA       VAL   8   8.326  -0.816   6.081
   45    HB   VAL   8           HB       VAL   8   9.852  -1.856   3.998
   46   HG11  VAL   8          1HG1      VAL   8   9.915  -3.267   6.596
   47   HG12  VAL   8          2HG1      VAL   8  11.220  -2.505   5.683
   48   HG13  VAL   8          3HG1      VAL   8  10.117  -1.515   6.640
   49   HG21  VAL   8          1HG2      VAL   8   9.498  -4.163   3.872
   50   HG22  VAL   8          2HG2      VAL   8   8.430  -4.170   5.275
   51   HG23  VAL   8          3HG2      VAL   8   7.879  -3.475   3.752
   52    H    TRP   9           HN       TRP   9   7.666   1.187   5.415
   53    HA   TRP   9           HA       TRP   9   7.151   1.820   2.676
   54    HB2  TRP   9          2HB       TRP   9   6.021   3.375   3.860
   55    HB3  TRP   9          3HB       TRP   9   7.082   3.214   5.257
   56    HD1  TRP   9          1HD       TRP   9   9.211   4.838   5.379
   57    HE1  TRP   9          1HE       TRP   9   9.741   7.061   4.195
   58    HE3  TRP   9          3HE       TRP   9   5.706   4.635   1.662
   59    HZ2  TRP   9          2HZ       TRP   9   8.799   8.534   1.980
   60    HZ3  TRP   9          3HZ       TRP   9   5.587   6.492   0.051
   61    HH2  TRP   9          2HH       TRP   9   7.101   8.400   0.209
   62    H    THR  10           HN       THR  10   8.333   3.678   1.603
   63    HA   THR  10           HA       THR  10  11.181   3.788   2.227
   64    HB   THR  10           HB       THR  10  11.497   3.500  -0.394
   65    HG1  THR  10          1HG       THR  10  10.061   1.977  -1.225
   66   HG21  THR  10          1HG2      THR  10  12.123   2.019   1.809
   67   HG22  THR  10          2HG2      THR  10  12.604   1.619   0.160
   68   HG23  THR  10          3HG2      THR  10  11.173   0.870   0.868
   69    H    ALA  11           HN       ALA  11   9.865   4.596  -0.900
   70    HA   ALA  11           HA       ALA  11   8.929   7.130  -0.646
   71    HB1  ALA  11          1HB       ALA  11  10.694   8.096   0.441
   72    HB2  ALA  11          2HB       ALA  11  11.888   7.062  -0.345
   73    HB3  ALA  11          3HB       ALA  11  11.157   8.398  -1.234
   74    H    GLU  12           HN       GLU  12  10.962   4.933  -2.405
   75    HA   GLU  12           HA       GLU  12  11.111   6.216  -4.877
   76    HB2  GLU  12          2HB       GLU  12  11.197   3.358  -4.003
   77    HB3  GLU  12          3HB       GLU  12  11.100   3.721  -5.721
   78    HG2  GLU  12          2HG       GLU  12  13.104   5.325  -5.159
   79    HG3  GLU  12          3HG       GLU  12  13.302   4.231  -3.793
   80    H    SER  13           HN       SER  13   9.108   3.326  -4.557
   81    HA   SER  13           HA       SER  13   6.698   4.701  -5.335
   82    HB2  SER  13          2HB       SER  13   6.399   3.403  -7.437
   83    HB3  SER  13          3HB       SER  13   7.757   4.524  -7.516
   84    HG   SER  13           HG       SER  13   8.810   2.353  -6.621
   85    H    LEU  14           HN       LEU  14   5.560   3.804  -3.701
   86    HA   LEU  14           HA       LEU  14   5.699   0.931  -3.235
   87    HB2  LEU  14          2HB       LEU  14   5.222   3.188  -1.625
   88    HB3  LEU  14          3HB       LEU  14   3.719   2.269  -1.647
   89    HG   LEU  14           HG       LEU  14   6.428   1.294  -0.746
   90   HD11  LEU  14          1HD1      LEU  14   5.252   1.031   1.418
   91   HD12  LEU  14          2HD1      LEU  14   3.852   1.840   0.718
   92   HD13  LEU  14          3HD1      LEU  14   5.377   2.708   0.887
   93   HD21  LEU  14          1HD2      LEU  14   5.262  -0.492  -1.900
   94   HD22  LEU  14          2HD2      LEU  14   3.806  -0.185  -0.952
   95   HD23  LEU  14          3HD2      LEU  14   5.263  -0.789  -0.161
   96    H    PHE  15           HN       PHE  15   3.586  -0.221  -2.844
   97    HA   PHE  15           HA       PHE  15   1.649   0.564  -4.921
   98    HB2  PHE  15          2HB       PHE  15   2.514  -2.165  -3.964
   99    HB3  PHE  15          3HB       PHE  15   1.077  -1.914  -4.949
  100    HD1  PHE  15          1HD       PHE  15   4.568  -0.595  -5.046
  101    HD2  PHE  15          2HD       PHE  15   1.415  -2.569  -7.116
  102    HE1  PHE  15          1HE       PHE  15   5.956  -0.674  -7.078
  103    HE2  PHE  15          2HE       PHE  15   2.797  -2.651  -9.150
  104    HZ   PHE  15           HZ       PHE  15   5.071  -1.704  -9.132
  105    HA   PRO  16           HA       PRO  16  -0.319  -0.610  -5.566
  106    HB2  PRO  16          2HB       PRO  16  -2.646   0.764  -5.833
  107    HB3  PRO  16          3HB       PRO  16  -2.577  -0.906  -5.259
  108    HG2  PRO  16          2HG       PRO  16  -2.828   1.629  -3.686
  109    HG3  PRO  16          3HG       PRO  16  -3.685   0.090  -3.474
  110    HD2  PRO  16          2HD       PRO  16  -1.577   0.808  -1.933
  111    HD3  PRO  16          3HD       PRO  16  -1.922  -0.883  -2.352
  112    H    CYS  17           HN       CYS  17  -1.193   2.516  -4.074
  113    HA   CYS  17           HA       CYS  17   0.773   3.901  -5.661
  114    HB2  CYS  17          2HB       CYS  17  -0.720   5.326  -6.877
  115    HB3  CYS  17          3HB       CYS  17  -1.202   3.663  -7.198
  116    H    ARG  18           HN       ARG  18  -0.354   6.481  -5.410
  117    HA   ARG  18           HA       ARG  18  -0.136   6.826  -2.503
  118    HB2  ARG  18          2HB       ARG  18   0.557   9.107  -2.969
  119    HB3  ARG  18          3HB       ARG  18   1.543   7.982  -3.891
  120    HG2  ARG  18          2HG       ARG  18   1.117   9.487  -5.525
  121    HG3  ARG  18          3HG       ARG  18  -0.308   8.467  -5.731
  122    HD2  ARG  18          2HD       ARG  18  -1.176  10.629  -5.703
  123    HD3  ARG  18          3HD       ARG  18  -1.436  10.052  -4.058
  124    HE   ARG  18           HE       ARG  18   1.042  11.419  -4.283
  125   HH11  ARG  18          1HH1      ARG  18  -2.395  11.934  -4.083
  126   HH12  ARG  18          2HH1      ARG  18  -2.249  13.509  -3.376
  127   HH21  ARG  18          1HH2      ARG  18   1.247  13.492  -3.353
  128   HH22  ARG  18          2HH2      ARG  18  -0.178  14.395  -2.962
  129    H    VAL  19           HN       VAL  19  -2.296   7.140  -5.145
  130    HA   VAL  19           HA       VAL  19  -4.070   8.969  -3.730
  131    HB   VAL  19           HB       VAL  19  -4.437   7.643  -6.420
  132   HG11  VAL  19          1HG1      VAL  19  -5.981   9.830  -6.514
  133   HG12  VAL  19          2HG1      VAL  19  -6.572   8.257  -5.977
  134   HG13  VAL  19          3HG1      VAL  19  -6.092   9.473  -4.791
  135   HG21  VAL  19          1HG2      VAL  19  -2.551   9.071  -6.585
  136   HG22  VAL  19          2HG2      VAL  19  -3.911   9.959  -7.272
  137   HG23  VAL  19          3HG2      VAL  19  -3.341  10.338  -5.646
  138    H    CYS  20           HN       CYS  20  -3.462   5.742  -3.641
  139    HA   CYS  20           HA       CYS  20  -6.269   4.992  -3.205
  140    HB2  CYS  20          2HB       CYS  20  -3.805   3.459  -3.934
  141    HB3  CYS  20          3HB       CYS  20  -5.104   2.628  -3.086
  142    H    THR  21           HN       THR  21  -6.487   3.231  -1.436
  143    HA   THR  21           HA       THR  21  -5.301   4.348   0.993
  144    HB   THR  21           HB       THR  21  -7.014   2.945   2.175
  145    HG1  THR  21          1HG       THR  21  -8.271   2.612  -0.333
  146   HG21  THR  21          1HG2      THR  21  -7.310   5.377   1.351
  147   HG22  THR  21          2HG2      THR  21  -8.743   4.478   1.850
  148   HG23  THR  21          3HG2      THR  21  -8.377   4.673   0.136
  149    H    ARG  22           HN       ARG  22  -6.470   1.066   0.809
  150    HA   ARG  22           HA       ARG  22  -4.614  -0.193   2.275
  151    HB2  ARG  22          2HB       ARG  22  -5.566  -1.425  -0.307
  152    HB3  ARG  22          3HB       ARG  22  -5.173  -2.239   1.201
  153    HG2  ARG  22          2HG       ARG  22  -7.129  -0.761   2.138
  154    HG3  ARG  22          3HG       ARG  22  -7.615  -0.723   0.441
  155    HD2  ARG  22          2HD       ARG  22  -7.029  -3.256   1.965
  156    HD3  ARG  22          3HD       ARG  22  -8.643  -2.563   1.800
  157    HE   ARG  22           HE       ARG  22  -7.668  -2.797  -0.762
  158   HH11  ARG  22          1HH1      ARG  22  -8.305  -4.943   1.905
  159   HH12  ARG  22          2HH1      ARG  22  -8.653  -6.307   0.894
  160   HH21  ARG  22          1HH2      ARG  22  -8.125  -4.585  -2.103
  161   HH22  ARG  22          2HH2      ARG  22  -8.550  -6.101  -1.386
  162    H    VAL  23           HN       VAL  23  -2.701  -1.443   1.848
  163    HA   VAL  23           HA       VAL  23  -1.154  -0.496  -0.474
  164    HB   VAL  23           HB       VAL  23   0.878  -0.544   0.941
  165   HG11  VAL  23          1HG1      VAL  23  -0.222   1.410   2.534
  166   HG12  VAL  23          2HG1      VAL  23   0.397   1.637   0.897
  167   HG13  VAL  23          3HG1      VAL  23  -1.324   1.348   1.158
  168   HG21  VAL  23          1HG2      VAL  23  -1.116  -1.048   3.142
  169   HG22  VAL  23          2HG2      VAL  23   0.246  -2.065   2.667
  170   HG23  VAL  23          3HG2      VAL  23   0.536  -0.498   3.424
  171    H    PHE  24           HN       PHE  24  -0.332  -2.063  -1.694
  172    HA   PHE  24           HA       PHE  24   0.428  -4.611  -0.521
  173    HB2  PHE  24          2HB       PHE  24  -0.982  -5.340  -2.850
  174    HB3  PHE  24          3HB       PHE  24  -1.399  -5.717  -1.181
  175    HD1  PHE  24          1HD       PHE  24  -3.305  -4.807  -0.190
  176    HD2  PHE  24          2HD       PHE  24  -1.851  -3.181  -3.845
  177    HE1  PHE  24          1HE       PHE  24  -5.344  -3.443  -0.391
  178    HE2  PHE  24          2HE       PHE  24  -3.887  -1.814  -4.051
  179    HZ   PHE  24           HZ       PHE  24  -5.635  -1.944  -2.322
  180    H    HIS  25           HN       HIS  25   2.418  -4.931  -1.239
  181    HA   HIS  25           HA       HIS  25   3.726  -3.609  -3.250
  182    HB2  HIS  25          2HB       HIS  25   4.146  -6.319  -2.029
  183    HB3  HIS  25          3HB       HIS  25   5.182  -5.770  -3.344
  184    HD2  HIS  25          2HD       HIS  25   4.689  -2.642  -1.523
  185    HE1  HIS  25          1HE       HIS  25   7.809  -4.563   0.618
  186    HE2  HIS  25          2HE       HIS  25   6.529  -2.420   0.283
  187    H    ASP  26           HN       ASP  26   4.738  -4.833  -5.229
  188    HA   ASP  26           HA       ASP  26   2.496  -5.544  -6.929
  189    HB2  ASP  26          2HB       ASP  26   3.811  -4.947  -8.714
  190    HB3  ASP  26          3HB       ASP  26   4.584  -3.992  -7.452
  191    H    GLY  27           HN       GLY  27   5.272  -7.054  -5.442
  192    HA2  GLY  27          1HA       GLY  27   4.913  -9.509  -6.975
  193    HA3  GLY  27          2HA       GLY  27   6.172  -9.195  -5.790
  194    H    CYS  28           HN       CYS  28   4.090  -8.210  -3.862
  195    HA   CYS  28           HA       CYS  28   3.632 -10.710  -2.569
  196    HB2  CYS  28          2HB       CYS  28   2.871  -7.866  -1.957
  197    HB3  CYS  28          3HB       CYS  28   2.262  -9.198  -0.981
  198    H    LEU  29           HN       LEU  29   1.676  -8.508  -4.472
  199    HA   LEU  29           HA       LEU  29  -0.834  -9.696  -3.868
  200    HB2  LEU  29          2HB       LEU  29   0.102  -7.961  -6.140
  201    HB3  LEU  29          3HB       LEU  29  -1.564  -8.506  -5.970
  202    HG   LEU  29           HG       LEU  29  -0.114  -6.831  -3.924
  203   HD11  LEU  29          1HD1      LEU  29  -0.274  -5.408  -5.759
  204   HD12  LEU  29          2HD1      LEU  29  -1.728  -5.054  -4.829
  205   HD13  LEU  29          3HD1      LEU  29  -1.826  -6.074  -6.263
  206   HD21  LEU  29          1HD2      LEU  29  -2.653  -8.219  -3.984
  207   HD22  LEU  29          2HD2      LEU  29  -2.859  -6.487  -3.720
  208   HD23  LEU  29          3HD2      LEU  29  -1.831  -7.429  -2.639
  209    H    ARG  30           HN       ARG  30   1.708 -10.417  -6.126
  210    HA   ARG  30           HA       ARG  30   0.047 -12.243  -7.662
  211    HB2  ARG  30          2HB       ARG  30   1.607 -12.049  -9.267
  212    HB3  ARG  30          3HB       ARG  30   2.252 -10.732  -8.298
  213    HG2  ARG  30          2HG       ARG  30   3.798 -12.275  -7.213
  214    HG3  ARG  30          3HG       ARG  30   3.144 -13.604  -8.173
  215    HD2  ARG  30          2HD       ARG  30   3.774 -12.186 -10.212
  216    HD3  ARG  30          3HD       ARG  30   4.745 -11.235  -9.087
  217    HE   ARG  30           HE       ARG  30   6.281 -12.924  -9.058
  218   HH11  ARG  30          1HH1      ARG  30   3.270 -14.167 -10.284
  219   HH12  ARG  30          2HH1      ARG  30   3.929 -15.713 -10.706
  220   HH21  ARG  30          1HH2      ARG  30   7.161 -14.956  -9.609
  221   HH22  ARG  30          2HH2      ARG  30   6.142 -16.160 -10.321
  222    H    ARG  31           HN       ARG  31   2.197 -12.311  -4.978
  223    HA   ARG  31           HA       ARG  31   2.826 -15.119  -5.192
  224    HB2  ARG  31          2HB       ARG  31   3.972 -12.984  -3.878
  225    HB3  ARG  31          3HB       ARG  31   3.205 -13.874  -2.570
  226    HG2  ARG  31          2HG       ARG  31   4.732 -15.492  -2.638
  227    HG3  ARG  31          3HG       ARG  31   4.663 -15.600  -4.398
  228    HD2  ARG  31          2HD       ARG  31   6.463 -14.287  -4.664
  229    HD3  ARG  31          3HD       ARG  31   5.946 -13.167  -3.404
  230    HE   ARG  31           HE       ARG  31   6.769 -15.390  -2.050
  231   HH11  ARG  31          1HH1      ARG  31   8.214 -13.247  -4.381
  232   HH12  ARG  31          2HH1      ARG  31   9.823 -13.461  -3.776
  233   HH21  ARG  31          1HH2      ARG  31   8.883 -15.680  -1.243
  234   HH22  ARG  31          2HH2      ARG  31  10.203 -14.845  -1.991
  235    H    MET  32           HN       MET  32   0.648 -13.091  -3.283
  236    HA   MET  32           HA       MET  32  -0.410 -15.387  -1.861
  237    HB2  MET  32          2HB       MET  32  -1.403 -12.535  -1.811
  238    HB3  MET  32          3HB       MET  32  -1.757 -13.801  -0.643
  239    HG2  MET  32          2HG       MET  32   1.002 -12.720  -1.144
  240    HG3  MET  32          3HG       MET  32  -0.085 -12.105   0.098
  241    HE1  MET  32          1HE       MET  32  -0.750 -14.700   2.441
  242    HE2  MET  32          2HE       MET  32   0.520 -13.570   2.912
  243    HE3  MET  32          3HE       MET  32  -0.827 -13.017   1.917
  244    H    GLY  33           HN       GLY  33  -0.710 -14.857  -4.869
  245    HA2  GLY  33          1HA       GLY  33  -2.321 -15.127  -6.486
  246    HA3  GLY  33          2HA       GLY  33  -3.134 -16.118  -5.284
  247    H    TYR  34           HN       TYR  34  -2.520 -12.730  -4.743
  248    HA   TYR  34           HA       TYR  34  -5.264 -12.201  -4.236
  249    HB2  TYR  34          2HB       TYR  34  -2.756 -10.589  -4.304
  250    HB3  TYR  34          3HB       TYR  34  -4.290  -9.730  -4.373
  251    HD1  TYR  34          1HD       TYR  34  -1.866 -10.357  -2.186
  252    HD2  TYR  34          2HD       TYR  34  -6.024 -11.164  -2.586
  253    HE1  TYR  34          1HE       TYR  34  -2.061 -10.524   0.260
  254    HE2  TYR  34          2HE       TYR  34  -6.232 -11.331  -0.141
  255    HH   TYR  34           HH       TYR  34  -3.773 -10.325   1.987
  256    H    ILE  35           HN       ILE  35  -3.268 -12.003  -7.051
  257    HA   ILE  35           HA       ILE  35  -5.573 -11.311  -8.663
  258    HB   ILE  35           HB       ILE  35  -4.956  -9.282  -9.437
  259   HG12  ILE  35          2HG1      ILE  35  -2.939 -10.037 -10.545
  260   HG13  ILE  35          3HG1      ILE  35  -2.595  -8.537  -9.693
  261   HG21  ILE  35          1HG2      ILE  35  -3.896  -7.886  -7.725
  262   HG22  ILE  35          2HG2      ILE  35  -5.081  -8.988  -7.026
  263   HG23  ILE  35          3HG2      ILE  35  -3.359  -9.338  -6.881
  264   HD11  ILE  35          1HD1      ILE  35  -0.825  -9.602  -8.878
  265   HD12  ILE  35          2HD1      ILE  35  -1.964 -10.454  -7.836
  266   HD13  ILE  35          3HD1      ILE  35  -1.447 -11.181  -9.358
  267    H    GLN  36           HN       GLN  36  -4.897 -11.243 -11.059
  268    HA   GLN  36           HA       GLN  36  -3.462 -13.670 -11.598
  269    HB2  GLN  36          2HB       GLN  36  -5.115 -11.760 -13.144
  270    HB3  GLN  36          3HB       GLN  36  -3.909 -12.657 -14.056
  271    HG2  GLN  36          2HG       GLN  36  -5.073 -14.553 -13.951
  272    HG3  GLN  36          3HG       GLN  36  -5.462 -14.329 -12.246
  273   HE21  GLN  36          1HE2      GLN  36  -6.837 -14.761 -15.107
  274   HE22  GLN  36          2HE2      GLN  36  -8.304 -13.871 -14.905
  275    H    GLY  37           HN       GLY  37  -3.094 -10.612 -13.360
  276    HA2  GLY  37          1HA       GLY  37  -0.167 -10.930 -13.083
  277    HA3  GLY  37          2HA       GLY  37  -0.932 -10.416 -14.580
  278    H    ASP  38           HN       ASP  38   0.820  -8.706 -14.069
  279    HA   ASP  38           HA       ASP  38  -0.585  -6.402 -12.984
  280    HB2  ASP  38          2HB       ASP  38   1.175  -5.734 -11.494
  281    HB3  ASP  38          3HB       ASP  38   0.735  -7.392 -11.093
  282    H    SER  39           HN       SER  39   1.462  -4.568 -13.042
  283    HA   SER  39           HA       SER  39   2.513  -4.725 -15.783
  284    HB2  SER  39          2HB       SER  39   0.380  -3.255 -15.415
  285    HB3  SER  39          3HB       SER  39   1.514  -2.115 -14.691
  286    HG   SER  39           HG       SER  39   1.613  -1.545 -16.753
  287    H    ALA  40           HN       ALA  40   4.293  -3.204 -16.196
  288    HA   ALA  40           HA       ALA  40   6.243  -3.332 -14.145
  289    HB1  ALA  40          1HB       ALA  40   6.654  -1.452 -16.393
  290    HB2  ALA  40          2HB       ALA  40   7.729  -2.682 -15.729
  291    HB3  ALA  40          3HB       ALA  40   6.410  -3.150 -16.801
  292    H    ALA  41           HN       ALA  41   7.534  -0.812 -14.483
  293    HA   ALA  41           HA       ALA  41   5.650   1.115 -13.338
  294    HB1  ALA  41          1HB       ALA  41   8.197   0.200 -12.018
  295    HB2  ALA  41          2HB       ALA  41   7.331   1.669 -11.563
  296    HB3  ALA  41          3HB       ALA  41   6.553   0.096 -11.386
  297    H    GLU  42           HN       GLU  42   9.058   1.575 -13.011
  298    HA   GLU  42           HA       GLU  42  10.317   3.358 -13.758
  299    HB2  GLU  42          2HB       GLU  42   9.891   1.370 -15.774
  300    HB3  GLU  42          3HB       GLU  42  10.037   2.943 -16.548
  301    HG2  GLU  42          2HG       GLU  42  12.204   3.231 -15.878
  302    HG3  GLU  42          3HG       GLU  42  12.025   2.183 -14.473
  303    H    VAL  43           HN       VAL  43   9.058   5.146 -13.171
  304    HA   VAL  43           HA       VAL  43   8.150   6.734 -15.384
  305    HB   VAL  43           HB       VAL  43   6.174   5.530 -13.489
  306   HG11  VAL  43          1HG1      VAL  43   5.964   8.255 -14.754
  307   HG12  VAL  43          2HG1      VAL  43   4.578   7.351 -14.143
  308   HG13  VAL  43          3HG1      VAL  43   5.861   7.849 -13.041
  309   HG21  VAL  43          1HG2      VAL  43   6.586   5.754 -16.387
  310   HG22  VAL  43          2HG2      VAL  43   5.793   4.490 -15.447
  311   HG23  VAL  43          3HG2      VAL  43   4.918   5.965 -15.855
  312    H    THR  44           HN       THR  44   8.171   6.341 -11.860
  313    HA   THR  44           HA       THR  44   9.579   8.772 -11.454
  314    HB   THR  44           HB       THR  44   6.973   9.317 -11.867
  315    HG1  THR  44          1HG       THR  44   8.469  10.941 -11.574
  316   HG21  THR  44          1HG2      THR  44   6.328   7.910  -9.902
  317   HG22  THR  44          2HG2      THR  44   5.798   9.588  -9.790
  318   HG23  THR  44          3HG2      THR  44   7.200   9.043  -8.870
  319    H    GLU  45           HN       GLU  45  10.375   8.954  -9.372
  320    HA   GLU  45           HA       GLU  45   9.745   6.690  -7.596
  321    HB2  GLU  45          2HB       GLU  45  12.278   8.135  -8.226
  322    HB3  GLU  45          3HB       GLU  45  12.080   7.472  -6.610
  323    HG2  GLU  45          2HG       GLU  45  11.672   5.258  -7.580
  324    HG3  GLU  45          3HG       GLU  45  11.914   5.931  -9.191
  325    H    MET  46           HN       MET  46   9.020   9.826  -7.954
  326    HA   MET  46           HA       MET  46   9.588  11.109  -5.565
  327    HB2  MET  46          2HB       MET  46   7.101  11.323  -7.272
  328    HB3  MET  46          3HB       MET  46   7.549  12.461  -6.009
  329    HG2  MET  46          2HG       MET  46   9.195  11.874  -8.458
  330    HG3  MET  46          3HG       MET  46   8.107  13.247  -8.272
  331    HE1  MET  46          1HE       MET  46  10.838  15.452  -8.110
  332    HE2  MET  46          2HE       MET  46  11.688  14.005  -8.654
  333    HE3  MET  46          3HE       MET  46  10.041  14.321  -9.204
  334    H    ALA  47           HN       ALA  47   6.335   9.845  -6.252
  335    HA   ALA  47           HA       ALA  47   4.900   8.593  -4.977
  336    HB1  ALA  47          1HB       ALA  47   7.321   7.678  -4.125
  337    HB2  ALA  47          2HB       ALA  47   6.616   8.284  -2.625
  338    HB3  ALA  47          3HB       ALA  47   5.758   7.070  -3.575
  339    H    HIS  48           HN       HIS  48   6.330  11.480  -4.136
  340    HA   HIS  48           HA       HIS  48   4.430  11.932  -1.930
  341    HB2  HIS  48          2HB       HIS  48   7.049  12.245  -1.704
  342    HB3  HIS  48          3HB       HIS  48   6.701  13.801  -2.450
  343    HD1  HIS  48          1HD       HIS  48   7.637  13.168   0.587
  344    HD2  HIS  48          2HD       HIS  48   3.863  14.308  -0.720
  345    HE1  HIS  48          1HE       HIS  48   6.520  14.207   2.586
  346    H    THR  49           HN       THR  49   5.917  13.513  -4.748
  347    HA   THR  49           HA       THR  49   4.452  15.834  -4.845
  348    HB   THR  49           HB       THR  49   4.781  15.817  -7.300
  349    HG1  THR  49          1HG       THR  49   6.276  13.542  -7.384
  350   HG21  THR  49          1HG2      THR  49   6.984  15.210  -5.392
  351   HG22  THR  49          2HG2      THR  49   6.669  16.674  -6.324
  352   HG23  THR  49          3HG2      THR  49   7.363  15.259  -7.113
  353    H    GLU  50           HN       GLU  50   2.778  16.328  -6.646
  354    HA   GLU  50           HA       GLU  50   0.496  14.600  -6.136
  355    HB2  GLU  50          2HB       GLU  50   0.839  17.359  -7.263
  356    HB3  GLU  50          3HB       GLU  50  -0.669  16.487  -7.500
  357    HG2  GLU  50          2HG       GLU  50  -1.231  17.528  -5.590
  358    HG3  GLU  50          3HG       GLU  50  -0.392  16.160  -4.862
  359    H    THR  51           HN       THR  51   2.198  13.210  -7.657
  360    HA   THR  51           HA       THR  51   1.490  13.541 -10.462
  361    HB   THR  51           HB       THR  51   2.990  11.474 -10.721
  362    HG1  THR  51          1HG       THR  51   4.314  12.044  -8.403
  363   HG21  THR  51          1HG2      THR  51   5.007  12.801 -10.650
  364   HG22  THR  51          2HG2      THR  51   4.248  13.961  -9.558
  365   HG23  THR  51          3HG2      THR  51   3.677  13.809 -11.220
  366    H    GLY  52           HN       GLY  52   1.136  11.127  -7.879
  367    HA2  GLY  52          1HA       GLY  52  -0.569   9.600  -7.549
  368    HA3  GLY  52          2HA       GLY  52  -1.365  10.236  -8.980
  369    H    TRP  53           HN       TRP  53   0.432   7.680  -7.680
  370    HA   TRP  53           HA       TRP  53   1.435   6.661 -10.182
  371    HB2  TRP  53          2HB       TRP  53   2.560   6.256  -7.984
  372    HB3  TRP  53          3HB       TRP  53   1.200   5.233  -7.527
  373    HD1  TRP  53          1HD       TRP  53   1.179   2.778  -8.423
  374    HE1  TRP  53          1HE       TRP  53   2.833   1.367  -9.800
  375    HE3  TRP  53          3HE       TRP  53   4.337   6.495  -9.953
  376    HZ2  TRP  53          2HZ       TRP  53   5.168   1.775 -11.332
  377    HZ3  TRP  53          3HZ       TRP  53   6.257   5.901 -11.373
  378    HH2  TRP  53          2HH       TRP  53   6.663   3.589 -12.047
  379    H    SER  54           HN       SER  54   0.693   4.857 -11.308
  380    HA   SER  54           HA       SER  54  -2.159   4.449 -11.167
  381    HB2  SER  54          2HB       SER  54  -1.476   2.751 -13.090
  382    HB3  SER  54          3HB       SER  54  -1.515   4.489 -13.380
  383    HG   SER  54           HG       SER  54   0.450   3.228 -14.017
  384    H    CYS  55           HN       CYS  55  -3.226   2.500 -10.788
  385    HA   CYS  55           HA       CYS  55  -1.725   0.173  -9.940
  386    HB2  CYS  55          2HB       CYS  55  -2.448   0.086  -7.709
  387    HB3  CYS  55          3HB       CYS  55  -1.978   1.768  -7.934
  388    H    HIS  56           HN       HIS  56  -3.777  -1.178  -8.641
  389    HA   HIS  56           HA       HIS  56  -5.376  -1.979 -10.873
  390    HB2  HIS  56          2HB       HIS  56  -4.655  -3.051  -8.319
  391    HB3  HIS  56          3HB       HIS  56  -6.409  -3.102  -8.478
  392    HD1  HIS  56          1HD       HIS  56  -6.741  -3.832 -11.399
  393    HD2  HIS  56          2HD       HIS  56  -3.896  -5.578  -8.928
  394    HE1  HIS  56          1HE       HIS  56  -6.194  -6.044 -12.463
  395    H    TYR  57           HN       TYR  57  -6.076  -0.417  -7.758
  396    HA   TYR  57           HA       TYR  57  -8.787   0.180  -8.708
  397    HB2  TYR  57          2HB       TYR  57  -7.777   0.708  -5.924
  398    HB3  TYR  57          3HB       TYR  57  -9.434   0.460  -6.464
  399    HD1  TYR  57          1HD       TYR  57  -7.202  -0.965  -4.443
  400    HD2  TYR  57          2HD       TYR  57  -9.386  -1.992  -7.947
  401    HE1  TYR  57          1HE       TYR  57  -7.035  -3.345  -3.842
  402    HE2  TYR  57          2HE       TYR  57  -9.225  -4.374  -7.357
  403    HH   TYR  57           HH       TYR  57  -8.414  -5.475  -4.362
  404    H    CYS  58           HN       CYS  58  -7.240   1.685 -10.125
  405    HA   CYS  58           HA       CYS  58  -6.920   4.261  -8.749
  406    HB2  CYS  58          2HB       CYS  58  -5.462   2.895 -10.884
  407    HB3  CYS  58          3HB       CYS  58  -5.840   4.570 -11.273
  408    H    ASP  59           HN       ASP  59  -7.694   3.301 -12.092
  409    HA   ASP  59           HA       ASP  59 -10.084   4.999 -11.973
  410    HB2  ASP  59          2HB       ASP  59  -7.837   5.182 -13.969
  411    HB3  ASP  59          3HB       ASP  59  -9.463   5.736 -14.361
  412    H    ASN  60           HN       ASN  60  -8.682   3.594 -14.863
  413    HA   ASN  60           HA       ASN  60 -10.145   1.168 -14.822
  414    HB2  ASN  60          2HB       ASN  60 -11.780   3.294 -15.352
  415    HB3  ASN  60          3HB       ASN  60 -11.297   2.813 -16.975
  416   HD21  ASN  60          1HD2      ASN  60 -13.845   2.573 -16.543
  417   HD22  ASN  60          2HD2      ASN  60 -14.323   0.937 -16.262
  Start of MODEL    6
    1    H1   GLU   1           HN       GLU   1   1.397   4.174   6.389
    2    HA   GLU   1           HA       GLU   1   0.913   2.728   4.700
    3    HB2  GLU   1          2HB       GLU   1   2.911   4.532   3.347
    4    HB3  GLU   1          3HB       GLU   1   2.109   3.222   2.491
    5    HG2  GLU   1          2HG       GLU   1   0.284   4.436   2.195
    6    HG3  GLU   1          3HG       GLU   1   0.189   4.823   3.911
    7    H    MET   2           HN       MET   2   1.513   0.728   5.310
    8    HA   MET   2           HA       MET   2   4.176  -0.179   4.472
    9    HB2  MET   2          2HB       MET   2   3.255  -1.547   6.866
   10    HB3  MET   2          3HB       MET   2   4.817  -0.815   6.523
   11    HG2  MET   2          2HG       MET   2   2.387   0.736   7.378
   12    HG3  MET   2          3HG       MET   2   3.620   0.137   8.486
   13    HE1  MET   2          1HE       MET   2   6.425   2.356   8.389
   14    HE2  MET   2          2HE       MET   2   5.785   0.741   8.698
   15    HE3  MET   2          3HE       MET   2   6.635   1.081   7.190
   16    H    CYS   3           HN       CYS   3   4.030  -1.873   3.166
   17    HA   CYS   3           HA       CYS   3   1.813  -3.054   2.195
   18    HB2  CYS   3          2HB       CYS   3   4.113  -3.478   1.372
   19    HB3  CYS   3          3HB       CYS   3   4.393  -4.531   2.756
   20    H    ASP   4           HN       ASP   4   0.180  -4.169   3.010
   21    HA   ASP   4           HA       ASP   4   0.122  -5.067   5.693
   22    HB2  ASP   4          2HB       ASP   4  -1.787  -4.478   3.865
   23    HB3  ASP   4          3HB       ASP   4  -1.831  -6.239   3.805
   24    H    VAL   5           HN       VAL   5   1.655  -6.379   3.082
   25    HA   VAL   5           HA       VAL   5   1.376  -9.130   4.100
   26    HB   VAL   5           HB       VAL   5   2.255  -8.199   1.363
   27   HG11  VAL   5          1HG1      VAL   5   3.475 -10.136   1.646
   28   HG12  VAL   5          2HG1      VAL   5   2.256 -10.879   2.682
   29   HG13  VAL   5          3HG1      VAL   5   1.981 -10.756   0.944
   30   HG21  VAL   5          1HG2      VAL   5   0.054  -9.935   1.216
   31   HG22  VAL   5          2HG2      VAL   5  -0.322  -8.774   2.490
   32   HG23  VAL   5          3HG2      VAL   5   0.087  -8.206   0.872
   33    H    CYS   6           HN       CYS   6   3.377  -6.510   4.194
   34    HA   CYS   6           HA       CYS   6   5.659  -8.180   4.929
   35    HB2  CYS   6          2HB       CYS   6   5.880  -5.843   3.019
   36    HB3  CYS   6          3HB       CYS   6   7.227  -6.775   3.664
   37    H    GLU   7           HN       GLU   7   4.518  -4.816   4.645
   38    HA   GLU   7           HA       GLU   7   4.345  -3.186   6.251
   39    HB2  GLU   7          2HB       GLU   7   5.773  -4.870   8.273
   40    HB3  GLU   7          3HB       GLU   7   4.507  -3.676   8.516
   41    HG2  GLU   7          2HG       GLU   7   3.239  -5.566   7.002
   42    HG3  GLU   7          3HG       GLU   7   4.315  -6.539   8.003
   43    H    VAL   8           HN       VAL   8   6.036  -2.451   4.645
   44    HA   VAL   8           HA       VAL   8   8.300  -1.449   6.118
   45    HB   VAL   8           HB       VAL   8   9.574  -2.372   3.809
   46   HG11  VAL   8          1HG1      VAL   8  10.740  -2.128   5.847
   47   HG12  VAL   8          2HG1      VAL   8   9.655  -3.238   6.688
   48   HG13  VAL   8          3HG1      VAL   8  10.779  -3.851   5.475
   49   HG21  VAL   8          1HG2      VAL   8   9.251  -4.779   3.845
   50   HG22  VAL   8          2HG2      VAL   8   8.022  -4.615   5.099
   51   HG23  VAL   8          3HG2      VAL   8   7.729  -3.963   3.487
   52    H    TRP   9           HN       TRP   9   8.746   0.554   5.457
   53    HA   TRP   9           HA       TRP   9   8.135   1.322   2.695
   54    HB2  TRP   9          2HB       TRP   9   6.203   2.172   3.648
   55    HB3  TRP   9          3HB       TRP   9   6.987   2.510   5.189
   56    HD1  TRP   9          1HD       TRP   9   7.889   4.917   5.564
   57    HE1  TRP   9          1HE       TRP   9   7.947   7.061   4.142
   58    HE3  TRP   9          3HE       TRP   9   6.446   2.949   1.072
   59    HZ2  TRP   9          2HZ       TRP   9   7.444   7.818   1.469
   60    HZ3  TRP   9          3HZ       TRP   9   6.258   4.452  -0.867
   61    HH2  TRP   9          2HH       TRP   9   6.747   6.835  -0.671
   62    H    THR  10           HN       THR  10   9.129   3.406   2.086
   63    HA   THR  10           HA       THR  10  11.280   4.379   3.768
   64    HB   THR  10           HB       THR  10  11.985   3.315   1.033
   65    HG1  THR  10          1HG       THR  10  13.007   1.601   2.237
   66   HG21  THR  10          1HG2      THR  10  13.281   5.155   2.542
   67   HG22  THR  10          2HG2      THR  10  14.085   4.056   1.421
   68   HG23  THR  10          3HG2      THR  10  14.014   3.668   3.140
   69    H    ALA  11           HN       ALA  11  10.484   4.414   0.288
   70    HA   ALA  11           HA       ALA  11   9.228   6.792   0.020
   71    HB1  ALA  11          1HB       ALA  11  12.045   7.215   0.727
   72    HB2  ALA  11          2HB       ALA  11  11.483   8.136  -0.669
   73    HB3  ALA  11          3HB       ALA  11  10.658   8.294   0.882
   74    H    GLU  12           HN       GLU  12  11.693   4.661  -1.180
   75    HA   GLU  12           HA       GLU  12  12.234   5.334  -3.705
   76    HB2  GLU  12          2HB       GLU  12  11.586   2.727  -2.447
   77    HB3  GLU  12          3HB       GLU  12  11.607   2.767  -4.205
   78    HG2  GLU  12          2HG       GLU  12  13.902   3.840  -3.997
   79    HG3  GLU  12          3HG       GLU  12  13.848   3.355  -2.303
   80    H    SER  13           HN       SER  13   9.589   3.016  -3.511
   81    HA   SER  13           HA       SER  13   7.618   4.719  -4.654
   82    HB2  SER  13          2HB       SER  13   7.493   3.774  -6.881
   83    HB3  SER  13          3HB       SER  13   9.124   4.394  -6.622
   84    HG   SER  13           HG       SER  13   8.319   1.874  -7.168
   85    H    LEU  14           HN       LEU  14   6.460   3.794  -2.917
   86    HA   LEU  14           HA       LEU  14   5.904   0.933  -3.031
   87    HB2  LEU  14          2HB       LEU  14   6.401   2.242  -0.892
   88    HB3  LEU  14          3HB       LEU  14   4.771   2.892  -1.058
   89    HG   LEU  14           HG       LEU  14   4.029   0.420  -1.085
   90   HD11  LEU  14          1HD1      LEU  14   6.561  -0.010   0.450
   91   HD12  LEU  14          2HD1      LEU  14   6.504  -0.287  -1.291
   92   HD13  LEU  14          3HD1      LEU  14   5.442  -1.199  -0.219
   93   HD21  LEU  14          1HD2      LEU  14   4.915   0.763   1.615
   94   HD22  LEU  14          2HD2      LEU  14   3.296   0.953   0.940
   95   HD23  LEU  14          3HD2      LEU  14   4.412   2.320   0.953
   96    H    PHE  15           HN       PHE  15   3.811   0.080  -3.226
   97    HA   PHE  15           HA       PHE  15   1.950   1.847  -4.649
   98    HB2  PHE  15          2HB       PHE  15   1.532  -1.100  -4.569
   99    HB3  PHE  15          3HB       PHE  15   1.250   0.040  -5.881
  100    HD1  PHE  15          1HD       PHE  15   3.575   1.231  -6.653
  101    HD2  PHE  15          2HD       PHE  15   3.163  -2.650  -4.954
  102    HE1  PHE  15          1HE       PHE  15   5.696   0.551  -7.700
  103    HE2  PHE  15          2HE       PHE  15   5.283  -3.335  -5.998
  104    HZ   PHE  15           HZ       PHE  15   6.553  -1.734  -7.373
  105    HA   PRO  16           HA       PRO  16  -0.230   1.311  -5.440
  106    HB2  PRO  16          2HB       PRO  16  -2.238   3.104  -5.087
  107    HB3  PRO  16          3HB       PRO  16  -2.492   1.356  -5.040
  108    HG2  PRO  16          2HG       PRO  16  -2.186   3.286  -2.773
  109    HG3  PRO  16          3HG       PRO  16  -3.329   1.943  -2.952
  110    HD2  PRO  16          2HD       PRO  16  -1.081   1.753  -1.456
  111    HD3  PRO  16          3HD       PRO  16  -1.769   0.366  -2.325
  112    H    CYS  17           HN       CYS  17  -0.634   3.578  -6.566
  113    HA   CYS  17           HA       CYS  17   1.629   5.049  -6.550
  114    HB2  CYS  17          2HB       CYS  17   0.282   6.956  -7.447
  115    HB3  CYS  17          3HB       CYS  17  -0.052   5.417  -8.233
  116    H    ARG  18           HN       ARG  18  -1.250   5.785  -4.593
  117    HA   ARG  18           HA       ARG  18  -0.113   6.461  -2.248
  118    HB2  ARG  18          2HB       ARG  18   1.242   8.202  -2.672
  119    HB3  ARG  18          3HB       ARG  18   0.541   8.463  -4.264
  120    HG2  ARG  18          2HG       ARG  18   0.301  10.407  -2.782
  121    HG3  ARG  18          3HG       ARG  18  -1.253   9.759  -3.309
  122    HD2  ARG  18          2HD       ARG  18  -0.710   8.378  -0.973
  123    HD3  ARG  18          3HD       ARG  18  -0.151  10.016  -0.635
  124    HE   ARG  18           HE       ARG  18  -2.658  10.245  -1.795
  125   HH11  ARG  18          1HH1      ARG  18  -1.259   8.862   1.078
  126   HH12  ARG  18          2HH1      ARG  18  -2.688   9.076   2.034
  127   HH21  ARG  18          1HH2      ARG  18  -4.544  10.532  -0.547
  128   HH22  ARG  18          2HH2      ARG  18  -4.557  10.026   1.108
  129    H    VAL  19           HN       VAL  19  -2.199   8.222  -4.546
  130    HA   VAL  19           HA       VAL  19  -4.065   9.171  -2.724
  131    HB   VAL  19           HB       VAL  19  -5.505   9.603  -4.529
  132   HG11  VAL  19          1HG1      VAL  19  -3.035  10.494  -4.616
  133   HG12  VAL  19          2HG1      VAL  19  -2.963   9.510  -6.079
  134   HG13  VAL  19          3HG1      VAL  19  -4.155  10.803  -5.942
  135   HG21  VAL  19          1HG2      VAL  19  -5.779   7.367  -5.380
  136   HG22  VAL  19          2HG2      VAL  19  -5.324   8.434  -6.709
  137   HG23  VAL  19          3HG2      VAL  19  -4.126   7.357  -5.994
  138    H    CYS  20           HN       CYS  20  -4.089   6.123  -4.549
  139    HA   CYS  20           HA       CYS  20  -6.541   5.130  -3.743
  140    HB2  CYS  20          2HB       CYS  20  -3.980   3.594  -4.235
  141    HB3  CYS  20          3HB       CYS  20  -5.590   2.883  -4.172
  142    H    THR  21           HN       THR  21  -6.975   3.345  -2.206
  143    HA   THR  21           HA       THR  21  -5.814   3.997   0.387
  144    HB   THR  21           HB       THR  21  -7.684   3.041   1.389
  145    HG1  THR  21          1HG       THR  21  -8.967   1.474   0.381
  146   HG21  THR  21          1HG2      THR  21  -8.259   5.022  -0.010
  147   HG22  THR  21          2HG2      THR  21  -9.616   3.928   0.258
  148   HG23  THR  21          3HG2      THR  21  -8.768   3.919  -1.288
  149    H    ARG  22           HN       ARG  22  -5.389   2.182   1.921
  150    HA   ARG  22           HA       ARG  22  -4.125   0.386   2.513
  151    HB2  ARG  22          2HB       ARG  22  -5.259  -0.897   0.023
  152    HB3  ARG  22          3HB       ARG  22  -4.620  -1.718   1.440
  153    HG2  ARG  22          2HG       ARG  22  -6.537  -0.278   2.617
  154    HG3  ARG  22          3HG       ARG  22  -7.245  -0.441   1.009
  155    HD2  ARG  22          2HD       ARG  22  -6.103  -2.899   2.167
  156    HD3  ARG  22          3HD       ARG  22  -7.532  -2.262   2.980
  157    HE   ARG  22           HE       ARG  22  -7.514  -3.672   0.565
  158   HH11  ARG  22          1HH1      ARG  22  -8.912  -0.797   1.945
  159   HH12  ARG  22          2HH1      ARG  22 -10.326  -0.847   0.945
  160   HH21  ARG  22          1HH2      ARG  22  -9.371  -3.749  -0.757
  161   HH22  ARG  22          2HH2      ARG  22 -10.586  -2.527  -0.590
  162    H    VAL  23           HN       VAL  23  -2.263  -0.969   1.912
  163    HA   VAL  23           HA       VAL  23  -0.863  -0.044  -0.500
  164    HB   VAL  23           HB       VAL  23   1.243   0.139   0.760
  165   HG11  VAL  23          1HG1      VAL  23  -0.287   1.997   2.362
  166   HG12  VAL  23          2HG1      VAL  23   0.832   2.310   1.033
  167   HG13  VAL  23          3HG1      VAL  23  -0.862   1.952   0.696
  168   HG21  VAL  23          1HG2      VAL  23  -0.538  -0.557   3.067
  169   HG22  VAL  23          2HG2      VAL  23   1.021  -1.251   2.616
  170   HG23  VAL  23          3HG2      VAL  23   0.943   0.368   3.311
  171    H    PHE  24           HN       PHE  24  -0.003  -1.654  -1.641
  172    HA   PHE  24           HA       PHE  24   0.871  -4.094  -0.313
  173    HB2  PHE  24          2HB       PHE  24  -0.509  -5.014  -2.588
  174    HB3  PHE  24          3HB       PHE  24  -0.929  -5.284  -0.900
  175    HD1  PHE  24          1HD       PHE  24  -2.919  -4.457  -0.047
  176    HD2  PHE  24          2HD       PHE  24  -1.374  -2.855  -3.676
  177    HE1  PHE  24          1HE       PHE  24  -4.992  -3.168  -0.356
  178    HE2  PHE  24          2HE       PHE  24  -3.444  -1.563  -3.990
  179    HZ   PHE  24           HZ       PHE  24  -5.255  -1.717  -2.328
  180    H    HIS  25           HN       HIS  25   2.596  -5.021  -1.283
  181    HA   HIS  25           HA       HIS  25   4.039  -3.588  -3.229
  182    HB2  HIS  25          2HB       HIS  25   4.348  -6.421  -2.224
  183    HB3  HIS  25          3HB       HIS  25   5.503  -5.630  -3.292
  184    HD2  HIS  25          2HD       HIS  25   4.530  -2.969  -0.903
  185    HE1  HIS  25          1HE       HIS  25   7.717  -5.014   1.008
  186    HE2  HIS  25          2HE       HIS  25   6.223  -2.988   1.052
  187    H    ASP  26           HN       ASP  26   4.990  -5.031  -5.167
  188    HA   ASP  26           HA       ASP  26   2.660  -5.613  -6.832
  189    HB2  ASP  26          2HB       ASP  26   4.201  -4.050  -7.804
  190    HB3  ASP  26          3HB       ASP  26   5.565  -5.123  -7.501
  191    H    GLY  27           HN       GLY  27   5.413  -7.163  -5.373
  192    HA2  GLY  27          1HA       GLY  27   5.023  -9.606  -6.921
  193    HA3  GLY  27          2HA       GLY  27   6.293  -9.312  -5.744
  194    H    CYS  28           HN       CYS  28   3.949  -8.259  -3.981
  195    HA   CYS  28           HA       CYS  28   3.594 -10.743  -2.578
  196    HB2  CYS  28          2HB       CYS  28   2.809  -7.892  -2.088
  197    HB3  CYS  28          3HB       CYS  28   2.065  -9.175  -1.138
  198    H    LEU  29           HN       LEU  29   1.281  -8.355  -3.881
  199    HA   LEU  29           HA       LEU  29  -1.039  -9.793  -3.563
  200    HB2  LEU  29          2HB       LEU  29  -0.359  -8.026  -5.908
  201    HB3  LEU  29          3HB       LEU  29  -1.979  -8.466  -5.370
  202    HG   LEU  29           HG       LEU  29  -0.031  -6.837  -3.742
  203   HD11  LEU  29          1HD1      LEU  29  -0.667  -4.997  -4.809
  204   HD12  LEU  29          2HD1      LEU  29  -2.370  -5.440  -4.692
  205   HD13  LEU  29          3HD1      LEU  29  -1.393  -6.039  -6.032
  206   HD21  LEU  29          1HD2      LEU  29  -2.756  -7.905  -3.309
  207   HD22  LEU  29          2HD2      LEU  29  -2.452  -6.254  -2.768
  208   HD23  LEU  29          3HD2      LEU  29  -1.465  -7.581  -2.153
  209    H    ARG  30           HN       ARG  30   1.340 -10.028  -6.156
  210    HA   ARG  30           HA       ARG  30  -0.184 -11.848  -7.742
  211    HB2  ARG  30          2HB       ARG  30   2.405 -10.539  -7.882
  212    HB3  ARG  30          3HB       ARG  30   2.497 -12.215  -8.406
  213    HG2  ARG  30          2HG       ARG  30   0.996 -11.877 -10.157
  214    HG3  ARG  30          3HG       ARG  30   0.392 -10.370  -9.467
  215    HD2  ARG  30          2HD       ARG  30   1.923  -9.191 -10.566
  216    HD3  ARG  30          3HD       ARG  30   3.221 -10.188  -9.913
  217    HE   ARG  30           HE       ARG  30   1.998 -10.407 -12.515
  218   HH11  ARG  30          1HH1      ARG  30   3.875 -12.006 -10.058
  219   HH12  ARG  30          2HH1      ARG  30   4.585 -13.143 -11.155
  220   HH21  ARG  30          1HH2      ARG  30   2.925 -11.899 -13.971
  221   HH22  ARG  30          2HH2      ARG  30   4.045 -13.080 -13.381
  222    H    ARG  31           HN       ARG  31   2.593 -12.239  -5.551
  223    HA   ARG  31           HA       ARG  31   2.704 -15.063  -5.798
  224    HB2  ARG  31          2HB       ARG  31   4.495 -13.387  -4.929
  225    HB3  ARG  31          3HB       ARG  31   3.690 -13.586  -3.380
  226    HG2  ARG  31          2HG       ARG  31   4.671 -15.931  -4.973
  227    HG3  ARG  31          3HG       ARG  31   5.709 -15.055  -3.847
  228    HD2  ARG  31          2HD       ARG  31   3.486 -15.476  -2.331
  229    HD3  ARG  31          3HD       ARG  31   3.512 -16.929  -3.329
  230    HE   ARG  31           HE       ARG  31   5.364 -17.641  -2.185
  231   HH11  ARG  31          1HH1      ARG  31   4.860 -14.255  -1.554
  232   HH12  ARG  31          2HH1      ARG  31   6.071 -14.171  -0.319
  233   HH21  ARG  31          1HH2      ARG  31   6.961 -17.544  -0.560
  234   HH22  ARG  31          2HH2      ARG  31   7.267 -16.042   0.245
  235    H    MET  32           HN       MET  32   0.520 -13.039  -4.236
  236    HA   MET  32           HA       MET  32  -0.235 -15.111  -2.294
  237    HB2  MET  32          2HB       MET  32  -1.019 -12.196  -2.454
  238    HB3  MET  32          3HB       MET  32  -1.607 -13.327  -1.242
  239    HG2  MET  32          2HG       MET  32   1.315 -12.782  -1.623
  240    HG3  MET  32          3HG       MET  32   0.299 -11.784  -0.586
  241    HE1  MET  32          1HE       MET  32   0.110 -12.755   2.319
  242    HE2  MET  32          2HE       MET  32  -1.146 -12.576   1.093
  243    HE3  MET  32          3HE       MET  32  -1.031 -14.068   2.026
  244    H    GLY  33           HN       GLY  33  -0.837 -14.727  -5.328
  245    HA2  GLY  33          1HA       GLY  33  -2.628 -15.008  -6.753
  246    HA3  GLY  33          2HA       GLY  33  -3.181 -16.119  -5.509
  247    H    TYR  34           HN       TYR  34  -2.827 -12.756  -4.756
  248    HA   TYR  34           HA       TYR  34  -5.567 -12.539  -4.011
  249    HB2  TYR  34          2HB       TYR  34  -3.175 -10.793  -3.940
  250    HB3  TYR  34          3HB       TYR  34  -4.732  -9.972  -3.971
  251    HD1  TYR  34          1HD       TYR  34  -2.365 -10.579  -1.776
  252    HD2  TYR  34          2HD       TYR  34  -6.421 -11.722  -2.358
  253    HE1  TYR  34          1HE       TYR  34  -2.602 -10.949   0.645
  254    HE2  TYR  34          2HE       TYR  34  -6.670 -12.094   0.060
  255    HH   TYR  34           HH       TYR  34  -4.415 -12.606   2.083
  256    H    ILE  35           HN       ILE  35  -3.638 -11.291  -6.702
  257    HA   ILE  35           HA       ILE  35  -6.079 -10.221  -7.934
  258    HB   ILE  35           HB       ILE  35  -4.575  -9.054  -9.498
  259   HG12  ILE  35          2HG1      ILE  35  -2.225  -9.756  -7.789
  260   HG13  ILE  35          3HG1      ILE  35  -2.737 -10.899  -9.026
  261   HG21  ILE  35          1HG2      ILE  35  -3.465  -7.574  -7.723
  262   HG22  ILE  35          2HG2      ILE  35  -5.219  -7.743  -7.676
  263   HG23  ILE  35          3HG2      ILE  35  -4.215  -8.653  -6.547
  264   HD11  ILE  35          1HD1      ILE  35  -2.526  -8.159  -9.992
  265   HD12  ILE  35          2HD1      ILE  35  -1.005  -8.827  -9.396
  266   HD13  ILE  35          3HD1      ILE  35  -1.895  -9.658 -10.671
  267    H    GLN  36           HN       GLN  36  -5.888 -10.342 -10.474
  268    HA   GLN  36           HA       GLN  36  -5.975 -13.141 -11.116
  269    HB2  GLN  36          2HB       GLN  36  -7.331 -10.976 -12.035
  270    HB3  GLN  36          3HB       GLN  36  -6.142 -11.180 -13.315
  271    HG2  GLN  36          2HG       GLN  36  -7.657 -12.580 -14.175
  272    HG3  GLN  36          3HG       GLN  36  -6.991 -13.726 -13.014
  273   HE21  GLN  36          1HE2      GLN  36  -8.038 -13.609 -10.806
  274   HE22  GLN  36          2HE2      GLN  36  -9.760 -13.466 -10.777
  275    H    GLY  37           HN       GLY  37  -5.148 -12.864 -13.882
  276    HA2  GLY  37          1HA       GLY  37  -2.224 -12.657 -13.498
  277    HA3  GLY  37          2HA       GLY  37  -2.967 -13.938 -14.444
  278    H    ASP  38           HN       ASP  38  -2.513 -10.433 -14.287
  279    HA   ASP  38           HA       ASP  38  -1.826 -10.212 -17.006
  280    HB2  ASP  38          2HB       ASP  38  -3.792  -9.008 -17.863
  281    HB3  ASP  38          3HB       ASP  38  -4.201 -10.659 -17.399
  282    H    SER  39           HN       SER  39  -0.223  -9.137 -15.605
  283    HA   SER  39           HA       SER  39  -0.727  -6.287 -15.545
  284    HB2  SER  39          2HB       SER  39  -0.024  -7.799 -13.017
  285    HB3  SER  39          3HB       SER  39   0.013  -6.043 -13.181
  286    HG   SER  39           HG       SER  39  -1.963  -6.513 -12.354
  287    H    ALA  40           HN       ALA  40   1.233  -5.035 -15.196
  288    HA   ALA  40           HA       ALA  40   3.784  -6.262 -14.998
  289    HB1  ALA  40          1HB       ALA  40   4.601  -6.086 -17.210
  290    HB2  ALA  40          2HB       ALA  40   3.058  -6.935 -17.321
  291    HB3  ALA  40          3HB       ALA  40   3.159  -5.228 -17.753
  292    H    ALA  41           HN       ALA  41   5.359  -4.774 -14.586
  293    HA   ALA  41           HA       ALA  41   5.060  -2.004 -15.316
  294    HB1  ALA  41          1HB       ALA  41   4.693  -2.886 -12.467
  295    HB2  ALA  41          2HB       ALA  41   5.209  -1.253 -12.892
  296    HB3  ALA  41          3HB       ALA  41   3.645  -1.856 -13.444
  297    H    GLU  42           HN       GLU  42   6.672  -2.769 -12.356
  298    HA   GLU  42           HA       GLU  42   8.866  -2.710 -11.753
  299    HB2  GLU  42          2HB       GLU  42   9.670  -3.898 -14.372
  300    HB3  GLU  42          3HB       GLU  42  10.236  -4.277 -12.751
  301    HG2  GLU  42          2HG       GLU  42   8.379  -5.606 -12.281
  302    HG3  GLU  42          3HG       GLU  42   7.444  -4.926 -13.612
  303    H    VAL  43           HN       VAL  43   7.801  -0.427 -13.166
  304    HA   VAL  43           HA       VAL  43  10.039   0.515 -14.791
  305    HB   VAL  43           HB       VAL  43   7.290   0.974 -14.911
  306   HG11  VAL  43          1HG1      VAL  43   7.636   2.653 -13.095
  307   HG12  VAL  43          2HG1      VAL  43   8.677   3.553 -14.199
  308   HG13  VAL  43          3HG1      VAL  43   6.971   3.321 -14.585
  309   HG21  VAL  43          1HG2      VAL  43   9.655   2.246 -16.263
  310   HG22  VAL  43          2HG2      VAL  43   8.613   0.957 -16.863
  311   HG23  VAL  43          3HG2      VAL  43   7.993   2.602 -16.732
  312    H    THR  44           HN       THR  44   8.758   0.788 -11.614
  313    HA   THR  44           HA       THR  44   9.460   1.898  -9.754
  314    HB   THR  44           HB       THR  44  11.913   2.706 -11.315
  315    HG1  THR  44          1HG       THR  44  11.297   0.333 -11.248
  316   HG21  THR  44          1HG2      THR  44  12.618   3.538  -9.374
  317   HG22  THR  44          2HG2      THR  44  12.387   1.971  -8.599
  318   HG23  THR  44          3HG2      THR  44  11.063   3.135  -8.648
  319    H    GLU  45           HN       GLU  45   7.900   3.487  -9.712
  320    HA   GLU  45           HA       GLU  45   8.277   5.922 -11.247
  321    HB2  GLU  45          2HB       GLU  45   6.089   4.704  -9.674
  322    HB3  GLU  45          3HB       GLU  45   6.153   6.460  -9.657
  323    HG2  GLU  45          2HG       GLU  45   6.257   4.931 -12.227
  324    HG3  GLU  45          3HG       GLU  45   4.726   5.306 -11.441
  325    H    MET  46           HN       MET  46   7.006   6.006  -8.000
  326    HA   MET  46           HA       MET  46   9.313   6.853  -6.639
  327    HB2  MET  46          2HB       MET  46   8.057   9.323  -6.530
  328    HB3  MET  46          3HB       MET  46   9.545   8.949  -7.390
  329    HG2  MET  46          2HG       MET  46   8.526   8.911  -9.427
  330    HG3  MET  46          3HG       MET  46   6.970   8.419  -8.763
  331    HE1  MET  46          1HE       MET  46   8.498  12.658  -7.897
  332    HE2  MET  46          2HE       MET  46   8.423  11.375  -6.689
  333    HE3  MET  46          3HE       MET  46   9.516  11.228  -8.066
  334    H    ALA  47           HN       ALA  47   5.834   6.912  -6.973
  335    HA   ALA  47           HA       ALA  47   4.156   6.576  -5.470
  336    HB1  ALA  47          1HB       ALA  47   5.580   4.739  -4.664
  337    HB2  ALA  47          2HB       ALA  47   6.362   5.855  -3.544
  338    HB3  ALA  47          3HB       ALA  47   4.647   5.484  -3.365
  339    H    HIS  48           HN       HIS  48   3.473   7.281  -3.110
  340    HA   HIS  48           HA       HIS  48   2.894   9.063  -1.814
  341    HB2  HIS  48          2HB       HIS  48   4.956   8.727  -0.695
  342    HB3  HIS  48          3HB       HIS  48   5.881   9.409  -2.030
  343    HD1  HIS  48          1HD       HIS  48   3.007  11.490  -1.292
  344    HD2  HIS  48          2HD       HIS  48   6.872  11.087   0.178
  345    HE1  HIS  48          1HE       HIS  48   3.466  13.608  -0.017
  346    H    THR  49           HN       THR  49   5.484  10.956  -3.182
  347    HA   THR  49           HA       THR  49   3.666  13.012  -3.988
  348    HB   THR  49           HB       THR  49   6.564  12.911  -4.791
  349    HG1  THR  49          1HG       THR  49   6.921  13.952  -2.696
  350   HG21  THR  49          1HG2      THR  49   4.454  14.858  -4.859
  351   HG22  THR  49          2HG2      THR  49   6.092  14.970  -5.503
  352   HG23  THR  49          3HG2      THR  49   5.766  15.434  -3.832
  353    H    GLU  50           HN       GLU  50   3.202  13.749  -6.062
  354    HA   GLU  50           HA       GLU  50   2.730  13.591  -8.282
  355    HB2  GLU  50          2HB       GLU  50   5.463  12.800  -8.014
  356    HB3  GLU  50          3HB       GLU  50   4.710  11.791  -9.240
  357    HG2  GLU  50          2HG       GLU  50   3.851  13.943 -10.273
  358    HG3  GLU  50          3HG       GLU  50   4.966  14.779  -9.193
  359    H    THR  51           HN       THR  51   2.068  12.055 -10.011
  360    HA   THR  51           HA       THR  51   1.385   9.399  -8.941
  361    HB   THR  51           HB       THR  51  -0.600  10.605 -10.763
  362    HG1  THR  51          1HG       THR  51  -1.447  11.975  -9.236
  363   HG21  THR  51          1HG2      THR  51  -1.253   8.541  -9.951
  364   HG22  THR  51          2HG2      THR  51  -2.059   9.631  -8.824
  365   HG23  THR  51          3HG2      THR  51  -0.559   8.833  -8.357
  366    H    GLY  52           HN       GLY  52   0.693   7.865 -10.680
  367    HA2  GLY  52          1HA       GLY  52   0.907   8.080 -13.361
  368    HA3  GLY  52          2HA       GLY  52   2.590   8.021 -12.860
  369    H    TRP  53           HN       TRP  53   1.883   6.246 -10.569
  370    HA   TRP  53           HA       TRP  53   2.207   3.765 -11.966
  371    HB2  TRP  53          2HB       TRP  53   3.360   4.199  -9.838
  372    HB3  TRP  53          3HB       TRP  53   1.806   4.305  -9.015
  373    HD1  TRP  53          1HD       TRP  53   0.429   1.991  -8.703
  374    HE1  TRP  53          1HE       TRP  53   1.238  -0.450  -8.613
  375    HE3  TRP  53          3HE       TRP  53   5.071   2.599 -10.758
  376    HZ2  TRP  53          2HZ       TRP  53   3.540  -1.924  -9.319
  377    HZ3  TRP  53          3HZ       TRP  53   6.514   0.623 -11.014
  378    HH2  TRP  53          2HH       TRP  53   5.763  -1.590 -10.309
  379    H    SER  54           HN       SER  54   0.703   2.330 -12.532
  380    HA   SER  54           HA       SER  54  -2.074   2.927 -12.054
  381    HB2  SER  54          2HB       SER  54  -1.711   0.347 -13.252
  382    HB3  SER  54          3HB       SER  54  -2.337   1.824 -13.985
  383    HG   SER  54           HG       SER  54  -0.551   1.887 -15.068
  384    H    CYS  55           HN       CYS  55  -3.586   1.578 -11.022
  385    HA   CYS  55           HA       CYS  55  -2.582  -0.644  -9.426
  386    HB2  CYS  55          2HB       CYS  55  -4.281   1.272  -7.928
  387    HB3  CYS  55          3HB       CYS  55  -2.967   0.248  -7.359
  388    H    HIS  56           HN       HIS  56  -4.470  -1.668  -8.178
  389    HA   HIS  56           HA       HIS  56  -6.410  -2.515  -9.988
  390    HB2  HIS  56          2HB       HIS  56  -5.608  -3.311  -7.499
  391    HB3  HIS  56          3HB       HIS  56  -7.207  -2.654  -7.156
  392    HD1  HIS  56          1HD       HIS  56  -5.503  -5.587  -8.546
  393    HD2  HIS  56          2HD       HIS  56  -9.331  -3.975  -8.609
  394    HE1  HIS  56          1HE       HIS  56  -7.001  -7.445  -9.338
  395    H    TYR  57           HN       TYR  57  -6.829  -0.320  -7.206
  396    HA   TYR  57           HA       TYR  57  -9.408   0.525  -8.284
  397    HB2  TYR  57          2HB       TYR  57  -8.117   1.394  -5.696
  398    HB3  TYR  57          3HB       TYR  57  -9.812   1.543  -6.151
  399    HD1  TYR  57          1HD       TYR  57 -10.909  -0.831  -6.817
  400    HD2  TYR  57          2HD       TYR  57  -7.593  -0.281  -4.209
  401    HE1  TYR  57          1HE       TYR  57 -11.388  -3.001  -5.761
  402    HE2  TYR  57          2HE       TYR  57  -8.060  -2.449  -3.146
  403    HH   TYR  57           HH       TYR  57 -10.936  -4.096  -3.520
  404    H    CYS  58           HN       CYS  58  -6.820   1.267  -9.520
  405    HA   CYS  58           HA       CYS  58  -6.676   4.141  -9.032
  406    HB2  CYS  58          2HB       CYS  58  -4.747   2.264  -9.624
  407    HB3  CYS  58          3HB       CYS  58  -4.998   3.055 -11.175
  408    H    ASP  59           HN       ASP  59  -7.223   1.900 -11.737
  409    HA   ASP  59           HA       ASP  59  -8.916   3.923 -12.999
  410    HB2  ASP  59          2HB       ASP  59  -6.566   2.567 -14.327
  411    HB3  ASP  59          3HB       ASP  59  -7.851   3.370 -15.227
  412    H    ASN  60           HN       ASN  60 -10.610   3.103 -14.168
  413    HA   ASN  60           HA       ASN  60 -11.494   0.505 -13.568
  414    HB2  ASN  60          2HB       ASN  60 -12.780   2.669 -14.375
  415    HB3  ASN  60          3HB       ASN  60 -12.558   1.940 -15.964
  416   HD21  ASN  60          1HD2      ASN  60 -14.601   1.350 -16.402
  417   HD22  ASN  60          2HD2      ASN  60 -15.515   0.221 -15.467
  Start of MODEL    7
    1    H1   GLU   1           HN       GLU   1   1.450   4.274   5.442
    2    HA   GLU   1           HA       GLU   1   1.068   2.742   3.778
    3    HB2  GLU   1          2HB       GLU   1   3.327   4.471   2.897
    4    HB3  GLU   1          3HB       GLU   1   2.928   3.078   1.901
    5    HG2  GLU   1          2HG       GLU   1   0.781   3.883   1.436
    6    HG3  GLU   1          3HG       GLU   1   0.843   5.057   2.749
    7    H    MET   2           HN       MET   2   1.811   1.136   5.553
    8    HA   MET   2           HA       MET   2   4.241  -0.285   4.729
    9    HB2  MET   2          2HB       MET   2   2.651  -1.092   7.122
   10    HB3  MET   2          3HB       MET   2   4.388  -1.159   6.859
   11    HG2  MET   2          2HG       MET   2   4.070   1.485   6.835
   12    HG3  MET   2          3HG       MET   2   2.699   1.050   7.852
   13    HE1  MET   2          1HE       MET   2   7.137   0.841   8.890
   14    HE2  MET   2          2HE       MET   2   6.535   0.267   7.334
   15    HE3  MET   2          3HE       MET   2   6.332   1.960   7.789
   16    H    CYS   3           HN       CYS   3   3.900  -1.778   3.219
   17    HA   CYS   3           HA       CYS   3   1.670  -2.870   2.235
   18    HB2  CYS   3          2HB       CYS   3   3.933  -3.411   1.420
   19    HB3  CYS   3          3HB       CYS   3   4.181  -4.454   2.816
   20    H    ASP   4           HN       ASP   4  -0.053  -3.811   3.081
   21    HA   ASP   4           HA       ASP   4  -0.217  -4.746   5.722
   22    HB2  ASP   4          2HB       ASP   4  -2.071  -4.037   3.973
   23    HB3  ASP   4          3HB       ASP   4  -2.113  -5.769   3.653
   24    H    VAL   5           HN       VAL   5   1.232  -6.166   3.070
   25    HA   VAL   5           HA       VAL   5   0.822  -8.894   4.084
   26    HB   VAL   5           HB       VAL   5   2.031  -8.006   1.461
   27   HG11  VAL   5          1HG1      VAL   5   2.985 -10.086   1.953
   28   HG12  VAL   5          2HG1      VAL   5   1.489 -10.707   2.653
   29   HG13  VAL   5          3HG1      VAL   5   1.617 -10.468   0.911
   30   HG21  VAL   5          1HG2      VAL   5  -0.717  -8.977   2.197
   31   HG22  VAL   5          2HG2      VAL   5  -0.268  -7.494   1.354
   32   HG23  VAL   5          3HG2      VAL   5  -0.097  -9.053   0.547
   33    H    CYS   6           HN       CYS   6   3.064  -6.348   4.029
   34    HA   CYS   6           HA       CYS   6   5.154  -8.151   5.041
   35    HB2  CYS   6          2HB       CYS   6   5.612  -5.799   3.193
   36    HB3  CYS   6          3HB       CYS   6   6.868  -6.804   3.909
   37    H    GLU   7           HN       GLU   7   4.337  -4.694   4.694
   38    HA   GLU   7           HA       GLU   7   4.101  -3.087   6.325
   39    HB2  GLU   7          2HB       GLU   7   5.259  -4.909   8.406
   40    HB3  GLU   7          3HB       GLU   7   4.096  -3.605   8.599
   41    HG2  GLU   7          2HG       GLU   7   2.917  -5.520   6.898
   42    HG3  GLU   7          3HG       GLU   7   3.629  -6.391   8.255
   43    H    VAL   8           HN       VAL   8   5.993  -2.548   4.806
   44    HA   VAL   8           HA       VAL   8   8.058  -1.396   6.346
   45    HB   VAL   8           HB       VAL   8   9.697  -2.951   4.689
   46   HG11  VAL   8          1HG1      VAL   8  10.414  -3.911   6.951
   47   HG12  VAL   8          2HG1      VAL   8  10.521  -2.164   6.733
   48   HG13  VAL   8          3HG1      VAL   8   9.180  -2.860   7.643
   49   HG21  VAL   8          1HG2      VAL   8   7.615  -4.473   4.676
   50   HG22  VAL   8          2HG2      VAL   8   9.184  -5.194   5.040
   51   HG23  VAL   8          3HG2      VAL   8   8.056  -4.832   6.346
   52    H    TRP   9           HN       TRP   9   7.670   0.464   5.227
   53    HA   TRP   9           HA       TRP   9   7.448   0.581   2.392
   54    HB2  TRP   9          2HB       TRP   9   6.446   2.457   3.150
   55    HB3  TRP   9          3HB       TRP   9   7.394   2.472   4.634
   56    HD1  TRP   9          1HD       TRP   9   9.879   3.642   4.455
   57    HE1  TRP   9          1HE       TRP   9  10.674   5.585   2.967
   58    HE3  TRP   9          3HE       TRP   9   6.161   3.551   0.947
   59    HZ2  TRP   9          2HZ       TRP   9   9.836   6.906   0.618
   60    HZ3  TRP   9          3HZ       TRP   9   6.232   5.189  -0.888
   61    HH2  TRP   9          2HH       TRP   9   8.031   6.831  -1.048
   62    H    THR  10           HN       THR  10   8.924   1.209   0.854
   63    HA   THR  10           HA       THR  10  11.737   1.175   1.720
   64    HB   THR  10           HB       THR  10  11.955   0.804  -0.929
   65    HG1  THR  10          1HG       THR  10  10.239  -0.450  -1.670
   66   HG21  THR  10          1HG2      THR  10  11.194  -1.681   0.444
   67   HG22  THR  10          2HG2      THR  10  12.382  -0.699   1.301
   68   HG23  THR  10          3HG2      THR  10  12.706  -1.239  -0.346
   69    H    ALA  11           HN       ALA  11  10.385   2.304  -1.340
   70    HA   ALA  11           HA       ALA  11  10.249   4.991  -1.050
   71    HB1  ALA  11          1HB       ALA  11  12.293   5.554  -0.294
   72    HB2  ALA  11          2HB       ALA  11  13.048   4.091  -0.928
   73    HB3  ALA  11          3HB       ALA  11  12.730   5.454  -2.000
   74    H    GLU  12           HN       GLU  12  11.801   2.520  -3.048
   75    HA   GLU  12           HA       GLU  12  11.909   3.632  -5.507
   76    HB2  GLU  12          2HB       GLU  12  11.103   0.888  -4.622
   77    HB3  GLU  12          3HB       GLU  12  11.026   1.303  -6.329
   78    HG2  GLU  12          2HG       GLU  12  13.453   2.061  -6.065
   79    HG3  GLU  12          3HG       GLU  12  13.424   1.177  -4.540
   80    H    SER  13           HN       SER  13   9.108   1.551  -4.980
   81    HA   SER  13           HA       SER  13   7.220   3.656  -5.543
   82    HB2  SER  13          2HB       SER  13   7.983   3.177  -7.811
   83    HB3  SER  13          3HB       SER  13   7.680   1.457  -7.574
   84    HG   SER  13           HG       SER  13   5.810   1.982  -8.411
   85    H    LEU  14           HN       LEU  14   6.429   2.934  -3.513
   86    HA   LEU  14           HA       LEU  14   5.594   0.257  -3.057
   87    HB2  LEU  14          2HB       LEU  14   5.765   2.666  -1.585
   88    HB3  LEU  14          3HB       LEU  14   4.102   2.096  -1.465
   89    HG   LEU  14           HG       LEU  14   6.614   0.713  -0.558
   90   HD11  LEU  14          1HD1      LEU  14   4.558   2.269   0.694
   91   HD12  LEU  14          2HD1      LEU  14   6.031   1.595   1.390
   92   HD13  LEU  14          3HD1      LEU  14   4.556   0.630   1.346
   93   HD21  LEU  14          1HD2      LEU  14   5.473  -1.065  -1.540
   94   HD22  LEU  14          2HD2      LEU  14   3.891  -0.420  -1.099
   95   HD23  LEU  14          3HD2      LEU  14   4.940  -1.109   0.142
   96    H    PHE  15           HN       PHE  15   3.811  -0.761  -3.691
   97    HA   PHE  15           HA       PHE  15   1.818   0.682  -5.218
   98    HB2  PHE  15          2HB       PHE  15   2.436  -2.206  -4.724
   99    HB3  PHE  15          3HB       PHE  15   0.848  -1.757  -5.334
  100    HD1  PHE  15          1HD       PHE  15   4.376  -0.756  -6.043
  101    HD2  PHE  15          2HD       PHE  15   0.619  -2.023  -7.592
  102    HE1  PHE  15          1HE       PHE  15   5.287  -0.656  -8.327
  103    HE2  PHE  15          2HE       PHE  15   1.523  -1.925  -9.877
  104    HZ   PHE  15           HZ       PHE  15   3.860  -1.242 -10.247
  105    HA   PRO  16           HA       PRO  16  -0.323  -0.067  -5.932
  106    HB2  PRO  16          2HB       PRO  16  -2.396   1.685  -5.948
  107    HB3  PRO  16          3HB       PRO  16  -2.595  -0.032  -5.585
  108    HG2  PRO  16          2HG       PRO  16  -2.403   2.289  -3.706
  109    HG3  PRO  16          3HG       PRO  16  -3.498   0.896  -3.654
  110    HD2  PRO  16          2HD       PRO  16  -1.281   1.063  -2.111
  111    HD3  PRO  16          3HD       PRO  16  -1.903  -0.483  -2.723
  112    H    CYS  17           HN       CYS  17  -0.651   2.944  -4.039
  113    HA   CYS  17           HA       CYS  17   1.558   4.202  -5.283
  114    HB2  CYS  17          2HB       CYS  17   0.503   5.794  -6.702
  115    HB3  CYS  17          3HB       CYS  17  -0.152   4.222  -7.152
  116    H    ARG  18           HN       ARG  18   0.295   6.878  -5.158
  117    HA   ARG  18           HA       ARG  18   0.457   7.195  -2.261
  118    HB2  ARG  18          2HB       ARG  18   1.662   8.981  -2.846
  119    HB3  ARG  18          3HB       ARG  18   1.232   8.769  -4.538
  120    HG2  ARG  18          2HG       ARG  18   0.598  10.971  -3.802
  121    HG3  ARG  18          3HG       ARG  18  -0.849  10.020  -4.145
  122    HD2  ARG  18          2HD       ARG  18  -1.589  10.340  -2.076
  123    HD3  ARG  18          3HD       ARG  18  -0.109   9.651  -1.411
  124    HE   ARG  18           HE       ARG  18   0.295  12.337  -2.236
  125   HH11  ARG  18          1HH1      ARG  18  -1.119  10.399   0.287
  126   HH12  ARG  18          2HH1      ARG  18  -0.947  11.622   1.502
  127   HH21  ARG  18          1HH2      ARG  18   0.527  13.955  -0.645
  128   HH22  ARG  18          2HH2      ARG  18  -0.012  13.645   0.971
  129    H    VAL  19           HN       VAL  19  -1.677   8.061  -4.962
  130    HA   VAL  19           HA       VAL  19  -3.657   9.369  -3.479
  131    HB   VAL  19           HB       VAL  19  -3.814   7.849  -6.077
  132   HG11  VAL  19          1HG1      VAL  19  -6.025   7.732  -5.659
  133   HG12  VAL  19          2HG1      VAL  19  -5.965   8.985  -4.418
  134   HG13  VAL  19          3HG1      VAL  19  -6.001   9.433  -6.124
  135   HG21  VAL  19          1HG2      VAL  19  -4.382  10.576  -6.398
  136   HG22  VAL  19          2HG2      VAL  19  -2.998  10.494  -5.308
  137   HG23  VAL  19          3HG2      VAL  19  -2.922   9.716  -6.889
  138    H    CYS  20           HN       CYS  20  -4.705   6.475  -5.111
  139    HA   CYS  20           HA       CYS  20  -6.615   5.667  -3.382
  140    HB2  CYS  20          2HB       CYS  20  -6.294   3.363  -4.224
  141    HB3  CYS  20          3HB       CYS  20  -6.257   4.559  -5.516
  142    H    THR  21           HN       THR  21  -6.655   5.181  -1.300
  143    HA   THR  21           HA       THR  21  -4.433   4.948   0.347
  144    HB   THR  21           HB       THR  21  -6.506   3.449   1.564
  145    HG1  THR  21          1HG       THR  21  -7.639   5.835   0.621
  146   HG21  THR  21          1HG2      THR  21  -6.686   5.400   3.012
  147   HG22  THR  21          2HG2      THR  21  -5.813   6.377   1.831
  148   HG23  THR  21          3HG2      THR  21  -4.993   5.055   2.660
  149    H    ARG  22           HN       ARG  22  -4.634   2.767   1.943
  150    HA   ARG  22           HA       ARG  22  -4.025   0.586   2.182
  151    HB2  ARG  22          2HB       ARG  22  -4.704  -0.130  -0.621
  152    HB3  ARG  22          3HB       ARG  22  -5.052  -0.986   0.875
  153    HG2  ARG  22          2HG       ARG  22  -6.616   1.162   1.221
  154    HG3  ARG  22          3HG       ARG  22  -6.615   1.070  -0.542
  155    HD2  ARG  22          2HD       ARG  22  -7.889  -0.771  -0.556
  156    HD3  ARG  22          3HD       ARG  22  -6.983  -1.516   0.759
  157    HE   ARG  22           HE       ARG  22  -8.592  -0.799   2.209
  158   HH11  ARG  22          1HH1      ARG  22  -8.824   1.057  -0.728
  159   HH12  ARG  22          2HH1      ARG  22 -10.273   1.877  -0.249
  160   HH21  ARG  22          1HH2      ARG  22 -10.500   0.273   2.850
  161   HH22  ARG  22          2HH2      ARG  22 -11.225   1.431   1.786
  162    H    VAL  23           HN       VAL  23  -2.436  -1.034   1.390
  163    HA   VAL  23           HA       VAL  23  -0.580  -0.103  -0.646
  164    HB   VAL  23           HB       VAL  23   0.363   1.036   1.216
  165   HG11  VAL  23          1HG1      VAL  23   0.887  -0.045   3.337
  166   HG12  VAL  23          2HG1      VAL  23  -0.839  -0.158   2.986
  167   HG13  VAL  23          3HG1      VAL  23   0.204  -1.560   2.746
  168   HG21  VAL  23          1HG2      VAL  23   1.709  -1.072  -0.099
  169   HG22  VAL  23          2HG2      VAL  23   2.397   0.396   0.595
  170   HG23  VAL  23          3HG2      VAL  23   2.261  -1.063   1.576
  171    H    PHE  24           HN       PHE  24   0.084  -1.783  -1.804
  172    HA   PHE  24           HA       PHE  24   0.590  -4.348  -0.538
  173    HB2  PHE  24          2HB       PHE  24  -0.839  -5.089  -2.821
  174    HB3  PHE  24          3HB       PHE  24  -1.366  -5.250  -1.150
  175    HD1  PHE  24          1HD       PHE  24  -3.030  -3.812  -0.230
  176    HD2  PHE  24          2HD       PHE  24  -1.567  -3.179  -4.176
  177    HE1  PHE  24          1HE       PHE  24  -4.884  -2.253  -0.663
  178    HE2  PHE  24          2HE       PHE  24  -3.418  -1.619  -4.616
  179    HZ   PHE  24           HZ       PHE  24  -5.079  -1.154  -2.858
  180    H    HIS  25           HN       HIS  25   2.589  -4.773  -1.192
  181    HA   HIS  25           HA       HIS  25   3.980  -3.672  -3.277
  182    HB2  HIS  25          2HB       HIS  25   4.276  -6.437  -2.089
  183    HB3  HIS  25          3HB       HIS  25   5.461  -5.690  -3.157
  184    HD2  HIS  25          2HD       HIS  25   4.393  -2.904  -0.970
  185    HE1  HIS  25          1HE       HIS  25   7.497  -4.826   1.192
  186    HE2  HIS  25          2HE       HIS  25   6.004  -2.802   1.052
  187    H    ASP  26           HN       ASP  26   4.023  -3.875  -5.425
  188    HA   ASP  26           HA       ASP  26   2.033  -5.092  -6.890
  189    HB2  ASP  26          2HB       ASP  26   3.107  -4.272  -8.711
  190    HB3  ASP  26          3HB       ASP  26   4.102  -3.460  -7.506
  191    H    GLY  27           HN       GLY  27   4.930  -6.488  -5.578
  192    HA2  GLY  27          1HA       GLY  27   4.728  -8.891  -7.199
  193    HA3  GLY  27          2HA       GLY  27   5.919  -8.572  -5.947
  194    H    CYS  28           HN       CYS  28   4.169  -7.948  -3.833
  195    HA   CYS  28           HA       CYS  28   3.688 -10.438  -2.727
  196    HB2  CYS  28          2HB       CYS  28   2.709  -7.680  -2.111
  197    HB3  CYS  28          3HB       CYS  28   2.001  -9.046  -1.256
  198    H    LEU  29           HN       LEU  29   1.193  -8.183  -3.923
  199    HA   LEU  29           HA       LEU  29  -1.038  -9.702  -3.696
  200    HB2  LEU  29          2HB       LEU  29  -0.352  -8.057  -6.126
  201    HB3  LEU  29          3HB       LEU  29  -1.969  -8.514  -5.594
  202    HG   LEU  29           HG       LEU  29  -0.126  -6.756  -3.983
  203   HD11  LEU  29          1HD1      LEU  29  -1.935  -6.129  -6.241
  204   HD12  LEU  29          2HD1      LEU  29  -0.459  -5.324  -5.709
  205   HD13  LEU  29          3HD1      LEU  29  -1.974  -5.047  -4.849
  206   HD21  LEU  29          1HD2      LEU  29  -2.878  -6.299  -3.513
  207   HD22  LEU  29          2HD2      LEU  29  -1.674  -6.966  -2.409
  208   HD23  LEU  29          3HD2      LEU  29  -2.610  -8.041  -3.449
  209    H    ARG  30           HN       ARG  30   1.500 -10.069  -6.092
  210    HA   ARG  30           HA       ARG  30   0.038 -12.187  -7.456
  211    HB2  ARG  30          2HB       ARG  30   1.186 -11.420  -9.209
  212    HB3  ARG  30          3HB       ARG  30   2.119 -10.354  -8.168
  213    HG2  ARG  30          2HG       ARG  30   3.708 -12.152  -7.736
  214    HG3  ARG  30          3HG       ARG  30   2.767 -13.232  -8.766
  215    HD2  ARG  30          2HD       ARG  30   3.678 -12.401 -10.626
  216    HD3  ARG  30          3HD       ARG  30   3.415 -10.739 -10.099
  217    HE   ARG  30           HE       ARG  30   5.590 -11.923  -8.710
  218   HH11  ARG  30          1HH1      ARG  30   4.687 -10.531 -11.770
  219   HH12  ARG  30          2HH1      ARG  30   6.296 -10.021 -12.160
  220   HH21  ARG  30          1HH2      ARG  30   7.713 -11.255  -9.212
  221   HH22  ARG  30          2HH2      ARG  30   8.016 -10.433 -10.704
  222    H    ARG  31           HN       ARG  31   2.520 -11.775  -5.091
  223    HA   ARG  31           HA       ARG  31   3.602 -14.432  -5.364
  224    HB2  ARG  31          2HB       ARG  31   4.474 -12.067  -4.198
  225    HB3  ARG  31          3HB       ARG  31   4.131 -13.109  -2.824
  226    HG2  ARG  31          2HG       ARG  31   5.768 -14.618  -3.380
  227    HG3  ARG  31          3HG       ARG  31   5.731 -14.188  -5.090
  228    HD2  ARG  31          2HD       ARG  31   6.514 -11.841  -3.963
  229    HD3  ARG  31          3HD       ARG  31   7.258 -13.013  -2.876
  230    HE   ARG  31           HE       ARG  31   8.698 -13.623  -4.557
  231   HH11  ARG  31          1HH1      ARG  31   6.130 -11.675  -5.870
  232   HH12  ARG  31          2HH1      ARG  31   6.881 -11.498  -7.422
  233   HH21  ARG  31          1HH2      ARG  31   9.697 -13.398  -6.596
  234   HH22  ARG  31          2HH2      ARG  31   8.909 -12.479  -7.834
  235    H    MET  32           HN       MET  32   0.839 -13.123  -3.969
  236    HA   MET  32           HA       MET  32   0.602 -15.373  -2.084
  237    HB2  MET  32          2HB       MET  32  -0.891 -12.743  -2.082
  238    HB3  MET  32          3HB       MET  32  -1.076 -14.031  -0.899
  239    HG2  MET  32          2HG       MET  32   1.551 -12.669  -1.386
  240    HG3  MET  32          3HG       MET  32   0.360 -12.049  -0.245
  241    HE1  MET  32          1HE       MET  32  -0.603 -13.172   1.541
  242    HE2  MET  32          2HE       MET  32  -0.623 -14.935   1.532
  243    HE3  MET  32          3HE       MET  32   0.379 -14.070   2.699
  244    H    GLY  33           HN       GLY  33  -0.528 -14.091  -5.009
  245    HA2  GLY  33          1HA       GLY  33  -1.941 -15.229  -6.501
  246    HA3  GLY  33          2HA       GLY  33  -2.558 -16.178  -5.157
  247    H    TYR  34           HN       TYR  34  -2.411 -12.822  -4.582
  248    HA   TYR  34           HA       TYR  34  -5.252 -12.645  -4.344
  249    HB2  TYR  34          2HB       TYR  34  -3.046 -10.602  -4.088
  250    HB3  TYR  34          3HB       TYR  34  -4.745 -10.207  -3.855
  251    HD1  TYR  34          1HD       TYR  34  -2.024 -10.494  -2.012
  252    HD2  TYR  34          2HD       TYR  34  -5.776 -12.470  -2.359
  253    HE1  TYR  34          1HE       TYR  34  -1.862 -11.203   0.338
  254    HE2  TYR  34          2HE       TYR  34  -5.624 -13.184  -0.011
  255    HH   TYR  34           HH       TYR  34  -4.189 -12.060   2.165
  256    H    ILE  35           HN       ILE  35  -3.002 -12.050  -6.861
  257    HA   ILE  35           HA       ILE  35  -5.142 -11.285  -8.647
  258    HB   ILE  35           HB       ILE  35  -3.857  -9.308  -9.526
  259   HG12  ILE  35          2HG1      ILE  35  -2.407  -8.236  -7.650
  260   HG13  ILE  35          3HG1      ILE  35  -2.285  -9.878  -7.030
  261   HG21  ILE  35          1HG2      ILE  35  -5.880  -9.149  -8.087
  262   HG22  ILE  35          2HG2      ILE  35  -4.820  -9.013  -6.687
  263   HG23  ILE  35          3HG2      ILE  35  -4.791  -7.772  -7.939
  264   HD11  ILE  35          1HD1      ILE  35  -0.764  -8.647  -9.061
  265   HD12  ILE  35          2HD1      ILE  35  -0.654 -10.300  -8.454
  266   HD13  ILE  35          3HD1      ILE  35  -1.717  -9.927  -9.810
  267    H    GLN  36           HN       GLN  36  -4.591 -11.492 -10.862
  268    HA   GLN  36           HA       GLN  36  -2.110 -13.015 -11.315
  269    HB2  GLN  36          2HB       GLN  36  -4.427 -14.132 -11.619
  270    HB3  GLN  36          3HB       GLN  36  -4.529 -13.175 -13.091
  271    HG2  GLN  36          2HG       GLN  36  -2.281 -14.205 -13.712
  272    HG3  GLN  36          3HG       GLN  36  -2.588 -15.353 -12.410
  273   HE21  GLN  36          1HE2      GLN  36  -3.032 -17.194 -13.424
  274   HE22  GLN  36          2HE2      GLN  36  -4.247 -17.402 -14.635
  275    H    GLY  37           HN       GLY  37  -0.756 -11.362 -11.922
  276    HA2  GLY  37          1HA       GLY  37  -0.096 -10.591 -14.276
  277    HA3  GLY  37          2HA       GLY  37  -1.613  -9.707 -14.206
  278    H    ASP  38           HN       ASP  38   0.246  -8.059 -14.703
  279    HA   ASP  38           HA       ASP  38   0.590  -6.533 -12.279
  280    HB2  ASP  38          2HB       ASP  38   2.879  -7.878 -13.643
  281    HB3  ASP  38          3HB       ASP  38   3.130  -6.257 -12.999
  282    H    SER  39           HN       SER  39   2.008  -4.480 -12.906
  283    HA   SER  39           HA       SER  39   1.380  -3.625 -15.636
  284    HB2  SER  39          2HB       SER  39   0.776  -1.757 -13.365
  285    HB3  SER  39          3HB       SER  39   0.148  -1.746 -15.013
  286    HG   SER  39           HG       SER  39  -0.575  -3.400 -12.848
  287    H    ALA  40           HN       ALA  40   2.868  -2.288 -16.521
  288    HA   ALA  40           HA       ALA  40   4.999  -1.270 -14.759
  289    HB1  ALA  40          1HB       ALA  40   6.611  -1.718 -16.570
  290    HB2  ALA  40          2HB       ALA  40   5.853  -3.187 -15.955
  291    HB3  ALA  40          3HB       ALA  40   5.327  -2.501 -17.491
  292    H    ALA  41           HN       ALA  41   5.332   0.849 -14.898
  293    HA   ALA  41           HA       ALA  41   5.173   2.300 -17.351
  294    HB1  ALA  41          1HB       ALA  41   3.193   3.380 -17.213
  295    HB2  ALA  41          2HB       ALA  41   2.728   1.936 -16.313
  296    HB3  ALA  41          3HB       ALA  41   3.200   3.399 -15.450
  297    H    GLU  42           HN       GLU  42   7.027   3.373 -17.037
  298    HA   GLU  42           HA       GLU  42   7.362   4.839 -14.502
  299    HB2  GLU  42          2HB       GLU  42   9.800   4.540 -16.049
  300    HB3  GLU  42          3HB       GLU  42   9.483   4.133 -14.367
  301    HG2  GLU  42          2HG       GLU  42   8.494   2.007 -15.075
  302    HG3  GLU  42          3HG       GLU  42   8.842   2.414 -16.754
  303    H    VAL  43           HN       VAL  43   5.991   5.645 -17.026
  304    HA   VAL  43           HA       VAL  43   7.371   7.372 -18.634
  305    HB   VAL  43           HB       VAL  43   4.588   7.689 -17.513
  306   HG11  VAL  43          1HG1      VAL  43   5.305   9.873 -18.177
  307   HG12  VAL  43          2HG1      VAL  43   5.971   9.252 -19.688
  308   HG13  VAL  43          3HG1      VAL  43   4.227   9.250 -19.425
  309   HG21  VAL  43          1HG2      VAL  43   4.305   7.120 -20.136
  310   HG22  VAL  43          2HG2      VAL  43   5.796   6.247 -19.782
  311   HG23  VAL  43          3HG2      VAL  43   4.332   5.898 -18.863
  312    H    THR  44           HN       THR  44   5.772   8.266 -15.573
  313    HA   THR  44           HA       THR  44   7.884  10.136 -14.959
  314    HB   THR  44           HB       THR  44   6.491  11.517 -16.425
  315    HG1  THR  44          1HG       THR  44   6.974  13.063 -15.075
  316   HG21  THR  44          1HG2      THR  44   4.367  10.127 -15.339
  317   HG22  THR  44          2HG2      THR  44   4.252  11.547 -16.377
  318   HG23  THR  44          3HG2      THR  44   4.213  11.731 -14.624
  319    H    GLU  45           HN       GLU  45   6.933  11.545 -12.939
  320    HA   GLU  45           HA       GLU  45   6.331  11.496 -10.746
  321    HB2  GLU  45          2HB       GLU  45   4.541   9.168 -11.432
  322    HB3  GLU  45          3HB       GLU  45   4.371  10.296 -10.094
  323    HG2  GLU  45          2HG       GLU  45   4.334  11.933 -12.305
  324    HG3  GLU  45          3HG       GLU  45   3.451  10.504 -12.838
  325    H    MET  46           HN       MET  46   5.942   9.675  -8.871
  326    HA   MET  46           HA       MET  46   7.802   7.464  -9.224
  327    HB2  MET  46          2HB       MET  46   8.205   9.651  -7.179
  328    HB3  MET  46          3HB       MET  46   9.037   8.102  -7.138
  329    HG2  MET  46          2HG       MET  46   9.712   8.775  -9.587
  330    HG3  MET  46          3HG       MET  46   9.391  10.400  -8.985
  331    HE1  MET  46          1HE       MET  46  10.174   9.608  -5.830
  332    HE2  MET  46          2HE       MET  46  11.799  10.292  -5.770
  333    HE3  MET  46          3HE       MET  46  10.492  11.191  -6.542
  334    H    ALA  47           HN       ALA  47   6.681   8.997  -6.241
  335    HA   ALA  47           HA       ALA  47   4.659   6.941  -5.857
  336    HB1  ALA  47          1HB       ALA  47   7.235   6.663  -4.745
  337    HB2  ALA  47          2HB       ALA  47   6.144   7.078  -3.422
  338    HB3  ALA  47          3HB       ALA  47   5.805   5.677  -4.438
  339    H    HIS  48           HN       HIS  48   6.405   9.636  -4.322
  340    HA   HIS  48           HA       HIS  48   3.991  10.406  -2.879
  341    HB2  HIS  48          2HB       HIS  48   6.151  10.416  -1.690
  342    HB3  HIS  48          3HB       HIS  48   6.764  11.617  -2.824
  343    HD1  HIS  48          1HD       HIS  48   4.380  11.220   0.046
  344    HD2  HIS  48          2HD       HIS  48   5.948  14.231  -2.349
  345    HE1  HIS  48          1HE       HIS  48   3.716  13.377   1.157
  346    H    THR  49           HN       THR  49   3.815  10.627  -5.672
  347    HA   THR  49           HA       THR  49   3.798  13.553  -6.042
  348    HB   THR  49           HB       THR  49   3.553  12.475  -8.581
  349    HG1  THR  49          1HG       THR  49   4.211  10.425  -7.735
  350   HG21  THR  49          1HG2      THR  49   5.616  13.517  -9.012
  351   HG22  THR  49          2HG2      THR  49   6.198  13.234  -7.371
  352   HG23  THR  49          3HG2      THR  49   4.934  14.427  -7.664
  353    H    GLU  50           HN       GLU  50   2.078  14.351  -7.510
  354    HA   GLU  50           HA       GLU  50  -0.456  13.678  -6.617
  355    HB2  GLU  50          2HB       GLU  50  -1.317  15.119  -8.297
  356    HB3  GLU  50          3HB       GLU  50   0.235  15.789  -7.817
  357    HG2  GLU  50          2HG       GLU  50   0.921  15.743  -9.914
  358    HG3  GLU  50          3HG       GLU  50   0.682  13.997  -9.969
  359    H    THR  51           HN       THR  51  -2.271  13.115  -8.333
  360    HA   THR  51           HA       THR  51  -2.204  10.411  -8.805
  361    HB   THR  51           HB       THR  51  -3.741  12.143 -10.702
  362    HG1  THR  51          1HG       THR  51  -5.245  12.545  -9.021
  363   HG21  THR  51          1HG2      THR  51  -5.185  10.116  -9.230
  364   HG22  THR  51          2HG2      THR  51  -3.758   9.440 -10.017
  365   HG23  THR  51          3HG2      THR  51  -4.969  10.299 -10.970
  366    H    GLY  52           HN       GLY  52  -1.646   9.073 -10.478
  367    HA2  GLY  52          1HA       GLY  52  -1.123   9.682 -13.104
  368    HA3  GLY  52          2HA       GLY  52   0.384  10.019 -12.265
  369    H    TRP  53           HN       TRP  53   0.143   7.931 -10.317
  370    HA   TRP  53           HA       TRP  53   1.148   5.757 -11.909
  371    HB2  TRP  53          2HB       TRP  53   1.845   6.607  -9.493
  372    HB3  TRP  53          3HB       TRP  53   0.619   5.447  -8.988
  373    HD1  TRP  53          1HD       TRP  53   1.149   2.860  -9.340
  374    HE1  TRP  53          1HE       TRP  53   3.339   1.590  -9.803
  375    HE3  TRP  53          3HE       TRP  53   4.094   6.801 -10.730
  376    HZ2  TRP  53          2HZ       TRP  53   5.968   2.181 -10.645
  377    HZ3  TRP  53          3HZ       TRP  53   6.435   6.363 -11.349
  378    HH2  TRP  53          2HH       TRP  53   7.350   4.100 -11.306
  379    H    SER  54           HN       SER  54  -0.022   4.166 -12.735
  380    HA   SER  54           HA       SER  54  -2.798   3.859 -12.049
  381    HB2  SER  54          2HB       SER  54  -1.909   1.696 -13.676
  382    HB3  SER  54          3HB       SER  54  -2.879   3.090 -14.150
  383    HG   SER  54           HG       SER  54  -0.714   2.680 -15.204
  384    H    CYS  55           HN       CYS  55  -3.793   2.064 -11.127
  385    HA   CYS  55           HA       CYS  55  -2.184  -0.117 -10.107
  386    HB2  CYS  55          2HB       CYS  55  -3.826   1.130  -7.990
  387    HB3  CYS  55          3HB       CYS  55  -2.246   0.359  -7.886
  388    H    HIS  56           HN       HIS  56  -3.607  -1.688  -8.853
  389    HA   HIS  56           HA       HIS  56  -5.691  -2.574 -10.437
  390    HB2  HIS  56          2HB       HIS  56  -4.441  -3.401  -8.046
  391    HB3  HIS  56          3HB       HIS  56  -6.169  -3.358  -7.710
  392    HD1  HIS  56          1HD       HIS  56  -4.414  -4.439 -10.902
  393    HD2  HIS  56          2HD       HIS  56  -6.887  -5.964  -7.932
  394    HE1  HIS  56          1HE       HIS  56  -4.996  -6.771 -11.643
  395    H    TYR  57           HN       TYR  57  -6.147  -1.219  -7.167
  396    HA   TYR  57           HA       TYR  57  -8.901  -0.586  -7.784
  397    HB2  TYR  57          2HB       TYR  57  -7.487   0.239  -5.265
  398    HB3  TYR  57          3HB       TYR  57  -9.183  -0.171  -5.496
  399    HD1  TYR  57          1HD       TYR  57  -9.861  -2.543  -5.733
  400    HD2  TYR  57          2HD       TYR  57  -5.858  -1.445  -4.795
  401    HE1  TYR  57          1HE       TYR  57  -9.411  -4.842  -4.983
  402    HE2  TYR  57          2HE       TYR  57  -5.398  -3.741  -4.045
  403    HH   TYR  57           HH       TYR  57  -6.285  -6.012  -4.413
  404    H    CYS  58           HN       CYS  58  -6.549   0.820  -9.072
  405    HA   CYS  58           HA       CYS  58  -6.685   3.528  -8.111
  406    HB2  CYS  58          2HB       CYS  58  -4.812   2.166  -9.510
  407    HB3  CYS  58          3HB       CYS  58  -5.625   3.008 -10.825
  408    H    ASP  59           HN       ASP  59  -7.377   2.207 -11.350
  409    HA   ASP  59           HA       ASP  59  -9.327   4.340 -11.761
  410    HB2  ASP  59          2HB       ASP  59  -7.736   2.557 -13.514
  411    HB3  ASP  59          3HB       ASP  59  -9.336   2.997 -14.104
  412    H    ASN  60           HN       ASN  60 -11.168   3.785 -10.693
  413    HA   ASN  60           HA       ASN  60 -12.229   1.131 -10.692
  414    HB2  ASN  60          2HB       ASN  60 -12.631   3.381  -9.159
  415    HB3  ASN  60          3HB       ASN  60 -14.121   3.291 -10.092
  416   HD21  ASN  60          1HD2      ASN  60 -14.686   3.012  -7.659
  417   HD22  ASN  60          2HD2      ASN  60 -14.867   1.373  -7.144
  Start of MODEL    8
    1    H1   GLU   1           HN       GLU   1   2.929   4.767   4.903
    2    HA   GLU   1           HA       GLU   1   0.880   2.784   4.243
    3    HB2  GLU   1          2HB       GLU   1   2.663   4.500   2.512
    4    HB3  GLU   1          3HB       GLU   1   1.580   3.272   1.873
    5    HG2  GLU   1          2HG       GLU   1  -0.179   4.616   2.017
    6    HG3  GLU   1          3HG       GLU   1   0.213   5.077   3.673
    7    H    MET   2           HN       MET   2   1.888   0.983   5.237
    8    HA   MET   2           HA       MET   2   4.303   0.027   3.847
    9    HB2  MET   2          2HB       MET   2   3.474  -1.122   6.471
   10    HB3  MET   2          3HB       MET   2   5.083  -0.943   5.786
   11    HG2  MET   2          2HG       MET   2   4.881   1.517   6.159
   12    HG3  MET   2          3HG       MET   2   3.378   1.201   7.022
   13    HE1  MET   2          1HE       MET   2   7.385   0.036   7.251
   14    HE2  MET   2          2HE       MET   2   6.890   1.714   7.027
   15    HE3  MET   2          3HE       MET   2   7.526   1.182   8.584
   16    H    CYS   3           HN       CYS   3   4.149  -1.790   2.693
   17    HA   CYS   3           HA       CYS   3   1.944  -2.971   1.779
   18    HB2  CYS   3          2HB       CYS   3   4.253  -3.592   1.112
   19    HB3  CYS   3          3HB       CYS   3   4.400  -4.543   2.588
   20    H    ASP   4           HN       ASP   4   0.229  -3.978   2.578
   21    HA   ASP   4           HA       ASP   4   0.006  -4.614   5.336
   22    HB2  ASP   4          2HB       ASP   4  -1.807  -4.023   3.463
   23    HB3  ASP   4          3HB       ASP   4  -1.919  -5.780   3.387
   24    H    VAL   5           HN       VAL   5   1.614  -6.206   2.966
   25    HA   VAL   5           HA       VAL   5   1.120  -8.847   4.184
   26    HB   VAL   5           HB       VAL   5   2.145  -8.232   1.407
   27   HG11  VAL   5          1HG1      VAL   5   1.749 -10.757   1.157
   28   HG12  VAL   5          2HG1      VAL   5   3.195 -10.228   2.019
   29   HG13  VAL   5          3HG1      VAL   5   1.791 -10.799   2.919
   30   HG21  VAL   5          1HG2      VAL   5  -0.146  -7.803   1.344
   31   HG22  VAL   5          2HG2      VAL   5  -0.025  -9.480   0.813
   32   HG23  VAL   5          3HG2      VAL   5  -0.520  -9.113   2.465
   33    H    CYS   6           HN       CYS   6   3.245  -6.346   4.168
   34    HA   CYS   6           HA       CYS   6   5.418  -8.068   5.083
   35    HB2  CYS   6          2HB       CYS   6   5.811  -5.891   3.016
   36    HB3  CYS   6          3HB       CYS   6   7.092  -6.834   3.773
   37    H    GLU   7           HN       GLU   7   4.320  -4.723   4.594
   38    HA   GLU   7           HA       GLU   7   4.136  -3.029   6.143
   39    HB2  GLU   7          2HB       GLU   7   5.775  -4.566   8.129
   40    HB3  GLU   7          3HB       GLU   7   4.524  -3.367   8.420
   41    HG2  GLU   7          2HG       GLU   7   3.318  -5.509   7.035
   42    HG3  GLU   7          3HG       GLU   7   4.302  -6.200   8.324
   43    H    VAL   8           HN       VAL   8   5.806  -2.594   4.255
   44    HA   VAL   8           HA       VAL   8   8.033  -1.239   5.517
   45    HB   VAL   8           HB       VAL   8   9.194  -2.487   3.250
   46   HG11  VAL   8          1HG1      VAL   8   9.655  -2.665   6.217
   47   HG12  VAL   8          2HG1      VAL   8  10.706  -3.448   5.035
   48   HG13  VAL   8          3HG1      VAL   8  10.527  -1.693   5.033
   49   HG21  VAL   8          1HG2      VAL   8   8.003  -4.473   5.184
   50   HG22  VAL   8          2HG2      VAL   8   7.490  -4.238   3.513
   51   HG23  VAL   8          3HG2      VAL   8   9.111  -4.840   3.862
   52    H    TRP   9           HN       TRP   9   8.180   0.713   4.644
   53    HA   TRP   9           HA       TRP   9   7.091   1.124   1.942
   54    HB2  TRP   9          2HB       TRP   9   5.884   2.684   3.037
   55    HB3  TRP   9          3HB       TRP   9   6.956   2.661   4.433
   56    HD1  TRP   9          1HD       TRP   9   8.666   4.611   4.662
   57    HE1  TRP   9          1HE       TRP   9   9.188   6.713   3.272
   58    HE3  TRP   9          3HE       TRP   9   5.934   3.518   0.482
   59    HZ2  TRP   9          2HZ       TRP   9   8.529   7.769   0.738
   60    HZ3  TRP   9          3HZ       TRP   9   5.932   5.127  -1.379
   61    HH2  TRP   9          2HH       TRP   9   7.203   7.208  -1.252
   62    H    THR  10           HN       THR  10   8.145   2.875   0.666
   63    HA   THR  10           HA       THR  10  10.848   3.602   1.263
   64    HB   THR  10           HB       THR  10  11.584   2.451  -1.014
   65    HG1  THR  10          1HG       THR  10   9.225   1.242  -0.385
   66   HG21  THR  10          1HG2      THR  10  11.529   0.518   1.225
   67   HG22  THR  10          2HG2      THR  10  12.227   2.100   1.573
   68   HG23  THR  10          3HG2      THR  10  12.890   1.111   0.272
   69    H    ALA  11           HN       ALA  11  11.247   5.491   0.312
   70    HA   ALA  11           HA       ALA  11   9.488   6.996  -1.096
   71    HB1  ALA  11          1HB       ALA  11  12.221   7.426  -2.035
   72    HB2  ALA  11          2HB       ALA  11  11.129   8.514  -1.178
   73    HB3  ALA  11          3HB       ALA  11  12.076   7.328  -0.281
   74    H    GLU  12           HN       GLU  12  11.482   4.432  -2.344
   75    HA   GLU  12           HA       GLU  12  11.766   4.798  -4.971
   76    HB2  GLU  12          2HB       GLU  12  11.022   2.440  -3.357
   77    HB3  GLU  12          3HB       GLU  12  10.712   2.300  -5.082
   78    HG2  GLU  12          2HG       GLU  12  12.871   1.404  -4.629
   79    HG3  GLU  12          3HG       GLU  12  13.074   2.920  -5.505
   80    H    SER  13           HN       SER  13   8.863   2.964  -4.135
   81    HA   SER  13           HA       SER  13   6.906   4.702  -5.029
   82    HB2  SER  13          2HB       SER  13   8.445   3.505  -7.199
   83    HB3  SER  13          3HB       SER  13   6.721   3.152  -7.324
   84    HG   SER  13           HG       SER  13   6.635   5.595  -6.799
   85    H    LEU  14           HN       LEU  14   6.381   3.334  -3.080
   86    HA   LEU  14           HA       LEU  14   5.606   0.607  -3.520
   87    HB2  LEU  14          2HB       LEU  14   6.389   1.522  -1.336
   88    HB3  LEU  14          3HB       LEU  14   4.879   2.422  -1.227
   89    HG   LEU  14           HG       LEU  14   4.086  -0.212  -1.628
   90   HD11  LEU  14          1HD1      LEU  14   5.299  -1.596  -0.208
   91   HD12  LEU  14          2HD1      LEU  14   6.118  -0.243   0.572
   92   HD13  LEU  14          3HD1      LEU  14   6.549  -0.705  -1.075
   93   HD21  LEU  14          1HD2      LEU  14   3.069   0.015   0.460
   94   HD22  LEU  14          2HD2      LEU  14   3.218   1.674  -0.122
   95   HD23  LEU  14          3HD2      LEU  14   4.354   1.054   1.078
   96    H    PHE  15           HN       PHE  15   3.628  -0.219  -3.948
   97    HA   PHE  15           HA       PHE  15   1.609   1.607  -4.914
   98    HB2  PHE  15          2HB       PHE  15   1.143  -1.338  -4.726
   99    HB3  PHE  15          3HB       PHE  15   0.662  -0.207  -5.986
  100    HD1  PHE  15          1HD       PHE  15   3.028  -2.666  -4.989
  101    HD2  PHE  15          2HD       PHE  15   2.506   0.744  -7.481
  102    HE1  PHE  15          1HE       PHE  15   4.959  -3.366  -6.344
  103    HE2  PHE  15          2HE       PHE  15   4.435   0.050  -8.841
  104    HZ   PHE  15           HZ       PHE  15   5.663  -2.008  -8.274
  105    HA   PRO  16           HA       PRO  16  -0.660   1.178  -5.450
  106    HB2  PRO  16          2HB       PRO  16  -2.528   3.072  -4.904
  107    HB3  PRO  16          3HB       PRO  16  -2.860   1.338  -4.808
  108    HG2  PRO  16          2HG       PRO  16  -2.215   3.269  -2.612
  109    HG3  PRO  16          3HG       PRO  16  -3.436   1.983  -2.649
  110    HD2  PRO  16          2HD       PRO  16  -1.049   1.692  -1.403
  111    HD3  PRO  16          3HD       PRO  16  -1.895   0.335  -2.174
  112    H    CYS  17           HN       CYS  17  -1.106   3.478  -6.530
  113    HA   CYS  17           HA       CYS  17   1.131   4.830  -6.950
  114    HB2  CYS  17          2HB       CYS  17  -1.350   6.461  -6.479
  115    HB3  CYS  17          3HB       CYS  17  -0.107   6.678  -7.707
  116    H    ARG  18           HN       ARG  18  -1.142   6.258  -4.608
  117    HA   ARG  18           HA       ARG  18   0.915   6.601  -2.628
  118    HB2  ARG  18          2HB       ARG  18   1.654   8.585  -3.364
  119    HB3  ARG  18          3HB       ARG  18   0.344   8.722  -4.531
  120    HG2  ARG  18          2HG       ARG  18   0.228  10.581  -3.039
  121    HG3  ARG  18          3HG       ARG  18  -1.131   9.510  -2.694
  122    HD2  ARG  18          2HD       ARG  18  -0.461   9.739  -0.561
  123    HD3  ARG  18          3HD       ARG  18   0.735   8.520  -1.003
  124    HE   ARG  18           HE       ARG  18   2.325  10.097  -0.622
  125   HH11  ARG  18          1HH1      ARG  18  -0.614  11.721  -1.540
  126   HH12  ARG  18          2HH1      ARG  18   0.055  13.309  -1.368
  127   HH21  ARG  18          1HH2      ARG  18   3.219  12.183  -0.393
  128   HH22  ARG  18          2HH2      ARG  18   2.236  13.571  -0.717
  129    H    VAL  19           HN       VAL  19  -2.320   7.413  -3.772
  130    HA   VAL  19           HA       VAL  19  -3.349   6.924  -1.083
  131    HB   VAL  19           HB       VAL  19  -4.866   8.912  -1.273
  132   HG11  VAL  19          1HG1      VAL  19  -3.450   9.990   0.069
  133   HG12  VAL  19          2HG1      VAL  19  -2.281   8.724  -0.309
  134   HG13  VAL  19          3HG1      VAL  19  -2.281  10.229  -1.228
  135   HG21  VAL  19          1HG2      VAL  19  -4.828  10.304  -3.020
  136   HG22  VAL  19          2HG2      VAL  19  -3.067  10.368  -3.041
  137   HG23  VAL  19          3HG2      VAL  19  -3.910   9.048  -3.851
  138    H    CYS  20           HN       CYS  20  -4.359   5.065  -1.754
  139    HA   CYS  20           HA       CYS  20  -6.769   5.450  -3.336
  140    HB2  CYS  20          2HB       CYS  20  -5.042   3.106  -4.046
  141    HB3  CYS  20          3HB       CYS  20  -6.321   3.869  -4.985
  142    H    THR  21           HN       THR  21  -5.649   4.604  -0.558
  143    HA   THR  21           HA       THR  21  -6.555   3.407   1.172
  144    HB   THR  21           HB       THR  21  -8.384   1.729  -0.398
  145    HG1  THR  21          1HG       THR  21  -9.156   3.292  -1.583
  146   HG21  THR  21          1HG2      THR  21  -8.417   3.389   2.077
  147   HG22  THR  21          2HG2      THR  21  -8.895   1.708   1.839
  148   HG23  THR  21          3HG2      THR  21  -9.955   3.010   1.300
  149    H    ARG  22           HN       ARG  22  -5.308   1.881   2.011
  150    HA   ARG  22           HA       ARG  22  -4.399  -0.200   2.355
  151    HB2  ARG  22          2HB       ARG  22  -5.197  -1.094  -0.393
  152    HB3  ARG  22          3HB       ARG  22  -5.013  -2.048   1.073
  153    HG2  ARG  22          2HG       ARG  22  -7.063  -0.125   1.503
  154    HG3  ARG  22          3HG       ARG  22  -7.370  -0.949  -0.027
  155    HD2  ARG  22          2HD       ARG  22  -8.386  -2.430   1.362
  156    HD3  ARG  22          3HD       ARG  22  -6.747  -3.071   1.453
  157    HE   ARG  22           HE       ARG  22  -6.736  -2.525   3.661
  158   HH11  ARG  22          1HH1      ARG  22  -9.103  -0.544   2.053
  159   HH12  ARG  22          2HH1      ARG  22  -9.661   0.204   3.512
  160   HH21  ARG  22          1HH2      ARG  22  -7.462  -1.548   5.591
  161   HH22  ARG  22          2HH2      ARG  22  -8.726  -0.367   5.524
  162    H    VAL  23           HN       VAL  23  -2.398  -1.159   1.881
  163    HA   VAL  23           HA       VAL  23  -0.942  -0.062  -0.423
  164    HB   VAL  23           HB       VAL  23   1.003   0.423   0.878
  165   HG11  VAL  23          1HG1      VAL  23  -0.068   2.022   2.651
  166   HG12  VAL  23          2HG1      VAL  23  -0.295   2.321   0.926
  167   HG13  VAL  23          3HG1      VAL  23  -1.575   1.552   1.865
  168   HG21  VAL  23          1HG2      VAL  23   1.024  -1.335   2.471
  169   HG22  VAL  23          2HG2      VAL  23   0.933   0.169   3.386
  170   HG23  VAL  23          3HG2      VAL  23  -0.513  -0.817   3.165
  171    H    PHE  24           HN       PHE  24   0.088  -1.572  -1.556
  172    HA   PHE  24           HA       PHE  24   1.076  -3.976  -0.231
  173    HB2  PHE  24          2HB       PHE  24   0.025  -5.093  -2.489
  174    HB3  PHE  24          3HB       PHE  24  -0.745  -5.129  -0.906
  175    HD1  PHE  24          1HD       PHE  24  -2.920  -4.416  -0.737
  176    HD2  PHE  24          2HD       PHE  24  -0.501  -2.933  -3.910
  177    HE1  PHE  24          1HE       PHE  24  -4.863  -3.218  -1.656
  178    HE2  PHE  24          2HE       PHE  24  -2.440  -1.732  -4.833
  179    HZ   PHE  24           HZ       PHE  24  -4.624  -1.873  -3.705
  180    H    HIS  25           HN       HIS  25   2.344  -5.353  -1.837
  181    HA   HIS  25           HA       HIS  25   4.021  -3.548  -3.413
  182    HB2  HIS  25          2HB       HIS  25   4.430  -6.241  -2.168
  183    HB3  HIS  25          3HB       HIS  25   5.456  -5.746  -3.511
  184    HD2  HIS  25          2HD       HIS  25   5.941  -2.622  -2.555
  185    HE1  HIS  25          1HE       HIS  25   7.480  -4.424   0.964
  186    HE2  HIS  25          2HE       HIS  25   7.309  -2.303  -0.384
  187    H    ASP  26           HN       ASP  26   5.148  -5.097  -5.270
  188    HA   ASP  26           HA       ASP  26   2.924  -5.627  -7.085
  189    HB2  ASP  26          2HB       ASP  26   4.416  -4.291  -8.222
  190    HB3  ASP  26          3HB       ASP  26   5.818  -4.989  -7.418
  191    H    GLY  27           HN       GLY  27   5.388  -7.281  -5.309
  192    HA2  GLY  27          1HA       GLY  27   5.069  -9.733  -6.863
  193    HA3  GLY  27          2HA       GLY  27   6.203  -9.477  -5.545
  194    H    CYS  28           HN       CYS  28   4.395  -8.517  -3.608
  195    HA   CYS  28           HA       CYS  28   3.475 -10.928  -2.505
  196    HB2  CYS  28          2HB       CYS  28   2.683  -8.089  -1.824
  197    HB3  CYS  28          3HB       CYS  28   2.355  -9.501  -0.823
  198    H    LEU  29           HN       LEU  29   1.672  -8.254  -4.007
  199    HA   LEU  29           HA       LEU  29  -0.896  -9.230  -3.728
  200    HB2  LEU  29          2HB       LEU  29   0.285  -7.697  -6.038
  201    HB3  LEU  29          3HB       LEU  29  -1.440  -7.922  -5.760
  202    HG   LEU  29           HG       LEU  29   0.423  -6.473  -3.880
  203   HD11  LEU  29          1HD1      LEU  29   0.043  -4.550  -4.957
  204   HD12  LEU  29          2HD1      LEU  29  -1.639  -4.955  -5.294
  205   HD13  LEU  29          3HD1      LEU  29  -0.359  -5.578  -6.333
  206   HD21  LEU  29          1HD2      LEU  29  -1.247  -6.652  -2.430
  207   HD22  LEU  29          2HD2      LEU  29  -2.252  -7.478  -3.621
  208   HD23  LEU  29          3HD2      LEU  29  -2.256  -5.716  -3.533
  209    H    ARG  30           HN       ARG  30   1.649 -10.372  -5.757
  210    HA   ARG  30           HA       ARG  30  -0.172 -11.956  -7.399
  211    HB2  ARG  30          2HB       ARG  30   1.412 -11.717  -8.950
  212    HB3  ARG  30          3HB       ARG  30   2.391 -10.815  -7.801
  213    HG2  ARG  30          2HG       ARG  30   3.281 -13.004  -6.977
  214    HG3  ARG  30          3HG       ARG  30   2.443 -13.775  -8.326
  215    HD2  ARG  30          2HD       ARG  30   3.949 -13.052  -9.832
  216    HD3  ARG  30          3HD       ARG  30   4.097 -11.469  -9.068
  217    HE   ARG  30           HE       ARG  30   5.890 -12.248  -7.860
  218   HH11  ARG  30          1HH1      ARG  30   4.256 -14.917  -9.383
  219   HH12  ARG  30          2HH1      ARG  30   5.496 -16.065  -9.000
  220   HH21  ARG  30          1HH2      ARG  30   7.531 -13.749  -7.350
  221   HH22  ARG  30          2HH2      ARG  30   7.358 -15.399  -7.843
  222    H    ARG  31           HN       ARG  31   2.203 -12.314  -4.846
  223    HA   ARG  31           HA       ARG  31   2.438 -15.131  -4.955
  224    HB2  ARG  31          2HB       ARG  31   3.552 -13.043  -3.443
  225    HB3  ARG  31          3HB       ARG  31   2.764 -14.099  -2.278
  226    HG2  ARG  31          2HG       ARG  31   4.000 -16.015  -3.312
  227    HG3  ARG  31          3HG       ARG  31   4.903 -14.830  -4.259
  228    HD2  ARG  31          2HD       ARG  31   5.543 -13.740  -2.085
  229    HD3  ARG  31          3HD       ARG  31   4.832 -15.130  -1.263
  230    HE   ARG  31           HE       ARG  31   6.665 -16.374  -1.847
  231   HH11  ARG  31          1HH1      ARG  31   6.622 -13.441  -3.720
  232   HH12  ARG  31          2HH1      ARG  31   8.203 -13.687  -4.384
  233   HH21  ARG  31          1HH2      ARG  31   8.748 -16.710  -2.714
  234   HH22  ARG  31          2HH2      ARG  31   9.412 -15.548  -3.811
  235    H    MET  32           HN       MET  32   0.234 -12.959  -3.276
  236    HA   MET  32           HA       MET  32  -1.085 -15.199  -1.954
  237    HB2  MET  32          2HB       MET  32  -1.811 -12.269  -1.836
  238    HB3  MET  32          3HB       MET  32  -2.349 -13.543  -0.747
  239    HG2  MET  32          2HG       MET  32   0.566 -13.040  -0.993
  240    HG3  MET  32          3HG       MET  32  -0.415 -11.883  -0.097
  241    HE1  MET  32          1HE       MET  32  -2.136 -14.198   2.515
  242    HE2  MET  32          2HE       MET  32  -1.432 -12.582   2.558
  243    HE3  MET  32          3HE       MET  32  -2.484 -13.051   1.221
  244    H    GLY  33           HN       GLY  33  -1.142 -14.292  -4.964
  245    HA2  GLY  33          1HA       GLY  33  -2.660 -14.381  -6.683
  246    HA3  GLY  33          2HA       GLY  33  -3.622 -15.385  -5.608
  247    H    TYR  34           HN       TYR  34  -2.712 -12.000  -5.154
  248    HA   TYR  34           HA       TYR  34  -5.493 -11.321  -4.716
  249    HB2  TYR  34          2HB       TYR  34  -2.869 -10.002  -4.246
  250    HB3  TYR  34          3HB       TYR  34  -4.266  -8.956  -4.469
  251    HD1  TYR  34          1HD       TYR  34  -6.430 -10.204  -3.120
  252    HD2  TYR  34          2HD       TYR  34  -2.323 -10.153  -2.014
  253    HE1  TYR  34          1HE       TYR  34  -7.066 -10.545  -0.769
  254    HE2  TYR  34          2HE       TYR  34  -2.946 -10.494   0.340
  255    HH   TYR  34           HH       TYR  34  -5.512 -11.669   1.412
  256    H    ILE  35           HN       ILE  35  -2.990 -10.752  -7.108
  257    HA   ILE  35           HA       ILE  35  -5.033  -9.699  -8.922
  258    HB   ILE  35           HB       ILE  35  -3.452  -7.971  -9.755
  259   HG12  ILE  35          2HG1      ILE  35  -1.693  -7.347  -7.891
  260   HG13  ILE  35          3HG1      ILE  35  -1.820  -9.057  -7.495
  261   HG21  ILE  35          1HG2      ILE  35  -3.623  -6.997  -7.071
  262   HG22  ILE  35          2HG2      ILE  35  -4.598  -6.567  -8.475
  263   HG23  ILE  35          3HG2      ILE  35  -5.072  -7.926  -7.456
  264   HD11  ILE  35          1HD1      ILE  35  -1.142  -7.999 -10.227
  265   HD12  ILE  35          2HD1      ILE  35   0.045  -8.506  -9.024
  266   HD13  ILE  35          3HD1      ILE  35  -1.094  -9.677  -9.688
  267    H    GLN  36           HN       GLN  36  -3.692  -9.249 -11.153
  268    HA   GLN  36           HA       GLN  36  -2.782 -11.887 -11.913
  269    HB2  GLN  36          2HB       GLN  36  -4.154  -9.855 -13.210
  270    HB3  GLN  36          3HB       GLN  36  -2.564  -9.824 -13.959
  271    HG2  GLN  36          2HG       GLN  36  -3.939 -11.258 -15.251
  272    HG3  GLN  36          3HG       GLN  36  -2.790 -12.270 -14.375
  273   HE21  GLN  36          1HE2      GLN  36  -6.016 -10.864 -13.899
  274   HE22  GLN  36          2HE2      GLN  36  -6.724 -12.287 -13.224
  275    H    GLY  37           HN       GLY  37  -1.460  -8.579 -12.090
  276    HA2  GLY  37          1HA       GLY  37   0.743  -7.923 -11.691
  277    HA3  GLY  37          2HA       GLY  37   1.199  -9.616 -11.570
  278    H    ASP  38           HN       ASP  38   2.676  -7.652 -12.965
  279    HA   ASP  38           HA       ASP  38   3.821  -7.423 -14.919
  280    HB2  ASP  38          2HB       ASP  38   3.365 -10.069 -14.778
  281    HB3  ASP  38          3HB       ASP  38   2.462  -9.704 -16.246
  282    H    SER  39           HN       SER  39   3.284  -5.724 -16.105
  283    HA   SER  39           HA       SER  39   1.352  -5.886 -18.185
  284    HB2  SER  39          2HB       SER  39   0.434  -4.946 -15.614
  285    HB3  SER  39          3HB       SER  39   0.324  -3.655 -16.810
  286    HG   SER  39           HG       SER  39  -1.380  -5.556 -16.494
  287    H    ALA  40           HN       ALA  40   4.158  -5.132 -17.628
  288    HA   ALA  40           HA       ALA  40   5.699  -3.631 -18.369
  289    HB1  ALA  40          1HB       ALA  40   5.265  -3.132 -20.485
  290    HB2  ALA  40          2HB       ALA  40   3.572  -3.552 -20.225
  291    HB3  ALA  40          3HB       ALA  40   4.116  -1.892 -19.980
  292    H    ALA  41           HN       ALA  41   6.579  -1.757 -17.634
  293    HA   ALA  41           HA       ALA  41   5.367   0.643 -17.088
  294    HB1  ALA  41          1HB       ALA  41   5.070  -1.312 -14.844
  295    HB2  ALA  41          2HB       ALA  41   5.236   0.412 -14.510
  296    HB3  ALA  41          3HB       ALA  41   3.895  -0.170 -15.497
  297    H    GLU  42           HN       GLU  42   6.992  -0.641 -14.322
  298    HA   GLU  42           HA       GLU  42   8.984  -0.066 -13.365
  299    HB2  GLU  42          2HB       GLU  42  10.214  -0.400 -16.085
  300    HB3  GLU  42          3HB       GLU  42  10.880  -0.829 -14.516
  301    HG2  GLU  42          2HG       GLU  42   8.585  -2.358 -14.706
  302    HG3  GLU  42          3HG       GLU  42   9.261  -2.391 -16.332
  303    H    VAL  43           HN       VAL  43   7.461   2.150 -14.286
  304    HA   VAL  43           HA       VAL  43   9.637   4.047 -14.872
  305    HB   VAL  43           HB       VAL  43   8.443   4.057 -16.885
  306   HG11  VAL  43          1HG1      VAL  43   6.034   3.717 -15.152
  307   HG12  VAL  43          2HG1      VAL  43   5.860   4.399 -16.769
  308   HG13  VAL  43          3HG1      VAL  43   6.545   2.787 -16.560
  309   HG21  VAL  43          1HG2      VAL  43   6.824   6.222 -15.717
  310   HG22  VAL  43          2HG2      VAL  43   8.555   6.303 -15.385
  311   HG23  VAL  43          3HG2      VAL  43   7.978   6.258 -17.051
  312    H    THR  44           HN       THR  44   9.821   4.426 -12.616
  313    HA   THR  44           HA       THR  44   8.361   6.613 -11.657
  314    HB   THR  44           HB       THR  44   6.594   4.810 -11.414
  315    HG1  THR  44          1HG       THR  44   7.317   6.772  -9.775
  316   HG21  THR  44          1HG2      THR  44   8.088   3.006 -10.668
  317   HG22  THR  44          2HG2      THR  44   6.792   3.299  -9.508
  318   HG23  THR  44          3HG2      THR  44   8.418   3.901  -9.185
  319    H    GLU  45           HN       GLU  45   9.398   7.550  -9.959
  320    HA   GLU  45           HA       GLU  45  11.424   5.951  -8.546
  321    HB2  GLU  45          2HB       GLU  45  11.927   8.034 -10.393
  322    HB3  GLU  45          3HB       GLU  45  12.288   8.676  -8.796
  323    HG2  GLU  45          2HG       GLU  45  13.800   6.817  -8.374
  324    HG3  GLU  45          3HG       GLU  45  13.424   6.144  -9.958
  325    H    MET  46           HN       MET  46   8.718   7.809  -8.304
  326    HA   MET  46           HA       MET  46   9.381   8.604  -5.546
  327    HB2  MET  46          2HB       MET  46   7.934  10.086  -7.698
  328    HB3  MET  46          3HB       MET  46   7.437  10.329  -6.028
  329    HG2  MET  46          2HG       MET  46  10.325  10.538  -6.669
  330    HG3  MET  46          3HG       MET  46   9.258  11.844  -7.180
  331    HE1  MET  46          1HE       MET  46  10.916  13.344  -5.721
  332    HE2  MET  46          2HE       MET  46   9.249  13.922  -5.698
  333    HE3  MET  46          3HE       MET  46  10.195  13.895  -4.209
  334    H    ALA  47           HN       ALA  47   6.225   8.991  -6.960
  335    HA   ALA  47           HA       ALA  47   4.934   6.650  -6.558
  336    HB1  ALA  47          1HB       ALA  47   5.224   6.136  -4.404
  337    HB2  ALA  47          2HB       ALA  47   5.788   7.758  -4.001
  338    HB3  ALA  47          3HB       ALA  47   4.059   7.418  -4.072
  339    H    HIS  48           HN       HIS  48   4.124   8.232  -8.261
  340    HA   HIS  48           HA       HIS  48   2.181   9.191  -9.036
  341    HB2  HIS  48          2HB       HIS  48   1.295   8.244  -6.676
  342    HB3  HIS  48          3HB       HIS  48   1.172   9.972  -6.358
  343    HD1  HIS  48          1HD       HIS  48  -1.269  10.411  -6.553
  344    HD2  HIS  48          2HD       HIS  48   0.172   8.136  -9.717
  345    HE1  HIS  48          1HE       HIS  48  -3.195  10.190  -8.155
  346    H    THR  49           HN       THR  49   4.369  10.609  -9.173
  347    HA   THR  49           HA       THR  49   3.464  13.323  -8.697
  348    HB   THR  49           HB       THR  49   5.853  13.869  -7.806
  349    HG1  THR  49          1HG       THR  49   5.560  11.139  -7.028
  350   HG21  THR  49          1HG2      THR  49   4.831  14.243  -5.842
  351   HG22  THR  49          2HG2      THR  49   4.436  12.537  -5.623
  352   HG23  THR  49          3HG2      THR  49   3.399  13.564  -6.612
  353    H    GLU  50           HN       GLU  50   3.629  14.174 -10.663
  354    HA   GLU  50           HA       GLU  50   4.407  14.715 -12.734
  355    HB2  GLU  50          2HB       GLU  50   6.156  15.733 -11.194
  356    HB3  GLU  50          3HB       GLU  50   7.159  14.335 -11.559
  357    HG2  GLU  50          2HG       GLU  50   6.196  15.473 -13.996
  358    HG3  GLU  50          3HG       GLU  50   6.930  16.732 -13.004
  359    H    THR  51           HN       THR  51   4.112  11.822 -11.946
  360    HA   THR  51           HA       THR  51   5.810  10.675 -14.067
  361    HB   THR  51           HB       THR  51   5.545   8.483 -12.864
  362    HG1  THR  51          1HG       THR  51   4.858   8.582 -10.696
  363   HG21  THR  51          1HG2      THR  51   7.638   9.134 -12.367
  364   HG22  THR  51          2HG2      THR  51   6.976   9.543 -10.784
  365   HG23  THR  51          3HG2      THR  51   7.140  10.789 -12.020
  366    H    GLY  52           HN       GLY  52   3.219   9.008 -12.398
  367    HA2  GLY  52          1HA       GLY  52   0.909   9.173 -13.409
  368    HA3  GLY  52          2HA       GLY  52   1.728   8.947 -14.947
  369    H    TRP  53           HN       TRP  53   1.695   7.372 -11.745
  370    HA   TRP  53           HA       TRP  53   1.771   4.777 -13.113
  371    HB2  TRP  53          2HB       TRP  53   3.130   5.770 -10.863
  372    HB3  TRP  53          3HB       TRP  53   1.967   4.605 -10.235
  373    HD1  TRP  53          1HD       TRP  53   4.984   4.821 -12.614
  374    HE1  TRP  53          1HE       TRP  53   5.970   2.460 -12.886
  375    HE3  TRP  53          3HE       TRP  53   1.443   2.161 -10.060
  376    HZ2  TRP  53          2HZ       TRP  53   5.332  -0.182 -12.120
  377    HZ3  TRP  53          3HZ       TRP  53   1.704  -0.278  -9.876
  378    HH2  TRP  53          2HH       TRP  53   3.610  -1.423 -10.886
  379    H    SER  54           HN       SER  54  -0.006   3.583 -13.244
  380    HA   SER  54           HA       SER  54  -2.286   4.269 -11.520
  381    HB2  SER  54          2HB       SER  54  -3.387   2.684 -13.411
  382    HB3  SER  54          3HB       SER  54  -3.218   4.430 -13.593
  383    HG   SER  54           HG       SER  54  -2.172   2.538 -15.106
  384    H    CYS  55           HN       CYS  55  -2.212   3.019  -9.750
  385    HA   CYS  55           HA       CYS  55  -1.168   0.385  -9.685
  386    HB2  CYS  55          2HB       CYS  55  -1.810   0.339  -7.412
  387    HB3  CYS  55          3HB       CYS  55  -1.406   2.021  -7.737
  388    H    HIS  56           HN       HIS  56  -2.465  -1.520  -8.934
  389    HA   HIS  56           HA       HIS  56  -4.277  -2.359 -10.796
  390    HB2  HIS  56          2HB       HIS  56  -3.910  -3.165  -7.919
  391    HB3  HIS  56          3HB       HIS  56  -5.097  -3.958  -8.951
  392    HD1  HIS  56          1HD       HIS  56  -3.623  -4.413 -11.506
  393    HD2  HIS  56          2HD       HIS  56  -1.815  -4.862  -7.792
  394    HE1  HIS  56          1HE       HIS  56  -1.662  -5.938 -11.894
  395    H    TYR  57           HN       TYR  57  -5.229  -1.377  -7.499
  396    HA   TYR  57           HA       TYR  57  -7.979  -1.192  -8.126
  397    HB2  TYR  57          2HB       TYR  57  -6.338  -0.113  -5.836
  398    HB3  TYR  57          3HB       TYR  57  -8.082   0.102  -5.936
  399    HD1  TYR  57          1HD       TYR  57  -9.491  -1.519  -5.048
  400    HD2  TYR  57          2HD       TYR  57  -5.471  -2.560  -5.975
  401    HE1  TYR  57          1HE       TYR  57  -9.827  -3.721  -4.005
  402    HE2  TYR  57          2HE       TYR  57  -5.797  -4.765  -4.936
  403    HH   TYR  57           HH       TYR  57  -8.934  -5.703  -3.559
  404    H    CYS  58           HN       CYS  58  -6.317   1.593  -6.772
  405    HA   CYS  58           HA       CYS  58  -6.270   3.793  -7.352
  406    HB2  CYS  58          2HB       CYS  58  -6.205   2.378  -9.923
  407    HB3  CYS  58          3HB       CYS  58  -6.843   4.015 -10.028
  408    H    ASP  59           HN       ASP  59  -8.646   2.706  -9.754
  409    HA   ASP  59           HA       ASP  59 -10.972   3.290  -8.356
  410    HB2  ASP  59          2HB       ASP  59 -11.539   5.508  -9.492
  411    HB3  ASP  59          3HB       ASP  59 -10.386   5.571  -8.161
  412    H    ASN  60           HN       ASN  60 -10.242   1.353 -10.138
  413    HA   ASN  60           HA       ASN  60 -12.390   1.353 -11.955
  414    HB2  ASN  60          2HB       ASN  60 -10.737   1.183 -14.019
  415    HB3  ASN  60          3HB       ASN  60 -11.368   2.738 -13.481
  416   HD21  ASN  60          1HD2      ASN  60  -9.687   3.972 -14.164
  417   HD22  ASN  60          2HD2      ASN  60  -8.095   3.876 -13.501
  Start of MODEL    9
    1    H1   GLU   1           HN       GLU   1   3.327   4.936   4.411
    2    HA   GLU   1           HA       GLU   1   1.656   3.304   2.623
    3    HB2  GLU   1          2HB       GLU   1   4.415   3.453   1.805
    4    HB3  GLU   1          3HB       GLU   1   2.970   3.956   0.939
    5    HG2  GLU   1          2HG       GLU   1   3.034   6.078   2.285
    6    HG3  GLU   1          3HG       GLU   1   4.624   5.572   2.855
    7    H    MET   2           HN       MET   2   1.430   1.578   4.106
    8    HA   MET   2           HA       MET   2   3.889  -0.004   4.471
    9    HB2  MET   2          2HB       MET   2   1.570  -0.407   6.297
   10    HB3  MET   2          3HB       MET   2   3.289  -0.602   6.609
   11    HG2  MET   2          2HG       MET   2   3.029   2.098   6.132
   12    HG3  MET   2          3HG       MET   2   1.566   1.691   7.026
   13    HE1  MET   2          1HE       MET   2   5.296   1.033   6.800
   14    HE2  MET   2          2HE       MET   2   5.382   2.630   7.542
   15    HE3  MET   2          3HE       MET   2   5.893   1.205   8.451
   16    H    CYS   3           HN       CYS   3   3.828  -1.579   3.000
   17    HA   CYS   3           HA       CYS   3   1.803  -2.577   1.534
   18    HB2  CYS   3          2HB       CYS   3   4.191  -3.270   1.359
   19    HB3  CYS   3          3HB       CYS   3   3.958  -4.309   2.761
   20    H    ASP   4           HN       ASP   4   0.121  -3.975   1.725
   21    HA   ASP   4           HA       ASP   4  -0.903  -4.471   4.348
   22    HB2  ASP   4          2HB       ASP   4  -2.207  -4.014   2.153
   23    HB3  ASP   4          3HB       ASP   4  -1.994  -5.736   1.849
   24    H    VAL   5           HN       VAL   5   1.489  -5.973   2.748
   25    HA   VAL   5           HA       VAL   5   0.877  -8.574   3.991
   26    HB   VAL   5           HB       VAL   5   2.322  -8.094   1.383
   27   HG11  VAL   5          1HG1      VAL   5   1.940 -10.608   2.996
   28   HG12  VAL   5          2HG1      VAL   5   2.403 -10.604   1.293
   29   HG13  VAL   5          3HG1      VAL   5   3.459  -9.863   2.498
   30   HG21  VAL   5          1HG2      VAL   5   0.497  -9.450   0.431
   31   HG22  VAL   5          2HG2      VAL   5  -0.277  -9.492   2.015
   32   HG23  VAL   5          3HG2      VAL   5  -0.089  -7.958   1.166
   33    H    CYS   6           HN       CYS   6   2.967  -5.933   3.777
   34    HA   CYS   6           HA       CYS   6   5.000  -7.383   5.330
   35    HB2  CYS   6          2HB       CYS   6   5.646  -5.239   3.300
   36    HB3  CYS   6          3HB       CYS   6   6.787  -6.229   4.206
   37    H    GLU   7           HN       GLU   7   3.404  -4.344   4.579
   38    HA   GLU   7           HA       GLU   7   3.097  -2.433   5.774
   39    HB2  GLU   7          2HB       GLU   7   3.889  -3.690   8.341
   40    HB3  GLU   7          3HB       GLU   7   2.483  -2.707   7.955
   41    HG2  GLU   7          2HG       GLU   7   1.576  -4.683   6.701
   42    HG3  GLU   7          3HG       GLU   7   2.896  -5.627   7.387
   43    H    VAL   8           HN       VAL   8   5.488  -2.475   4.567
   44    HA   VAL   8           HA       VAL   8   7.127  -0.918   6.394
   45    HB   VAL   8           HB       VAL   8   8.902  -2.621   4.902
   46   HG11  VAL   8          1HG1      VAL   8   9.751  -1.447   6.740
   47   HG12  VAL   8          2HG1      VAL   8   8.435  -1.966   7.795
   48   HG13  VAL   8          3HG1      VAL   8   9.671  -3.120   7.292
   49   HG21  VAL   8          1HG2      VAL   8   6.941  -4.185   5.124
   50   HG22  VAL   8          2HG2      VAL   8   8.448  -4.756   5.841
   51   HG23  VAL   8          3HG2      VAL   8   7.172  -4.105   6.871
   52    H    TRP   9           HN       TRP   9   7.183   0.932   5.283
   53    HA   TRP   9           HA       TRP   9   7.104   1.085   2.446
   54    HB2  TRP   9          2HB       TRP   9   6.353   3.090   3.145
   55    HB3  TRP   9          3HB       TRP   9   7.174   2.950   4.697
   56    HD1  TRP   9          1HD       TRP   9   9.741   3.847   4.802
   57    HE1  TRP   9          1HE       TRP   9  10.944   5.640   3.401
   58    HE3  TRP   9          3HE       TRP   9   6.493   4.116   0.862
   59    HZ2  TRP   9          2HZ       TRP   9  10.566   6.990   0.951
   60    HZ3  TRP   9          3HZ       TRP   9   6.986   5.684  -0.968
   61    HH2  TRP   9          2HH       TRP   9   8.981   7.091  -0.922
   62    H    THR  10           HN       THR  10   8.735   1.890   1.027
   63    HA   THR  10           HA       THR  10  11.474   1.331   1.967
   64    HB   THR  10           HB       THR  10  11.785   1.010  -0.661
   65    HG1  THR  10          1HG       THR  10   9.066   0.309  -0.154
   66   HG21  THR  10          1HG2      THR  10  12.481  -0.789   0.572
   67   HG22  THR  10          2HG2      THR  10  11.036  -1.487  -0.160
   68   HG23  THR  10          3HG2      THR  10  10.982  -0.876   1.494
   69    H    ALA  11           HN       ALA  11  10.721   2.603  -1.187
   70    HA   ALA  11           HA       ALA  11  10.700   5.290  -0.930
   71    HB1  ALA  11          1HB       ALA  11  13.319   5.658  -1.291
   72    HB2  ALA  11          2HB       ALA  11  12.562   5.683   0.302
   73    HB3  ALA  11          3HB       ALA  11  13.378   4.225  -0.264
   74    H    GLU  12           HN       GLU  12  12.696   2.825  -2.535
   75    HA   GLU  12           HA       GLU  12  13.330   3.886  -4.904
   76    HB2  GLU  12          2HB       GLU  12  11.910   1.253  -4.999
   77    HB3  GLU  12          3HB       GLU  12  13.382   1.754  -5.819
   78    HG2  GLU  12          2HG       GLU  12  14.479   1.797  -3.542
   79    HG3  GLU  12          3HG       GLU  12  13.041   0.973  -2.943
   80    H    SER  13           HN       SER  13  10.115   2.484  -4.261
   81    HA   SER  13           HA       SER  13   8.554   4.427  -5.370
   82    HB2  SER  13          2HB       SER  13   9.969   2.918  -7.429
   83    HB3  SER  13          3HB       SER  13   8.218   2.874  -7.642
   84    HG   SER  13           HG       SER  13   9.411   5.330  -7.057
   85    H    LEU  14           HN       LEU  14   7.588   3.330  -3.481
   86    HA   LEU  14           HA       LEU  14   6.497   0.710  -3.749
   87    HB2  LEU  14          2HB       LEU  14   7.045   1.848  -1.590
   88    HB3  LEU  14          3HB       LEU  14   5.642   2.884  -1.847
   89    HG   LEU  14           HG       LEU  14   4.142   1.062  -1.577
   90   HD11  LEU  14          1HD1      LEU  14   4.952  -0.788  -2.636
   91   HD12  LEU  14          2HD1      LEU  14   5.304  -1.227  -0.964
   92   HD13  LEU  14          3HD1      LEU  14   6.582  -0.582  -1.994
   93   HD21  LEU  14          1HD2      LEU  14   5.068   0.072   0.663
   94   HD22  LEU  14          2HD2      LEU  14   4.632   1.777   0.549
   95   HD23  LEU  14          3HD2      LEU  14   6.324   1.290   0.441
   96    H    PHE  15           HN       PHE  15   4.730   0.102  -4.800
   97    HA   PHE  15           HA       PHE  15   2.505   1.971  -5.102
   98    HB2  PHE  15          2HB       PHE  15   2.322   1.167  -7.542
   99    HB3  PHE  15          3HB       PHE  15   3.548   2.373  -7.166
  100    HD1  PHE  15          1HD       PHE  15   5.783   1.991  -7.686
  101    HD2  PHE  15          2HD       PHE  15   3.050  -1.272  -7.650
  102    HE1  PHE  15          1HE       PHE  15   7.514   0.535  -8.655
  103    HE2  PHE  15          2HE       PHE  15   4.776  -2.733  -8.617
  104    HZ   PHE  15           HZ       PHE  15   7.012  -1.831  -9.120
  105    HA   PRO  16           HA       PRO  16   0.632   1.820  -6.556
  106    HB2  PRO  16          2HB       PRO  16  -1.867   1.850  -5.496
  107    HB3  PRO  16          3HB       PRO  16  -1.447   0.919  -6.939
  108    HG2  PRO  16          2HG       PRO  16  -1.715  -0.001  -4.103
  109    HG3  PRO  16          3HG       PRO  16  -2.284  -0.781  -5.591
  110    HD2  PRO  16          2HD       PRO  16  -0.022  -1.550  -4.317
  111    HD3  PRO  16          3HD       PRO  16  -0.207  -1.650  -6.080
  112    H    CYS  17           HN       CYS  17  -0.716   3.715  -5.436
  113    HA   CYS  17           HA       CYS  17   0.893   4.860  -3.504
  114    HB2  CYS  17          2HB       CYS  17  -2.029   5.526  -3.607
  115    HB3  CYS  17          3HB       CYS  17  -0.650   6.602  -3.406
  116    H    ARG  18           HN       ARG  18  -0.499   5.772  -1.394
  117    HA   ARG  18           HA       ARG  18  -1.084   3.320   0.129
  118    HB2  ARG  18          2HB       ARG  18  -0.035   4.207   1.969
  119    HB3  ARG  18          3HB       ARG  18   0.906   4.959   0.688
  120    HG2  ARG  18          2HG       ARG  18  -1.406   6.252   2.120
  121    HG3  ARG  18          3HG       ARG  18   0.299   6.526   2.482
  122    HD2  ARG  18          2HD       ARG  18  -1.062   7.095  -0.150
  123    HD3  ARG  18          3HD       ARG  18  -0.624   8.297   1.064
  124    HE   ARG  18           HE       ARG  18   1.711   6.985   0.475
  125   HH11  ARG  18          1HH1      ARG  18  -0.670   8.784  -1.319
  126   HH12  ARG  18          2HH1      ARG  18   0.463   9.355  -2.501
  127   HH21  ARG  18          1HH2      ARG  18   3.211   7.730  -1.074
  128   HH22  ARG  18          2HH2      ARG  18   2.669   8.754  -2.360
  129    H    VAL  19           HN       VAL  19  -2.639   5.747  -1.356
  130    HA   VAL  19           HA       VAL  19  -4.621   6.184   0.760
  131    HB   VAL  19           HB       VAL  19  -5.507   7.658  -1.366
  132   HG11  VAL  19          1HG1      VAL  19  -3.598   8.442   0.831
  133   HG12  VAL  19          2HG1      VAL  19  -4.481   9.590  -0.178
  134   HG13  VAL  19          3HG1      VAL  19  -5.359   8.486   0.881
  135   HG21  VAL  19          1HG2      VAL  19  -3.688   8.721  -2.452
  136   HG22  VAL  19          2HG2      VAL  19  -2.511   7.942  -1.396
  137   HG23  VAL  19          3HG2      VAL  19  -3.401   6.986  -2.581
  138    H    CYS  20           HN       CYS  20  -4.720   5.632  -2.766
  139    HA   CYS  20           HA       CYS  20  -7.239   4.938  -3.236
  140    HB2  CYS  20          2HB       CYS  20  -6.051   2.861  -4.552
  141    HB3  CYS  20          3HB       CYS  20  -6.111   4.518  -5.146
  142    H    THR  21           HN       THR  21  -4.975   2.966  -1.416
  143    HA   THR  21           HA       THR  21  -6.775   1.726   0.218
  144    HB   THR  21           HB       THR  21  -6.567  -0.644  -1.085
  145    HG1  THR  21          1HG       THR  21  -7.410   0.958  -3.201
  146   HG21  THR  21          1HG2      THR  21  -8.704  -0.384  -0.456
  147   HG22  THR  21          2HG2      THR  21  -8.955   0.322  -2.053
  148   HG23  THR  21          3HG2      THR  21  -8.641   1.366  -0.667
  149    H    ARG  22           HN       ARG  22  -4.028   2.610   0.061
  150    HA   ARG  22           HA       ARG  22  -2.140   2.038   1.246
  151    HB2  ARG  22          2HB       ARG  22  -2.969  -0.851   1.245
  152    HB3  ARG  22          3HB       ARG  22  -1.945   0.001   2.394
  153    HG2  ARG  22          2HG       ARG  22  -3.680   0.600   3.656
  154    HG3  ARG  22          3HG       ARG  22  -4.641   1.087   2.258
  155    HD2  ARG  22          2HD       ARG  22  -4.668  -1.599   1.967
  156    HD3  ARG  22          3HD       ARG  22  -4.572  -1.469   3.723
  157    HE   ARG  22           HE       ARG  22  -6.563   0.274   2.872
  158   HH11  ARG  22          1HH1      ARG  22  -5.932  -3.150   2.884
  159   HH12  ARG  22          2HH1      ARG  22  -7.606  -3.590   2.956
  160   HH21  ARG  22          1HH2      ARG  22  -8.770  -0.293   2.968
  161   HH22  ARG  22          2HH2      ARG  22  -9.219  -1.964   3.004
  162    H    VAL  23           HN       VAL  23  -0.302   0.175   0.962
  163    HA   VAL  23           HA       VAL  23   0.149   0.071  -1.940
  164    HB   VAL  23           HB       VAL  23   2.522  -0.130  -1.440
  165   HG11  VAL  23          1HG1      VAL  23   2.519   2.095   0.137
  166   HG12  VAL  23          2HG1      VAL  23   2.284   2.094  -1.612
  167   HG13  VAL  23          3HG1      VAL  23   0.888   2.125  -0.534
  168   HG21  VAL  23          1HG2      VAL  23   2.931  -1.218   0.498
  169   HG22  VAL  23          2HG2      VAL  23   2.972   0.419   1.155
  170   HG23  VAL  23          3HG2      VAL  23   1.507  -0.552   1.298
  171    H    PHE  24           HN       PHE  24   1.163  -1.808  -2.857
  172    HA   PHE  24           HA       PHE  24   1.145  -4.254  -1.289
  173    HB2  PHE  24          2HB       PHE  24  -0.303  -4.539  -3.847
  174    HB3  PHE  24          3HB       PHE  24  -0.603  -5.303  -2.289
  175    HD1  PHE  24          1HD       PHE  24  -1.722  -2.886  -4.605
  176    HD2  PHE  24          2HD       PHE  24  -1.611  -3.784  -0.446
  177    HE1  PHE  24          1HE       PHE  24  -3.616  -1.360  -4.229
  178    HE2  PHE  24          2HE       PHE  24  -3.504  -2.260  -0.063
  179    HZ   PHE  24           HZ       PHE  24  -4.510  -1.046  -1.955
  180    H    HIS  25           HN       HIS  25   3.088  -5.061  -1.698
  181    HA   HIS  25           HA       HIS  25   4.698  -4.433  -3.892
  182    HB2  HIS  25          2HB       HIS  25   4.835  -6.909  -2.158
  183    HB3  HIS  25          3HB       HIS  25   6.135  -6.273  -3.162
  184    HD2  HIS  25          2HD       HIS  25   4.726  -3.251  -1.560
  185    HE1  HIS  25          1HE       HIS  25   7.554  -4.720   1.240
  186    HE2  HIS  25          2HE       HIS  25   6.049  -2.799   0.615
  187    H    ASP  26           HN       ASP  26   4.871  -5.208  -5.906
  188    HA   ASP  26           HA       ASP  26   2.868  -6.683  -7.122
  189    HB2  ASP  26          2HB       ASP  26   4.574  -7.048  -8.968
  190    HB3  ASP  26          3HB       ASP  26   4.289  -5.372  -8.503
  191    H    GLY  27           HN       GLY  27   5.662  -7.772  -5.372
  192    HA2  GLY  27          1HA       GLY  27   5.519 -10.482  -6.372
  193    HA3  GLY  27          2HA       GLY  27   6.574  -9.892  -5.096
  194    H    CYS  28           HN       CYS  28   4.573  -8.769  -3.428
  195    HA   CYS  28           HA       CYS  28   3.891 -10.966  -1.857
  196    HB2  CYS  28          2HB       CYS  28   3.013  -8.107  -1.936
  197    HB3  CYS  28          3HB       CYS  28   2.153  -9.235  -0.894
  198    H    LEU  29           HN       LEU  29   1.843  -9.063  -4.057
  199    HA   LEU  29           HA       LEU  29  -0.490 -10.613  -3.656
  200    HB2  LEU  29          2HB       LEU  29   0.216  -8.988  -6.091
  201    HB3  LEU  29          3HB       LEU  29  -1.396  -9.453  -5.550
  202    HG   LEU  29           HG       LEU  29   0.350  -7.692  -3.863
  203   HD11  LEU  29          1HD1      LEU  29  -1.342  -5.952  -5.064
  204   HD12  LEU  29          2HD1      LEU  29  -0.964  -7.035  -6.403
  205   HD13  LEU  29          3HD1      LEU  29   0.335  -6.208  -5.545
  206   HD21  LEU  29          1HD2      LEU  29  -1.691  -7.032  -2.860
  207   HD22  LEU  29          2HD2      LEU  29  -1.740  -8.791  -2.980
  208   HD23  LEU  29          3HD2      LEU  29  -2.646  -7.803  -4.128
  209    H    ARG  30           HN       ARG  30   2.314 -11.023  -5.641
  210    HA   ARG  30           HA       ARG  30   1.079 -12.968  -7.389
  211    HB2  ARG  30          2HB       ARG  30   2.801 -12.444  -8.704
  212    HB3  ARG  30          3HB       ARG  30   3.420 -11.381  -7.447
  213    HG2  ARG  30          2HG       ARG  30   4.600 -13.335  -6.462
  214    HG3  ARG  30          3HG       ARG  30   4.080 -14.287  -7.853
  215    HD2  ARG  30          2HD       ARG  30   5.321 -12.915  -9.354
  216    HD3  ARG  30          3HD       ARG  30   5.653 -11.733  -8.089
  217    HE   ARG  30           HE       ARG  30   7.410 -13.023  -7.405
  218   HH11  ARG  30          1HH1      ARG  30   5.294 -14.955  -9.384
  219   HH12  ARG  30          2HH1      ARG  30   6.363 -16.319  -9.422
  220   HH21  ARG  30          1HH2      ARG  30   8.823 -14.812  -7.447
  221   HH22  ARG  30          2HH2      ARG  30   8.369 -16.237  -8.318
  222    H    ARG  31           HN       ARG  31   2.882 -12.936  -4.425
  223    HA   ARG  31           HA       ARG  31   3.462 -15.781  -4.539
  224    HB2  ARG  31          2HB       ARG  31   4.398 -13.506  -3.006
  225    HB3  ARG  31          3HB       ARG  31   3.998 -14.857  -1.954
  226    HG2  ARG  31          2HG       ARG  31   5.750 -15.179  -4.369
  227    HG3  ARG  31          3HG       ARG  31   6.386 -14.708  -2.791
  228    HD2  ARG  31          2HD       ARG  31   4.732 -16.900  -2.293
  229    HD3  ARG  31          3HD       ARG  31   5.614 -17.313  -3.763
  230    HE   ARG  31           HE       ARG  31   7.405 -16.281  -1.854
  231   HH11  ARG  31          1HH1      ARG  31   5.456 -19.096  -2.484
  232   HH12  ARG  31          2HH1      ARG  31   6.499 -20.173  -1.615
  233   HH21  ARG  31          1HH2      ARG  31   8.786 -17.689  -0.708
  234   HH22  ARG  31          2HH2      ARG  31   8.392 -19.372  -0.605
  235    H    MET  32           HN       MET  32   1.226 -13.580  -2.974
  236    HA   MET  32           HA       MET  32   0.133 -15.620  -1.247
  237    HB2  MET  32          2HB       MET  32  -0.494 -12.737  -1.781
  238    HB3  MET  32          3HB       MET  32  -1.645 -13.739  -0.907
  239    HG2  MET  32          2HG       MET  32   0.297 -12.315   0.270
  240    HG3  MET  32          3HG       MET  32  -0.396 -13.785   0.952
  241    HE1  MET  32          1HE       MET  32   3.633 -12.889  -0.729
  242    HE2  MET  32          2HE       MET  32   2.272 -11.856  -0.294
  243    HE3  MET  32          3HE       MET  32   3.310 -12.525   0.966
  244    H    GLY  33           HN       GLY  33  -0.016 -15.350  -4.426
  245    HA2  GLY  33          1HA       GLY  33  -1.443 -16.172  -6.026
  246    HA3  GLY  33          2HA       GLY  33  -2.322 -16.946  -4.716
  247    H    TYR  34           HN       TYR  34  -2.117 -13.659  -4.152
  248    HA   TYR  34           HA       TYR  34  -4.879 -13.234  -4.378
  249    HB2  TYR  34          2HB       TYR  34  -2.541 -11.353  -4.123
  250    HB3  TYR  34          3HB       TYR  34  -4.195 -10.761  -4.224
  251    HD1  TYR  34          1HD       TYR  34  -5.710 -12.604  -2.596
  252    HD2  TYR  34          2HD       TYR  34  -1.803 -11.047  -1.952
  253    HE1  TYR  34          1HE       TYR  34  -5.982 -12.940  -0.175
  254    HE2  TYR  34          2HE       TYR  34  -2.063 -11.381   0.471
  255    HH   TYR  34           HH       TYR  34  -4.926 -11.842   1.966
  256    H    ILE  35           HN       ILE  35  -2.390 -13.136  -6.728
  257    HA   ILE  35           HA       ILE  35  -4.323 -12.192  -8.720
  258    HB   ILE  35           HB       ILE  35  -2.701 -10.796  -9.827
  259   HG12  ILE  35          2HG1      ILE  35  -0.666 -10.756  -7.745
  260   HG13  ILE  35          3HG1      ILE  35  -0.818 -12.345  -8.485
  261   HG21  ILE  35          1HG2      ILE  35  -2.466  -9.015  -8.186
  262   HG22  ILE  35          2HG2      ILE  35  -4.046  -9.784  -8.052
  263   HG23  ILE  35          3HG2      ILE  35  -2.781 -10.159  -6.882
  264   HD11  ILE  35          1HD1      ILE  35  -0.227 -11.551 -10.589
  265   HD12  ILE  35          2HD1      ILE  35  -0.558  -9.874 -10.151
  266   HD13  ILE  35          3HD1      ILE  35   0.854 -10.698  -9.487
  267    H    GLN  36           HN       GLN  36  -3.052 -12.403 -11.002
  268    HA   GLN  36           HA       GLN  36  -1.322 -14.672 -11.200
  269    HB2  GLN  36          2HB       GLN  36  -4.172 -15.106 -11.252
  270    HB3  GLN  36          3HB       GLN  36  -3.462 -15.538 -12.802
  271    HG2  GLN  36          2HG       GLN  36  -1.962 -16.532 -10.505
  272    HG3  GLN  36          3HG       GLN  36  -3.607 -17.157 -10.613
  273   HE21  GLN  36          1HE2      GLN  36  -3.805 -18.951 -11.723
  274   HE22  GLN  36          2HE2      GLN  36  -2.785 -19.474 -13.016
  275    H    GLY  37           HN       GLY  37  -0.016 -13.412 -12.477
  276    HA2  GLY  37          1HA       GLY  37   0.144 -13.420 -15.067
  277    HA3  GLY  37          2HA       GLY  37  -1.183 -12.277 -14.924
  278    H    ASP  38           HN       ASP  38   1.580 -11.986 -15.989
  279    HA   ASP  38           HA       ASP  38   2.764 -10.079 -14.124
  280    HB2  ASP  38          2HB       ASP  38   4.583  -9.979 -15.904
  281    HB3  ASP  38          3HB       ASP  38   4.377 -11.525 -15.085
  282    H    SER  39           HN       SER  39   1.492  -8.273 -14.183
  283    HA   SER  39           HA       SER  39   0.392  -7.150 -16.528
  284    HB2  SER  39          2HB       SER  39   0.091  -6.706 -13.834
  285    HB3  SER  39          3HB       SER  39   0.945  -5.254 -14.353
  286    HG   SER  39           HG       SER  39  -1.353  -6.242 -15.679
  287    H    ALA  40           HN       ALA  40   1.359  -6.092 -18.116
  288    HA   ALA  40           HA       ALA  40   4.092  -5.143 -17.762
  289    HB1  ALA  40          1HB       ALA  40   2.838  -4.778 -20.387
  290    HB2  ALA  40          2HB       ALA  40   4.380  -5.518 -19.955
  291    HB3  ALA  40          3HB       ALA  40   2.888  -6.449 -19.822
  292    H    ALA  41           HN       ALA  41   4.181  -3.135 -19.671
  293    HA   ALA  41           HA       ALA  41   3.670  -0.938 -20.106
  294    HB1  ALA  41          1HB       ALA  41   1.478  -0.772 -18.125
  295    HB2  ALA  41          2HB       ALA  41   1.573  -0.145 -19.771
  296    HB3  ALA  41          3HB       ALA  41   1.237  -1.855 -19.496
  297    H    GLU  42           HN       GLU  42   5.132   0.423 -19.330
  298    HA   GLU  42           HA       GLU  42   5.040   1.211 -16.533
  299    HB2  GLU  42          2HB       GLU  42   7.338  -0.237 -17.798
  300    HB3  GLU  42          3HB       GLU  42   7.649   0.962 -16.551
  301    HG2  GLU  42          2HG       GLU  42   6.160  -0.278 -15.029
  302    HG3  GLU  42          3HG       GLU  42   5.949  -1.506 -16.275
  303    H    VAL  43           HN       VAL  43   4.392   3.231 -17.312
  304    HA   VAL  43           HA       VAL  43   6.146   4.671 -19.131
  305    HB   VAL  43           HB       VAL  43   3.634   5.644 -17.767
  306   HG11  VAL  43          1HG1      VAL  43   4.105   6.915 -20.245
  307   HG12  VAL  43          2HG1      VAL  43   4.144   7.625 -18.630
  308   HG13  VAL  43          3HG1      VAL  43   5.617   6.961 -19.338
  309   HG21  VAL  43          1HG2      VAL  43   4.080   4.112 -20.288
  310   HG22  VAL  43          2HG2      VAL  43   2.816   3.930 -19.072
  311   HG23  VAL  43          3HG2      VAL  43   2.762   5.282 -20.205
  312    H    THR  44           HN       THR  44   4.881   5.084 -15.829
  313    HA   THR  44           HA       THR  44   7.373   6.177 -14.921
  314    HB   THR  44           HB       THR  44   6.318   8.159 -16.021
  315    HG1  THR  44          1HG       THR  44   6.474   8.416 -13.189
  316   HG21  THR  44          1HG2      THR  44   3.976   7.628 -15.557
  317   HG22  THR  44          2HG2      THR  44   4.399   9.219 -14.921
  318   HG23  THR  44          3HG2      THR  44   4.264   7.839 -13.830
  319    H    GLU  45           HN       GLU  45   7.615   5.895 -12.767
  320    HA   GLU  45           HA       GLU  45   5.286   4.862 -11.301
  321    HB2  GLU  45          2HB       GLU  45   7.384   4.231  -9.713
  322    HB3  GLU  45          3HB       GLU  45   6.756   3.177 -10.973
  323    HG2  GLU  45          2HG       GLU  45   8.912   5.164 -11.566
  324    HG3  GLU  45          3HG       GLU  45   9.287   3.597 -10.852
  325    H    MET  46           HN       MET  46   8.216   5.972  -9.763
  326    HA   MET  46           HA       MET  46   8.611   7.556  -8.180
  327    HB2  MET  46          2HB       MET  46   6.541   9.054  -9.794
  328    HB3  MET  46          3HB       MET  46   7.521   9.778  -8.525
  329    HG2  MET  46          2HG       MET  46   9.462   8.716 -10.031
  330    HG3  MET  46          3HG       MET  46   8.245   8.999 -11.273
  331    HE1  MET  46          1HE       MET  46  10.359  12.196  -8.731
  332    HE2  MET  46          2HE       MET  46   9.374  10.934  -7.990
  333    HE3  MET  46          3HE       MET  46  10.841  10.504  -8.872
  334    H    ALA  47           HN       ALA  47   7.857   6.409  -6.407
  335    HA   ALA  47           HA       ALA  47   5.062   6.513  -5.672
  336    HB1  ALA  47          1HB       ALA  47   7.353   5.461  -4.024
  337    HB2  ALA  47          2HB       ALA  47   5.639   5.081  -3.860
  338    HB3  ALA  47          3HB       ALA  47   6.534   4.522  -5.272
  339    H    HIS  48           HN       HIS  48   6.213   9.070  -5.878
  340    HA   HIS  48           HA       HIS  48   5.883   9.984  -3.114
  341    HB2  HIS  48          2HB       HIS  48   8.369   9.921  -4.307
  342    HB3  HIS  48          3HB       HIS  48   7.836  11.571  -4.614
  343    HD1  HIS  48          1HD       HIS  48   9.940  10.093  -2.402
  344    HD2  HIS  48          2HD       HIS  48   6.509  12.359  -1.798
  345    HE1  HIS  48          1HE       HIS  48  10.137  11.002  -0.065
  346    H    THR  49           HN       THR  49   4.026   9.959  -5.268
  347    HA   THR  49           HA       THR  49   3.593  12.851  -5.551
  348    HB   THR  49           HB       THR  49   2.634  12.415  -7.840
  349    HG1  THR  49          1HG       THR  49   3.896  10.353  -8.655
  350   HG21  THR  49          1HG2      THR  49   5.563  12.023  -7.279
  351   HG22  THR  49          2HG2      THR  49   4.730  13.491  -7.788
  352   HG23  THR  49          3HG2      THR  49   4.932  12.155  -8.919
  353    H    GLU  50           HN       GLU  50   1.483  13.524  -5.398
  354    HA   GLU  50           HA       GLU  50  -0.316  12.012  -3.924
  355    HB2  GLU  50          2HB       GLU  50  -0.377  14.484  -4.149
  356    HB3  GLU  50          3HB       GLU  50  -0.981  14.295  -5.790
  357    HG2  GLU  50          2HG       GLU  50  -3.061  13.712  -5.112
  358    HG3  GLU  50          3HG       GLU  50  -2.485  12.934  -3.638
  359    H    THR  51           HN       THR  51  -1.000  13.056  -7.257
  360    HA   THR  51           HA       THR  51  -2.228  10.417  -7.731
  361    HB   THR  51           HB       THR  51  -3.134  12.933  -9.113
  362    HG1  THR  51          1HG       THR  51  -3.842  13.500  -7.187
  363   HG21  THR  51          1HG2      THR  51  -3.730  10.214  -9.424
  364   HG22  THR  51          2HG2      THR  51  -4.582  11.583 -10.140
  365   HG23  THR  51          3HG2      THR  51  -5.123  10.913  -8.601
  366    H    GLY  52           HN       GLY  52  -0.715   9.375  -8.912
  367    HA2  GLY  52          1HA       GLY  52  -0.105  10.481 -11.544
  368    HA3  GLY  52          2HA       GLY  52   1.265  10.129 -10.502
  369    H    TRP  53           HN       TRP  53   0.872   7.804  -9.397
  370    HA   TRP  53           HA       TRP  53   1.062   5.962 -11.577
  371    HB2  TRP  53          2HB       TRP  53   2.488   5.633  -9.664
  372    HB3  TRP  53          3HB       TRP  53   1.100   5.561  -8.581
  373    HD1  TRP  53          1HD       TRP  53   0.313   3.201  -7.984
  374    HE1  TRP  53          1HE       TRP  53   0.644   0.843  -8.961
  375    HE3  TRP  53          3HE       TRP  53   2.907   4.434 -12.212
  376    HZ2  TRP  53          2HZ       TRP  53   1.846  -0.337 -11.227
  377    HZ3  TRP  53          3HZ       TRP  53   3.611   2.633 -13.732
  378    HH2  TRP  53          2HH       TRP  53   3.091   0.297 -13.247
  379    H    SER  54           HN       SER  54  -0.282   4.223 -12.071
  380    HA   SER  54           HA       SER  54  -3.077   4.655 -11.416
  381    HB2  SER  54          2HB       SER  54  -2.622   2.327 -13.057
  382    HB3  SER  54          3HB       SER  54  -3.440   3.834 -13.470
  383    HG   SER  54           HG       SER  54  -1.234   4.692 -13.760
  384    H    CYS  55           HN       CYS  55  -4.453   3.074 -10.537
  385    HA   CYS  55           HA       CYS  55  -3.324   0.625  -9.483
  386    HB2  CYS  55          2HB       CYS  55  -4.686   2.336  -7.451
  387    HB3  CYS  55          3HB       CYS  55  -3.476   1.077  -7.226
  388    H    HIS  56           HN       HIS  56  -4.904  -0.874  -8.783
  389    HA   HIS  56           HA       HIS  56  -7.136  -1.207 -10.234
  390    HB2  HIS  56          2HB       HIS  56  -6.085  -2.612  -8.234
  391    HB3  HIS  56          3HB       HIS  56  -7.425  -1.893  -7.346
  392    HD1  HIS  56          1HD       HIS  56  -9.311  -2.041 -10.007
  393    HD2  HIS  56          2HD       HIS  56  -7.304  -5.142  -8.106
  394    HE1  HIS  56          1HE       HIS  56 -10.550  -4.134 -10.646
  395    H    TYR  57           HN       TYR  57  -6.999   0.611  -7.189
  396    HA   TYR  57           HA       TYR  57  -9.588   1.824  -7.906
  397    HB2  TYR  57          2HB       TYR  57  -8.913   1.890  -5.056
  398    HB3  TYR  57          3HB       TYR  57 -10.425   1.455  -5.846
  399    HD1  TYR  57          1HD       TYR  57  -6.991   0.087  -5.289
  400    HD2  TYR  57          2HD       TYR  57 -11.145  -0.736  -5.707
  401    HE1  TYR  57          1HE       TYR  57  -6.567  -2.282  -4.783
  402    HE2  TYR  57          2HE       TYR  57 -10.732  -3.107  -5.200
  403    HH   TYR  57           HH       TYR  57  -9.037  -4.474  -4.041
  404    H    CYS  58           HN       CYS  58  -7.422   3.011  -8.912
  405    HA   CYS  58           HA       CYS  58  -6.580   5.119  -7.070
  406    HB2  CYS  58          2HB       CYS  58  -5.102   3.762  -8.827
  407    HB3  CYS  58          3HB       CYS  58  -5.647   5.049  -9.897
  408    H    ASP  59           HN       ASP  59  -8.002   4.804 -10.318
  409    HA   ASP  59           HA       ASP  59  -9.302   6.204 -11.555
  410    HB2  ASP  59          2HB       ASP  59 -10.737   5.833  -9.478
  411    HB3  ASP  59          3HB       ASP  59 -10.187   7.418  -8.940
  412    H    ASN  60           HN       ASN  60  -8.181   7.624 -12.726
  413    HA   ASN  60           HA       ASN  60  -6.901   9.896 -11.391
  414    HB2  ASN  60          2HB       ASN  60  -6.621   8.973 -14.260
  415    HB3  ASN  60          3HB       ASN  60  -5.643  10.193 -13.450
  416   HD21  ASN  60          1HD2      ASN  60  -4.342   9.480 -11.625
  417   HD22  ASN  60          2HD2      ASN  60  -3.698   7.876 -11.634
  Start of MODEL   10
    1    H1   GLU   1           HN       GLU   1   1.140   4.606   5.067
    2    HA   GLU   1           HA       GLU   1  -0.408   2.512   3.738
    3    HB2  GLU   1          2HB       GLU   1   1.306   4.750   2.854
    4    HB3  GLU   1          3HB       GLU   1   1.417   3.286   1.887
    5    HG2  GLU   1          2HG       GLU   1  -0.336   5.180   1.355
    6    HG3  GLU   1          3HG       GLU   1  -0.697   3.474   1.094
    7    H    MET   2           HN       MET   2   0.395   0.747   4.974
    8    HA   MET   2           HA       MET   2   3.182   0.022   4.342
    9    HB2  MET   2          2HB       MET   2   1.798  -1.332   6.590
   10    HB3  MET   2          3HB       MET   2   3.483  -0.852   6.429
   11    HG2  MET   2          2HG       MET   2   1.208   1.048   6.947
   12    HG3  MET   2          3HG       MET   2   2.253   0.369   8.192
   13    HE1  MET   2          1HE       MET   2   4.750   0.385   7.975
   14    HE2  MET   2          2HE       MET   2   5.676   1.811   7.506
   15    HE3  MET   2          3HE       MET   2   4.617   1.871   8.916
   16    H    CYS   3           HN       CYS   3   3.376  -1.587   2.943
   17    HA   CYS   3           HA       CYS   3   1.529  -2.957   1.601
   18    HB2  CYS   3          2HB       CYS   3   3.959  -3.207   1.240
   19    HB3  CYS   3          3HB       CYS   3   4.057  -4.227   2.672
   20    H    ASP   4           HN       ASP   4  -0.182  -4.132   2.119
   21    HA   ASP   4           HA       ASP   4  -0.708  -5.082   4.715
   22    HB2  ASP   4          2HB       ASP   4  -2.307  -4.567   2.687
   23    HB3  ASP   4          3HB       ASP   4  -2.073  -6.276   2.334
   24    H    VAL   5           HN       VAL   5   1.372  -6.285   2.415
   25    HA   VAL   5           HA       VAL   5   1.118  -9.048   3.402
   26    HB   VAL   5           HB       VAL   5   2.540  -8.045   0.931
   27   HG11  VAL   5          1HG1      VAL   5   2.520 -10.559   0.417
   28   HG12  VAL   5          2HG1      VAL   5   3.699  -9.964   1.588
   29   HG13  VAL   5          3HG1      VAL   5   2.232 -10.771   2.143
   30   HG21  VAL   5          1HG2      VAL   5   0.702  -9.431  -0.189
   31   HG22  VAL   5          2HG2      VAL   5  -0.136  -9.338   1.360
   32   HG23  VAL   5          3HG2      VAL   5   0.249  -7.861   0.476
   33    H    CYS   6           HN       CYS   6   2.825  -6.300   3.966
   34    HA   CYS   6           HA       CYS   6   5.008  -7.796   5.187
   35    HB2  CYS   6          2HB       CYS   6   5.496  -5.465   3.321
   36    HB3  CYS   6          3HB       CYS   6   6.723  -6.299   4.268
   37    H    GLU   7           HN       GLU   7   3.857  -4.478   4.557
   38    HA   GLU   7           HA       GLU   7   3.192  -2.865   6.058
   39    HB2  GLU   7          2HB       GLU   7   4.237  -4.472   8.364
   40    HB3  GLU   7          3HB       GLU   7   2.920  -3.308   8.334
   41    HG2  GLU   7          2HG       GLU   7   2.126  -5.314   6.584
   42    HG3  GLU   7          3HG       GLU   7   2.867  -6.162   7.940
   43    H    VAL   8           HN       VAL   8   5.087  -1.951   4.884
   44    HA   VAL   8           HA       VAL   8   6.806  -0.617   6.662
   45    HB   VAL   8           HB       VAL   8   8.853  -1.837   5.240
   46   HG11  VAL   8          1HG1      VAL   8   8.121  -2.737   7.997
   47   HG12  VAL   8          2HG1      VAL   8   9.708  -2.350   7.329
   48   HG13  VAL   8          3HG1      VAL   8   8.567  -1.057   7.702
   49   HG21  VAL   8          1HG2      VAL   8   7.305  -4.080   6.468
   50   HG22  VAL   8          2HG2      VAL   8   7.001  -3.609   4.795
   51   HG23  VAL   8          3HG2      VAL   8   8.611  -4.136   5.284
   52    H    TRP   9           HN       TRP   9   6.265   1.199   5.521
   53    HA   TRP   9           HA       TRP   9   6.624   1.302   2.650
   54    HB2  TRP   9          2HB       TRP   9   4.857   2.661   3.099
   55    HB3  TRP   9          3HB       TRP   9   5.424   3.035   4.724
   56    HD1  TRP   9          1HD       TRP   9   7.240   5.048   4.946
   57    HE1  TRP   9          1HE       TRP   9   7.659   7.095   3.445
   58    HE3  TRP   9          3HE       TRP   9   4.823   3.469   0.727
   59    HZ2  TRP   9          2HZ       TRP   9   7.047   7.932   0.820
   60    HZ3  TRP   9          3HZ       TRP   9   4.786   4.953  -1.235
   61    HH2  TRP   9          2HH       TRP   9   5.874   7.139  -1.187
   62    H    THR  10           HN       THR  10   7.833   3.218   1.723
   63    HA   THR  10           HA       THR  10  10.058   4.222   3.253
   64    HB   THR  10           HB       THR  10  11.615   3.289   1.296
   65    HG1  THR  10          1HG       THR  10   9.348   1.693   1.282
   66   HG21  THR  10          1HG2      THR  10  12.623   2.374   3.059
   67   HG22  THR  10          2HG2      THR  10  11.366   1.142   3.182
   68   HG23  THR  10          3HG2      THR  10  11.172   2.686   4.012
   69    H    ALA  11           HN       ALA  11  10.018   3.580  -0.215
   70    HA   ALA  11           HA       ALA  11   8.814   5.746  -1.293
   71    HB1  ALA  11          1HB       ALA  11   9.878   7.469  -0.287
   72    HB2  ALA  11          2HB       ALA  11  11.339   6.531   0.025
   73    HB3  ALA  11          3HB       ALA  11  11.046   7.199  -1.580
   74    H    GLU  12           HN       GLU  12  11.454   3.543  -1.305
   75    HA   GLU  12           HA       GLU  12  12.811   3.783  -3.586
   76    HB2  GLU  12          2HB       GLU  12  12.195   1.165  -3.856
   77    HB3  GLU  12          3HB       GLU  12  13.353   1.780  -2.685
   78    HG2  GLU  12          2HG       GLU  12  11.923   1.498  -0.912
   79    HG3  GLU  12          3HG       GLU  12  10.481   1.579  -1.923
   80    H    SER  13           HN       SER  13   9.693   2.044  -3.604
   81    HA   SER  13           HA       SER  13   8.628   3.427  -5.810
   82    HB2  SER  13          2HB       SER  13  10.498   2.199  -6.964
   83    HB3  SER  13          3HB       SER  13   9.699   0.690  -6.526
   84    HG   SER  13           HG       SER  13   9.258   1.983  -8.669
   85    H    LEU  14           HN       LEU  14   7.817   2.414  -3.254
   86    HA   LEU  14           HA       LEU  14   6.295   0.088  -3.339
   87    HB2  LEU  14          2HB       LEU  14   6.848   1.438  -1.314
   88    HB3  LEU  14          3HB       LEU  14   5.617   2.597  -1.814
   89    HG   LEU  14           HG       LEU  14   3.868   1.056  -1.404
   90   HD11  LEU  14          1HD1      LEU  14   4.710  -0.952  -2.331
   91   HD12  LEU  14          2HD1      LEU  14   4.388  -1.281  -0.629
   92   HD13  LEU  14          3HD1      LEU  14   6.042  -1.009  -1.177
   93   HD21  LEU  14          1HD2      LEU  14   5.037   0.134   0.976
   94   HD22  LEU  14          2HD2      LEU  14   4.042   1.572   0.747
   95   HD23  LEU  14          3HD2      LEU  14   5.797   1.686   0.620
   96    H    PHE  15           HN       PHE  15   4.544  -0.460  -4.444
   97    HA   PHE  15           HA       PHE  15   2.670   1.643  -5.279
   98    HB2  PHE  15          2HB       PHE  15   2.504  -0.184  -7.329
   99    HB3  PHE  15          3HB       PHE  15   3.379   1.341  -7.394
  100    HD1  PHE  15          1HD       PHE  15   4.051  -2.009  -5.888
  101    HD2  PHE  15          2HD       PHE  15   5.410   1.128  -8.423
  102    HE1  PHE  15          1HE       PHE  15   6.149  -3.235  -6.274
  103    HE2  PHE  15          2HE       PHE  15   7.510  -0.094  -8.815
  104    HZ   PHE  15           HZ       PHE  15   7.881  -2.279  -7.740
  105    HA   PRO  16           HA       PRO  16   0.837   1.454  -6.778
  106    HB2  PRO  16          2HB       PRO  16  -1.626   2.248  -5.958
  107    HB3  PRO  16          3HB       PRO  16  -1.373   0.892  -7.063
  108    HG2  PRO  16          2HG       PRO  16  -1.883   0.861  -4.114
  109    HG3  PRO  16          3HG       PRO  16  -2.566  -0.176  -5.379
  110    HD2  PRO  16          2HD       PRO  16  -0.535  -0.978  -3.778
  111    HD3  PRO  16          3HD       PRO  16  -0.698  -1.525  -5.458
  112    H    CYS  17           HN       CYS  17  -0.138   3.802  -6.304
  113    HA   CYS  17           HA       CYS  17   1.628   5.166  -4.721
  114    HB2  CYS  17          2HB       CYS  17  -1.181   6.188  -4.955
  115    HB3  CYS  17          3HB       CYS  17   0.338   7.071  -5.080
  116    H    ARG  18           HN       ARG  18   0.859   6.649  -2.809
  117    HA   ARG  18           HA       ARG  18   0.325   4.890  -0.619
  118    HB2  ARG  18          2HB       ARG  18   0.609   6.851   0.782
  119    HB3  ARG  18          3HB       ARG  18   1.871   6.807  -0.441
  120    HG2  ARG  18          2HG       ARG  18   1.263   9.019  -0.479
  121    HG3  ARG  18          3HG       ARG  18   0.257   8.358  -1.770
  122    HD2  ARG  18          2HD       ARG  18  -1.539   9.133  -0.723
  123    HD3  ARG  18          3HD       ARG  18  -1.194   8.045   0.620
  124    HE   ARG  18           HE       ARG  18   0.316  10.485   0.716
  125   HH11  ARG  18          1HH1      ARG  18  -2.718   8.974   1.518
  126   HH12  ARG  18          2HH1      ARG  18  -3.077  10.081   2.802
  127   HH21  ARG  18          1HH2      ARG  18  -0.148  11.948   2.403
  128   HH22  ARG  18          2HH2      ARG  18  -1.617  11.773   3.303
  129    H    VAL  19           HN       VAL  19  -1.461   7.493  -2.226
  130    HA   VAL  19           HA       VAL  19  -3.666   7.599  -0.515
  131    HB   VAL  19           HB       VAL  19  -3.710   9.346  -1.989
  132   HG11  VAL  19          1HG1      VAL  19  -3.544   8.586  -4.602
  133   HG12  VAL  19          2HG1      VAL  19  -2.187   9.146  -3.623
  134   HG13  VAL  19          3HG1      VAL  19  -2.482   7.417  -3.817
  135   HG21  VAL  19          1HG2      VAL  19  -5.385   7.699  -3.800
  136   HG22  VAL  19          2HG2      VAL  19  -5.849   7.766  -2.100
  137   HG23  VAL  19          3HG2      VAL  19  -5.728   9.254  -3.040
  138    H    CYS  20           HN       CYS  20  -4.024   6.323  -3.797
  139    HA   CYS  20           HA       CYS  20  -6.242   4.872  -3.597
  140    HB2  CYS  20          2HB       CYS  20  -4.986   3.088  -5.072
  141    HB3  CYS  20          3HB       CYS  20  -5.285   4.710  -5.690
  142    H    THR  21           HN       THR  21  -6.704   4.012  -1.596
  143    HA   THR  21           HA       THR  21  -6.561   2.615   0.226
  144    HB   THR  21           HB       THR  21  -6.773   0.332  -0.321
  145    HG1  THR  21          1HG       THR  21  -5.573   0.768  -2.859
  146   HG21  THR  21          1HG2      THR  21  -8.375   0.318  -2.044
  147   HG22  THR  21          2HG2      THR  21  -7.583   1.639  -2.906
  148   HG23  THR  21          3HG2      THR  21  -8.432   1.956  -1.394
  149    H    ARG  22           HN       ARG  22  -4.995   0.141   0.316
  150    HA   ARG  22           HA       ARG  22  -2.562   1.273   1.368
  151    HB2  ARG  22          2HB       ARG  22  -4.102  -0.922   2.009
  152    HB3  ARG  22          3HB       ARG  22  -2.703  -1.646   1.228
  153    HG2  ARG  22          2HG       ARG  22  -1.217  -0.567   2.791
  154    HG3  ARG  22          3HG       ARG  22  -2.571   0.293   3.527
  155    HD2  ARG  22          2HD       ARG  22  -3.532  -1.787   4.287
  156    HD3  ARG  22          3HD       ARG  22  -2.287  -2.707   3.445
  157    HE   ARG  22           HE       ARG  22  -1.022  -0.966   5.223
  158   HH11  ARG  22          1HH1      ARG  22  -3.119  -3.744   5.296
  159   HH12  ARG  22          2HH1      ARG  22  -2.529  -4.312   6.822
  160   HH21  ARG  22          1HH2      ARG  22  -0.237  -1.704   7.234
  161   HH22  ARG  22          2HH2      ARG  22  -0.890  -3.150   7.924
  162    H    VAL  23           HN       VAL  23  -0.580  -0.423   0.940
  163    HA   VAL  23           HA       VAL  23  -0.136  -0.246  -1.960
  164    HB   VAL  23           HB       VAL  23   2.256  -0.330  -1.460
  165   HG11  VAL  23          1HG1      VAL  23   1.916   1.878  -1.489
  166   HG12  VAL  23          2HG1      VAL  23   0.453   1.753  -0.510
  167   HG13  VAL  23          3HG1      VAL  23   2.036   1.795   0.268
  168   HG21  VAL  23          1HG2      VAL  23   2.788   0.039   1.078
  169   HG22  VAL  23          2HG2      VAL  23   1.259  -0.808   1.311
  170   HG23  VAL  23          3HG2      VAL  23   2.576  -1.590   0.438
  171    H    PHE  24           HN       PHE  24   0.914  -1.961  -3.066
  172    HA   PHE  24           HA       PHE  24   0.989  -4.544  -1.685
  173    HB2  PHE  24          2HB       PHE  24  -0.073  -4.700  -4.421
  174    HB3  PHE  24          3HB       PHE  24  -0.588  -5.540  -2.963
  175    HD1  PHE  24          1HD       PHE  24  -1.693  -3.837  -1.168
  176    HD2  PHE  24          2HD       PHE  24  -1.628  -3.340  -5.394
  177    HE1  PHE  24          1HE       PHE  24  -3.667  -2.377  -1.022
  178    HE2  PHE  24          2HE       PHE  24  -3.602  -1.878  -5.255
  179    HZ   PHE  24           HZ       PHE  24  -4.623  -1.394  -3.068
  180    H    HIS  25           HN       HIS  25   3.009  -5.226  -1.904
  181    HA   HIS  25           HA       HIS  25   4.805  -4.314  -3.878
  182    HB2  HIS  25          2HB       HIS  25   4.953  -6.740  -2.077
  183    HB3  HIS  25          3HB       HIS  25   6.294  -6.127  -3.043
  184    HD2  HIS  25          2HD       HIS  25   4.565  -3.132  -1.603
  185    HE1  HIS  25          1HE       HIS  25   7.521  -4.211   1.243
  186    HE2  HIS  25          2HE       HIS  25   5.830  -2.475   0.555
  187    H    ASP  26           HN       ASP  26   5.002  -4.877  -5.935
  188    HA   ASP  26           HA       ASP  26   3.424  -6.440  -7.428
  189    HB2  ASP  26          2HB       ASP  26   6.159  -5.475  -7.695
  190    HB3  ASP  26          3HB       ASP  26   5.904  -6.986  -8.564
  191    H    GLY  27           HN       GLY  27   6.264  -7.618  -5.654
  192    HA2  GLY  27          1HA       GLY  27   6.001 -10.318  -6.522
  193    HA3  GLY  27          2HA       GLY  27   6.966  -9.754  -5.164
  194    H    CYS  28           HN       CYS  28   5.051  -8.651  -3.528
  195    HA   CYS  28           HA       CYS  28   4.071 -10.868  -2.154
  196    HB2  CYS  28          2HB       CYS  28   3.345  -7.945  -2.050
  197    HB3  CYS  28          3HB       CYS  28   2.590  -9.130  -0.988
  198    H    LEU  29           HN       LEU  29   2.570  -8.848  -4.602
  199    HA   LEU  29           HA       LEU  29  -0.084  -9.664  -4.313
  200    HB2  LEU  29          2HB       LEU  29   1.457  -8.824  -6.760
  201    HB3  LEU  29          3HB       LEU  29  -0.287  -9.075  -6.744
  202    HG   LEU  29           HG       LEU  29   1.124  -7.058  -5.005
  203   HD11  LEU  29          1HD1      LEU  29  -0.476  -6.137  -7.292
  204   HD12  LEU  29          2HD1      LEU  29   1.065  -6.890  -7.699
  205   HD13  LEU  29          3HD1      LEU  29   1.022  -5.497  -6.619
  206   HD21  LEU  29          1HD2      LEU  29  -1.719  -7.780  -5.558
  207   HD22  LEU  29          2HD2      LEU  29  -1.304  -6.116  -5.148
  208   HD23  LEU  29          3HD2      LEU  29  -0.928  -7.423  -4.023
  209    H    ARG  30           HN       ARG  30   2.640 -11.224  -5.856
  210    HA   ARG  30           HA       ARG  30   0.963 -13.300  -7.011
  211    HB2  ARG  30          2HB       ARG  30   3.978 -13.079  -6.980
  212    HB3  ARG  30          3HB       ARG  30   3.017 -14.171  -7.969
  213    HG2  ARG  30          2HG       ARG  30   2.253 -12.452  -9.343
  214    HG3  ARG  30          3HG       ARG  30   2.687 -11.202  -8.174
  215    HD2  ARG  30          2HD       ARG  30   4.946 -11.327  -8.688
  216    HD3  ARG  30          3HD       ARG  30   4.801 -12.948  -9.370
  217    HE   ARG  30           HE       ARG  30   3.295 -11.191 -10.942
  218   HH11  ARG  30          1HH1      ARG  30   6.617 -11.834 -10.123
  219   HH12  ARG  30          2HH1      ARG  30   7.238 -11.254 -11.633
  220   HH21  ARG  30          1HH2      ARG  30   4.101 -10.424 -12.933
  221   HH22  ARG  30          2HH2      ARG  30   5.806 -10.452 -13.231
  222    H    ARG  31           HN       ARG  31   3.234 -12.853  -4.366
  223    HA   ARG  31           HA       ARG  31   3.743 -15.438  -3.593
  224    HB2  ARG  31          2HB       ARG  31   3.918 -12.850  -2.408
  225    HB3  ARG  31          3HB       ARG  31   3.215 -13.946  -1.226
  226    HG2  ARG  31          2HG       ARG  31   5.506 -14.066  -0.834
  227    HG3  ARG  31          3HG       ARG  31   5.157 -15.509  -1.788
  228    HD2  ARG  31          2HD       ARG  31   5.727 -13.892  -3.794
  229    HD3  ARG  31          3HD       ARG  31   6.625 -13.033  -2.544
  230    HE   ARG  31           HE       ARG  31   7.352 -15.490  -3.785
  231   HH11  ARG  31          1HH1      ARG  31   7.510 -13.729  -0.786
  232   HH12  ARG  31          2HH1      ARG  31   8.943 -14.532  -0.239
  233   HH21  ARG  31          1HH2      ARG  31   9.240 -16.554  -3.076
  234   HH22  ARG  31          2HH2      ARG  31   9.928 -16.139  -1.542
  235    H    MET  32           HN       MET  32   0.959 -13.440  -2.625
  236    HA   MET  32           HA       MET  32  -0.330 -15.820  -1.512
  237    HB2  MET  32          2HB       MET  32  -1.908 -13.427  -1.266
  238    HB3  MET  32          3HB       MET  32  -1.218 -14.435  -0.001
  239    HG2  MET  32          2HG       MET  32   0.972 -13.195  -0.481
  240    HG3  MET  32          3HG       MET  32  -0.038 -12.034  -1.340
  241    HE1  MET  32          1HE       MET  32   0.684 -13.974   1.653
  242    HE2  MET  32          2HE       MET  32   0.855 -12.715   2.876
  243    HE3  MET  32          3HE       MET  32  -0.667 -13.596   2.723
  244    H    GLY  33           HN       GLY  33  -0.092 -14.476  -4.444
  245    HA2  GLY  33          1HA       GLY  33  -1.326 -14.688  -6.369
  246    HA3  GLY  33          2HA       GLY  33  -2.359 -15.802  -5.488
  247    H    TYR  34           HN       TYR  34  -1.860 -12.532  -4.391
  248    HA   TYR  34           HA       TYR  34  -4.448 -11.854  -3.963
  249    HB2  TYR  34          2HB       TYR  34  -1.974 -10.438  -4.200
  250    HB3  TYR  34          3HB       TYR  34  -3.234  -9.505  -5.000
  251    HD1  TYR  34          1HD       TYR  34  -2.278 -11.091  -1.792
  252    HD2  TYR  34          2HD       TYR  34  -4.857  -8.329  -3.745
  253    HE1  TYR  34          1HE       TYR  34  -3.047 -10.271   0.397
  254    HE2  TYR  34          2HE       TYR  34  -5.632  -7.499  -1.563
  255    HH   TYR  34           HH       TYR  34  -5.465  -8.986   1.133
  256    H    ILE  35           HN       ILE  35  -2.707 -10.845  -6.911
  257    HA   ILE  35           HA       ILE  35  -4.821  -9.836  -8.337
  258    HB   ILE  35           HB       ILE  35  -3.579 -10.412 -10.396
  259   HG12  ILE  35          2HG1      ILE  35  -2.345 -12.339  -8.582
  260   HG13  ILE  35          3HG1      ILE  35  -2.405 -12.331 -10.342
  261   HG21  ILE  35          1HG2      ILE  35  -1.701  -9.424  -8.263
  262   HG22  ILE  35          2HG2      ILE  35  -1.715  -9.004  -9.976
  263   HG23  ILE  35          3HG2      ILE  35  -3.016  -8.452  -8.922
  264   HD11  ILE  35          1HD1      ILE  35  -0.129 -12.258  -9.722
  265   HD12  ILE  35          2HD1      ILE  35  -0.551 -10.641 -10.287
  266   HD13  ILE  35          3HD1      ILE  35  -0.416 -10.963  -8.558
  267    H    GLN  36           HN       GLN  36  -6.483 -10.622  -9.519
  268    HA   GLN  36           HA       GLN  36  -6.780 -13.551  -9.633
  269    HB2  GLN  36          2HB       GLN  36  -8.892 -11.421  -9.282
  270    HB3  GLN  36          3HB       GLN  36  -9.252 -13.112  -9.604
  271    HG2  GLN  36          2HG       GLN  36  -8.695 -13.779  -7.512
  272    HG3  GLN  36          3HG       GLN  36  -7.478 -12.520  -7.312
  273   HE21  GLN  36          1HE2      GLN  36 -10.730 -13.438  -6.802
  274   HE22  GLN  36          2HE2      GLN  36 -11.251 -12.000  -5.999
  275    H    GLY  37           HN       GLY  37  -8.447 -10.798 -11.166
  276    HA2  GLY  37          1HA       GLY  37  -8.785 -12.162 -13.629
  277    HA3  GLY  37          2HA       GLY  37  -9.043 -10.445 -13.357
  278    H    ASP  38           HN       ASP  38  -8.114  -9.847 -15.316
  279    HA   ASP  38           HA       ASP  38  -5.200  -9.819 -15.283
  280    HB2  ASP  38          2HB       ASP  38  -5.411 -11.685 -16.670
  281    HB3  ASP  38          3HB       ASP  38  -6.877 -11.074 -17.433
  282    H    SER  39           HN       SER  39  -4.439  -7.875 -15.814
  283    HA   SER  39           HA       SER  39  -6.141  -6.088 -17.417
  284    HB2  SER  39          2HB       SER  39  -4.450  -5.029 -15.168
  285    HB3  SER  39          3HB       SER  39  -5.838  -4.281 -15.958
  286    HG   SER  39           HG       SER  39  -7.191  -5.622 -14.865
  287    H    ALA  40           HN       ALA  40  -4.792  -4.081 -18.095
  288    HA   ALA  40           HA       ALA  40  -2.126  -5.009 -18.946
  289    HB1  ALA  40          1HB       ALA  40  -2.598  -3.362 -20.915
  290    HB2  ALA  40          2HB       ALA  40  -3.280  -4.989 -20.940
  291    HB3  ALA  40          3HB       ALA  40  -4.286  -3.619 -20.468
  292    H    ALA  41           HN       ALA  41  -0.469  -3.788 -18.328
  293    HA   ALA  41           HA       ALA  41  -0.725  -0.921 -18.063
  294    HB1  ALA  41          1HB       ALA  41  -1.493  -1.413 -15.898
  295    HB2  ALA  41          2HB       ALA  41  -0.297  -2.690 -15.674
  296    HB3  ALA  41          3HB       ALA  41   0.210  -1.002 -15.700
  297    H    GLU  42           HN       GLU  42   1.631  -2.569 -16.151
  298    HA   GLU  42           HA       GLU  42   3.927  -2.321 -16.243
  299    HB2  GLU  42          2HB       GLU  42   2.917  -4.263 -18.052
  300    HB3  GLU  42          3HB       GLU  42   4.295  -3.493 -18.826
  301    HG2  GLU  42          2HG       GLU  42   5.662  -3.986 -16.848
  302    HG3  GLU  42          3HG       GLU  42   4.281  -4.802 -16.116
  303    H    VAL  43           HN       VAL  43   4.152  -0.064 -16.436
  304    HA   VAL  43           HA       VAL  43   4.967   0.814 -19.126
  305    HB   VAL  43           HB       VAL  43   3.343   2.380 -17.121
  306   HG11  VAL  43          1HG1      VAL  43   5.041   3.273 -19.391
  307   HG12  VAL  43          2HG1      VAL  43   3.496   4.087 -19.136
  308   HG13  VAL  43          3HG1      VAL  43   4.705   4.062 -17.851
  309   HG21  VAL  43          1HG2      VAL  43   2.103   0.836 -18.594
  310   HG22  VAL  43          2HG2      VAL  43   1.707   2.528 -18.899
  311   HG23  VAL  43          3HG2      VAL  43   2.781   1.662 -19.998
  312    H    THR  44           HN       THR  44   5.262   1.268 -15.635
  313    HA   THR  44           HA       THR  44   8.067   1.600 -15.749
  314    HB   THR  44           HB       THR  44   7.680   3.802 -16.592
  315    HG1  THR  44          1HG       THR  44   9.217   3.604 -14.845
  316   HG21  THR  44          1HG2      THR  44   5.247   3.721 -15.498
  317   HG22  THR  44          2HG2      THR  44   6.033   5.237 -15.940
  318   HG23  THR  44          3HG2      THR  44   6.062   4.685 -14.267
  319    H    GLU  45           HN       GLU  45   5.163   2.489 -13.902
  320    HA   GLU  45           HA       GLU  45   4.556   2.059 -11.750
  321    HB2  GLU  45          2HB       GLU  45   6.941   0.346 -11.242
  322    HB3  GLU  45          3HB       GLU  45   5.270   0.116 -10.746
  323    HG2  GLU  45          2HG       GLU  45   5.130  -1.400 -12.353
  324    HG3  GLU  45          3HG       GLU  45   5.155  -0.057 -13.495
  325    H    MET  46           HN       MET  46   4.800   3.885 -10.620
  326    HA   MET  46           HA       MET  46   7.480   4.491  -9.553
  327    HB2  MET  46          2HB       MET  46   5.416   6.240 -10.777
  328    HB3  MET  46          3HB       MET  46   6.294   6.891  -9.401
  329    HG2  MET  46          2HG       MET  46   8.057   5.644 -11.333
  330    HG3  MET  46          3HG       MET  46   7.093   6.939 -12.039
  331    HE1  MET  46          1HE       MET  46   7.984   9.975 -11.002
  332    HE2  MET  46          2HE       MET  46   6.569   8.948 -10.770
  333    HE3  MET  46          3HE       MET  46   7.441   9.577  -9.371
  334    H    ALA  47           HN       ALA  47   4.600   6.242  -8.679
  335    HA   ALA  47           HA       ALA  47   3.530   4.902  -6.585
  336    HB1  ALA  47          1HB       ALA  47   6.196   6.003  -5.863
  337    HB2  ALA  47          2HB       ALA  47   4.906   6.072  -4.663
  338    HB3  ALA  47          3HB       ALA  47   5.403   4.519  -5.334
  339    H    HIS  48           HN       HIS  48   5.055   7.874  -5.612
  340    HA   HIS  48           HA       HIS  48   2.620   9.192  -5.143
  341    HB2  HIS  48          2HB       HIS  48   5.127   9.633  -4.322
  342    HB3  HIS  48          3HB       HIS  48   5.062  10.825  -5.618
  343    HD1  HIS  48          1HD       HIS  48   1.778  10.998  -4.690
  344    HD2  HIS  48          2HD       HIS  48   5.260  12.059  -2.688
  345    HE1  HIS  48          1HE       HIS  48   1.072  12.677  -2.955
  346    H    THR  49           HN       THR  49   3.233  11.801  -6.212
  347    HA   THR  49           HA       THR  49   3.066  13.074  -8.121
  348    HB   THR  49           HB       THR  49   2.808  10.750  -9.958
  349    HG1  THR  49          1HG       THR  49   4.576   9.872  -9.208
  350   HG21  THR  49          1HG2      THR  49   4.706  12.340 -10.994
  351   HG22  THR  49          2HG2      THR  49   3.868  13.514  -9.979
  352   HG23  THR  49          3HG2      THR  49   2.983  12.631 -11.222
  353    H    GLU  50           HN       GLU  50   1.447  13.354 -10.002
  354    HA   GLU  50           HA       GLU  50  -1.175  12.954  -8.913
  355    HB2  GLU  50          2HB       GLU  50  -0.101  14.286 -11.381
  356    HB3  GLU  50          3HB       GLU  50  -1.828  14.033 -11.181
  357    HG2  GLU  50          2HG       GLU  50  -1.617  16.136 -10.332
  358    HG3  GLU  50          3HG       GLU  50  -1.417  15.181  -8.865
  359    H    THR  51           HN       THR  51  -2.139  11.040  -9.050
  360    HA   THR  51           HA       THR  51  -2.741   8.965  -9.816
  361    HB   THR  51           HB       THR  51  -3.451   9.218 -12.402
  362    HG1  THR  51          1HG       THR  51  -4.241  11.695 -11.995
  363   HG21  THR  51          1HG2      THR  51  -4.972   8.713 -10.569
  364   HG22  THR  51          2HG2      THR  51  -5.651   9.976 -11.594
  365   HG23  THR  51          3HG2      THR  51  -4.924  10.394 -10.043
  366    H    GLY  52           HN       GLY  52  -1.707   9.855 -13.033
  367    HA2  GLY  52          1HA       GLY  52  -0.125   8.962 -14.435
  368    HA3  GLY  52          2HA       GLY  52   0.888   8.795 -13.007
  369    H    TRP  53           HN       TRP  53   0.516   6.864 -11.654
  370    HA   TRP  53           HA       TRP  53   0.241   4.538 -13.355
  371    HB2  TRP  53          2HB       TRP  53   1.994   4.976 -11.454
  372    HB3  TRP  53          3HB       TRP  53   0.716   4.375 -10.402
  373    HD1  TRP  53          1HD       TRP  53   2.534   3.173 -13.624
  374    HE1  TRP  53          1HE       TRP  53   2.837   0.623 -13.451
  375    HE3  TRP  53          3HE       TRP  53   0.165   2.378  -9.165
  376    HZ2  TRP  53          2HZ       TRP  53   2.159  -1.451 -11.660
  377    HZ3  TRP  53          3HZ       TRP  53   0.035   0.082  -8.291
  378    HH2  TRP  53          2HH       TRP  53   1.011  -1.792  -9.515
  379    H    SER  54           HN       SER  54  -1.415   3.131 -13.383
  380    HA   SER  54           HA       SER  54  -3.854   3.860 -12.046
  381    HB2  SER  54          2HB       SER  54  -4.055   1.278 -13.256
  382    HB3  SER  54          3HB       SER  54  -4.754   2.802 -13.802
  383    HG   SER  54           HG       SER  54  -3.407   2.030 -15.406
  384    H    CYS  55           HN       CYS  55  -5.040   2.575 -10.585
  385    HA   CYS  55           HA       CYS  55  -3.807   0.239  -9.408
  386    HB2  CYS  55          2HB       CYS  55  -4.462   2.420  -7.470
  387    HB3  CYS  55          3HB       CYS  55  -3.349   1.066  -7.296
  388    H    HIS  56           HN       HIS  56  -5.209  -0.809  -7.821
  389    HA   HIS  56           HA       HIS  56  -7.705  -1.360  -8.573
  390    HB2  HIS  56          2HB       HIS  56  -6.644  -1.111  -5.765
  391    HB3  HIS  56          3HB       HIS  56  -8.264  -1.715  -6.095
  392    HD1  HIS  56          1HD       HIS  56  -5.685  -3.293  -4.903
  393    HD2  HIS  56          2HD       HIS  56  -7.347  -3.622  -8.696
  394    HE1  HIS  56          1HE       HIS  56  -4.992  -5.558  -5.746
  395    H    TYR  57           HN       TYR  57  -6.995   1.235  -6.234
  396    HA   TYR  57           HA       TYR  57  -9.533   2.505  -7.030
  397    HB2  TYR  57          2HB       TYR  57  -8.303   2.868  -4.310
  398    HB3  TYR  57          3HB       TYR  57  -9.960   3.176  -4.818
  399    HD1  TYR  57          1HD       TYR  57 -11.549   1.688  -4.074
  400    HD2  TYR  57          2HD       TYR  57  -7.577   0.291  -4.687
  401    HE1  TYR  57          1HE       TYR  57 -12.214  -0.538  -3.267
  402    HE2  TYR  57          2HE       TYR  57  -8.231  -1.939  -3.883
  403    HH   TYR  57           HH       TYR  57 -10.201  -3.293  -3.609
  404    H    CYS  58           HN       CYS  58  -7.374   3.123  -8.493
  405    HA   CYS  58           HA       CYS  58  -6.084   5.481  -7.385
  406    HB2  CYS  58          2HB       CYS  58  -5.088   3.608  -8.991
  407    HB3  CYS  58          3HB       CYS  58  -5.727   4.677 -10.235
  408    H    ASP  59           HN       ASP  59  -7.677   4.853 -10.513
  409    HA   ASP  59           HA       ASP  59  -9.534   6.986 -10.233
  410    HB2  ASP  59          2HB       ASP  59  -7.529   8.355 -10.568
  411    HB3  ASP  59          3HB       ASP  59  -7.167   7.479 -12.053
  412    H    ASN  60           HN       ASN  60 -10.444   4.742 -10.807
  413    HA   ASN  60           HA       ASN  60 -10.646   4.535 -13.741
  414    HB2  ASN  60          2HB       ASN  60 -10.668   2.373 -11.637
  415    HB3  ASN  60          3HB       ASN  60 -11.260   2.101 -13.274
  416   HD21  ASN  60          1HD2      ASN  60  -8.455   3.713 -11.806
  417   HD22  ASN  60          2HD2      ASN  60  -7.275   2.931 -12.798
  Start of MODEL   11
    1    H1   GLU   1           HN       GLU   1   3.829   4.432   6.546
    2    HA   GLU   1           HA       GLU   1   1.516   2.935   5.585
    3    HB2  GLU   1          2HB       GLU   1   3.313   4.316   3.604
    4    HB3  GLU   1          3HB       GLU   1   1.761   3.542   3.315
    5    HG2  GLU   1          2HG       GLU   1   1.053   5.678   3.286
    6    HG3  GLU   1          3HG       GLU   1   0.970   5.425   5.029
    7    H    MET   2           HN       MET   2   2.058   0.866   5.482
    8    HA   MET   2           HA       MET   2   4.678   0.092   4.474
    9    HB2  MET   2          2HB       MET   2   3.753  -1.233   6.991
   10    HB3  MET   2          3HB       MET   2   5.378  -1.105   6.332
   11    HG2  MET   2          2HG       MET   2   5.203   1.386   6.834
   12    HG3  MET   2          3HG       MET   2   3.792   0.967   7.803
   13    HE1  MET   2          1HE       MET   2   8.131   0.683   8.880
   14    HE2  MET   2          2HE       MET   2   7.733  -0.313   7.480
   15    HE3  MET   2          3HE       MET   2   7.356   1.410   7.472
   16    H    CYS   3           HN       CYS   3   4.438  -1.500   3.055
   17    HA   CYS   3           HA       CYS   3   2.210  -2.600   2.097
   18    HB2  CYS   3          2HB       CYS   3   4.479  -3.079   1.232
   19    HB3  CYS   3          3HB       CYS   3   4.739  -4.193   2.571
   20    H    ASP   4           HN       ASP   4   0.529  -3.645   2.909
   21    HA   ASP   4           HA       ASP   4   0.485  -4.694   5.537
   22    HB2  ASP   4          2HB       ASP   4  -1.457  -3.804   4.024
   23    HB3  ASP   4          3HB       ASP   4  -1.544  -5.475   3.475
   24    H    VAL   5           HN       VAL   5   1.877  -5.934   2.822
   25    HA   VAL   5           HA       VAL   5   1.454  -8.720   3.686
   26    HB   VAL   5           HB       VAL   5   2.323  -7.706   0.975
   27   HG11  VAL   5          1HG1      VAL   5   1.858 -10.173   0.394
   28   HG12  VAL   5          2HG1      VAL   5   3.378  -9.769   1.195
   29   HG13  VAL   5          3HG1      VAL   5   2.045 -10.460   2.124
   30   HG21  VAL   5          1HG2      VAL   5   0.057  -7.271   1.022
   31   HG22  VAL   5          2HG2      VAL   5   0.088  -8.915   0.385
   32   HG23  VAL   5          3HG2      VAL   5  -0.291  -8.636   2.084
   33    H    CYS   6           HN       CYS   6   3.584  -6.265   3.975
   34    HA   CYS   6           HA       CYS   6   5.785  -8.091   4.509
   35    HB2  CYS   6          2HB       CYS   6   6.084  -5.711   2.664
   36    HB3  CYS   6          3HB       CYS   6   7.406  -6.710   3.262
   37    H    GLU   7           HN       GLU   7   4.826  -4.663   4.408
   38    HA   GLU   7           HA       GLU   7   4.763  -3.131   6.127
   39    HB2  GLU   7          2HB       GLU   7   6.338  -4.943   7.920
   40    HB3  GLU   7          3HB       GLU   7   5.139  -3.729   8.346
   41    HG2  GLU   7          2HG       GLU   7   3.775  -5.605   6.794
   42    HG3  GLU   7          3HG       GLU   7   4.807  -6.541   7.873
   43    H    VAL   8           HN       VAL   8   6.264  -2.194   4.514
   44    HA   VAL   8           HA       VAL   8   8.649  -1.291   5.799
   45    HB   VAL   8           HB       VAL   8   9.753  -2.167   3.377
   46   HG11  VAL   8          1HG1      VAL   8  11.256  -3.425   4.807
   47   HG12  VAL   8          2HG1      VAL   8  10.901  -1.856   5.531
   48   HG13  VAL   8          3HG1      VAL   8  10.113  -3.310   6.145
   49   HG21  VAL   8          1HG2      VAL   8   9.436  -4.539   3.337
   50   HG22  VAL   8          2HG2      VAL   8   8.438  -4.483   4.790
   51   HG23  VAL   8          3HG2      VAL   8   7.845  -3.778   3.286
   52    H    TRP   9           HN       TRP   9   9.015   0.736   5.168
   53    HA   TRP   9           HA       TRP   9   8.299   1.558   2.454
   54    HB2  TRP   9          2HB       TRP   9   6.335   2.269   3.479
   55    HB3  TRP   9          3HB       TRP   9   7.146   2.654   4.994
   56    HD1  TRP   9          1HD       TRP   9   7.387   5.158   5.415
   57    HE1  TRP   9          1HE       TRP   9   7.487   7.279   3.960
   58    HE3  TRP   9          3HE       TRP   9   7.198   2.983   0.792
   59    HZ2  TRP   9          2HZ       TRP   9   7.486   7.943   1.216
   60    HZ3  TRP   9          3HZ       TRP   9   7.252   4.432  -1.197
   61    HH2  TRP   9          2HH       TRP   9   7.392   6.861  -0.986
   62    H    THR  10           HN       THR  10   9.299   3.550   1.785
   63    HA   THR  10           HA       THR  10  11.381   4.639   3.506
   64    HB   THR  10           HB       THR  10  12.621   4.295   0.976
   65    HG1  THR  10          1HG       THR  10  12.373   2.200   0.534
   66   HG21  THR  10          1HG2      THR  10  14.344   3.248   2.249
   67   HG22  THR  10          2HG2      THR  10  13.216   2.814   3.534
   68   HG23  THR  10          3HG2      THR  10  13.645   4.504   3.268
   69    H    ALA  11           HN       ALA  11  11.047   4.773  -0.015
   70    HA   ALA  11           HA       ALA  11   9.556   7.121  -0.213
   71    HB1  ALA  11          1HB       ALA  11  12.189   8.109  -0.877
   72    HB2  ALA  11          2HB       ALA  11  10.941   8.825   0.144
   73    HB3  ALA  11          3HB       ALA  11  12.078   7.662   0.825
   74    H    GLU  12           HN       GLU  12  12.040   5.038  -1.493
   75    HA   GLU  12           HA       GLU  12  12.418   5.769  -4.054
   76    HB2  GLU  12          2HB       GLU  12  11.632   2.938  -3.377
   77    HB3  GLU  12          3HB       GLU  12  12.730   3.480  -4.637
   78    HG2  GLU  12          2HG       GLU  12  14.130   4.423  -2.679
   79    HG3  GLU  12          3HG       GLU  12  13.176   3.320  -1.690
   80    H    SER  13           HN       SER  13   9.794   3.474  -3.318
   81    HA   SER  13           HA       SER  13   7.696   4.881  -4.463
   82    HB2  SER  13          2HB       SER  13   9.442   4.235  -6.466
   83    HB3  SER  13          3HB       SER  13   8.338   2.860  -6.509
   84    HG   SER  13           HG       SER  13   7.115   4.170  -7.607
   85    H    LEU  14           HN       LEU  14   6.262   3.952  -3.142
   86    HA   LEU  14           HA       LEU  14   6.273   1.058  -2.773
   87    HB2  LEU  14          2HB       LEU  14   5.618   3.279  -1.153
   88    HB3  LEU  14          3HB       LEU  14   4.138   2.352  -1.386
   89    HG   LEU  14           HG       LEU  14   6.731   1.327  -0.233
   90   HD11  LEU  14          1HD1      LEU  14   5.675   1.311   1.850
   91   HD12  LEU  14          2HD1      LEU  14   4.075   1.535   1.144
   92   HD13  LEU  14          3HD1      LEU  14   5.230   2.867   1.148
   93   HD21  LEU  14          1HD2      LEU  14   4.099  -0.099  -0.594
   94   HD22  LEU  14          2HD2      LEU  14   5.558  -0.754   0.148
   95   HD23  LEU  14          3HD2      LEU  14   5.540  -0.367  -1.573
   96    H    PHE  15           HN       PHE  15   3.857   0.210  -2.459
   97    HA   PHE  15           HA       PHE  15   2.144   1.200  -4.610
   98    HB2  PHE  15          2HB       PHE  15   3.371  -1.536  -4.468
   99    HB3  PHE  15          3HB       PHE  15   1.802  -1.308  -5.234
  100    HD1  PHE  15          1HD       PHE  15   5.320  -0.133  -5.324
  101    HD2  PHE  15          2HD       PHE  15   1.659  -0.600  -7.443
  102    HE1  PHE  15          1HE       PHE  15   6.443   0.547  -7.405
  103    HE2  PHE  15          2HE       PHE  15   2.776   0.078  -9.528
  104    HZ   PHE  15           HZ       PHE  15   5.170   0.652  -9.511
  105    HA   PRO  16           HA       PRO  16   0.306   0.101  -5.654
  106    HB2  PRO  16          2HB       PRO  16  -2.129   1.301  -5.636
  107    HB3  PRO  16          3HB       PRO  16  -1.921  -0.452  -5.551
  108    HG2  PRO  16          2HG       PRO  16  -2.440   1.502  -3.344
  109    HG3  PRO  16          3HG       PRO  16  -3.158  -0.097  -3.614
  110    HD2  PRO  16          2HD       PRO  16  -1.161   0.322  -1.833
  111    HD3  PRO  16          3HD       PRO  16  -1.338  -1.202  -2.727
  112    H    CYS  17           HN       CYS  17  -0.889   2.594  -3.391
  113    HA   CYS  17           HA       CYS  17   0.977   4.527  -4.437
  114    HB2  CYS  17          2HB       CYS  17  -1.908   5.323  -4.624
  115    HB3  CYS  17          3HB       CYS  17  -0.507   6.028  -5.425
  116    H    ARG  18           HN       ARG  18  -2.198   4.759  -2.836
  117    HA   ARG  18           HA       ARG  18  -1.565   4.871  -0.224
  118    HB2  ARG  18          2HB       ARG  18  -0.069   6.533  -0.003
  119    HB3  ARG  18          3HB       ARG  18  -0.416   7.170  -1.605
  120    HG2  ARG  18          2HG       ARG  18  -0.904   8.847   0.038
  121    HG3  ARG  18          3HG       ARG  18  -2.415   8.292  -0.687
  122    HD2  ARG  18          2HD       ARG  18  -3.200   7.658   1.294
  123    HD3  ARG  18          3HD       ARG  18  -1.762   6.686   1.604
  124    HE   ARG  18           HE       ARG  18  -2.340   9.299   2.638
  125   HH11  ARG  18          1HH1      ARG  18   0.193   7.061   1.804
  126   HH12  ARG  18          2HH1      ARG  18   1.345   7.756   2.896
  127   HH21  ARG  18          1HH2      ARG  18  -0.832  10.223   4.078
  128   HH22  ARG  18          2HH2      ARG  18   0.760   9.554   4.189
  129    H    VAL  19           HN       VAL  19  -3.192   6.704  -2.755
  130    HA   VAL  19           HA       VAL  19  -5.374   7.493  -1.047
  131    HB   VAL  19           HB       VAL  19  -5.060   7.649  -4.046
  132   HG11  VAL  19          1HG1      VAL  19  -7.432   7.538  -3.234
  133   HG12  VAL  19          2HG1      VAL  19  -7.126   9.033  -2.347
  134   HG13  VAL  19          3HG1      VAL  19  -7.012   9.012  -4.108
  135   HG21  VAL  19          1HG2      VAL  19  -5.100  10.040  -2.291
  136   HG22  VAL  19          2HG2      VAL  19  -3.644   9.045  -2.283
  137   HG23  VAL  19          3HG2      VAL  19  -4.221   9.751  -3.793
  138    H    CYS  20           HN       CYS  20  -5.128   5.383  -3.915
  139    HA   CYS  20           HA       CYS  20  -7.539   4.336  -4.222
  140    HB2  CYS  20          2HB       CYS  20  -6.133   1.983  -4.168
  141    HB3  CYS  20          3HB       CYS  20  -6.188   3.096  -5.532
  142    H    THR  21           HN       THR  21  -5.600   2.111  -2.341
  143    HA   THR  21           HA       THR  21  -7.472   2.233  -0.103
  144    HB   THR  21           HB       THR  21  -8.285   0.522  -1.815
  145    HG1  THR  21          1HG       THR  21  -8.387  -1.125   0.055
  146   HG21  THR  21          1HG2      THR  21  -6.895  -1.067  -2.524
  147   HG22  THR  21          2HG2      THR  21  -6.653  -1.618  -0.866
  148   HG23  THR  21          3HG2      THR  21  -5.609  -0.369  -1.542
  149    H    ARG  22           HN       ARG  22  -6.481  -0.407   0.819
  150    HA   ARG  22           HA       ARG  22  -4.494   0.363   2.547
  151    HB2  ARG  22          2HB       ARG  22  -5.799  -2.046   1.884
  152    HB3  ARG  22          3HB       ARG  22  -4.076  -2.389   1.814
  153    HG2  ARG  22          2HG       ARG  22  -3.833  -1.476   4.092
  154    HG3  ARG  22          3HG       ARG  22  -5.581  -1.239   4.154
  155    HD2  ARG  22          2HD       ARG  22  -5.192  -3.890   3.333
  156    HD3  ARG  22          3HD       ARG  22  -4.038  -3.618   4.638
  157    HE   ARG  22           HE       ARG  22  -6.409  -2.594   5.556
  158   HH11  ARG  22          1HH1      ARG  22  -5.310  -5.685   4.388
  159   HH12  ARG  22          2HH1      ARG  22  -6.421  -6.593   5.360
  160   HH21  ARG  22          1HH2      ARG  22  -7.876  -3.779   6.839
  161   HH22  ARG  22          2HH2      ARG  22  -7.881  -5.508   6.752
  162    H    VAL  23           HN       VAL  23  -2.255  -0.937   2.546
  163    HA   VAL  23           HA       VAL  23  -0.893  -0.084   0.086
  164    HB   VAL  23           HB       VAL  23   1.179  -0.113   1.437
  165   HG11  VAL  23          1HG1      VAL  23  -0.406   1.600   3.155
  166   HG12  VAL  23          2HG1      VAL  23   0.807   2.024   1.946
  167   HG13  VAL  23          3HG1      VAL  23  -0.867   1.756   1.460
  168   HG21  VAL  23          1HG2      VAL  23   0.686  -1.760   3.085
  169   HG22  VAL  23          2HG2      VAL  23   0.911  -0.229   3.931
  170   HG23  VAL  23          3HG2      VAL  23  -0.715  -0.855   3.659
  171    H    PHE  24           HN       PHE  24  -0.087  -1.555  -1.253
  172    HA   PHE  24           HA       PHE  24   0.858  -4.112  -0.250
  173    HB2  PHE  24          2HB       PHE  24  -0.533  -5.073  -2.353
  174    HB3  PHE  24          3HB       PHE  24  -1.158  -5.060  -0.707
  175    HD1  PHE  24          1HD       PHE  24  -2.783  -3.351  -0.013
  176    HD2  PHE  24          2HD       PHE  24  -1.459  -3.682  -4.045
  177    HE1  PHE  24          1HE       PHE  24  -4.693  -1.984  -0.750
  178    HE2  PHE  24          2HE       PHE  24  -3.366  -2.318  -4.787
  179    HZ   PHE  24           HZ       PHE  24  -4.986  -1.465  -3.140
  180    H    HIS  25           HN       HIS  25   2.499  -4.947  -1.444
  181    HA   HIS  25           HA       HIS  25   3.799  -3.273  -3.317
  182    HB2  HIS  25          2HB       HIS  25   4.239  -6.110  -2.417
  183    HB3  HIS  25          3HB       HIS  25   5.221  -5.395  -3.693
  184    HD2  HIS  25          2HD       HIS  25   5.066  -2.443  -1.718
  185    HE1  HIS  25          1HE       HIS  25   7.847  -4.785   0.467
  186    HE2  HIS  25          2HE       HIS  25   6.849  -2.494   0.155
  187    H    ASP  26           HN       ASP  26   4.578  -4.239  -5.484
  188    HA   ASP  26           HA       ASP  26   2.230  -4.707  -7.075
  189    HB2  ASP  26          2HB       ASP  26   4.484  -3.382  -7.606
  190    HB3  ASP  26          3HB       ASP  26   4.955  -4.951  -8.254
  191    H    GLY  27           HN       GLY  27   4.889  -6.610  -5.845
  192    HA2  GLY  27          1HA       GLY  27   4.142  -8.909  -7.484
  193    HA3  GLY  27          2HA       GLY  27   5.521  -8.809  -6.398
  194    H    CYS  28           HN       CYS  28   3.612  -7.680  -4.305
  195    HA   CYS  28           HA       CYS  28   3.072 -10.165  -3.023
  196    HB2  CYS  28          2HB       CYS  28   2.618  -7.283  -2.371
  197    HB3  CYS  28          3HB       CYS  28   1.752  -8.504  -1.443
  198    H    LEU  29           HN       LEU  29   1.056  -7.722  -4.602
  199    HA   LEU  29           HA       LEU  29  -1.459  -8.677  -3.973
  200    HB2  LEU  29          2HB       LEU  29  -0.424  -7.369  -6.474
  201    HB3  LEU  29          3HB       LEU  29  -2.130  -7.730  -6.226
  202    HG   LEU  29           HG       LEU  29  -0.506  -5.946  -4.417
  203   HD11  LEU  29          1HD1      LEU  29  -0.704  -4.315  -5.901
  204   HD12  LEU  29          2HD1      LEU  29  -2.456  -4.516  -5.896
  205   HD13  LEU  29          3HD1      LEU  29  -1.467  -5.427  -7.038
  206   HD21  LEU  29          1HD2      LEU  29  -2.844  -7.211  -3.888
  207   HD22  LEU  29          2HD2      LEU  29  -3.429  -5.705  -4.597
  208   HD23  LEU  29          3HD2      LEU  29  -2.366  -5.664  -3.189
  209    H    ARG  30           HN       ARG  30   0.892  -9.956  -6.199
  210    HA   ARG  30           HA       ARG  30  -1.032 -11.850  -7.310
  211    HB2  ARG  30          2HB       ARG  30   1.903 -11.487  -7.945
  212    HB3  ARG  30          3HB       ARG  30   0.767 -12.497  -8.829
  213    HG2  ARG  30          2HG       ARG  30  -0.006 -10.777 -10.016
  214    HG3  ARG  30          3HG       ARG  30  -0.107  -9.730  -8.600
  215    HD2  ARG  30          2HD       ARG  30   1.548  -8.619  -9.666
  216    HD3  ARG  30          3HD       ARG  30   2.557  -9.837  -8.886
  217    HE   ARG  30           HE       ARG  30   1.926 -11.015 -11.219
  218   HH11  ARG  30          1HH1      ARG  30   3.168  -7.858 -10.441
  219   HH12  ARG  30          2HH1      ARG  30   4.045  -7.693 -11.926
  220   HH21  ARG  30          1HH2      ARG  30   3.077 -10.811 -13.178
  221   HH22  ARG  30          2HH2      ARG  30   3.992  -9.374 -13.483
  222    H    ARG  31           HN       ARG  31   1.833 -11.751  -5.266
  223    HA   ARG  31           HA       ARG  31   2.294 -14.508  -5.059
  224    HB2  ARG  31          2HB       ARG  31   3.217 -12.101  -3.766
  225    HB3  ARG  31          3HB       ARG  31   2.960 -13.371  -2.575
  226    HG2  ARG  31          2HG       ARG  31   4.717 -14.564  -3.285
  227    HG3  ARG  31          3HG       ARG  31   4.381 -14.237  -4.986
  228    HD2  ARG  31          2HD       ARG  31   5.332 -11.991  -4.732
  229    HD3  ARG  31          3HD       ARG  31   5.681 -12.337  -3.038
  230    HE   ARG  31           HE       ARG  31   6.913 -14.329  -4.495
  231   HH11  ARG  31          1HH1      ARG  31   7.087 -10.859  -4.275
  232   HH12  ARG  31          2HH1      ARG  31   8.761 -10.784  -4.713
  233   HH21  ARG  31          1HH2      ARG  31   9.117 -14.244  -5.074
  234   HH22  ARG  31          2HH2      ARG  31   9.915 -12.709  -5.169
  235    H    MET  32           HN       MET  32   0.460 -12.349  -2.894
  236    HA   MET  32           HA       MET  32  -0.432 -14.367  -1.151
  237    HB2  MET  32          2HB       MET  32  -1.788 -11.743  -1.795
  238    HB3  MET  32          3HB       MET  32  -2.059 -12.730  -0.365
  239    HG2  MET  32          2HG       MET  32   0.411 -11.192  -1.105
  240    HG3  MET  32          3HG       MET  32  -0.660 -10.934   0.270
  241    HE1  MET  32          1HE       MET  32  -0.989 -12.306   2.115
  242    HE2  MET  32          2HE       MET  32  -0.850 -14.031   1.774
  243    HE3  MET  32          3HE       MET  32   0.273 -13.260   2.896
  244    H    GLY  33           HN       GLY  33  -1.182 -13.874  -4.362
  245    HA2  GLY  33          1HA       GLY  33  -2.607 -15.170  -5.675
  246    HA3  GLY  33          2HA       GLY  33  -3.372 -15.769  -4.211
  247    H    TYR  34           HN       TYR  34  -3.325 -12.570  -3.742
  248    HA   TYR  34           HA       TYR  34  -6.007 -12.111  -3.852
  249    HB2  TYR  34          2HB       TYR  34  -3.624 -10.333  -4.020
  250    HB3  TYR  34          3HB       TYR  34  -5.192  -9.628  -4.397
  251    HD1  TYR  34          1HD       TYR  34  -2.932  -9.850  -1.882
  252    HD2  TYR  34          2HD       TYR  34  -7.061 -10.617  -2.564
  253    HE1  TYR  34          1HE       TYR  34  -3.375  -9.569   0.521
  254    HE2  TYR  34          2HE       TYR  34  -7.516 -10.337  -0.164
  255    HH   TYR  34           HH       TYR  34  -6.672  -9.772   1.817
  256    H    ILE  35           HN       ILE  35  -3.684 -11.734  -6.485
  257    HA   ILE  35           HA       ILE  35  -5.857 -11.906  -8.406
  258    HB   ILE  35           HB       ILE  35  -5.078  -9.953  -9.696
  259   HG12  ILE  35          2HG1      ILE  35  -3.758  -8.421  -7.753
  260   HG13  ILE  35          3HG1      ILE  35  -2.982 -10.000  -7.701
  261   HG21  ILE  35          1HG2      ILE  35  -6.943  -9.885  -7.972
  262   HG22  ILE  35          2HG2      ILE  35  -5.789  -9.076  -6.912
  263   HG23  ILE  35          3HG2      ILE  35  -6.245  -8.336  -8.445
  264   HD11  ILE  35          1HD1      ILE  35  -1.862  -9.561  -9.554
  265   HD12  ILE  35          2HD1      ILE  35  -3.347  -9.165 -10.419
  266   HD13  ILE  35          3HD1      ILE  35  -2.504  -7.921  -9.497
  267    H    GLN  36           HN       GLN  36  -4.915 -11.906 -10.705
  268    HA   GLN  36           HA       GLN  36  -2.634 -13.720 -10.689
  269    HB2  GLN  36          2HB       GLN  36  -4.715 -13.016 -12.745
  270    HB3  GLN  36          3HB       GLN  36  -3.278 -13.937 -13.168
  271    HG2  GLN  36          2HG       GLN  36  -4.371 -15.766 -12.586
  272    HG3  GLN  36          3HG       GLN  36  -4.302 -15.208 -10.915
  273   HE21  GLN  36          1HE2      GLN  36  -6.069 -13.766 -10.224
  274   HE22  GLN  36          2HE2      GLN  36  -7.653 -14.059 -10.849
  275    H    GLY  37           HN       GLY  37  -3.578 -10.557 -11.886
  276    HA2  GLY  37          1HA       GLY  37  -1.281  -9.232 -11.884
  277    HA3  GLY  37          2HA       GLY  37  -1.049 -10.238 -13.305
  278    H    ASP  38           HN       ASP  38  -0.935  -7.593 -13.678
  279    HA   ASP  38           HA       ASP  38  -3.274  -7.114 -15.336
  280    HB2  ASP  38          2HB       ASP  38  -3.566  -4.807 -14.462
  281    HB3  ASP  38          3HB       ASP  38  -3.937  -6.045 -13.264
  282    H    SER  39           HN       SER  39  -0.248  -5.672 -14.135
  283    HA   SER  39           HA       SER  39   1.077  -5.641 -16.572
  284    HB2  SER  39          2HB       SER  39  -0.928  -3.600 -16.407
  285    HB3  SER  39          3HB       SER  39   0.662  -2.839 -16.423
  286    HG   SER  39           HG       SER  39   0.941  -4.549 -18.244
  287    H    ALA  40           HN       ALA  40   2.740  -3.589 -16.529
  288    HA   ALA  40           HA       ALA  40   3.743  -3.425 -13.763
  289    HB1  ALA  40          1HB       ALA  40   5.583  -3.532 -16.126
  290    HB2  ALA  40          2HB       ALA  40   5.932  -3.860 -14.428
  291    HB3  ALA  40          3HB       ALA  40   4.979  -5.007 -15.371
  292    H    ALA  41           HN       ALA  41   6.013  -1.835 -14.518
  293    HA   ALA  41           HA       ALA  41   5.688   0.386 -16.018
  294    HB1  ALA  41          1HB       ALA  41   3.958   0.519 -13.603
  295    HB2  ALA  41          2HB       ALA  41   4.774   1.990 -14.134
  296    HB3  ALA  41          3HB       ALA  41   3.681   1.143 -15.229
  297    H    GLU  42           HN       GLU  42   7.624   1.308 -15.947
  298    HA   GLU  42           HA       GLU  42   8.901   1.917 -13.423
  299    HB2  GLU  42          2HB       GLU  42   9.943  -0.176 -15.301
  300    HB3  GLU  42          3HB       GLU  42  11.061   0.780 -14.339
  301    HG2  GLU  42          2HG       GLU  42   9.730   0.059 -12.315
  302    HG3  GLU  42          3HG       GLU  42   8.927  -1.097 -13.376
  303    H    VAL  43           HN       VAL  43   8.851   4.063 -14.012
  304    HA   VAL  43           HA       VAL  43  10.582   4.798 -16.281
  305    HB   VAL  43           HB       VAL  43   8.118   6.269 -15.334
  306   HG11  VAL  43          1HG1      VAL  43   9.677   7.897 -16.050
  307   HG12  VAL  43          2HG1      VAL  43  10.171   6.921 -17.436
  308   HG13  VAL  43          3HG1      VAL  43   8.568   7.656 -17.399
  309   HG21  VAL  43          1HG2      VAL  43   8.532   5.053 -18.045
  310   HG22  VAL  43          2HG2      VAL  43   7.876   4.108 -16.709
  311   HG23  VAL  43          3HG2      VAL  43   7.028   5.549 -17.270
  312    H    THR  44           HN       THR  44   9.851   5.133 -12.961
  313    HA   THR  44           HA       THR  44  12.223   6.657 -12.486
  314    HB   THR  44           HB       THR  44  10.345   8.353 -13.142
  315    HG1  THR  44          1HG       THR  44  12.458   8.768 -12.105
  316   HG21  THR  44          1HG2      THR  44   9.698   8.317 -10.238
  317   HG22  THR  44          2HG2      THR  44   8.881   7.154 -11.283
  318   HG23  THR  44          3HG2      THR  44   8.736   8.882 -11.603
  319    H    GLU  45           HN       GLU  45  11.850   7.567  -9.973
  320    HA   GLU  45           HA       GLU  45  10.644   5.408  -8.413
  321    HB2  GLU  45          2HB       GLU  45  13.092   5.988  -7.134
  322    HB3  GLU  45          3HB       GLU  45  12.598   4.475  -7.882
  323    HG2  GLU  45          2HG       GLU  45  14.696   5.114  -8.803
  324    HG3  GLU  45          3HG       GLU  45  13.465   5.324 -10.045
  325    H    MET  46           HN       MET  46   9.124   6.763  -7.547
  326    HA   MET  46           HA       MET  46   9.819   8.276  -5.290
  327    HB2  MET  46          2HB       MET  46   9.592   9.760  -7.852
  328    HB3  MET  46          3HB       MET  46   8.825  10.482  -6.443
  329    HG2  MET  46          2HG       MET  46  11.261   9.815  -5.446
  330    HG3  MET  46          3HG       MET  46  11.658  10.207  -7.116
  331    HE1  MET  46          1HE       MET  46  10.303  11.563  -3.681
  332    HE2  MET  46          2HE       MET  46   9.604  13.105  -4.174
  333    HE3  MET  46          3HE       MET  46   8.882  11.593  -4.727
  334    H    ALA  47           HN       ALA  47   7.927   6.275  -6.170
  335    HA   ALA  47           HA       ALA  47   5.659   5.822  -6.275
  336    HB1  ALA  47          1HB       ALA  47   5.624   5.504  -4.052
  337    HB2  ALA  47          2HB       ALA  47   6.410   7.046  -3.715
  338    HB3  ALA  47          3HB       ALA  47   4.677   6.993  -4.036
  339    H    HIS  48           HN       HIS  48   5.018   8.787  -4.560
  340    HA   HIS  48           HA       HIS  48   2.949   9.557  -6.309
  341    HB2  HIS  48          2HB       HIS  48   3.442  10.215  -3.815
  342    HB3  HIS  48          3HB       HIS  48   4.322  11.552  -4.546
  343    HD1  HIS  48          1HD       HIS  48   2.425  12.286  -6.828
  344    HD2  HIS  48          2HD       HIS  48   1.165  11.426  -2.964
  345    HE1  HIS  48          1HE       HIS  48   0.186  13.405  -6.587
  346    H    THR  49           HN       THR  49   3.450   9.938  -8.395
  347    HA   THR  49           HA       THR  49   5.327  12.138  -8.932
  348    HB   THR  49           HB       THR  49   5.823  10.854 -11.136
  349    HG1  THR  49          1HG       THR  49   5.698   8.578 -10.861
  350   HG21  THR  49          1HG2      THR  49   7.143   9.383  -8.964
  351   HG22  THR  49          2HG2      THR  49   7.180  11.138  -8.790
  352   HG23  THR  49          3HG2      THR  49   7.835  10.381 -10.241
  353    H    GLU  50           HN       GLU  50   3.741  10.224 -11.386
  354    HA   GLU  50           HA       GLU  50   1.509  12.016 -11.682
  355    HB2  GLU  50          2HB       GLU  50   3.518  13.197 -12.728
  356    HB3  GLU  50          3HB       GLU  50   3.486  11.939 -13.954
  357    HG2  GLU  50          2HG       GLU  50   1.017  12.614 -14.261
  358    HG3  GLU  50          3HG       GLU  50   1.481  14.085 -13.407
  359    H    THR  51           HN       THR  51   3.407  10.027 -13.947
  360    HA   THR  51           HA       THR  51   1.096   8.214 -14.168
  361    HB   THR  51           HB       THR  51   2.491   8.229 -16.650
  362    HG1  THR  51          1HG       THR  51   1.409  10.764 -16.394
  363   HG21  THR  51          1HG2      THR  51   0.305   7.631 -16.870
  364   HG22  THR  51          2HG2      THR  51   0.136   9.346 -17.250
  365   HG23  THR  51          3HG2      THR  51  -0.241   8.759 -15.631
  366    H    GLY  52           HN       GLY  52   2.172   6.425 -15.984
  367    HA2  GLY  52          1HA       GLY  52   3.812   4.795 -16.279
  368    HA3  GLY  52          2HA       GLY  52   4.778   5.578 -15.037
  369    H    TRP  53           HN       TRP  53   4.042   5.292 -12.779
  370    HA   TRP  53           HA       TRP  53   3.571   2.534 -12.253
  371    HB2  TRP  53          2HB       TRP  53   3.826   3.090  -9.945
  372    HB3  TRP  53          3HB       TRP  53   4.962   4.098 -10.838
  373    HD1  TRP  53          1HD       TRP  53   2.914   6.394 -11.718
  374    HE1  TRP  53          1HE       TRP  53   2.047   8.043  -9.943
  375    HE3  TRP  53          3HE       TRP  53   3.794   3.607  -7.524
  376    HZ2  TRP  53          2HZ       TRP  53   1.774   8.150  -7.136
  377    HZ3  TRP  53          3HZ       TRP  53   3.201   4.556  -5.333
  378    HH2  TRP  53          2HH       TRP  53   2.213   6.780  -5.143
  379    H    SER  54           HN       SER  54   1.617   1.705 -12.685
  380    HA   SER  54           HA       SER  54  -0.753   3.176 -11.740
  381    HB2  SER  54          2HB       SER  54  -1.557   1.072 -13.451
  382    HB3  SER  54          3HB       SER  54  -1.601   2.805 -13.779
  383    HG   SER  54           HG       SER  54  -0.336   1.987 -15.353
  384    H    CYS  55           HN       CYS  55  -2.410   2.034 -10.669
  385    HA   CYS  55           HA       CYS  55  -1.618  -0.597  -9.608
  386    HB2  CYS  55          2HB       CYS  55  -1.858   0.072  -7.470
  387    HB3  CYS  55          3HB       CYS  55  -1.692   1.700  -8.120
  388    H    HIS  56           HN       HIS  56  -3.357  -1.995  -8.988
  389    HA   HIS  56           HA       HIS  56  -5.290  -2.514 -10.744
  390    HB2  HIS  56          2HB       HIS  56  -5.132  -2.919  -7.809
  391    HB3  HIS  56          3HB       HIS  56  -6.711  -3.159  -8.551
  392    HD1  HIS  56          1HD       HIS  56  -6.376  -4.750 -10.915
  393    HD2  HIS  56          2HD       HIS  56  -3.802  -5.255  -7.693
  394    HE1  HIS  56          1HE       HIS  56  -5.384  -7.044 -11.200
  395    H    TYR  57           HN       TYR  57  -6.724  -1.289  -7.799
  396    HA   TYR  57           HA       TYR  57  -8.623   0.244  -9.362
  397    HB2  TYR  57          2HB       TYR  57  -8.740   0.395  -6.415
  398    HB3  TYR  57          3HB       TYR  57 -10.019   0.068  -7.579
  399    HD1  TYR  57          1HD       TYR  57  -7.411  -1.407  -5.481
  400    HD2  TYR  57          2HD       TYR  57 -10.477  -2.205  -8.322
  401    HE1  TYR  57          1HE       TYR  57  -7.320  -3.796  -4.900
  402    HE2  TYR  57          2HE       TYR  57 -10.395  -4.595  -7.748
  403    HH   TYR  57           HH       TYR  57  -8.569  -6.186  -6.746
  404    H    CYS  58           HN       CYS  58  -6.784   1.690 -10.056
  405    HA   CYS  58           HA       CYS  58  -6.172   3.740  -8.043
  406    HB2  CYS  58          2HB       CYS  58  -4.460   2.477  -9.704
  407    HB3  CYS  58          3HB       CYS  58  -4.890   3.855 -10.712
  408    H    ASP  59           HN       ASP  59  -5.472   5.576 -10.311
  409    HA   ASP  59           HA       ASP  59  -8.170   6.294 -11.228
  410    HB2  ASP  59          2HB       ASP  59  -7.588   8.703 -10.778
  411    HB3  ASP  59          3HB       ASP  59  -7.818   7.718  -9.336
  412    H    ASN  60           HN       ASN  60  -6.559   4.983 -12.891
  413    HA   ASN  60           HA       ASN  60  -5.119   6.956 -14.506
  414    HB2  ASN  60          2HB       ASN  60  -5.259   3.961 -14.900
  415    HB3  ASN  60          3HB       ASN  60  -4.135   5.080 -15.663
  416   HD21  ASN  60          1HD2      ASN  60  -4.627   2.974 -13.118
  417   HD22  ASN  60          2HD2      ASN  60  -3.275   3.422 -12.142
  Start of MODEL   12
    1    H1   GLU   1           HN       GLU   1   1.751   4.688   4.998
    2    HA   GLU   1           HA       GLU   1   0.949   2.825   3.969
    3    HB2  GLU   1          2HB       GLU   1   2.065   4.416   1.693
    4    HB3  GLU   1          3HB       GLU   1   1.481   2.785   1.394
    5    HG2  GLU   1          2HG       GLU   1  -0.376   4.054   0.935
    6    HG3  GLU   1          3HG       GLU   1  -0.655   3.593   2.614
    7    H    MET   2           HN       MET   2   1.784   0.921   4.487
    8    HA   MET   2           HA       MET   2   4.333   0.123   3.269
    9    HB2  MET   2          2HB       MET   2   3.759  -0.803   6.040
   10    HB3  MET   2          3HB       MET   2   5.305  -0.527   5.247
   11    HG2  MET   2          2HG       MET   2   4.788   1.938   5.376
   12    HG3  MET   2          3HG       MET   2   3.444   1.509   6.431
   13    HE1  MET   2          1HE       MET   2   7.458   2.576   7.292
   14    HE2  MET   2          2HE       MET   2   7.789   0.934   6.740
   15    HE3  MET   2          3HE       MET   2   6.868   2.039   5.719
   16    H    CYS   3           HN       CYS   3   4.207  -1.776   2.268
   17    HA   CYS   3           HA       CYS   3   2.052  -3.222   1.682
   18    HB2  CYS   3          2HB       CYS   3   4.240  -3.771   0.775
   19    HB3  CYS   3          3HB       CYS   3   4.768  -4.381   2.341
   20    H    ASP   4           HN       ASP   4   0.450  -4.000   2.871
   21    HA   ASP   4           HA       ASP   4   0.563  -4.476   5.628
   22    HB2  ASP   4          2HB       ASP   4  -1.472  -4.149   3.992
   23    HB3  ASP   4          3HB       ASP   4  -1.432  -5.908   3.917
   24    H    VAL   5           HN       VAL   5   1.679  -6.358   3.036
   25    HA   VAL   5           HA       VAL   5   1.556  -8.857   4.553
   26    HB   VAL   5           HB       VAL   5   2.514  -8.341   1.733
   27   HG11  VAL   5          1HG1      VAL   5   3.678 -10.241   2.401
   28   HG12  VAL   5          2HG1      VAL   5   2.345 -10.827   3.397
   29   HG13  VAL   5          3HG1      VAL   5   2.232 -10.902   1.639
   30   HG21  VAL   5          1HG2      VAL   5  -0.027  -9.623   2.733
   31   HG22  VAL   5          2HG2      VAL   5   0.101  -8.014   2.022
   32   HG23  VAL   5          3HG2      VAL   5   0.451  -9.440   1.045
   33    H    CYS   6           HN       CYS   6   3.529  -6.263   4.443
   34    HA   CYS   6           HA       CYS   6   5.787  -7.796   5.442
   35    HB2  CYS   6          2HB       CYS   6   6.045  -5.876   3.118
   36    HB3  CYS   6          3HB       CYS   6   7.401  -6.569   4.004
   37    H    GLU   7           HN       GLU   7   5.041  -4.462   4.405
   38    HA   GLU   7           HA       GLU   7   4.823  -2.552   5.675
   39    HB2  GLU   7          2HB       GLU   7   5.856  -3.950   8.116
   40    HB3  GLU   7          3HB       GLU   7   4.737  -2.601   8.003
   41    HG2  GLU   7          2HG       GLU   7   3.537  -4.789   6.686
   42    HG3  GLU   7          3HG       GLU   7   4.178  -5.381   8.218
   43    H    VAL   8           HN       VAL   8   6.667  -2.106   4.228
   44    HA   VAL   8           HA       VAL   8   8.878  -1.081   5.726
   45    HB   VAL   8           HB       VAL   8  10.353  -2.484   3.859
   46   HG11  VAL   8          1HG1      VAL   8   9.964  -3.511   6.646
   47   HG12  VAL   8          2HG1      VAL   8  11.448  -3.390   5.697
   48   HG13  VAL   8          3HG1      VAL   8  10.700  -1.934   6.358
   49   HG21  VAL   8          1HG2      VAL   8   9.752  -4.838   4.179
   50   HG22  VAL   8          2HG2      VAL   8   8.319  -4.349   5.085
   51   HG23  VAL   8          3HG2      VAL   8   8.461  -3.945   3.374
   52    H    TRP   9           HN       TRP   9   8.391   0.883   4.807
   53    HA   TRP   9           HA       TRP   9   7.707   1.522   2.250
   54    HB2  TRP   9          2HB       TRP   9   7.715   3.407   3.534
   55    HB3  TRP   9          3HB       TRP   9   9.175   2.936   4.401
   56    HD1  TRP   9          1HD       TRP   9  11.449   3.912   3.561
   57    HE1  TRP   9          1HE       TRP   9  12.099   5.595   1.725
   58    HE3  TRP   9          3HE       TRP   9   6.978   4.190   1.096
   59    HZ2  TRP   9          2HZ       TRP   9  10.877   6.872  -0.476
   60    HZ3  TRP   9          3HZ       TRP   9   6.802   5.666  -0.864
   61    HH2  TRP   9          2HH       TRP   9   8.712   6.979  -1.633
   62    H    THR  10           HN       THR  10   8.760   1.998   0.329
   63    HA   THR  10           HA       THR  10  11.525   0.991   0.137
   64    HB   THR  10           HB       THR  10  10.742   0.792  -2.406
   65    HG1  THR  10          1HG       THR  10   8.627   0.629  -2.643
   66   HG21  THR  10          1HG2      THR  10  11.281  -0.965  -0.359
   67   HG22  THR  10          2HG2      THR  10  11.009  -1.407  -2.044
   68   HG23  THR  10          3HG2      THR  10   9.677  -1.467  -0.891
   69    H    ALA  11           HN       ALA  11   9.847   2.549  -2.485
   70    HA   ALA  11           HA       ALA  11  10.357   5.188  -2.251
   71    HB1  ALA  11          1HB       ALA  11  12.580   5.233  -1.825
   72    HB2  ALA  11          2HB       ALA  11  12.881   3.699  -2.641
   73    HB3  ALA  11          3HB       ALA  11  12.673   5.173  -3.586
   74    H    GLU  12           HN       GLU  12  11.291   2.606  -4.523
   75    HA   GLU  12           HA       GLU  12  10.928   3.901  -6.911
   76    HB2  GLU  12          2HB       GLU  12  10.401   1.046  -6.118
   77    HB3  GLU  12          3HB       GLU  12  10.173   1.595  -7.772
   78    HG2  GLU  12          2HG       GLU  12  12.638   2.526  -7.362
   79    HG3  GLU  12          3HG       GLU  12  12.659   1.167  -6.239
   80    H    SER  13           HN       SER  13   8.479   1.488  -6.390
   81    HA   SER  13           HA       SER  13   6.339   3.455  -6.288
   82    HB2  SER  13          2HB       SER  13   7.169   2.267  -8.752
   83    HB3  SER  13          3HB       SER  13   5.579   1.628  -8.333
   84    HG   SER  13           HG       SER  13   4.945   3.866  -8.016
   85    H    LEU  14           HN       LEU  14   5.471   2.668  -4.447
   86    HA   LEU  14           HA       LEU  14   5.059  -0.195  -4.128
   87    HB2  LEU  14          2HB       LEU  14   5.890   1.278  -2.278
   88    HB3  LEU  14          3HB       LEU  14   4.296   2.029  -2.246
   89    HG   LEU  14           HG       LEU  14   3.375  -0.286  -1.756
   90   HD11  LEU  14          1HD1      LEU  14   5.628  -1.331  -2.480
   91   HD12  LEU  14          2HD1      LEU  14   4.767  -2.014  -1.101
   92   HD13  LEU  14          3HD1      LEU  14   6.143  -0.944  -0.837
   93   HD21  LEU  14          1HD2      LEU  14   4.591   1.666  -0.073
   94   HD22  LEU  14          2HD2      LEU  14   4.870   0.067   0.616
   95   HD23  LEU  14          3HD2      LEU  14   3.226   0.602   0.270
   96    H    PHE  15           HN       PHE  15   3.091  -1.206  -4.056
   97    HA   PHE  15           HA       PHE  15   0.911   0.160  -5.369
   98    HB2  PHE  15          2HB       PHE  15   1.293  -2.679  -4.419
   99    HB3  PHE  15          3HB       PHE  15  -0.210  -2.110  -5.137
  100    HD1  PHE  15          1HD       PHE  15  -0.483  -2.727  -7.319
  101    HD2  PHE  15          2HD       PHE  15   3.429  -1.799  -5.923
  102    HE1  PHE  15          1HE       PHE  15   0.420  -3.173  -9.564
  103    HE2  PHE  15          2HE       PHE  15   4.339  -2.242  -8.165
  104    HZ   PHE  15           HZ       PHE  15   2.834  -2.929  -9.990
  105    HA   PRO  16           HA       PRO  16  -1.361  -0.541  -5.564
  106    HB2  PRO  16          2HB       PRO  16  -3.326   1.332  -5.488
  107    HB3  PRO  16          3HB       PRO  16  -3.524  -0.295  -4.827
  108    HG2  PRO  16          2HG       PRO  16  -2.888   2.262  -3.407
  109    HG3  PRO  16          3HG       PRO  16  -4.011   0.972  -2.938
  110    HD2  PRO  16          2HD       PRO  16  -1.537   1.213  -1.863
  111    HD3  PRO  16          3HD       PRO  16  -2.327  -0.360  -2.099
  112    H    CYS  17           HN       CYS  17  -1.252   2.748  -4.171
  113    HA   CYS  17           HA       CYS  17   0.675   3.607  -6.124
  114    HB2  CYS  17          2HB       CYS  17  -0.642   5.205  -7.286
  115    HB3  CYS  17          3HB       CYS  17  -1.563   3.704  -7.320
  116    H    ARG  18           HN       ARG  18  -1.746   4.664  -3.751
  117    HA   ARG  18           HA       ARG  18   0.170   5.863  -2.060
  118    HB2  ARG  18          2HB       ARG  18   0.338   7.958  -2.808
  119    HB3  ARG  18          3HB       ARG  18  -0.559   7.473  -4.241
  120    HG2  ARG  18          2HG       ARG  18  -1.805   9.249  -3.508
  121    HG3  ARG  18          3HG       ARG  18  -2.644   7.902  -2.734
  122    HD2  ARG  18          2HD       ARG  18  -2.402   9.523  -1.051
  123    HD3  ARG  18          3HD       ARG  18  -1.148   8.328  -0.724
  124    HE   ARG  18           HE       ARG  18   0.387   9.982  -1.007
  125   HH11  ARG  18          1HH1      ARG  18  -2.506  10.868  -2.729
  126   HH12  ARG  18          2HH1      ARG  18  -1.899  12.418  -3.212
  127   HH21  ARG  18          1HH2      ARG  18   1.196  12.018  -1.638
  128   HH22  ARG  18          2HH2      ARG  18   0.207  13.070  -2.592
  129    H    VAL  19           HN       VAL  19  -3.165   5.659  -3.134
  130    HA   VAL  19           HA       VAL  19  -4.008   5.521  -0.332
  131    HB   VAL  19           HB       VAL  19  -5.212   7.353  -2.403
  132   HG11  VAL  19          1HG1      VAL  19  -6.555   5.865  -0.367
  133   HG12  VAL  19          2HG1      VAL  19  -6.604   7.582   0.037
  134   HG13  VAL  19          3HG1      VAL  19  -7.220   7.022  -1.519
  135   HG21  VAL  19          1HG2      VAL  19  -4.765   8.320   0.316
  136   HG22  VAL  19          2HG2      VAL  19  -3.288   7.817  -0.506
  137   HG23  VAL  19          3HG2      VAL  19  -4.328   9.044  -1.231
  138    H    CYS  20           HN       CYS  20  -6.358   5.909  -2.823
  139    HA   CYS  20           HA       CYS  20  -7.921   4.517  -3.710
  140    HB2  CYS  20          2HB       CYS  20  -6.356   2.045  -3.496
  141    HB3  CYS  20          3HB       CYS  20  -7.059   2.814  -4.915
  142    H    THR  21           HN       THR  21  -6.252   2.172  -1.625
  143    HA   THR  21           HA       THR  21  -8.522   2.149   0.208
  144    HB   THR  21           HB       THR  21  -7.789  -0.105  -1.599
  145    HG1  THR  21          1HG       THR  21  -9.744   0.721  -2.054
  146   HG21  THR  21          1HG2      THR  21  -8.329  -0.357   1.311
  147   HG22  THR  21          2HG2      THR  21  -7.367  -1.382   0.245
  148   HG23  THR  21          3HG2      THR  21  -9.126  -1.501   0.233
  149    H    ARG  22           HN       ARG  22  -5.661   0.134  -0.507
  150    HA   ARG  22           HA       ARG  22  -4.595   0.807   2.140
  151    HB2  ARG  22          2HB       ARG  22  -5.882  -1.542   1.794
  152    HB3  ARG  22          3HB       ARG  22  -4.261  -2.010   1.298
  153    HG2  ARG  22          2HG       ARG  22  -3.403  -1.792   3.386
  154    HG3  ARG  22          3HG       ARG  22  -4.517  -0.496   3.829
  155    HD2  ARG  22          2HD       ARG  22  -6.344  -2.200   3.893
  156    HD3  ARG  22          3HD       ARG  22  -5.118  -3.444   3.653
  157    HE   ARG  22           HE       ARG  22  -4.457  -3.184   5.840
  158   HH11  ARG  22          1HH1      ARG  22  -6.607  -0.596   4.943
  159   HH12  ARG  22          2HH1      ARG  22  -6.789  -0.011   6.562
  160   HH21  ARG  22          1HH2      ARG  22  -4.689  -2.423   7.977
  161   HH22  ARG  22          2HH2      ARG  22  -5.697  -1.050   8.288
  162    H    VAL  23           HN       VAL  23  -2.552  -1.330   1.755
  163    HA   VAL  23           HA       VAL  23  -1.042  -0.260  -0.520
  164    HB   VAL  23           HB       VAL  23   0.943   0.101   0.745
  165   HG11  VAL  23          1HG1      VAL  23  -1.533   1.318   1.897
  166   HG12  VAL  23          2HG1      VAL  23   0.051   1.722   2.563
  167   HG13  VAL  23          3HG1      VAL  23  -0.303   2.048   0.865
  168   HG21  VAL  23          1HG2      VAL  23   0.776  -0.181   3.313
  169   HG22  VAL  23          2HG2      VAL  23  -0.554  -1.277   2.941
  170   HG23  VAL  23          3HG2      VAL  23   1.060  -1.605   2.313
  171    H    PHE  24           HN       PHE  24  -0.200  -1.839  -1.704
  172    HA   PHE  24           HA       PHE  24   0.406  -4.410  -0.404
  173    HB2  PHE  24          2HB       PHE  24  -0.386  -4.565  -3.232
  174    HB3  PHE  24          3HB       PHE  24  -0.833  -5.598  -1.877
  175    HD1  PHE  24          1HD       PHE  24  -2.566  -4.667  -0.225
  176    HD2  PHE  24          2HD       PHE  24  -1.921  -3.074  -4.118
  177    HE1  PHE  24          1HE       PHE  24  -4.797  -3.630  -0.167
  178    HE2  PHE  24          2HE       PHE  24  -4.148  -2.034  -4.067
  179    HZ   PHE  24           HZ       PHE  24  -5.590  -2.311  -2.089
  180    H    HIS  25           HN       HIS  25   1.801  -5.807  -1.933
  181    HA   HIS  25           HA       HIS  25   3.961  -4.091  -2.946
  182    HB2  HIS  25          2HB       HIS  25   3.908  -6.513  -1.356
  183    HB3  HIS  25          3HB       HIS  25   4.916  -6.716  -2.786
  184    HD2  HIS  25          2HD       HIS  25   5.782  -3.324  -2.412
  185    HE1  HIS  25          1HE       HIS  25   7.927  -5.058   0.812
  186    HE2  HIS  25          2HE       HIS  25   7.616  -3.005  -0.615
  187    H    ASP  26           HN       ASP  26   5.320  -5.306  -4.689
  188    HA   ASP  26           HA       ASP  26   3.484  -5.889  -6.865
  189    HB2  ASP  26          2HB       ASP  26   5.500  -4.326  -7.038
  190    HB3  ASP  26          3HB       ASP  26   6.493  -5.781  -7.037
  191    H    GLY  27           HN       GLY  27   5.910  -7.511  -4.919
  192    HA2  GLY  27          1HA       GLY  27   5.720  -9.932  -6.540
  193    HA3  GLY  27          2HA       GLY  27   6.811  -9.668  -5.187
  194    H    CYS  28           HN       CYS  28   4.506  -8.645  -3.554
  195    HA   CYS  28           HA       CYS  28   3.788 -11.165  -2.404
  196    HB2  CYS  28          2HB       CYS  28   3.095  -8.303  -1.781
  197    HB3  CYS  28          3HB       CYS  28   2.316  -9.635  -0.933
  198    H    LEU  29           HN       LEU  29   1.746  -8.496  -3.608
  199    HA   LEU  29           HA       LEU  29  -0.705  -9.550  -3.602
  200    HB2  LEU  29          2HB       LEU  29   0.591  -8.085  -5.891
  201    HB3  LEU  29          3HB       LEU  29  -1.139  -8.401  -5.789
  202    HG   LEU  29           HG       LEU  29   0.391  -6.808  -3.739
  203   HD11  LEU  29          1HD1      LEU  29   0.325  -5.019  -5.047
  204   HD12  LEU  29          2HD1      LEU  29  -1.392  -5.258  -5.368
  205   HD13  LEU  29          3HD1      LEU  29  -0.188  -6.060  -6.375
  206   HD21  LEU  29          1HD2      LEU  29  -2.136  -5.971  -3.565
  207   HD22  LEU  29          2HD2      LEU  29  -1.521  -7.342  -2.642
  208   HD23  LEU  29          3HD2      LEU  29  -2.430  -7.616  -4.129
  209    H    ARG  30           HN       ARG  30   1.888 -10.560  -5.730
  210    HA   ARG  30           HA       ARG  30   0.188 -12.313  -7.275
  211    HB2  ARG  30          2HB       ARG  30   1.849 -12.037  -8.739
  212    HB3  ARG  30          3HB       ARG  30   2.824 -11.225  -7.521
  213    HG2  ARG  30          2HG       ARG  30   3.746 -13.319  -6.787
  214    HG3  ARG  30          3HG       ARG  30   2.670 -14.211  -7.866
  215    HD2  ARG  30          2HD       ARG  30   4.011 -13.895  -9.625
  216    HD3  ARG  30          3HD       ARG  30   4.223 -12.184  -9.256
  217    HE   ARG  30           HE       ARG  30   6.284 -12.751  -8.492
  218   HH11  ARG  30          1HH1      ARG  30   4.146 -15.440  -7.932
  219   HH12  ARG  30          2HH1      ARG  30   5.365 -16.423  -7.193
  220   HH21  ARG  30          1HH2      ARG  30   7.899 -14.036  -7.520
  221   HH22  ARG  30          2HH2      ARG  30   7.499 -15.624  -6.957
  222    H    ARG  31           HN       ARG  31   2.820 -12.714  -4.913
  223    HA   ARG  31           HA       ARG  31   2.514 -15.558  -4.795
  224    HB2  ARG  31          2HB       ARG  31   4.315 -13.565  -3.718
  225    HB3  ARG  31          3HB       ARG  31   3.855 -14.729  -2.483
  226    HG2  ARG  31          2HG       ARG  31   4.699 -15.752  -5.142
  227    HG3  ARG  31          3HG       ARG  31   5.931 -15.126  -4.044
  228    HD2  ARG  31          2HD       ARG  31   5.800 -16.918  -2.716
  229    HD3  ARG  31          3HD       ARG  31   4.037 -16.888  -2.717
  230    HE   ARG  31           HE       ARG  31   4.030 -18.422  -4.437
  231   HH11  ARG  31          1HH1      ARG  31   7.261 -17.241  -3.903
  232   HH12  ARG  31          2HH1      ARG  31   8.005 -18.436  -4.914
  233   HH21  ARG  31          1HH2      ARG  31   4.998 -20.000  -5.770
  234   HH22  ARG  31          2HH2      ARG  31   6.717 -20.005  -5.976
  235    H    MET  32           HN       MET  32   0.499 -13.232  -3.795
  236    HA   MET  32           HA       MET  32  -0.336 -14.718  -1.391
  237    HB2  MET  32          2HB       MET  32  -0.543 -11.801  -2.095
  238    HB3  MET  32          3HB       MET  32  -1.586 -12.521  -0.875
  239    HG2  MET  32          2HG       MET  32   1.420 -12.597  -0.796
  240    HG3  MET  32          3HG       MET  32   0.428 -11.402   0.036
  241    HE1  MET  32          1HE       MET  32  -1.740 -12.293   1.163
  242    HE2  MET  32          2HE       MET  32  -1.752 -13.642   2.300
  243    HE3  MET  32          3HE       MET  32  -0.833 -12.182   2.671
  244    H    GLY  33           HN       GLY  33  -1.012 -14.562  -4.522
  245    HA2  GLY  33          1HA       GLY  33  -2.842 -15.129  -5.786
  246    HA3  GLY  33          2HA       GLY  33  -3.582 -15.688  -4.293
  247    H    TYR  34           HN       TYR  34  -2.647 -12.457  -4.094
  248    HA   TYR  34           HA       TYR  34  -5.317 -11.545  -3.854
  249    HB2  TYR  34          2HB       TYR  34  -2.617 -10.300  -3.768
  250    HB3  TYR  34          3HB       TYR  34  -3.986  -9.234  -4.063
  251    HD1  TYR  34          1HD       TYR  34  -1.936 -10.424  -1.577
  252    HD2  TYR  34          2HD       TYR  34  -6.074  -9.860  -2.399
  253    HE1  TYR  34          1HE       TYR  34  -2.402 -10.366   0.836
  254    HE2  TYR  34          2HE       TYR  34  -6.550  -9.800   0.014
  255    HH   TYR  34           HH       TYR  34  -5.496  -9.445   2.090
  256    H    ILE  35           HN       ILE  35  -2.989 -11.539  -6.468
  257    HA   ILE  35           HA       ILE  35  -5.099 -10.671  -8.294
  258    HB   ILE  35           HB       ILE  35  -3.615  -9.124  -9.469
  259   HG12  ILE  35          2HG1      ILE  35  -1.557  -8.412  -7.936
  260   HG13  ILE  35          3HG1      ILE  35  -1.676 -10.090  -7.418
  261   HG21  ILE  35          1HG2      ILE  35  -5.012  -8.009  -7.984
  262   HG22  ILE  35          2HG2      ILE  35  -4.184  -8.652  -6.568
  263   HG23  ILE  35          3HG2      ILE  35  -3.412  -7.409  -7.551
  264   HD11  ILE  35          1HD1      ILE  35  -0.133  -9.398  -9.409
  265   HD12  ILE  35          2HD1      ILE  35  -1.049 -10.905  -9.459
  266   HD13  ILE  35          3HD1      ILE  35  -1.635  -9.486 -10.329
  267    H    GLN  36           HN       GLN  36  -4.041 -10.722 -10.652
  268    HA   GLN  36           HA       GLN  36  -2.539 -13.248 -10.850
  269    HB2  GLN  36          2HB       GLN  36  -5.132 -12.685 -11.798
  270    HB3  GLN  36          3HB       GLN  36  -4.091 -12.719 -13.216
  271    HG2  GLN  36          2HG       GLN  36  -3.964 -14.910 -11.190
  272    HG3  GLN  36          3HG       GLN  36  -5.226 -14.894 -12.419
  273   HE21  GLN  36          1HE2      GLN  36  -1.750 -14.164 -12.374
  274   HE22  GLN  36          2HE2      GLN  36  -1.346 -15.184 -13.707
  275    H    GLY  37           HN       GLY  37  -3.404 -10.315 -12.688
  276    HA2  GLY  37          1HA       GLY  37  -0.643 -10.311 -13.739
  277    HA3  GLY  37          2HA       GLY  37  -2.024  -9.948 -14.764
  278    H    ASP  38           HN       ASP  38  -0.162  -8.833 -11.985
  279    HA   ASP  38           HA       ASP  38  -0.806  -6.082 -12.739
  280    HB2  ASP  38          2HB       ASP  38  -1.498  -7.400 -10.167
  281    HB3  ASP  38          3HB       ASP  38  -0.862  -5.758 -10.076
  282    H    SER  39           HN       SER  39   1.518  -7.093 -13.439
  283    HA   SER  39           HA       SER  39   3.414  -5.996 -11.471
  284    HB2  SER  39          2HB       SER  39   4.742  -7.928 -13.099
  285    HB3  SER  39          3HB       SER  39   4.489  -7.956 -11.355
  286    HG   SER  39           HG       SER  39   2.874  -9.059 -13.392
  287    H    ALA  40           HN       ALA  40   3.953  -4.092 -12.352
  288    HA   ALA  40           HA       ALA  40   4.243  -3.770 -15.209
  289    HB1  ALA  40          1HB       ALA  40   3.342  -2.054 -13.471
  290    HB2  ALA  40          2HB       ALA  40   5.050  -1.680 -13.235
  291    HB3  ALA  40          3HB       ALA  40   4.319  -1.497 -14.830
  292    H    ALA  41           HN       ALA  41   6.395  -1.762 -14.872
  293    HA   ALA  41           HA       ALA  41   8.633  -3.625 -15.065
  294    HB1  ALA  41          1HB       ALA  41   9.648  -2.131 -16.445
  295    HB2  ALA  41          2HB       ALA  41   7.974  -1.635 -16.697
  296    HB3  ALA  41          3HB       ALA  41   9.004  -0.730 -15.587
  297    H    GLU  42           HN       GLU  42   7.263  -1.515 -12.813
  298    HA   GLU  42           HA       GLU  42   8.097  -0.386 -10.973
  299    HB2  GLU  42          2HB       GLU  42   9.099  -1.957  -9.374
  300    HB3  GLU  42          3HB       GLU  42   7.710  -2.662 -10.189
  301    HG2  GLU  42          2HG       GLU  42   9.216  -3.876 -11.692
  302    HG3  GLU  42          3HG       GLU  42  10.600  -3.190 -10.841
  303    H    VAL  43           HN       VAL  43   9.600   0.453 -13.070
  304    HA   VAL  43           HA       VAL  43  12.317   0.532 -11.929
  305    HB   VAL  43           HB       VAL  43  12.439  -0.761 -13.959
  306   HG11  VAL  43          1HG1      VAL  43  10.307   0.700 -14.819
  307   HG12  VAL  43          2HG1      VAL  43  11.617   1.371 -15.792
  308   HG13  VAL  43          3HG1      VAL  43  11.281  -0.360 -15.838
  309   HG21  VAL  43          1HG2      VAL  43  13.772   1.743 -13.587
  310   HG22  VAL  43          2HG2      VAL  43  14.391   0.249 -14.290
  311   HG23  VAL  43          3HG2      VAL  43  13.576   1.433 -15.312
  312    H    THR  44           HN       THR  44  11.984   2.459 -10.841
  313    HA   THR  44           HA       THR  44  12.466   4.834 -12.240
  314    HB   THR  44           HB       THR  44  10.044   4.465 -12.895
  315    HG1  THR  44          1HG       THR  44  10.334   6.541 -13.171
  316   HG21  THR  44          1HG2      THR  44   9.205   5.545 -10.270
  317   HG22  THR  44          2HG2      THR  44   9.615   3.830 -10.325
  318   HG23  THR  44          3HG2      THR  44   8.354   4.470 -11.378
  319    H    GLU  45           HN       GLU  45  12.818   6.609 -10.866
  320    HA   GLU  45           HA       GLU  45  12.843   5.908  -8.009
  321    HB2  GLU  45          2HB       GLU  45  14.573   7.806  -9.599
  322    HB3  GLU  45          3HB       GLU  45  14.605   7.699  -7.844
  323    HG2  GLU  45          2HG       GLU  45  15.972   5.963  -7.911
  324    HG3  GLU  45          3HG       GLU  45  14.893   5.088  -8.996
  325    H    MET  46           HN       MET  46  11.013   7.568 -10.106
  326    HA   MET  46           HA       MET  46  10.626  10.125  -9.353
  327    HB2  MET  46          2HB       MET  46   8.661   7.963 -10.015
  328    HB3  MET  46          3HB       MET  46   8.077   9.553  -9.544
  329    HG2  MET  46          2HG       MET  46   9.991   9.044 -11.807
  330    HG3  MET  46          3HG       MET  46   8.248   9.224 -11.989
  331    HE1  MET  46          1HE       MET  46  11.496  10.453 -11.860
  332    HE2  MET  46          2HE       MET  46  11.290  12.060 -12.555
  333    HE3  MET  46          3HE       MET  46  11.511  11.874 -10.815
  334    H    ALA  47           HN       ALA  47   8.215   7.993  -7.957
  335    HA   ALA  47           HA       ALA  47   7.315   7.842  -5.872
  336    HB1  ALA  47          1HB       ALA  47   8.755   7.461  -4.152
  337    HB2  ALA  47          2HB       ALA  47   9.895   7.352  -5.493
  338    HB3  ALA  47          3HB       ALA  47   9.778   8.840  -4.554
  339    H    HIS  48           HN       HIS  48   5.778   9.317  -5.543
  340    HA   HIS  48           HA       HIS  48   4.723  11.238  -4.931
  341    HB2  HIS  48          2HB       HIS  48   7.350  11.564  -3.496
  342    HB3  HIS  48          3HB       HIS  48   6.085  12.784  -3.389
  343    HD1  HIS  48          1HD       HIS  48   7.315  10.279  -1.391
  344    HD2  HIS  48          2HD       HIS  48   3.479  11.098  -2.759
  345    HE1  HIS  48          1HE       HIS  48   5.767   9.123   0.219
  346    H    THR  49           HN       THR  49   4.890  11.678  -7.296
  347    HA   THR  49           HA       THR  49   6.038  14.320  -7.687
  348    HB   THR  49           HB       THR  49   6.874  13.464 -10.016
  349    HG1  THR  49          1HG       THR  49   6.642  11.359 -10.153
  350   HG21  THR  49          1HG2      THR  49   9.034  13.517  -9.207
  351   HG22  THR  49          2HG2      THR  49   8.623  12.611  -7.751
  352   HG23  THR  49          3HG2      THR  49   8.163  14.307  -7.893
  353    H    GLU  50           HN       GLU  50   4.643  11.697  -9.671
  354    HA   GLU  50           HA       GLU  50   2.127  12.860 -10.008
  355    HB2  GLU  50          2HB       GLU  50   3.206  14.656 -11.189
  356    HB3  GLU  50          3HB       GLU  50   4.118  13.525 -12.178
  357    HG2  GLU  50          2HG       GLU  50   2.034  14.710 -13.157
  358    HG3  GLU  50          3HG       GLU  50   2.313  13.003 -13.497
  359    H    THR  51           HN       THR  51   4.485  11.370 -12.236
  360    HA   THR  51           HA       THR  51   2.509   9.315 -12.887
  361    HB   THR  51           HB       THR  51   4.253   8.648 -14.628
  362    HG1  THR  51          1HG       THR  51   6.111   9.617 -14.200
  363   HG21  THR  51          1HG2      THR  51   3.734  11.263 -15.579
  364   HG22  THR  51          2HG2      THR  51   2.361  10.786 -14.581
  365   HG23  THR  51          3HG2      THR  51   2.855   9.779 -15.941
  366    H    GLY  52           HN       GLY  52   3.786   7.121 -13.487
  367    HA2  GLY  52          1HA       GLY  52   5.256   5.435 -12.765
  368    HA3  GLY  52          2HA       GLY  52   5.732   6.457 -11.418
  369    H    TRP  53           HN       TRP  53   4.230   6.676  -9.624
  370    HA   TRP  53           HA       TRP  53   3.142   4.151  -8.874
  371    HB2  TRP  53          2HB       TRP  53   2.244   5.607  -6.899
  372    HB3  TRP  53          3HB       TRP  53   3.976   5.330  -7.057
  373    HD1  TRP  53          1HD       TRP  53   5.458   7.417  -7.988
  374    HE1  TRP  53          1HE       TRP  53   5.047   9.954  -7.841
  375    HE3  TRP  53          3HE       TRP  53   0.465   7.367  -6.893
  376    HZ2  TRP  53          2HZ       TRP  53   2.890  11.702  -7.330
  377    HZ3  TRP  53          3HZ       TRP  53  -0.698   9.514  -6.591
  378    HH2  TRP  53          2HH       TRP  53   0.492  11.636  -6.804
  379    H    SER  54           HN       SER  54   1.501   3.624 -10.312
  380    HA   SER  54           HA       SER  54  -1.002   5.094  -9.886
  381    HB2  SER  54          2HB       SER  54  -1.319   4.345 -12.475
  382    HB3  SER  54          3HB       SER  54  -0.742   5.937 -11.982
  383    HG   SER  54           HG       SER  54   0.701   3.747 -12.982
  384    H    CYS  55           HN       CYS  55  -2.393   3.715  -9.028
  385    HA   CYS  55           HA       CYS  55  -2.103   0.856  -9.487
  386    HB2  CYS  55          2HB       CYS  55  -3.463   0.532  -7.614
  387    HB3  CYS  55          3HB       CYS  55  -2.566   1.993  -7.210
  388    H    HIS  56           HN       HIS  56  -4.430  -0.276  -9.504
  389    HA   HIS  56           HA       HIS  56  -5.585   0.493 -12.031
  390    HB2  HIS  56          2HB       HIS  56  -5.615  -1.869 -10.292
  391    HB3  HIS  56          3HB       HIS  56  -7.156  -1.552 -11.082
  392    HD1  HIS  56          1HD       HIS  56  -4.183  -0.563 -13.017
  393    HD2  HIS  56          2HD       HIS  56  -6.615  -3.908 -12.629
  394    HE1  HIS  56          1HE       HIS  56  -3.656  -2.011 -15.004
  395    H    TYR  57           HN       TYR  57  -6.715   0.216  -8.676
  396    HA   TYR  57           HA       TYR  57  -9.359   1.064  -9.177
  397    HB2  TYR  57          2HB       TYR  57  -7.970   1.550  -6.560
  398    HB3  TYR  57          3HB       TYR  57  -9.644   1.097  -6.856
  399    HD1  TYR  57          1HD       TYR  57  -6.831  -0.089  -5.414
  400    HD2  TYR  57          2HD       TYR  57  -9.629  -1.255  -8.400
  401    HE1  TYR  57          1HE       TYR  57  -6.256  -2.448  -5.024
  402    HE2  TYR  57          2HE       TYR  57  -9.063  -3.616  -8.017
  403    HH   TYR  57           HH       TYR  57  -7.068  -4.907  -7.116
  404    H    CYS  58           HN       CYS  58  -6.515   2.751  -9.443
  405    HA   CYS  58           HA       CYS  58  -6.982   5.238  -8.319
  406    HB2  CYS  58          2HB       CYS  58  -5.367   4.215 -10.579
  407    HB3  CYS  58          3HB       CYS  58  -5.704   5.943 -10.598
  408    H    ASP  59           HN       ASP  59  -7.832   4.153 -11.604
  409    HA   ASP  59           HA       ASP  59  -9.812   6.336 -11.706
  410    HB2  ASP  59          2HB       ASP  59  -8.604   5.010 -14.129
  411    HB3  ASP  59          3HB       ASP  59  -9.478   6.538 -14.040
  412    H    ASN  60           HN       ASN  60 -11.793   5.894 -12.857
  413    HA   ASN  60           HA       ASN  60 -12.442   3.111 -13.386
  414    HB2  ASN  60          2HB       ASN  60 -13.503   4.664 -11.072
  415    HB3  ASN  60          3HB       ASN  60 -14.619   3.606 -11.933
  416   HD21  ASN  60          1HD2      ASN  60 -11.556   3.711 -10.214
  417   HD22  ASN  60          2HD2      ASN  60 -11.568   2.056  -9.716
  Start of MODEL   13
    1    H1   GLU   1           HN       GLU   1   2.989   4.605   5.173
    2    HA   GLU   1           HA       GLU   1   0.878   3.130   4.025
    3    HB2  GLU   1          2HB       GLU   1   1.397   3.057   1.747
    4    HB3  GLU   1          3HB       GLU   1   1.544   4.762   2.149
    5    HG2  GLU   1          2HG       GLU   1   4.043   4.224   2.502
    6    HG3  GLU   1          3HG       GLU   1   3.693   2.771   1.566
    7    H    MET   2           HN       MET   2   1.296   1.094   4.550
    8    HA   MET   2           HA       MET   2   4.026   0.073   4.336
    9    HB2  MET   2          2HB       MET   2   2.439  -0.551   6.805
   10    HB3  MET   2          3HB       MET   2   4.169  -0.707   6.535
   11    HG2  MET   2          2HG       MET   2   4.012   1.911   6.274
   12    HG3  MET   2          3HG       MET   2   2.566   1.683   7.254
   13    HE1  MET   2          1HE       MET   2   6.232   1.760   6.897
   14    HE2  MET   2          2HE       MET   2   6.915   1.404   8.484
   15    HE3  MET   2          3HE       MET   2   6.395   0.086   7.432
   16    H    CYS   3           HN       CYS   3   3.807  -1.563   2.959
   17    HA   CYS   3           HA       CYS   3   1.656  -2.896   2.085
   18    HB2  CYS   3          2HB       CYS   3   3.986  -3.295   1.315
   19    HB3  CYS   3          3HB       CYS   3   4.267  -4.270   2.755
   20    H    ASP   4           HN       ASP   4   0.082  -4.098   2.907
   21    HA   ASP   4           HA       ASP   4   0.030  -4.803   5.662
   22    HB2  ASP   4          2HB       ASP   4  -1.917  -4.302   3.934
   23    HB3  ASP   4          3HB       ASP   4  -1.862  -6.049   3.719
   24    H    VAL   5           HN       VAL   5   1.693  -6.180   3.213
   25    HA   VAL   5           HA       VAL   5   1.496  -8.877   4.391
   26    HB   VAL   5           HB       VAL   5   2.247  -8.148   1.556
   27   HG11  VAL   5          1HG1      VAL   5   1.994 -10.736   1.360
   28   HG12  VAL   5          2HG1      VAL   5   3.504 -10.042   1.952
   29   HG13  VAL   5          3HG1      VAL   5   2.333 -10.709   3.091
   30   HG21  VAL   5          1HG2      VAL   5  -0.226  -9.348   2.773
   31   HG22  VAL   5          2HG2      VAL   5  -0.090  -7.922   1.745
   32   HG23  VAL   5          3HG2      VAL   5   0.168  -9.527   1.063
   33    H    CYS   6           HN       CYS   6   3.373  -6.201   4.295
   34    HA   CYS   6           HA       CYS   6   5.750  -7.718   5.028
   35    HB2  CYS   6          2HB       CYS   6   5.812  -5.542   2.925
   36    HB3  CYS   6          3HB       CYS   6   7.217  -6.365   3.595
   37    H    GLU   7           HN       GLU   7   4.284  -4.511   4.639
   38    HA   GLU   7           HA       GLU   7   4.125  -2.774   6.122
   39    HB2  GLU   7          2HB       GLU   7   5.840  -4.274   8.083
   40    HB3  GLU   7          3HB       GLU   7   4.617  -3.053   8.405
   41    HG2  GLU   7          2HG       GLU   7   2.907  -4.529   8.296
   42    HG3  GLU   7          3HG       GLU   7   3.707  -5.537   7.090
   43    H    VAL   8           HN       VAL   8   6.195  -3.060   4.149
   44    HA   VAL   8           HA       VAL   8   8.345  -1.487   5.416
   45    HB   VAL   8           HB       VAL   8   9.299  -2.443   2.953
   46   HG11  VAL   8          1HG1      VAL   8   9.875  -2.860   5.834
   47   HG12  VAL   8          2HG1      VAL   8  10.634  -3.956   4.677
   48   HG13  VAL   8          3HG1      VAL   8  10.904  -2.217   4.555
   49   HG21  VAL   8          1HG2      VAL   8   7.424  -4.096   3.094
   50   HG22  VAL   8          2HG2      VAL   8   9.033  -4.815   3.035
   51   HG23  VAL   8          3HG2      VAL   8   8.165  -4.721   4.567
   52    H    TRP   9           HN       TRP   9   8.751   0.489   4.624
   53    HA   TRP   9           HA       TRP   9   7.296   1.305   2.197
   54    HB2  TRP   9          2HB       TRP   9   6.417   2.831   3.607
   55    HB3  TRP   9          3HB       TRP   9   7.669   2.565   4.817
   56    HD1  TRP   9          1HD       TRP   9   9.563   4.337   4.986
   57    HE1  TRP   9          1HE       TRP   9  10.101   6.520   3.732
   58    HE3  TRP   9          3HE       TRP   9   6.219   3.912   1.142
   59    HZ2  TRP   9          2HZ       TRP   9   9.223   7.882   1.421
   60    HZ3  TRP   9          3HZ       TRP   9   6.131   5.698  -0.548
   61    HH2  TRP   9          2HH       TRP   9   7.603   7.641  -0.409
   62    H    THR  10           HN       THR  10   8.336   3.070   0.942
   63    HA   THR  10           HA       THR  10  11.160   3.482   1.205
   64    HB   THR  10           HB       THR  10  11.640   2.531  -1.124
   65    HG1  THR  10          1HG       THR  10  10.012   0.505  -1.102
   66   HG21  THR  10          1HG2      THR  10  12.265   1.558   1.192
   67   HG22  THR  10          2HG2      THR  10  12.388   0.516  -0.224
   68   HG23  THR  10          3HG2      THR  10  11.004   0.373   0.859
   69    H    ALA  11           HN       ALA  11  11.670   5.399   0.346
   70    HA   ALA  11           HA       ALA  11   9.795   7.145  -0.704
   71    HB1  ALA  11          1HB       ALA  11  11.650   8.219   0.117
   72    HB2  ALA  11          2HB       ALA  11  12.776   7.106  -0.663
   73    HB3  ALA  11          3HB       ALA  11  11.944   8.332  -1.619
   74    H    GLU  12           HN       GLU  12  11.969   4.929  -2.368
   75    HA   GLU  12           HA       GLU  12  12.028   5.673  -4.926
   76    HB2  GLU  12          2HB       GLU  12  11.627   3.027  -3.650
   77    HB3  GLU  12          3HB       GLU  12  11.323   3.116  -5.379
   78    HG2  GLU  12          2HG       GLU  12  13.531   3.745  -5.849
   79    HG3  GLU  12          3HG       GLU  12  13.864   4.141  -4.163
   80    H    SER  13           HN       SER  13   9.532   3.263  -4.491
   81    HA   SER  13           HA       SER  13   7.333   4.976  -5.091
   82    HB2  SER  13          2HB       SER  13   8.590   4.793  -7.310
   83    HB3  SER  13          3HB       SER  13   8.102   3.098  -7.326
   84    HG   SER  13           HG       SER  13   6.282   3.773  -8.103
   85    H    LEU  14           HN       LEU  14   5.992   4.021  -3.691
   86    HA   LEU  14           HA       LEU  14   5.744   1.092  -3.749
   87    HB2  LEU  14          2HB       LEU  14   5.921   2.959  -1.630
   88    HB3  LEU  14          3HB       LEU  14   4.300   2.268  -1.589
   89    HG   LEU  14           HG       LEU  14   6.895   0.733  -1.465
   90   HD11  LEU  14          1HD1      LEU  14   6.271   0.253   0.818
   91   HD12  LEU  14          2HD1      LEU  14   4.783   1.182   0.638
   92   HD13  LEU  14          3HD1      LEU  14   6.345   1.998   0.576
   93   HD21  LEU  14          1HD2      LEU  14   5.230  -1.129  -0.831
   94   HD22  LEU  14          2HD2      LEU  14   5.429  -0.719  -2.535
   95   HD23  LEU  14          3HD2      LEU  14   4.030  -0.122  -1.641
   96    H    PHE  15           HN       PHE  15   3.744   0.112  -3.959
   97    HA   PHE  15           HA       PHE  15   1.676   1.808  -5.148
   98    HB2  PHE  15          2HB       PHE  15   2.138  -1.176  -5.196
   99    HB3  PHE  15          3HB       PHE  15   0.692  -0.418  -5.853
  100    HD1  PHE  15          1HD       PHE  15   4.404  -0.252  -6.096
  101    HD2  PHE  15          2HD       PHE  15   0.661   0.215  -8.068
  102    HE1  PHE  15          1HE       PHE  15   5.577   0.126  -8.224
  103    HE2  PHE  15          2HE       PHE  15   1.828   0.593 -10.200
  104    HZ   PHE  15           HZ       PHE  15   4.289   0.548 -10.281
  105    HA   PRO  16           HA       PRO  16  -0.521   1.171  -5.806
  106    HB2  PRO  16          2HB       PRO  16  -2.591   2.847  -5.282
  107    HB3  PRO  16          3HB       PRO  16  -2.750   1.086  -5.258
  108    HG2  PRO  16          2HG       PRO  16  -2.396   2.987  -2.972
  109    HG3  PRO  16          3HG       PRO  16  -3.476   1.588  -3.107
  110    HD2  PRO  16          2HD       PRO  16  -1.127   1.490  -1.766
  111    HD3  PRO  16          3HD       PRO  16  -1.799   0.085  -2.619
  112    H    CYS  17           HN       CYS  17  -0.698   3.739  -3.328
  113    HA   CYS  17           HA       CYS  17   1.392   5.266  -4.470
  114    HB2  CYS  17          2HB       CYS  17  -0.283   7.242  -4.996
  115    HB3  CYS  17          3HB       CYS  17   0.097   6.029  -6.214
  116    H    ARG  18           HN       ARG  18  -1.419   6.981  -3.390
  117    HA   ARG  18           HA       ARG  18  -0.537   6.997  -0.615
  118    HB2  ARG  18          2HB       ARG  18   0.069   9.196  -0.474
  119    HB3  ARG  18          3HB       ARG  18   0.563   8.879  -2.131
  120    HG2  ARG  18          2HG       ARG  18  -2.089  10.072  -1.356
  121    HG3  ARG  18          3HG       ARG  18  -0.670  11.009  -1.825
  122    HD2  ARG  18          2HD       ARG  18  -1.289   8.894  -3.720
  123    HD3  ARG  18          3HD       ARG  18  -2.623  10.027  -3.515
  124    HE   ARG  18           HE       ARG  18  -0.112  10.531  -4.796
  125   HH11  ARG  18          1HH1      ARG  18  -2.756  11.987  -3.062
  126   HH12  ARG  18          2HH1      ARG  18  -2.509  13.560  -3.747
  127   HH21  ARG  18          1HH2      ARG  18   0.224  12.596  -5.703
  128   HH22  ARG  18          2HH2      ARG  18  -0.813  13.905  -5.249
  129    H    VAL  19           HN       VAL  19  -2.840   8.010  -3.069
  130    HA   VAL  19           HA       VAL  19  -4.875   8.527  -1.035
  131    HB   VAL  19           HB       VAL  19  -6.285   9.193  -3.021
  132   HG11  VAL  19          1HG1      VAL  19  -4.451  11.174  -3.488
  133   HG12  VAL  19          2HG1      VAL  19  -5.591  11.131  -2.141
  134   HG13  VAL  19          3HG1      VAL  19  -3.942  10.545  -1.921
  135   HG21  VAL  19          1HG2      VAL  19  -4.116   9.715  -4.805
  136   HG22  VAL  19          2HG2      VAL  19  -4.158   7.992  -4.432
  137   HG23  VAL  19          3HG2      VAL  19  -5.587   8.787  -5.090
  138    H    CYS  20           HN       CYS  20  -4.088   6.283  -3.615
  139    HA   CYS  20           HA       CYS  20  -6.459   4.938  -3.966
  140    HB2  CYS  20          2HB       CYS  20  -3.590   4.122  -4.100
  141    HB3  CYS  20          3HB       CYS  20  -4.820   2.864  -4.183
  142    H    THR  21           HN       THR  21  -6.567   2.445  -3.225
  143    HA   THR  21           HA       THR  21  -7.394   2.499  -0.539
  144    HB   THR  21           HB       THR  21  -7.956   0.227  -0.761
  145    HG1  THR  21          1HG       THR  21  -6.971  -1.043  -2.505
  146   HG21  THR  21          1HG2      THR  21  -8.048   0.817  -3.666
  147   HG22  THR  21          2HG2      THR  21  -8.825   1.976  -2.588
  148   HG23  THR  21          3HG2      THR  21  -9.328   0.286  -2.577
  149    H    ARG  22           HN       ARG  22  -6.364  -0.120   0.256
  150    HA   ARG  22           HA       ARG  22  -4.293   0.623   1.923
  151    HB2  ARG  22          2HB       ARG  22  -5.333  -1.986   0.933
  152    HB3  ARG  22          3HB       ARG  22  -3.780  -1.986   1.758
  153    HG2  ARG  22          2HG       ARG  22  -5.501  -0.431   3.336
  154    HG3  ARG  22          3HG       ARG  22  -6.416  -1.862   2.858
  155    HD2  ARG  22          2HD       ARG  22  -5.210  -2.224   4.956
  156    HD3  ARG  22          3HD       ARG  22  -4.636  -3.298   3.682
  157    HE   ARG  22           HE       ARG  22  -2.589  -2.263   3.768
  158   HH11  ARG  22          1HH1      ARG  22  -4.928  -0.363   5.513
  159   HH12  ARG  22          2HH1      ARG  22  -3.747   0.709   6.189
  160   HH21  ARG  22          1HH2      ARG  22  -1.025  -0.857   4.652
  161   HH22  ARG  22          2HH2      ARG  22  -1.527   0.428   5.697
  162    H    VAL  23           HN       VAL  23  -2.143  -0.919   1.789
  163    HA   VAL  23           HA       VAL  23  -0.893  -0.243  -0.795
  164    HB   VAL  23           HB       VAL  23   0.236   1.170   0.624
  165   HG11  VAL  23          1HG1      VAL  23  -0.473  -0.820   2.689
  166   HG12  VAL  23          2HG1      VAL  23   1.011   0.098   2.959
  167   HG13  VAL  23          3HG1      VAL  23  -0.524   0.941   2.743
  168   HG21  VAL  23          1HG2      VAL  23   2.018  -1.065   1.362
  169   HG22  VAL  23          2HG2      VAL  23   1.656  -0.893  -0.356
  170   HG23  VAL  23          3HG2      VAL  23   2.379   0.449   0.532
  171    H    PHE  24           HN       PHE  24   0.291  -1.777  -1.817
  172    HA   PHE  24           HA       PHE  24   1.046  -4.216  -0.432
  173    HB2  PHE  24          2HB       PHE  24  -0.107  -5.150  -2.825
  174    HB3  PHE  24          3HB       PHE  24  -0.669  -5.439  -1.181
  175    HD1  PHE  24          1HD       PHE  24  -2.650  -4.456  -0.380
  176    HD2  PHE  24          2HD       PHE  24  -1.005  -3.200  -4.099
  177    HE1  PHE  24          1HE       PHE  24  -4.712  -3.202  -0.865
  178    HE2  PHE  24          2HE       PHE  24  -3.064  -1.944  -4.590
  179    HZ   PHE  24           HZ       PHE  24  -4.920  -1.943  -2.972
  180    H    HIS  25           HN       HIS  25   2.526  -5.538  -1.649
  181    HA   HIS  25           HA       HIS  25   4.201  -3.935  -3.392
  182    HB2  HIS  25          2HB       HIS  25   4.556  -6.679  -2.178
  183    HB3  HIS  25          3HB       HIS  25   5.738  -5.931  -3.248
  184    HD2  HIS  25          2HD       HIS  25   4.716  -3.048  -1.252
  185    HE1  HIS  25          1HE       HIS  25   7.603  -4.977   1.187
  186    HE2  HIS  25          2HE       HIS  25   6.224  -2.897   0.844
  187    H    ASP  26           HN       ASP  26   5.242  -5.165  -5.292
  188    HA   ASP  26           HA       ASP  26   3.101  -5.944  -7.056
  189    HB2  ASP  26          2HB       ASP  26   5.051  -4.495  -7.735
  190    HB3  ASP  26          3HB       ASP  26   6.066  -5.933  -7.642
  191    H    GLY  27           HN       GLY  27   5.597  -7.526  -5.225
  192    HA2  GLY  27          1HA       GLY  27   5.239 -10.045  -6.651
  193    HA3  GLY  27          2HA       GLY  27   6.386  -9.736  -5.357
  194    H    CYS  28           HN       CYS  28   4.315  -8.546  -3.630
  195    HA   CYS  28           HA       CYS  28   3.559 -10.866  -2.230
  196    HB2  CYS  28          2HB       CYS  28   2.831  -7.964  -2.025
  197    HB3  CYS  28          3HB       CYS  28   1.965  -9.152  -1.058
  198    H    LEU  29           HN       LEU  29   1.376  -8.474  -3.732
  199    HA   LEU  29           HA       LEU  29  -0.971  -9.853  -3.597
  200    HB2  LEU  29          2HB       LEU  29  -0.101  -8.259  -6.000
  201    HB3  LEU  29          3HB       LEU  29  -1.755  -8.565  -5.470
  202    HG   LEU  29           HG       LEU  29   0.241  -6.959  -3.881
  203   HD11  LEU  29          1HD1      LEU  29  -1.459  -5.107  -4.733
  204   HD12  LEU  29          2HD1      LEU  29  -1.559  -6.201  -6.112
  205   HD13  LEU  29          3HD1      LEU  29  -0.001  -5.529  -5.630
  206   HD21  LEU  29          1HD2      LEU  29  -2.492  -7.896  -3.456
  207   HD22  LEU  29          2HD2      LEU  29  -2.292  -6.160  -3.216
  208   HD23  LEU  29          3HD2      LEU  29  -1.303  -7.297  -2.299
  209    H    ARG  30           HN       ARG  30   1.539 -10.192  -6.071
  210    HA   ARG  30           HA       ARG  30   0.150 -12.021  -7.707
  211    HB2  ARG  30          2HB       ARG  30   2.783 -10.861  -7.583
  212    HB3  ARG  30          3HB       ARG  30   2.904 -12.583  -7.918
  213    HG2  ARG  30          2HG       ARG  30   1.525 -12.372  -9.860
  214    HG3  ARG  30          3HG       ARG  30   1.158 -10.689  -9.472
  215    HD2  ARG  30          2HD       ARG  30   3.357  -9.992  -9.953
  216    HD3  ARG  30          3HD       ARG  30   3.966 -11.647  -9.943
  217    HE   ARG  30           HE       ARG  30   2.690 -10.279 -12.128
  218   HH11  ARG  30          1HH1      ARG  30   3.464 -13.374 -10.736
  219   HH12  ARG  30          2HH1      ARG  30   3.371 -14.222 -12.244
  220   HH21  ARG  30          1HH2      ARG  30   2.564 -11.384 -14.120
  221   HH22  ARG  30          2HH2      ARG  30   2.860 -13.089 -14.168
  222    H    ARG  31           HN       ARG  31   2.698 -12.590  -5.276
  223    HA   ARG  31           HA       ARG  31   2.448 -15.422  -5.384
  224    HB2  ARG  31          2HB       ARG  31   4.051 -13.466  -3.948
  225    HB3  ARG  31          3HB       ARG  31   3.575 -14.808  -2.915
  226    HG2  ARG  31          2HG       ARG  31   4.730 -15.348  -5.615
  227    HG3  ARG  31          3HG       ARG  31   5.787 -14.932  -4.263
  228    HD2  ARG  31          2HD       ARG  31   4.121 -16.820  -3.171
  229    HD3  ARG  31          3HD       ARG  31   4.329 -17.400  -4.822
  230    HE   ARG  31           HE       ARG  31   6.368 -18.131  -4.142
  231   HH11  ARG  31          1HH1      ARG  31   5.612 -15.228  -2.375
  232   HH12  ARG  31          2HH1      ARG  31   7.111 -15.210  -1.507
  233   HH21  ARG  31          1HH2      ARG  31   8.345 -18.118  -3.005
  234   HH22  ARG  31          2HH2      ARG  31   8.666 -16.854  -1.867
  235    H    MET  32           HN       MET  32   0.399 -13.126  -4.169
  236    HA   MET  32           HA       MET  32  -0.633 -14.929  -2.082
  237    HB2  MET  32          2HB       MET  32  -0.779 -11.945  -2.417
  238    HB3  MET  32          3HB       MET  32  -1.914 -12.798  -1.380
  239    HG2  MET  32          2HG       MET  32   0.446 -13.801  -0.505
  240    HG3  MET  32          3HG       MET  32   0.916 -12.167  -0.968
  241    HE1  MET  32          1HE       MET  32  -0.100 -14.436   1.351
  242    HE2  MET  32          2HE       MET  32  -0.187 -13.454   2.814
  243    HE3  MET  32          3HE       MET  32  -1.669 -13.961   2.002
  244    H    GLY  33           HN       GLY  33  -1.118 -14.158  -5.220
  245    HA2  GLY  33          1HA       GLY  33  -2.863 -14.467  -6.677
  246    HA3  GLY  33          2HA       GLY  33  -3.616 -15.420  -5.408
  247    H    TYR  34           HN       TYR  34  -2.832 -12.168  -4.637
  248    HA   TYR  34           HA       TYR  34  -5.558 -11.519  -4.140
  249    HB2  TYR  34          2HB       TYR  34  -2.939 -10.162  -3.846
  250    HB3  TYR  34          3HB       TYR  34  -4.348  -9.117  -3.984
  251    HD1  TYR  34          1HD       TYR  34  -6.408 -10.573  -2.534
  252    HD2  TYR  34          2HD       TYR  34  -2.277 -10.114  -1.625
  253    HE1  TYR  34          1HE       TYR  34  -6.900 -10.920  -0.150
  254    HE2  TYR  34          2HE       TYR  34  -2.758 -10.461   0.762
  255    HH   TYR  34           HH       TYR  34  -4.517 -11.549   2.146
  256    H    ILE  35           HN       ILE  35  -3.417 -11.084  -6.826
  257    HA   ILE  35           HA       ILE  35  -5.574 -10.176  -8.487
  258    HB   ILE  35           HB       ILE  35  -4.441  -8.106  -9.255
  259   HG12  ILE  35          2HG1      ILE  35  -2.889  -7.414  -7.033
  260   HG13  ILE  35          3HG1      ILE  35  -2.412  -9.064  -7.417
  261   HG21  ILE  35          1HG2      ILE  35  -6.286  -8.186  -7.526
  262   HG22  ILE  35          2HG2      ILE  35  -5.029  -7.958  -6.311
  263   HG23  ILE  35          3HG2      ILE  35  -5.298  -6.725  -7.542
  264   HD11  ILE  35          1HD1      ILE  35  -1.026  -8.145  -8.889
  265   HD12  ILE  35          2HD1      ILE  35  -2.456  -7.840  -9.875
  266   HD13  ILE  35          3HD1      ILE  35  -1.839  -6.582  -8.805
  267    H    GLN  36           HN       GLN  36  -4.572  -9.522 -10.745
  268    HA   GLN  36           HA       GLN  36  -2.144 -10.988 -11.363
  269    HB2  GLN  36          2HB       GLN  36  -4.734 -12.144 -11.742
  270    HB3  GLN  36          3HB       GLN  36  -4.016 -11.836 -13.317
  271    HG2  GLN  36          2HG       GLN  36  -2.601 -13.309 -11.112
  272    HG3  GLN  36          3HG       GLN  36  -3.574 -14.101 -12.351
  273   HE21  GLN  36          1HE2      GLN  36  -1.295 -15.093 -12.491
  274   HE22  GLN  36          2HE2      GLN  36  -0.250 -14.383 -13.670
  275    H    GLY  37           HN       GLY  37  -1.004  -9.843 -12.778
  276    HA2  GLY  37          1HA       GLY  37  -0.762  -8.782 -14.911
  277    HA3  GLY  37          2HA       GLY  37  -2.436  -8.260 -14.802
  278    H    ASP  38           HN       ASP  38  -2.769  -6.205 -14.291
  279    HA   ASP  38           HA       ASP  38  -2.411  -4.063 -13.613
  280    HB2  ASP  38          2HB       ASP  38  -0.922  -5.632 -11.530
  281    HB3  ASP  38          3HB       ASP  38  -0.872  -3.871 -11.518
  282    H    SER  39           HN       SER  39  -0.515  -5.480 -15.509
  283    HA   SER  39           HA       SER  39   1.460  -5.109 -16.597
  284    HB2  SER  39          2HB       SER  39   1.371  -3.077 -17.565
  285    HB3  SER  39          3HB       SER  39  -0.029  -2.777 -16.535
  286    HG   SER  39           HG       SER  39   2.025  -1.329 -16.532
  287    H    ALA  40           HN       ALA  40   3.534  -3.377 -16.316
  288    HA   ALA  40           HA       ALA  40   4.438  -3.387 -13.557
  289    HB1  ALA  40          1HB       ALA  40   5.326  -5.367 -15.531
  290    HB2  ALA  40          2HB       ALA  40   6.628  -4.543 -14.672
  291    HB3  ALA  40          3HB       ALA  40   5.386  -5.411 -13.769
  292    H    ALA  41           HN       ALA  41   6.321  -2.117 -13.210
  293    HA   ALA  41           HA       ALA  41   7.324  -0.595 -15.500
  294    HB1  ALA  41          1HB       ALA  41   7.109   1.514 -14.115
  295    HB2  ALA  41          2HB       ALA  41   5.610   0.849 -14.764
  296    HB3  ALA  41          3HB       ALA  41   6.022   0.602 -13.067
  297    H    GLU  42           HN       GLU  42   7.813   0.538 -12.270
  298    HA   GLU  42           HA       GLU  42   9.717   0.798 -11.041
  299    HB2  GLU  42          2HB       GLU  42  10.639  -1.938 -11.746
  300    HB3  GLU  42          3HB       GLU  42  10.532  -1.158 -10.174
  301    HG2  GLU  42          2HG       GLU  42   7.956  -1.343 -10.600
  302    HG3  GLU  42          3HG       GLU  42   8.448  -2.621 -11.710
  303    H    VAL  43           HN       VAL  43   9.864   1.443 -13.901
  304    HA   VAL  43           HA       VAL  43  12.707   0.908 -14.438
  305    HB   VAL  43           HB       VAL  43  10.578   0.609 -16.129
  306   HG11  VAL  43          1HG1      VAL  43  10.304   3.087 -16.171
  307   HG12  VAL  43          2HG1      VAL  43  11.902   3.202 -16.912
  308   HG13  VAL  43          3HG1      VAL  43  10.595   2.367 -17.754
  309   HG21  VAL  43          1HG2      VAL  43  12.350  -0.454 -16.990
  310   HG22  VAL  43          2HG2      VAL  43  12.656   1.049 -17.861
  311   HG23  VAL  43          3HG2      VAL  43  13.489   0.726 -16.340
  312    H    THR  44           HN       THR  44  10.423   3.369 -13.674
  313    HA   THR  44           HA       THR  44  12.445   5.295 -13.184
  314    HB   THR  44           HB       THR  44  11.989   5.275 -15.802
  315    HG1  THR  44          1HG       THR  44  13.421   6.742 -15.057
  316   HG21  THR  44          1HG2      THR  44  10.240   6.581 -16.558
  317   HG22  THR  44          2HG2      THR  44  10.060   7.418 -15.016
  318   HG23  THR  44          3HG2      THR  44   9.490   5.759 -15.190
  319    H    GLU  45           HN       GLU  45  11.436   7.488 -12.662
  320    HA   GLU  45           HA       GLU  45   9.834   8.786 -11.657
  321    HB2  GLU  45          2HB       GLU  45   8.291   7.151 -13.210
  322    HB3  GLU  45          3HB       GLU  45   7.701   6.762 -11.600
  323    HG2  GLU  45          2HG       GLU  45   7.976   9.618 -12.007
  324    HG3  GLU  45          3HG       GLU  45   6.896   8.870 -13.182
  325    H    MET  46           HN       MET  46   8.576   8.836  -9.591
  326    HA   MET  46           HA       MET  46   9.484   6.722  -7.752
  327    HB2  MET  46          2HB       MET  46   9.192   9.625  -6.992
  328    HB3  MET  46          3HB       MET  46   9.951   8.339  -6.066
  329    HG2  MET  46          2HG       MET  46  11.708   8.180  -7.788
  330    HG3  MET  46          3HG       MET  46  10.966   9.540  -8.629
  331    HE1  MET  46          1HE       MET  46  14.158   9.306  -5.965
  332    HE2  MET  46          2HE       MET  46  12.956   9.211  -4.678
  333    HE3  MET  46          3HE       MET  46  12.891   8.080  -6.031
  334    H    ALA  47           HN       ALA  47   8.055   8.634  -5.723
  335    HA   ALA  47           HA       ALA  47   5.548   7.200  -5.807
  336    HB1  ALA  47          1HB       ALA  47   5.123   8.140  -3.643
  337    HB2  ALA  47          2HB       ALA  47   6.801   7.596  -3.694
  338    HB3  ALA  47          3HB       ALA  47   6.425   9.313  -3.846
  339    H    HIS  48           HN       HIS  48   6.450  10.652  -5.661
  340    HA   HIS  48           HA       HIS  48   4.401  11.342  -7.558
  341    HB2  HIS  48          2HB       HIS  48   4.060  12.846  -5.030
  342    HB3  HIS  48          3HB       HIS  48   2.858  12.350  -6.218
  343    HD1  HIS  48          1HD       HIS  48   1.801  10.001  -5.926
  344    HD2  HIS  48          2HD       HIS  48   4.483  11.053  -2.934
  345    HE1  HIS  48          1HE       HIS  48   1.443   8.328  -4.084
  346    H    THR  49           HN       THR  49   6.246  12.127  -8.664
  347    HA   THR  49           HA       THR  49   7.284  14.663  -7.576
  348    HB   THR  49           HB       THR  49   9.324  14.160  -9.071
  349    HG1  THR  49          1HG       THR  49   8.063  12.191  -9.896
  350   HG21  THR  49          1HG2      THR  49  10.430  12.930  -7.286
  351   HG22  THR  49          2HG2      THR  49   8.867  12.463  -6.614
  352   HG23  THR  49          3HG2      THR  49   9.361  14.155  -6.604
  353    H    GLU  50           HN       GLU  50   5.632  13.108 -10.085
  354    HA   GLU  50           HA       GLU  50   5.548  15.584 -11.610
  355    HB2  GLU  50          2HB       GLU  50   7.081  13.304 -12.448
  356    HB3  GLU  50          3HB       GLU  50   5.741  13.546 -13.561
  357    HG2  GLU  50          2HG       GLU  50   6.438  15.882 -13.863
  358    HG3  GLU  50          3HG       GLU  50   7.808  15.594 -12.793
  359    H    THR  51           HN       THR  51   4.513  12.173 -11.673
  360    HA   THR  51           HA       THR  51   1.740  13.092 -11.937
  361    HB   THR  51           HB       THR  51   1.854  10.739 -13.449
  362    HG1  THR  51          1HG       THR  51   3.728  12.520 -14.576
  363   HG21  THR  51          1HG2      THR  51   1.308  13.606 -13.891
  364   HG22  THR  51          2HG2      THR  51   0.326  12.192 -14.274
  365   HG23  THR  51          3HG2      THR  51   1.655  12.657 -15.335
  366    H    GLY  52           HN       GLY  52   0.385  10.789 -12.022
  367    HA2  GLY  52          1HA       GLY  52   1.094   9.550  -9.453
  368    HA3  GLY  52          2HA       GLY  52  -0.505   9.556 -10.182
  369    H    TRP  53           HN       TRP  53   0.860   7.273  -9.146
  370    HA   TRP  53           HA       TRP  53   1.646   5.770 -11.527
  371    HB2  TRP  53          2HB       TRP  53   2.714   5.773  -9.040
  372    HB3  TRP  53          3HB       TRP  53   1.595   4.420  -8.894
  373    HD1  TRP  53          1HD       TRP  53   1.883   2.577 -11.098
  374    HE1  TRP  53          1HE       TRP  53   4.101   1.624 -11.992
  375    HE3  TRP  53          3HE       TRP  53   5.086   6.122  -9.278
  376    HZ2  TRP  53          2HZ       TRP  53   6.843   2.286 -11.933
  377    HZ3  TRP  53          3HZ       TRP  53   7.490   5.889  -9.741
  378    HH2  TRP  53          2HH       TRP  53   8.349   4.009 -11.040
  379    H    SER  54           HN       SER  54   0.657   3.796 -12.104
  380    HA   SER  54           HA       SER  54  -2.189   3.763 -11.641
  381    HB2  SER  54          2HB       SER  54  -1.415   1.443 -13.064
  382    HB3  SER  54          3HB       SER  54  -2.144   2.913 -13.712
  383    HG   SER  54           HG       SER  54   0.492   2.065 -13.753
  384    H    CYS  55           HN       CYS  55  -3.387   2.028 -10.782
  385    HA   CYS  55           HA       CYS  55  -1.981  -0.117  -9.424
  386    HB2  CYS  55          2HB       CYS  55  -3.851   1.541  -7.760
  387    HB3  CYS  55          3HB       CYS  55  -2.616   0.401  -7.234
  388    H    HIS  56           HN       HIS  56  -4.165  -0.835  -7.743
  389    HA   HIS  56           HA       HIS  56  -5.778  -2.229  -9.640
  390    HB2  HIS  56          2HB       HIS  56  -5.132  -3.161  -7.424
  391    HB3  HIS  56          3HB       HIS  56  -6.178  -1.973  -6.652
  392    HD1  HIS  56          1HD       HIS  56  -6.439  -5.208  -6.687
  393    HD2  HIS  56          2HD       HIS  56  -8.752  -2.446  -8.758
  394    HE1  HIS  56          1HE       HIS  56  -8.614  -6.376  -7.165
  395    H    TYR  57           HN       TYR  57  -6.863  -0.150  -6.954
  396    HA   TYR  57           HA       TYR  57  -9.320   0.438  -8.342
  397    HB2  TYR  57          2HB       TYR  57  -8.238   1.504  -5.726
  398    HB3  TYR  57          3HB       TYR  57  -9.870   1.757  -6.332
  399    HD1  TYR  57          1HD       TYR  57  -7.494  -0.920  -5.313
  400    HD2  TYR  57          2HD       TYR  57 -11.559   0.220  -5.839
  401    HE1  TYR  57          1HE       TYR  57  -8.213  -3.005  -4.225
  402    HE2  TYR  57          2HE       TYR  57 -12.290  -1.862  -4.752
  403    HH   TYR  57           HH       TYR  57 -10.525  -3.672  -2.872
  404    H    CYS  58           HN       CYS  58  -6.216   1.746  -8.305
  405    HA   CYS  58           HA       CYS  58  -6.290   4.414  -8.339
  406    HB2  CYS  58          2HB       CYS  58  -4.573   2.545  -9.387
  407    HB3  CYS  58          3HB       CYS  58  -5.081   3.425 -10.825
  408    H    ASP  59           HN       ASP  59  -6.951   2.645 -11.366
  409    HA   ASP  59           HA       ASP  59  -8.220   4.923 -12.546
  410    HB2  ASP  59          2HB       ASP  59  -7.432   2.226 -13.389
  411    HB3  ASP  59          3HB       ASP  59  -8.922   2.796 -14.137
  412    H    ASN  60           HN       ASN  60 -10.292   5.501 -12.466
  413    HA   ASN  60           HA       ASN  60 -12.209   3.604 -11.289
  414    HB2  ASN  60          2HB       ASN  60 -12.785   5.287  -9.937
  415    HB3  ASN  60          3HB       ASN  60 -11.644   6.355 -10.749
  416   HD21  ASN  60          1HD2      ASN  60 -14.771   6.010  -9.901
  417   HD22  ASN  60          2HD2      ASN  60 -15.519   7.013 -11.092
  Start of MODEL   14
    1    H1   GLU   1           HN       GLU   1   1.966   4.559   5.623
    2    HA   GLU   1           HA       GLU   1   0.421   2.526   4.371
    3    HB2  GLU   1          2HB       GLU   1   2.263   4.671   3.497
    4    HB3  GLU   1          3HB       GLU   1   2.098   3.305   2.403
    5    HG2  GLU   1          2HG       GLU   1   0.367   4.451   1.586
    6    HG3  GLU   1          3HG       GLU   1  -0.497   3.812   2.984
    7    H    MET   2           HN       MET   2   1.432   0.786   5.760
    8    HA   MET   2           HA       MET   2   3.954  -0.187   4.603
    9    HB2  MET   2          2HB       MET   2   2.822  -1.549   6.969
   10    HB3  MET   2          3HB       MET   2   4.487  -1.110   6.610
   11    HG2  MET   2          2HG       MET   2   3.395   1.332   6.985
   12    HG3  MET   2          3HG       MET   2   2.415   0.358   8.080
   13    HE1  MET   2          1HE       MET   2   6.530  -0.527   7.622
   14    HE2  MET   2          2HE       MET   2   5.840   0.826   6.725
   15    HE3  MET   2          3HE       MET   2   6.876   1.130   8.120
   16    H    CYS   3           HN       CYS   3   3.884  -1.828   3.224
   17    HA   CYS   3           HA       CYS   3   1.677  -2.996   2.164
   18    HB2  CYS   3          2HB       CYS   3   3.958  -3.276   1.268
   19    HB3  CYS   3          3HB       CYS   3   4.337  -4.372   2.593
   20    H    ASP   4           HN       ASP   4   0.079  -4.162   2.977
   21    HA   ASP   4           HA       ASP   4   0.060  -5.235   5.568
   22    HB2  ASP   4          2HB       ASP   4  -1.870  -4.672   3.802
   23    HB3  ASP   4          3HB       ASP   4  -1.763  -6.409   3.536
   24    H    VAL   5           HN       VAL   5   1.596  -6.371   2.826
   25    HA   VAL   5           HA       VAL   5   1.535  -9.159   3.765
   26    HB   VAL   5           HB       VAL   5   2.431  -8.081   1.088
   27   HG11  VAL   5          1HG1      VAL   5   3.660 -10.008   1.278
   28   HG12  VAL   5          2HG1      VAL   5   2.472 -10.792   2.321
   29   HG13  VAL   5          3HG1      VAL   5   2.165 -10.645   0.591
   30   HG21  VAL   5          1HG2      VAL   5   0.408  -9.194   0.226
   31   HG22  VAL   5          2HG2      VAL   5  -0.070  -9.571   1.882
   32   HG23  VAL   5          3HG2      VAL   5   0.030  -7.891   1.354
   33    H    CYS   6           HN       CYS   6   3.334  -6.457   4.117
   34    HA   CYS   6           HA       CYS   6   5.704  -7.994   4.807
   35    HB2  CYS   6          2HB       CYS   6   5.866  -5.611   2.948
   36    HB3  CYS   6          3HB       CYS   6   7.229  -6.529   3.582
   37    H    GLU   7           HN       GLU   7   4.559  -4.630   4.463
   38    HA   GLU   7           HA       GLU   7   4.236  -3.031   6.087
   39    HB2  GLU   7          2HB       GLU   7   5.612  -4.734   8.137
   40    HB3  GLU   7          3HB       GLU   7   4.364  -3.518   8.368
   41    HG2  GLU   7          2HG       GLU   7   3.198  -5.462   6.747
   42    HG3  GLU   7          3HG       GLU   7   4.112  -6.353   7.963
   43    H    VAL   8           HN       VAL   8   6.053  -2.402   4.476
   44    HA   VAL   8           HA       VAL   8   8.065  -1.060   5.961
   45    HB   VAL   8           HB       VAL   8   9.780  -2.408   4.241
   46   HG11  VAL   8          1HG1      VAL   8  10.544  -1.688   6.334
   47   HG12  VAL   8          2HG1      VAL   8   9.275  -2.559   7.197
   48   HG13  VAL   8          3HG1      VAL   8  10.593  -3.447   6.431
   49   HG21  VAL   8          1HG2      VAL   8   9.432  -4.683   4.373
   50   HG22  VAL   8          2HG2      VAL   8   8.382  -4.549   5.784
   51   HG23  VAL   8          3HG2      VAL   8   7.781  -4.087   4.191
   52    H    TRP   9           HN       TRP   9   7.498   0.782   4.899
   53    HA   TRP   9           HA       TRP   9   7.111   0.927   2.084
   54    HB2  TRP   9          2HB       TRP   9   6.047   2.743   2.876
   55    HB3  TRP   9          3HB       TRP   9   6.994   2.746   4.361
   56    HD1  TRP   9          1HD       TRP   9   9.287   4.178   4.348
   57    HE1  TRP   9          1HE       TRP   9  10.023   6.176   2.901
   58    HE3  TRP   9          3HE       TRP   9   5.875   3.743   0.566
   59    HZ2  TRP   9          2HZ       TRP   9   9.259   7.405   0.477
   60    HZ3  TRP   9          3HZ       TRP   9   5.945   5.370  -1.279
   61    HH2  TRP   9          2HH       TRP   9   7.602   7.162  -1.321
   62    H    THR  10           HN       THR  10   8.451   1.678   0.478
   63    HA   THR  10           HA       THR  10  11.307   1.752   1.164
   64    HB   THR  10           HB       THR  10  11.377   1.614  -1.507
   65    HG1  THR  10          1HG       THR  10   9.594   0.802  -2.362
   66   HG21  THR  10          1HG2      THR  10  11.871  -0.675  -1.288
   67   HG22  THR  10          2HG2      THR  10  10.755  -0.873   0.064
   68   HG23  THR  10          3HG2      THR  10  12.262   0.015   0.287
   69    H    ALA  11           HN       ALA  11  10.042   3.013  -1.825
   70    HA   ALA  11           HA       ALA  11   9.647   5.666  -1.342
   71    HB1  ALA  11          1HB       ALA  11  12.493   4.956  -1.123
   72    HB2  ALA  11          2HB       ALA  11  12.137   6.360  -2.130
   73    HB3  ALA  11          3HB       ALA  11  11.606   6.323  -0.449
   74    H    GLU  12           HN       GLU  12  11.524   3.500  -3.424
   75    HA   GLU  12           HA       GLU  12  11.577   4.843  -5.789
   76    HB2  GLU  12          2HB       GLU  12  10.718   1.983  -5.871
   77    HB3  GLU  12          3HB       GLU  12  11.925   2.815  -6.842
   78    HG2  GLU  12          2HG       GLU  12  13.265   2.980  -4.658
   79    HG3  GLU  12          3HG       GLU  12  12.166   1.738  -4.062
   80    H    SER  13           HN       SER  13   8.824   3.091  -4.428
   81    HA   SER  13           HA       SER  13   6.795   4.646  -5.274
   82    HB2  SER  13          2HB       SER  13   7.941   3.174  -7.552
   83    HB3  SER  13          3HB       SER  13   6.191   3.031  -7.398
   84    HG   SER  13           HG       SER  13   7.481   5.536  -7.244
   85    H    LEU  14           HN       LEU  14   6.050   3.696  -3.350
   86    HA   LEU  14           HA       LEU  14   5.477   0.863  -3.275
   87    HB2  LEU  14          2HB       LEU  14   6.036   2.719  -1.361
   88    HB3  LEU  14          3HB       LEU  14   4.284   2.581  -1.218
   89    HG   LEU  14           HG       LEU  14   6.412   0.637  -0.530
   90   HD11  LEU  14          1HD1      LEU  14   4.842   0.138   1.286
   91   HD12  LEU  14          2HD1      LEU  14   3.681   1.265   0.583
   92   HD13  LEU  14          3HD1      LEU  14   5.225   1.857   1.198
   93   HD21  LEU  14          1HD2      LEU  14   5.446  -0.775  -2.085
   94   HD22  LEU  14          2HD2      LEU  14   3.835  -0.095  -1.858
   95   HD23  LEU  14          3HD2      LEU  14   4.531  -1.145  -0.623
   96    H    PHE  15           HN       PHE  15   3.597  -0.086  -3.751
   97    HA   PHE  15           HA       PHE  15   1.451   1.525  -4.820
   98    HB2  PHE  15          2HB       PHE  15   2.073  -1.399  -4.717
   99    HB3  PHE  15          3HB       PHE  15   0.418  -0.892  -5.038
  100    HD1  PHE  15          1HD       PHE  15   0.138  -1.513  -7.271
  101    HD2  PHE  15          2HD       PHE  15   3.542   0.774  -6.131
  102    HE1  PHE  15          1HE       PHE  15   0.703  -1.178  -9.642
  103    HE2  PHE  15          2HE       PHE  15   4.112   1.113  -8.500
  104    HZ   PHE  15           HZ       PHE  15   2.691   0.138 -10.260
  105    HA   PRO  16           HA       PRO  16  -0.781   0.874  -5.327
  106    HB2  PRO  16          2HB       PRO  16  -2.798   2.642  -4.901
  107    HB3  PRO  16          3HB       PRO  16  -2.989   0.897  -4.690
  108    HG2  PRO  16          2HG       PRO  16  -2.508   3.014  -2.628
  109    HG3  PRO  16          3HG       PRO  16  -3.619   1.633  -2.576
  110    HD2  PRO  16          2HD       PRO  16  -1.221   1.621  -1.321
  111    HD3  PRO  16          3HD       PRO  16  -1.952   0.151  -1.999
  112    H    CYS  17           HN       CYS  17  -1.380   3.034  -6.575
  113    HA   CYS  17           HA       CYS  17   0.766   4.541  -7.028
  114    HB2  CYS  17          2HB       CYS  17  -0.771   6.448  -7.633
  115    HB3  CYS  17          3HB       CYS  17  -1.188   4.897  -8.353
  116    H    ARG  18           HN       ARG  18  -1.654   5.398  -4.560
  117    HA   ARG  18           HA       ARG  18  -0.072   6.115  -2.506
  118    HB2  ARG  18          2HB       ARG  18   1.236   7.769  -3.305
  119    HB3  ARG  18          3HB       ARG  18   0.179   8.065  -4.679
  120    HG2  ARG  18          2HG       ARG  18   0.415   9.997  -3.144
  121    HG3  ARG  18          3HG       ARG  18  -1.251   9.458  -3.366
  122    HD2  ARG  18          2HD       ARG  18  -1.480   9.007  -1.195
  123    HD3  ARG  18          3HD       ARG  18   0.028   8.096  -1.156
  124    HE   ARG  18           HE       ARG  18   1.000   9.903  -0.175
  125   HH11  ARG  18          1HH1      ARG  18  -1.783  10.993  -1.960
  126   HH12  ARG  18          2HH1      ARG  18  -1.631  12.640  -1.444
  127   HH21  ARG  18          1HH2      ARG  18   1.210  12.068   0.511
  128   HH22  ARG  18          2HH2      ARG  18   0.072  13.251  -0.040
  129    H    VAL  19           HN       VAL  19  -2.448   8.012  -4.378
  130    HA   VAL  19           HA       VAL  19  -3.922   8.944  -2.206
  131    HB   VAL  19           HB       VAL  19  -4.540  10.066  -4.088
  132   HG11  VAL  19          1HG1      VAL  19  -5.195   8.486  -6.191
  133   HG12  VAL  19          2HG1      VAL  19  -3.593   9.173  -5.921
  134   HG13  VAL  19          3HG1      VAL  19  -3.940   7.517  -5.418
  135   HG21  VAL  19          1HG2      VAL  19  -6.546   8.795  -2.951
  136   HG22  VAL  19          2HG2      VAL  19  -6.789   9.759  -4.407
  137   HG23  VAL  19          3HG2      VAL  19  -6.643   8.005  -4.525
  138    H    CYS  20           HN       CYS  20  -4.686   6.183  -4.334
  139    HA   CYS  20           HA       CYS  20  -6.949   5.253  -3.097
  140    HB2  CYS  20          2HB       CYS  20  -4.751   3.482  -4.181
  141    HB3  CYS  20          3HB       CYS  20  -6.460   3.084  -4.045
  142    H    THR  21           HN       THR  21  -7.449   4.140  -1.289
  143    HA   THR  21           HA       THR  21  -5.670   4.138   0.893
  144    HB   THR  21           HB       THR  21  -7.410   2.653   1.989
  145    HG1  THR  21          1HG       THR  21  -9.346   3.135   0.190
  146   HG21  THR  21          1HG2      THR  21  -8.040   5.323   0.779
  147   HG22  THR  21          2HG2      THR  21  -7.651   4.924   2.452
  148   HG23  THR  21          3HG2      THR  21  -9.223   4.487   1.784
  149    H    ARG  22           HN       ARG  22  -5.520   1.955   2.237
  150    HA   ARG  22           HA       ARG  22  -4.483  -0.055   2.477
  151    HB2  ARG  22          2HB       ARG  22  -5.614  -0.485  -0.291
  152    HB3  ARG  22          3HB       ARG  22  -4.819  -1.741   0.649
  153    HG2  ARG  22          2HG       ARG  22  -7.045  -0.305   1.961
  154    HG3  ARG  22          3HG       ARG  22  -7.460  -1.387   0.630
  155    HD2  ARG  22          2HD       ARG  22  -5.762  -2.965   1.985
  156    HD3  ARG  22          3HD       ARG  22  -6.392  -1.996   3.317
  157    HE   ARG  22           HE       ARG  22  -8.483  -2.990   1.660
  158   HH11  ARG  22          1HH1      ARG  22  -6.265  -3.885   4.189
  159   HH12  ARG  22          2HH1      ARG  22  -7.282  -5.140   4.816
  160   HH21  ARG  22          1HH2      ARG  22  -9.831  -4.639   2.477
  161   HH22  ARG  22          2HH2      ARG  22  -9.310  -5.568   3.840
  162    H    VAL  23           HN       VAL  23  -2.566  -1.230   1.891
  163    HA   VAL  23           HA       VAL  23  -0.934  -0.037  -0.230
  164    HB   VAL  23           HB       VAL  23   1.022   0.110   1.246
  165   HG11  VAL  23          1HG1      VAL  23  -1.135   1.855   1.126
  166   HG12  VAL  23          2HG1      VAL  23  -0.729   1.771   2.841
  167   HG13  VAL  23          3HG1      VAL  23   0.502   2.233   1.664
  168   HG21  VAL  23          1HG2      VAL  23  -0.948  -0.739   3.356
  169   HG22  VAL  23          2HG2      VAL  23   0.580  -1.504   2.918
  170   HG23  VAL  23          3HG2      VAL  23   0.578   0.057   3.739
  171    H    PHE  24           HN       PHE  24   0.084  -1.534  -1.394
  172    HA   PHE  24           HA       PHE  24   0.909  -4.043  -0.171
  173    HB2  PHE  24          2HB       PHE  24  -0.227  -4.845  -2.612
  174    HB3  PHE  24          3HB       PHE  24  -0.802  -5.226  -0.992
  175    HD1  PHE  24          1HD       PHE  24  -0.989  -2.527  -3.553
  176    HD2  PHE  24          2HD       PHE  24  -2.939  -4.612  -0.396
  177    HE1  PHE  24          1HE       PHE  24  -3.054  -1.263  -3.996
  178    HE2  PHE  24          2HE       PHE  24  -5.006  -3.351  -0.834
  179    HZ   PHE  24           HZ       PHE  24  -5.065  -1.675  -2.638
  180    H    HIS  25           HN       HIS  25   2.077  -5.428  -1.887
  181    HA   HIS  25           HA       HIS  25   3.838  -3.627  -3.392
  182    HB2  HIS  25          2HB       HIS  25   4.232  -6.427  -2.335
  183    HB3  HIS  25          3HB       HIS  25   5.368  -5.651  -3.435
  184    HD2  HIS  25          2HD       HIS  25   4.144  -3.078  -0.956
  185    HE1  HIS  25          1HE       HIS  25   7.708  -4.692   0.686
  186    HE2  HIS  25          2HE       HIS  25   5.947  -2.904   0.891
  187    H    ASP  26           HN       ASP  26   4.785  -4.608  -5.427
  188    HA   ASP  26           HA       ASP  26   2.618  -5.321  -7.169
  189    HB2  ASP  26          2HB       ASP  26   4.539  -5.441  -8.882
  190    HB3  ASP  26          3HB       ASP  26   4.186  -3.878  -8.153
  191    H    GLY  27           HN       GLY  27   5.246  -6.998  -5.595
  192    HA2  GLY  27          1HA       GLY  27   4.780  -9.422  -7.155
  193    HA3  GLY  27          2HA       GLY  27   6.039  -9.184  -5.951
  194    H    CYS  28           HN       CYS  28   4.190  -8.154  -3.938
  195    HA   CYS  28           HA       CYS  28   3.525 -10.589  -2.682
  196    HB2  CYS  28          2HB       CYS  28   2.713  -7.739  -2.098
  197    HB3  CYS  28          3HB       CYS  28   2.279  -9.096  -1.063
  198    H    LEU  29           HN       LEU  29   1.569  -8.205  -4.418
  199    HA   LEU  29           HA       LEU  29  -0.932  -9.418  -3.913
  200    HB2  LEU  29          2HB       LEU  29  -0.060  -7.646  -6.190
  201    HB3  LEU  29          3HB       LEU  29  -1.731  -8.060  -5.812
  202    HG   LEU  29           HG       LEU  29   0.057  -6.602  -3.879
  203   HD11  LEU  29          1HD1      LEU  29  -1.747  -4.774  -4.900
  204   HD12  LEU  29          2HD1      LEU  29  -1.163  -5.635  -6.324
  205   HD13  LEU  29          3HD1      LEU  29  -0.018  -4.844  -5.240
  206   HD21  LEU  29          1HD2      LEU  29  -2.420  -5.816  -3.306
  207   HD22  LEU  29          2HD2      LEU  29  -1.708  -7.275  -2.618
  208   HD23  LEU  29          3HD2      LEU  29  -2.797  -7.393  -4.001
  209    H    ARG  30           HN       ARG  30   1.633 -10.184  -6.068
  210    HA   ARG  30           HA       ARG  30  -0.073 -11.841  -7.761
  211    HB2  ARG  30          2HB       ARG  30   1.427 -11.292  -9.319
  212    HB3  ARG  30          3HB       ARG  30   2.410 -10.472  -8.113
  213    HG2  ARG  30          2HG       ARG  30   3.509 -12.603  -7.582
  214    HG3  ARG  30          3HG       ARG  30   2.550 -13.391  -8.837
  215    HD2  ARG  30          2HD       ARG  30   3.594 -11.338 -10.241
  216    HD3  ARG  30          3HD       ARG  30   4.882 -11.600  -9.065
  217    HE   ARG  30           HE       ARG  30   4.058 -14.053 -10.225
  218   HH11  ARG  30          1HH1      ARG  30   5.898 -11.171 -10.883
  219   HH12  ARG  30          2HH1      ARG  30   6.942 -11.943 -12.030
  220   HH21  ARG  30          1HH2      ARG  30   5.426 -15.080 -11.734
  221   HH22  ARG  30          2HH2      ARG  30   6.671 -14.166 -12.514
  222    H    ARG  31           HN       ARG  31   2.012 -12.093  -5.049
  223    HA   ARG  31           HA       ARG  31   2.441 -14.952  -5.402
  224    HB2  ARG  31          2HB       ARG  31   3.857 -12.894  -4.113
  225    HB3  ARG  31          3HB       ARG  31   3.262 -13.938  -2.827
  226    HG2  ARG  31          2HG       ARG  31   4.230 -15.873  -4.159
  227    HG3  ARG  31          3HG       ARG  31   5.062 -14.648  -5.120
  228    HD2  ARG  31          2HD       ARG  31   5.575 -13.875  -2.526
  229    HD3  ARG  31          3HD       ARG  31   5.634 -15.635  -2.439
  230    HE   ARG  31           HE       ARG  31   7.612 -13.974  -3.523
  231   HH11  ARG  31          1HH1      ARG  31   5.894 -16.907  -4.276
  232   HH12  ARG  31          2HH1      ARG  31   7.192 -17.582  -5.205
  233   HH21  ARG  31          1HH2      ARG  31   9.327 -14.853  -4.744
  234   HH22  ARG  31          2HH2      ARG  31   9.144 -16.413  -5.469
  235    H    MET  32           HN       MET  32   0.568 -12.728  -3.438
  236    HA   MET  32           HA       MET  32  -0.452 -14.833  -1.735
  237    HB2  MET  32          2HB       MET  32  -1.247 -11.924  -1.962
  238    HB3  MET  32          3HB       MET  32  -1.810 -13.038  -0.723
  239    HG2  MET  32          2HG       MET  32   1.034 -12.152  -1.153
  240    HG3  MET  32          3HG       MET  32  -0.050 -11.601   0.122
  241    HE1  MET  32          1HE       MET  32  -0.302 -12.979   2.503
  242    HE2  MET  32          2HE       MET  32  -1.479 -13.607   1.350
  243    HE3  MET  32          3HE       MET  32  -0.522 -14.720   2.327
  244    H    GLY  33           HN       GLY  33  -1.022 -14.100  -4.836
  245    HA2  GLY  33          1HA       GLY  33  -2.698 -14.738  -6.279
  246    HA3  GLY  33          2HA       GLY  33  -3.499 -15.504  -4.915
  247    H    TYR  34           HN       TYR  34  -2.709 -12.178  -4.580
  248    HA   TYR  34           HA       TYR  34  -5.438 -11.452  -4.250
  249    HB2  TYR  34          2HB       TYR  34  -2.819 -10.045  -4.142
  250    HB3  TYR  34          3HB       TYR  34  -4.256  -9.058  -4.383
  251    HD1  TYR  34          1HD       TYR  34  -6.281 -10.163  -2.730
  252    HD2  TYR  34          2HD       TYR  34  -2.104  -9.916  -1.956
  253    HE1  TYR  34          1HE       TYR  34  -6.731 -10.222  -0.313
  254    HE2  TYR  34          2HE       TYR  34  -2.543  -9.977   0.463
  255    HH   TYR  34           HH       TYR  34  -5.850 -10.000   1.730
  256    H    ILE  35           HN       ILE  35  -3.153 -11.238  -6.885
  257    HA   ILE  35           HA       ILE  35  -5.301 -10.153  -8.583
  258    HB   ILE  35           HB       ILE  35  -3.543  -9.018  -9.938
  259   HG12  ILE  35          2HG1      ILE  35  -1.571  -8.842  -7.836
  260   HG13  ILE  35          3HG1      ILE  35  -1.812 -10.521  -8.306
  261   HG21  ILE  35          1HG2      ILE  35  -4.506  -7.382  -8.740
  262   HG22  ILE  35          2HG2      ILE  35  -4.389  -8.282  -7.229
  263   HG23  ILE  35          3HG2      ILE  35  -2.994  -7.391  -7.833
  264   HD11  ILE  35          1HD1      ILE  35  -0.007  -9.238  -9.522
  265   HD12  ILE  35          2HD1      ILE  35  -1.177 -10.096 -10.525
  266   HD13  ILE  35          3HD1      ILE  35  -1.310  -8.351 -10.314
  267    H    GLN  36           HN       GLN  36  -4.994 -10.641 -10.911
  268    HA   GLN  36           HA       GLN  36  -3.427 -13.068 -11.407
  269    HB2  GLN  36          2HB       GLN  36  -5.431 -13.923 -12.744
  270    HB3  GLN  36          3HB       GLN  36  -5.534 -14.022 -10.991
  271    HG2  GLN  36          2HG       GLN  36  -7.339 -12.739 -10.941
  272    HG3  GLN  36          3HG       GLN  36  -6.583 -11.516 -11.961
  273   HE21  GLN  36          1HE2      GLN  36  -7.976 -11.072 -13.518
  274   HE22  GLN  36          2HE2      GLN  36  -8.790 -12.230 -14.508
  275    H    GLY  37           HN       GLY  37  -2.110 -11.328 -12.430
  276    HA2  GLY  37          1HA       GLY  37  -1.731 -11.358 -14.996
  277    HA3  GLY  37          2HA       GLY  37  -3.208 -10.406 -14.996
  278    H    ASP  38           HN       ASP  38   0.193 -10.417 -14.403
  279    HA   ASP  38           HA       ASP  38   0.084  -7.514 -13.905
  280    HB2  ASP  38          2HB       ASP  38   2.404  -7.963 -12.809
  281    HB3  ASP  38          3HB       ASP  38   0.940  -8.326 -11.899
  282    H    SER  39           HN       SER  39   1.274  -6.225 -15.197
  283    HA   SER  39           HA       SER  39   3.615  -6.866 -16.544
  284    HB2  SER  39          2HB       SER  39   2.647  -7.043 -18.905
  285    HB3  SER  39          3HB       SER  39   2.498  -8.472 -17.884
  286    HG   SER  39           HG       SER  39   0.353  -7.147 -17.380
  287    H    ALA  40           HN       ALA  40   1.027  -5.471 -18.424
  288    HA   ALA  40           HA       ALA  40   1.008  -3.384 -19.428
  289    HB1  ALA  40          1HB       ALA  40  -0.541  -3.187 -17.590
  290    HB2  ALA  40          2HB       ALA  40   0.771  -2.767 -16.486
  291    HB3  ALA  40          3HB       ALA  40   0.328  -1.665 -17.791
  292    H    ALA  41           HN       ALA  41   2.124  -1.471 -16.935
  293    HA   ALA  41           HA       ALA  41   4.931  -1.554 -17.466
  294    HB1  ALA  41          1HB       ALA  41   3.325   0.689 -18.680
  295    HB2  ALA  41          2HB       ALA  41   5.080   0.693 -18.505
  296    HB3  ALA  41          3HB       ALA  41   4.299  -0.506 -19.536
  297    H    GLU  42           HN       GLU  42   5.473  -1.363 -15.372
  298    HA   GLU  42           HA       GLU  42   5.122   1.165 -14.069
  299    HB2  GLU  42          2HB       GLU  42   4.117  -0.026 -11.989
  300    HB3  GLU  42          3HB       GLU  42   3.052   0.457 -13.301
  301    HG2  GLU  42          2HG       GLU  42   2.430  -1.636 -13.693
  302    HG3  GLU  42          3HG       GLU  42   4.095  -2.212 -13.692
  303    H    VAL  43           HN       VAL  43   7.471   0.532 -14.593
  304    HA   VAL  43           HA       VAL  43   8.793  -1.412 -13.023
  305    HB   VAL  43           HB       VAL  43   9.888   1.070 -14.353
  306   HG11  VAL  43          1HG1      VAL  43  11.329   0.255 -12.521
  307   HG12  VAL  43          2HG1      VAL  43  11.390  -1.325 -13.302
  308   HG13  VAL  43          3HG1      VAL  43  12.080   0.085 -14.107
  309   HG21  VAL  43          1HG2      VAL  43  10.694  -0.577 -16.045
  310   HG22  VAL  43          2HG2      VAL  43   9.732  -1.811 -15.229
  311   HG23  VAL  43          3HG2      VAL  43   8.939  -0.421 -15.970
  312    H    THR  44           HN       THR  44   9.371   2.086 -12.780
  313    HA   THR  44           HA       THR  44   8.623   2.437 -10.120
  314    HB   THR  44           HB       THR  44  10.769   0.784 -10.107
  315    HG1  THR  44          1HG       THR  44   9.833   1.119  -8.189
  316   HG21  THR  44          1HG2      THR  44  12.202   2.526 -11.136
  317   HG22  THR  44          2HG2      THR  44  12.762   2.032  -9.538
  318   HG23  THR  44          3HG2      THR  44  11.902   3.559  -9.739
  319    H    GLU  45           HN       GLU  45   8.831   4.552  -9.496
  320    HA   GLU  45           HA       GLU  45  10.682   6.314 -10.863
  321    HB2  GLU  45          2HB       GLU  45   7.756   6.287 -11.405
  322    HB3  GLU  45          3HB       GLU  45   8.538   7.855 -11.263
  323    HG2  GLU  45          2HG       GLU  45  10.207   6.385 -12.927
  324    HG3  GLU  45          3HG       GLU  45   8.573   5.969 -13.441
  325    H    MET  46           HN       MET  46   7.667   7.424  -9.499
  326    HA   MET  46           HA       MET  46   8.812   7.885  -6.880
  327    HB2  MET  46          2HB       MET  46   7.851  10.424  -7.494
  328    HB3  MET  46          3HB       MET  46   9.536   9.957  -7.311
  329    HG2  MET  46          2HG       MET  46   9.837   9.713  -9.620
  330    HG3  MET  46          3HG       MET  46   8.103   9.695  -9.928
  331    HE1  MET  46          1HE       MET  46  11.063  11.550  -8.641
  332    HE2  MET  46          2HE       MET  46  10.839  13.230  -9.129
  333    HE3  MET  46          3HE       MET  46  10.073  12.630  -7.658
  334    H    ALA  47           HN       ALA  47   7.199   7.033  -5.721
  335    HA   ALA  47           HA       ALA  47   4.535   6.815  -6.378
  336    HB1  ALA  47          1HB       ALA  47   4.667   5.621  -4.511
  337    HB2  ALA  47          2HB       ALA  47   6.133   6.465  -4.009
  338    HB3  ALA  47          3HB       ALA  47   4.551   7.130  -3.605
  339    H    HIS  48           HN       HIS  48   6.221   9.534  -4.937
  340    HA   HIS  48           HA       HIS  48   3.694  11.043  -4.887
  341    HB2  HIS  48          2HB       HIS  48   6.256  11.782  -3.470
  342    HB3  HIS  48          3HB       HIS  48   4.655  12.477  -3.226
  343    HD1  HIS  48          1HD       HIS  48   3.685  11.713  -1.099
  344    HD2  HIS  48          2HD       HIS  48   6.013   8.760  -2.865
  345    HE1  HIS  48          1HE       HIS  48   3.559   9.739   0.455
  346    H    THR  49           HN       THR  49   4.365  13.567  -5.027
  347    HA   THR  49           HA       THR  49   5.144  15.286  -6.319
  348    HB   THR  49           HB       THR  49   6.987  13.709  -7.988
  349    HG1  THR  49          1HG       THR  49   7.771  14.064  -5.306
  350   HG21  THR  49          1HG2      THR  49   6.906  16.297  -6.546
  351   HG22  THR  49          2HG2      THR  49   7.465  15.926  -8.177
  352   HG23  THR  49          3HG2      THR  49   8.492  15.567  -6.790
  353    H    GLU  50           HN       GLU  50   5.493  12.458  -8.466
  354    HA   GLU  50           HA       GLU  50   3.927  13.824 -10.498
  355    HB2  GLU  50          2HB       GLU  50   4.588  11.992 -11.965
  356    HB3  GLU  50          3HB       GLU  50   5.991  12.662 -11.147
  357    HG2  GLU  50          2HG       GLU  50   6.097  10.812  -9.650
  358    HG3  GLU  50          3HG       GLU  50   4.550  10.192 -10.222
  359    H    THR  51           HN       THR  51   1.995  13.085 -11.349
  360    HA   THR  51           HA       THR  51   0.645  10.959  -9.819
  361    HB   THR  51           HB       THR  51  -1.469  12.166 -10.064
  362    HG1  THR  51          1HG       THR  51  -1.585  14.083 -11.109
  363   HG21  THR  51          1HG2      THR  51  -1.139  13.613  -8.307
  364   HG22  THR  51          2HG2      THR  51   0.377  14.232  -8.962
  365   HG23  THR  51          3HG2      THR  51   0.330  12.643  -8.200
  366    H    GLY  52           HN       GLY  52   0.198   9.266 -11.059
  367    HA2  GLY  52          1HA       GLY  52  -1.393   8.996 -13.167
  368    HA3  GLY  52          2HA       GLY  52   0.062   9.588 -13.955
  369    H    TRP  53           HN       TRP  53   0.042   7.475 -11.150
  370    HA   TRP  53           HA       TRP  53   1.397   5.438 -12.769
  371    HB2  TRP  53          2HB       TRP  53   2.159   6.530 -10.403
  372    HB3  TRP  53          3HB       TRP  53   1.287   5.108  -9.835
  373    HD1  TRP  53          1HD       TRP  53   2.919   3.202  -9.389
  374    HE1  TRP  53          1HE       TRP  53   5.059   2.295 -10.494
  375    HE3  TRP  53          3HE       TRP  53   3.375   6.598 -13.183
  376    HZ2  TRP  53          2HZ       TRP  53   6.721   2.935 -12.684
  377    HZ3  TRP  53          3HZ       TRP  53   5.269   6.380 -14.739
  378    HH2  TRP  53          2HH       TRP  53   6.906   4.585 -14.493
  379    H    SER  54           HN       SER  54   0.764   3.279 -12.734
  380    HA   SER  54           HA       SER  54  -2.059   2.868 -12.260
  381    HB2  SER  54          2HB       SER  54  -0.805   0.429 -12.991
  382    HB3  SER  54          3HB       SER  54  -1.803   1.478 -13.996
  383    HG   SER  54           HG       SER  54  -0.028   1.769 -15.079
  384    H    CYS  55           HN       CYS  55  -2.954   1.264 -10.919
  385    HA   CYS  55           HA       CYS  55  -1.329  -0.290  -9.145
  386    HB2  CYS  55          2HB       CYS  55  -1.419   0.899  -7.222
  387    HB3  CYS  55          3HB       CYS  55  -1.642   2.273  -8.301
  388    H    HIS  56           HN       HIS  56  -3.014  -0.957  -7.183
  389    HA   HIS  56           HA       HIS  56  -4.769  -2.758  -8.272
  390    HB2  HIS  56          2HB       HIS  56  -4.352  -1.584  -5.619
  391    HB3  HIS  56          3HB       HIS  56  -6.000  -2.144  -5.888
  392    HD1  HIS  56          1HD       HIS  56  -5.432  -3.970  -4.037
  393    HD2  HIS  56          2HD       HIS  56  -3.344  -4.317  -7.612
  394    HE1  HIS  56          1HE       HIS  56  -4.468  -6.291  -4.029
  395    H    TYR  57           HN       TYR  57  -6.170  -0.121  -6.383
  396    HA   TYR  57           HA       TYR  57  -8.472  -0.085  -8.137
  397    HB2  TYR  57          2HB       TYR  57  -7.876   1.507  -5.635
  398    HB3  TYR  57          3HB       TYR  57  -9.417   1.488  -6.485
  399    HD1  TYR  57          1HD       TYR  57 -10.925  -0.379  -6.285
  400    HD2  TYR  57          2HD       TYR  57  -7.124  -0.458  -4.374
  401    HE1  TYR  57          1HE       TYR  57 -11.641  -2.319  -4.953
  402    HE2  TYR  57          2HE       TYR  57  -7.830  -2.398  -3.037
  403    HH   TYR  57           HH       TYR  57  -9.416  -3.931  -2.711
  404    H    CYS  58           HN       CYS  58  -6.496   0.700  -9.693
  405    HA   CYS  58           HA       CYS  58  -6.706   3.638  -9.813
  406    HB2  CYS  58          2HB       CYS  58  -4.412   1.939  -9.889
  407    HB3  CYS  58          3HB       CYS  58  -4.574   2.717 -11.460
  408    H    ASP  59           HN       ASP  59  -7.360   0.675 -11.377
  409    HA   ASP  59           HA       ASP  59  -8.850   1.930 -13.439
  410    HB2  ASP  59          2HB       ASP  59  -6.067   1.150 -14.021
  411    HB3  ASP  59          3HB       ASP  59  -7.259   0.554 -15.175
  412    H    ASN  60           HN       ASN  60 -10.498   0.584 -12.815
  413    HA   ASN  60           HA       ASN  60 -10.445  -2.077 -13.897
  414    HB2  ASN  60          2HB       ASN  60 -10.738  -1.696 -10.908
  415    HB3  ASN  60          3HB       ASN  60 -11.058  -3.201 -11.768
  416   HD21  ASN  60          1HD2      ASN  60  -9.206  -4.003 -13.113
  417   HD22  ASN  60          2HD2      ASN  60  -7.627  -3.873 -12.426
  Start of MODEL   15
    1    H1   GLU   1           HN       GLU   1   1.568   4.144   6.665
    2    HA   GLU   1           HA       GLU   1   0.645   2.597   5.254
    3    HB2  GLU   1          2HB       GLU   1   1.556   4.603   3.485
    4    HB3  GLU   1          3HB       GLU   1   2.080   3.067   2.811
    5    HG2  GLU   1          2HG       GLU   1  -0.304   2.276   3.124
    6    HG3  GLU   1          3HG       GLU   1  -0.714   3.961   3.439
    7    H    MET   2           HN       MET   2   1.272   0.583   5.613
    8    HA   MET   2           HA       MET   2   3.945  -0.248   4.722
    9    HB2  MET   2          2HB       MET   2   2.958  -1.593   7.146
   10    HB3  MET   2          3HB       MET   2   4.580  -1.045   6.742
   11    HG2  MET   2          2HG       MET   2   3.505   1.326   7.136
   12    HG3  MET   2          3HG       MET   2   2.374   0.391   8.110
   13    HE1  MET   2          1HE       MET   2   5.722   1.445   7.264
   14    HE2  MET   2          2HE       MET   2   6.228   2.075   8.832
   15    HE3  MET   2          3HE       MET   2   6.808   0.501   8.284
   16    H    CYS   3           HN       CYS   3   3.699  -1.767   3.233
   17    HA   CYS   3           HA       CYS   3   1.535  -3.032   2.330
   18    HB2  CYS   3          2HB       CYS   3   3.792  -3.351   1.390
   19    HB3  CYS   3          3HB       CYS   3   4.202  -4.404   2.741
   20    H    ASP   4           HN       ASP   4  -0.055  -4.141   3.229
   21    HA   ASP   4           HA       ASP   4  -0.013  -5.157   5.842
   22    HB2  ASP   4          2HB       ASP   4  -2.011  -4.562   4.250
   23    HB3  ASP   4          3HB       ASP   4  -1.896  -6.257   3.787
   24    H    VAL   5           HN       VAL   5   1.422  -6.378   3.079
   25    HA   VAL   5           HA       VAL   5   1.340  -9.146   4.071
   26    HB   VAL   5           HB       VAL   5   2.225  -8.130   1.366
   27   HG11  VAL   5          1HG1      VAL   5   1.997 -10.624   0.825
   28   HG12  VAL   5          2HG1      VAL   5   3.417 -10.110   1.738
   29   HG13  VAL   5          3HG1      VAL   5   2.062 -10.875   2.569
   30   HG21  VAL   5          1HG2      VAL   5  -0.074  -7.858   1.330
   31   HG22  VAL   5          2HG2      VAL   5   0.118  -9.493   0.700
   32   HG23  VAL   5          3HG2      VAL   5  -0.359  -9.246   2.380
   33    H    CYS   6           HN       CYS   6   3.206  -6.452   4.289
   34    HA   CYS   6           HA       CYS   6   5.557  -8.023   4.989
   35    HB2  CYS   6          2HB       CYS   6   5.711  -5.679   3.080
   36    HB3  CYS   6          3HB       CYS   6   7.080  -6.586   3.717
   37    H    GLU   7           HN       GLU   7   4.474  -4.642   4.607
   38    HA   GLU   7           HA       GLU   7   4.210  -3.008   6.205
   39    HB2  GLU   7          2HB       GLU   7   5.562  -4.712   8.272
   40    HB3  GLU   7          3HB       GLU   7   4.344  -3.463   8.492
   41    HG2  GLU   7          2HG       GLU   7   3.158  -5.446   6.899
   42    HG3  GLU   7          3HG       GLU   7   4.012  -6.285   8.192
   43    H    VAL   8           HN       VAL   8   5.863  -2.103   4.763
   44    HA   VAL   8           HA       VAL   8   8.055  -1.071   6.233
   45    HB   VAL   8           HB       VAL   8   9.522  -2.169   4.121
   46   HG11  VAL   8          1HG1      VAL   8  10.503  -1.696   6.226
   47   HG12  VAL   8          2HG1      VAL   8   9.398  -2.789   7.064
   48   HG13  VAL   8          3HG1      VAL   8  10.639  -3.438   5.991
   49   HG21  VAL   8          1HG2      VAL   8   8.237  -4.460   5.551
   50   HG22  VAL   8          2HG2      VAL   8   7.506  -3.803   4.086
   51   HG23  VAL   8          3HG2      VAL   8   9.144  -4.453   4.039
   52    H    TRP   9           HN       TRP   9   8.311   0.922   5.488
   53    HA   TRP   9           HA       TRP   9   7.969   1.416   2.609
   54    HB2  TRP   9          2HB       TRP   9   5.995   2.369   3.269
   55    HB3  TRP   9          3HB       TRP   9   6.574   2.696   4.900
   56    HD1  TRP   9          1HD       TRP   9   7.226   5.132   5.411
   57    HE1  TRP   9          1HE       TRP   9   7.562   7.267   4.014
   58    HE3  TRP   9          3HE       TRP   9   6.866   3.103   0.733
   59    HZ2  TRP   9          2HZ       TRP   9   7.659   7.994   1.289
   60    HZ3  TRP   9          3HZ       TRP   9   7.091   4.586  -1.216
   61    HH2  TRP   9          2HH       TRP   9   7.480   6.982  -0.942
   62    H    THR  10           HN       THR  10   9.005   3.406   1.857
   63    HA   THR  10           HA       THR  10  11.038   4.554   3.594
   64    HB   THR  10           HB       THR  10  11.707   2.972   1.115
   65    HG1  THR  10          1HG       THR  10  12.184   1.625   2.683
   66   HG21  THR  10          1HG2      THR  10  12.986   5.375   2.169
   67   HG22  THR  10          2HG2      THR  10  13.209   4.561   0.620
   68   HG23  THR  10          3HG2      THR  10  14.084   4.002   2.045
   69    H    ALA  11           HN       ALA  11  11.226   4.540   0.103
   70    HA   ALA  11           HA       ALA  11   9.665   6.813  -0.434
   71    HB1  ALA  11          1HB       ALA  11  12.476   7.322   0.396
   72    HB2  ALA  11          2HB       ALA  11  11.788   8.299  -0.903
   73    HB3  ALA  11          3HB       ALA  11  11.021   8.276   0.686
   74    H    GLU  12           HN       GLU  12  10.526   4.207  -1.520
   75    HA   GLU  12           HA       GLU  12  11.951   4.892  -3.958
   76    HB2  GLU  12          2HB       GLU  12  10.977   2.329  -2.736
   77    HB3  GLU  12          3HB       GLU  12  11.450   2.381  -4.429
   78    HG2  GLU  12          2HG       GLU  12  13.240   3.265  -2.183
   79    HG3  GLU  12          3HG       GLU  12  13.224   1.627  -2.835
   80    H    SER  13           HN       SER  13   9.017   2.937  -3.472
   81    HA   SER  13           HA       SER  13   7.278   4.583  -4.938
   82    HB2  SER  13          2HB       SER  13   7.160   3.499  -7.073
   83    HB3  SER  13          3HB       SER  13   8.855   3.892  -6.787
   84    HG   SER  13           HG       SER  13   7.614   1.367  -6.409
   85    H    LEU  14           HN       LEU  14   6.924   3.304  -2.610
   86    HA   LEU  14           HA       LEU  14   5.991   0.765  -2.427
   87    HB2  LEU  14          2HB       LEU  14   5.747   3.120  -0.924
   88    HB3  LEU  14          3HB       LEU  14   4.109   2.501  -1.118
   89    HG   LEU  14           HG       LEU  14   6.454   1.189   0.228
   90   HD11  LEU  14          1HD1      LEU  14   4.954   1.088   2.121
   91   HD12  LEU  14          2HD1      LEU  14   3.646   1.774   1.156
   92   HD13  LEU  14          3HD1      LEU  14   5.067   2.748   1.534
   93   HD21  LEU  14          1HD2      LEU  14   4.802  -0.729   0.559
   94   HD22  LEU  14          2HD2      LEU  14   5.587  -0.596  -1.015
   95   HD23  LEU  14          3HD2      LEU  14   3.923  -0.048  -0.809
   96    H    PHE  15           HN       PHE  15   4.172  -0.377  -2.938
   97    HA   PHE  15           HA       PHE  15   2.362   0.901  -4.862
   98    HB2  PHE  15          2HB       PHE  15   3.309  -1.897  -4.435
   99    HB3  PHE  15          3HB       PHE  15   1.718  -1.657  -5.148
  100    HD1  PHE  15          1HD       PHE  15   1.524  -1.354  -7.426
  101    HD2  PHE  15          2HD       PHE  15   5.263  -0.593  -5.539
  102    HE1  PHE  15          1HE       PHE  15   2.563  -1.005  -9.630
  103    HE2  PHE  15          2HE       PHE  15   6.306  -0.242  -7.738
  104    HZ   PHE  15           HZ       PHE  15   4.956  -0.447  -9.788
  105    HA   PRO  16           HA       PRO  16   0.434  -0.050  -5.880
  106    HB2  PRO  16          2HB       PRO  16  -1.817   1.451  -6.100
  107    HB3  PRO  16          3HB       PRO  16  -1.850  -0.296  -5.834
  108    HG2  PRO  16          2HG       PRO  16  -2.180   1.928  -3.857
  109    HG3  PRO  16          3HG       PRO  16  -3.095   0.417  -4.004
  110    HD2  PRO  16          2HD       PRO  16  -1.126   0.754  -2.177
  111    HD3  PRO  16          3HD       PRO  16  -1.475  -0.817  -2.925
  112    H    CYS  17           HN       CYS  17  -0.488   2.796  -3.928
  113    HA   CYS  17           HA       CYS  17   1.689   4.361  -4.864
  114    HB2  CYS  17          2HB       CYS  17   0.582   5.922  -6.282
  115    HB3  CYS  17          3HB       CYS  17   0.164   4.321  -6.884
  116    H    ARG  18           HN       ARG  18   0.100   6.865  -4.712
  117    HA   ARG  18           HA       ARG  18  -0.285   6.890  -1.793
  118    HB2  ARG  18          2HB       ARG  18   1.178   8.579  -1.823
  119    HB3  ARG  18          3HB       ARG  18   1.183   8.610  -3.581
  120    HG2  ARG  18          2HG       ARG  18   0.549  10.767  -2.672
  121    HG3  ARG  18          3HG       ARG  18  -0.791  10.045  -3.565
  122    HD2  ARG  18          2HD       ARG  18  -2.094  10.120  -1.768
  123    HD3  ARG  18          3HD       ARG  18  -0.902   9.236  -0.817
  124    HE   ARG  18           HE       ARG  18   0.000  11.843  -0.968
  125   HH11  ARG  18          1HH1      ARG  18  -2.793  10.171   0.266
  126   HH12  ARG  18          2HH1      ARG  18  -3.085  11.320   1.529
  127   HH21  ARG  18          1HH2      ARG  18  -0.374  13.363   0.691
  128   HH22  ARG  18          2HH2      ARG  18  -1.709  13.135   1.770
  129    H    VAL  19           HN       VAL  19  -1.484   8.373  -4.800
  130    HA   VAL  19           HA       VAL  19  -3.679   9.715  -3.800
  131    HB   VAL  19           HB       VAL  19  -4.731   9.306  -6.067
  132   HG11  VAL  19          1HG1      VAL  19  -2.847  10.539  -7.277
  133   HG12  VAL  19          2HG1      VAL  19  -3.516  11.294  -5.828
  134   HG13  VAL  19          3HG1      VAL  19  -1.971  10.444  -5.749
  135   HG21  VAL  19          1HG2      VAL  19  -3.664   7.100  -6.436
  136   HG22  VAL  19          2HG2      VAL  19  -3.416   8.223  -7.773
  137   HG23  VAL  19          3HG2      VAL  19  -2.113   7.917  -6.625
  138    H    CYS  20           HN       CYS  20  -3.190   6.317  -4.142
  139    HA   CYS  20           HA       CYS  20  -6.029   5.726  -3.809
  140    HB2  CYS  20          2HB       CYS  20  -3.627   3.946  -4.252
  141    HB3  CYS  20          3HB       CYS  20  -5.262   3.339  -4.006
  142    H    THR  21           HN       THR  21  -6.098   3.510  -2.309
  143    HA   THR  21           HA       THR  21  -5.064   4.402   0.303
  144    HB   THR  21           HB       THR  21  -6.989   3.142   1.296
  145    HG1  THR  21          1HG       THR  21  -8.339   2.109   0.022
  146   HG21  THR  21          1HG2      THR  21  -7.665   5.394  -0.600
  147   HG22  THR  21          2HG2      THR  21  -7.111   5.555   1.066
  148   HG23  THR  21          3HG2      THR  21  -8.688   4.845   0.726
  149    H    ARG  22           HN       ARG  22  -4.960   2.525   1.921
  150    HA   ARG  22           HA       ARG  22  -3.935   0.604   2.581
  151    HB2  ARG  22          2HB       ARG  22  -4.710  -0.616  -0.058
  152    HB3  ARG  22          3HB       ARG  22  -4.539  -1.404   1.504
  153    HG2  ARG  22          2HG       ARG  22  -6.527   0.612   1.738
  154    HG3  ARG  22          3HG       ARG  22  -6.873  -0.357   0.304
  155    HD2  ARG  22          2HD       ARG  22  -7.967  -1.525   1.978
  156    HD3  ARG  22          3HD       ARG  22  -6.427  -2.376   1.861
  157    HE   ARG  22           HE       ARG  22  -6.029  -1.783   4.020
  158   HH11  ARG  22          1HH1      ARG  22  -8.283   0.495   2.659
  159   HH12  ARG  22          2HH1      ARG  22  -8.501   1.364   4.141
  160   HH21  ARG  22          1HH2      ARG  22  -6.308  -0.646   5.977
  161   HH22  ARG  22          2HH2      ARG  22  -7.375   0.715   6.028
  162    H    VAL  23           HN       VAL  23  -2.444  -1.307   1.422
  163    HA   VAL  23           HA       VAL  23  -0.598  -0.189  -0.495
  164    HB   VAL  23           HB       VAL  23   0.380   0.873   1.374
  165   HG11  VAL  23          1HG1      VAL  23  -0.778  -0.247   3.161
  166   HG12  VAL  23          2HG1      VAL  23   0.084  -1.751   2.829
  167   HG13  VAL  23          3HG1      VAL  23   0.957  -0.352   3.453
  168   HG21  VAL  23          1HG2      VAL  23   1.718  -1.178  -0.004
  169   HG22  VAL  23          2HG2      VAL  23   2.425   0.231   0.785
  170   HG23  VAL  23          3HG2      VAL  23   2.247  -1.281   1.675
  171    H    PHE  24           HN       PHE  24   0.090  -1.788  -1.750
  172    HA   PHE  24           HA       PHE  24   0.640  -4.414  -0.623
  173    HB2  PHE  24          2HB       PHE  24  -0.790  -4.897  -3.037
  174    HB3  PHE  24          3HB       PHE  24  -1.201  -5.411  -1.403
  175    HD1  PHE  24          1HD       PHE  24  -2.756  -4.115  -0.047
  176    HD2  PHE  24          2HD       PHE  24  -1.851  -3.005  -4.055
  177    HE1  PHE  24          1HE       PHE  24  -4.726  -2.641  -0.079
  178    HE2  PHE  24          2HE       PHE  24  -3.819  -1.528  -4.093
  179    HZ   PHE  24           HZ       PHE  24  -5.259  -1.343  -2.104
  180    H    HIS  25           HN       HIS  25   2.654  -4.772  -1.270
  181    HA   HIS  25           HA       HIS  25   4.056  -3.529  -3.266
  182    HB2  HIS  25          2HB       HIS  25   4.362  -6.309  -2.135
  183    HB3  HIS  25          3HB       HIS  25   5.516  -5.616  -3.270
  184    HD2  HIS  25          2HD       HIS  25   5.055  -2.602  -1.460
  185    HE1  HIS  25          1HE       HIS  25   7.448  -4.839   1.235
  186    HE2  HIS  25          2HE       HIS  25   6.515  -2.568   0.675
  187    H    ASP  26           HN       ASP  26   5.003  -4.636  -5.262
  188    HA   ASP  26           HA       ASP  26   2.785  -5.392  -6.960
  189    HB2  ASP  26          2HB       ASP  26   4.004  -4.456  -8.590
  190    HB3  ASP  26          3HB       ASP  26   5.166  -3.991  -7.351
  191    H    GLY  27           HN       GLY  27   5.514  -6.902  -5.418
  192    HA2  GLY  27          1HA       GLY  27   5.264  -9.332  -7.000
  193    HA3  GLY  27          2HA       GLY  27   6.431  -9.036  -5.721
  194    H    CYS  28           HN       CYS  28   4.132  -8.081  -3.984
  195    HA   CYS  28           HA       CYS  28   3.660 -10.571  -2.694
  196    HB2  CYS  28          2HB       CYS  28   2.814  -7.742  -2.247
  197    HB3  CYS  28          3HB       CYS  28   1.935  -9.020  -1.415
  198    H    LEU  29           HN       LEU  29   1.348  -8.249  -4.112
  199    HA   LEU  29           HA       LEU  29  -0.940  -9.730  -3.990
  200    HB2  LEU  29          2HB       LEU  29  -0.102  -8.022  -6.328
  201    HB3  LEU  29          3HB       LEU  29  -1.753  -8.474  -5.904
  202    HG   LEU  29           HG       LEU  29  -0.022  -6.844  -4.063
  203   HD11  LEU  29          1HD1      LEU  29  -0.039  -5.309  -5.719
  204   HD12  LEU  29          2HD1      LEU  29  -1.666  -5.009  -5.110
  205   HD13  LEU  29          3HD1      LEU  29  -1.430  -6.030  -6.527
  206   HD21  LEU  29          1HD2      LEU  29  -2.695  -6.149  -3.823
  207   HD22  LEU  29          2HD2      LEU  29  -1.772  -7.177  -2.728
  208   HD23  LEU  29          3HD2      LEU  29  -2.718  -7.900  -4.030
  209    H    ARG  30           HN       ARG  30   1.772 -10.191  -6.121
  210    HA   ARG  30           HA       ARG  30   0.388 -12.009  -7.878
  211    HB2  ARG  30          2HB       ARG  30   2.119 -11.576  -9.216
  212    HB3  ARG  30          3HB       ARG  30   2.805 -10.562  -7.953
  213    HG2  ARG  30          2HG       ARG  30   4.009 -12.463  -7.046
  214    HG3  ARG  30          3HG       ARG  30   3.283 -13.519  -8.259
  215    HD2  ARG  30          2HD       ARG  30   5.199 -13.084  -9.373
  216    HD3  ARG  30          3HD       ARG  30   4.328 -11.631  -9.860
  217    HE   ARG  30           HE       ARG  30   5.759 -11.259  -7.421
  218   HH11  ARG  30          1HH1      ARG  30   6.090 -11.348 -10.885
  219   HH12  ARG  30          2HH1      ARG  30   7.482 -10.315 -10.908
  220   HH21  ARG  30          1HH2      ARG  30   7.590  -9.898  -7.439
  221   HH22  ARG  30          2HH2      ARG  30   8.334  -9.492  -8.948
  222    H    ARG  31           HN       ARG  31   2.795 -12.279  -5.284
  223    HA   ARG  31           HA       ARG  31   3.192 -15.040  -5.404
  224    HB2  ARG  31          2HB       ARG  31   3.627 -12.912  -3.400
  225    HB3  ARG  31          3HB       ARG  31   3.512 -14.546  -2.758
  226    HG2  ARG  31          2HG       ARG  31   5.274 -14.172  -5.098
  227    HG3  ARG  31          3HG       ARG  31   5.803 -13.449  -3.578
  228    HD2  ARG  31          2HD       ARG  31   6.685 -15.492  -3.218
  229    HD3  ARG  31          3HD       ARG  31   5.043 -15.884  -2.711
  230    HE   ARG  31           HE       ARG  31   4.782 -17.159  -4.612
  231   HH11  ARG  31          1HH1      ARG  31   7.714 -15.295  -4.823
  232   HH12  ARG  31          2HH1      ARG  31   8.306 -16.139  -6.215
  233   HH21  ARG  31          1HH2      ARG  31   5.550 -18.279  -6.445
  234   HH22  ARG  31          2HH2      ARG  31   7.073 -17.836  -7.137
  235    H    MET  32           HN       MET  32   1.224 -13.347  -2.956
  236    HA   MET  32           HA       MET  32  -0.071 -15.595  -1.969
  237    HB2  MET  32          2HB       MET  32  -1.214 -12.801  -2.138
  238    HB3  MET  32          3HB       MET  32  -1.710 -14.067  -1.023
  239    HG2  MET  32          2HG       MET  32   1.136 -13.233  -1.007
  240    HG3  MET  32          3HG       MET  32  -0.058 -12.140  -0.310
  241    HE1  MET  32          1HE       MET  32  -1.936 -13.001   0.986
  242    HE2  MET  32          2HE       MET  32  -2.013 -14.523   1.872
  243    HE3  MET  32          3HE       MET  32  -1.234 -13.117   2.601
  244    H    GLY  33           HN       GLY  33  -0.657 -13.775  -4.866
  245    HA2  GLY  33          1HA       GLY  33  -1.854 -14.619  -6.715
  246    HA3  GLY  33          2HA       GLY  33  -2.692 -15.727  -5.638
  247    H    TYR  34           HN       TYR  34  -2.471 -12.455  -4.620
  248    HA   TYR  34           HA       TYR  34  -5.265 -12.135  -4.481
  249    HB2  TYR  34          2HB       TYR  34  -2.907 -10.343  -4.104
  250    HB3  TYR  34          3HB       TYR  34  -4.498  -9.607  -4.256
  251    HD1  TYR  34          1HD       TYR  34  -6.276 -11.327  -2.817
  252    HD2  TYR  34          2HD       TYR  34  -2.252 -10.301  -1.892
  253    HE1  TYR  34          1HE       TYR  34  -6.714 -11.776  -0.438
  254    HE2  TYR  34          2HE       TYR  34  -2.679 -10.749   0.489
  255    HH   TYR  34           HH       TYR  34  -4.428 -12.281   1.790
  256    H    ILE  35           HN       ILE  35  -2.935 -11.385  -6.957
  257    HA   ILE  35           HA       ILE  35  -5.086 -10.196  -8.584
  258    HB   ILE  35           HB       ILE  35  -3.247  -9.119  -9.907
  259   HG12  ILE  35          2HG1      ILE  35  -1.294  -9.118  -7.792
  260   HG13  ILE  35          3HG1      ILE  35  -1.632 -10.773  -8.284
  261   HG21  ILE  35          1HG2      ILE  35  -2.869  -7.315  -8.286
  262   HG22  ILE  35          2HG2      ILE  35  -4.547  -7.859  -8.288
  263   HG23  ILE  35          3HG2      ILE  35  -3.459  -8.363  -6.996
  264   HD11  ILE  35          1HD1      ILE  35  -1.361  -9.267 -10.643
  265   HD12  ILE  35          2HD1      ILE  35  -0.034  -8.805  -9.576
  266   HD13  ILE  35          3HD1      ILE  35  -0.276 -10.499 -10.001
  267    H    GLN  36           HN       GLN  36  -5.792 -11.534 -10.099
  268    HA   GLN  36           HA       GLN  36  -4.234 -13.798 -10.957
  269    HB2  GLN  36          2HB       GLN  36  -6.190 -14.410 -12.261
  270    HB3  GLN  36          3HB       GLN  36  -6.671 -13.960 -10.630
  271    HG2  GLN  36          2HG       GLN  36  -6.740 -11.947 -12.836
  272    HG3  GLN  36          3HG       GLN  36  -8.047 -13.113 -12.643
  273   HE21  GLN  36          1HE2      GLN  36  -9.236 -13.104 -10.669
  274   HE22  GLN  36          2HE2      GLN  36  -9.348 -11.663  -9.722
  275    H    GLY  37           HN       GLY  37  -4.036 -10.660 -11.754
  276    HA2  GLY  37          1HA       GLY  37  -3.883 -10.921 -14.636
  277    HA3  GLY  37          2HA       GLY  37  -3.542  -9.475 -13.698
  278    H    ASP  38           HN       ASP  38  -2.018 -10.622 -15.897
  279    HA   ASP  38           HA       ASP  38   0.515 -11.113 -14.475
  280    HB2  ASP  38          2HB       ASP  38   0.779 -12.116 -17.092
  281    HB3  ASP  38          3HB       ASP  38   0.702 -13.040 -15.594
  282    H    SER  39           HN       SER  39   0.723  -8.767 -14.519
  283    HA   SER  39           HA       SER  39   1.455  -7.721 -17.172
  284    HB2  SER  39          2HB       SER  39   0.435  -5.788 -16.641
  285    HB3  SER  39          3HB       SER  39  -0.266  -6.650 -15.272
  286    HG   SER  39           HG       SER  39   1.912  -4.891 -15.351
  287    H    ALA  40           HN       ALA  40   3.070  -5.725 -16.762
  288    HA   ALA  40           HA       ALA  40   5.157  -6.500 -14.867
  289    HB1  ALA  40          1HB       ALA  40   6.780  -6.010 -16.898
  290    HB2  ALA  40          2HB       ALA  40   6.122  -7.621 -16.603
  291    HB3  ALA  40          3HB       ALA  40   5.393  -6.582 -17.827
  292    H    ALA  41           HN       ALA  41   6.354  -4.811 -14.099
  293    HA   ALA  41           HA       ALA  41   6.360  -2.243 -15.401
  294    HB1  ALA  41          1HB       ALA  41   4.570  -1.394 -14.396
  295    HB2  ALA  41          2HB       ALA  41   4.392  -2.821 -13.371
  296    HB3  ALA  41          3HB       ALA  41   5.455  -1.504 -12.874
  297    H    GLU  42           HN       GLU  42   8.592  -2.398 -15.330
  298    HA   GLU  42           HA       GLU  42   9.769  -1.876 -12.702
  299    HB2  GLU  42          2HB       GLU  42  11.114  -3.781 -14.602
  300    HB3  GLU  42          3HB       GLU  42  11.467  -3.498 -12.903
  301    HG2  GLU  42          2HG       GLU  42   9.159  -4.444 -12.424
  302    HG3  GLU  42          3HG       GLU  42   9.159  -4.992 -14.100
  303    H    VAL  43           HN       VAL  43   9.151  -0.237 -15.049
  304    HA   VAL  43           HA       VAL  43  11.612   0.319 -16.409
  305    HB   VAL  43           HB       VAL  43   9.604   0.804 -17.596
  306   HG11  VAL  43          1HG1      VAL  43   7.904   1.121 -16.083
  307   HG12  VAL  43          2HG1      VAL  43   8.843   2.247 -15.101
  308   HG13  VAL  43          3HG1      VAL  43   8.164   2.773 -16.642
  309   HG21  VAL  43          1HG2      VAL  43  10.095   2.917 -18.408
  310   HG22  VAL  43          2HG2      VAL  43  10.507   3.547 -16.814
  311   HG23  VAL  43          3HG2      VAL  43  11.611   2.447 -17.641
  312    H    THR  44           HN       THR  44   9.980   1.533 -13.571
  313    HA   THR  44           HA       THR  44  12.324   2.784 -12.583
  314    HB   THR  44           HB       THR  44  11.786   4.526 -14.200
  315    HG1  THR  44          1HG       THR  44  11.922   6.183 -12.753
  316   HG21  THR  44          1HG2      THR  44   9.675   5.008 -14.720
  317   HG22  THR  44          2HG2      THR  44   9.427   5.647 -13.095
  318   HG23  THR  44          3HG2      THR  44   9.104   3.947 -13.433
  319    H    GLU  45           HN       GLU  45  11.443   4.503 -10.745
  320    HA   GLU  45           HA       GLU  45   9.756   2.819  -9.057
  321    HB2  GLU  45          2HB       GLU  45  10.515   4.816  -7.413
  322    HB3  GLU  45          3HB       GLU  45  11.476   3.370  -7.691
  323    HG2  GLU  45          2HG       GLU  45  12.906   4.487  -9.195
  324    HG3  GLU  45          3HG       GLU  45  11.819   5.869  -9.317
  325    H    MET  46           HN       MET  46   9.988   6.251  -8.542
  326    HA   MET  46           HA       MET  46   8.393   7.858  -8.313
  327    HB2  MET  46          2HB       MET  46   7.199   6.509 -10.741
  328    HB3  MET  46          3HB       MET  46   6.878   8.152 -10.202
  329    HG2  MET  46          2HG       MET  46   9.388   8.539 -10.488
  330    HG3  MET  46          3HG       MET  46   9.383   7.030 -11.397
  331    HE1  MET  46          1HE       MET  46   9.554  10.676 -12.021
  332    HE2  MET  46          2HE       MET  46  10.538   9.382 -12.705
  333    HE3  MET  46          3HE       MET  46   9.528  10.372 -13.758
  334    H    ALA  47           HN       ALA  47   7.240   7.601  -6.496
  335    HA   ALA  47           HA       ALA  47   5.233   5.498  -6.313
  336    HB1  ALA  47          1HB       ALA  47   5.486   5.615  -4.087
  337    HB2  ALA  47          2HB       ALA  47   6.958   6.504  -4.475
  338    HB3  ALA  47          3HB       ALA  47   5.480   7.378  -4.075
  339    H    HIS  48           HN       HIS  48   5.460   8.942  -6.734
  340    HA   HIS  48           HA       HIS  48   2.746   9.156  -7.532
  341    HB2  HIS  48          2HB       HIS  48   2.169  10.864  -5.694
  342    HB3  HIS  48          3HB       HIS  48   2.093   9.154  -5.277
  343    HD1  HIS  48          1HD       HIS  48   5.063  11.536  -5.295
  344    HD2  HIS  48          2HD       HIS  48   2.970   9.032  -2.723
  345    HE1  HIS  48          1HE       HIS  48   6.322  11.603  -3.118
  346    H    THR  49           HN       THR  49   5.543   9.867  -8.278
  347    HA   THR  49           HA       THR  49   5.679  12.738  -8.228
  348    HB   THR  49           HB       THR  49   7.561  12.302  -9.947
  349    HG1  THR  49          1HG       THR  49   8.339  10.087  -9.758
  350   HG21  THR  49          1HG2      THR  49   7.491  11.609  -7.058
  351   HG22  THR  49          2HG2      THR  49   8.411  12.856  -7.900
  352   HG23  THR  49          3HG2      THR  49   8.937  11.174  -7.968
  353    H    GLU  50           HN       GLU  50   6.015  10.744 -11.133
  354    HA   GLU  50           HA       GLU  50   4.345  12.671 -12.572
  355    HB2  GLU  50          2HB       GLU  50   6.294  10.571 -13.522
  356    HB3  GLU  50          3HB       GLU  50   5.274  11.502 -14.610
  357    HG2  GLU  50          2HG       GLU  50   6.305  13.574 -13.619
  358    HG3  GLU  50          3HG       GLU  50   7.463  12.512 -12.819
  359    H    THR  51           HN       THR  51   2.284  12.195 -12.885
  360    HA   THR  51           HA       THR  51   0.865  10.030 -12.185
  361    HB   THR  51           HB       THR  51   0.279  12.260 -13.670
  362    HG1  THR  51          1HG       THR  51  -1.901  11.332 -13.591
  363   HG21  THR  51          1HG2      THR  51   0.891  11.003 -15.740
  364   HG22  THR  51          2HG2      THR  51  -0.778  11.571 -15.715
  365   HG23  THR  51          3HG2      THR  51  -0.418   9.877 -15.385
  366    H    GLY  52           HN       GLY  52   0.291   8.032 -12.984
  367    HA2  GLY  52          1HA       GLY  52   0.403   6.819 -15.320
  368    HA3  GLY  52          2HA       GLY  52   2.124   6.933 -14.982
  369    H    TRP  53           HN       TRP  53   1.035   6.667 -12.015
  370    HA   TRP  53           HA       TRP  53   1.642   3.873 -11.834
  371    HB2  TRP  53          2HB       TRP  53   1.026   4.274  -9.371
  372    HB3  TRP  53          3HB       TRP  53   2.409   5.153 -10.016
  373    HD1  TRP  53          1HD       TRP  53  -1.233   5.707  -8.923
  374    HE1  TRP  53          1HE       TRP  53  -1.566   8.215  -8.451
  375    HE3  TRP  53          3HE       TRP  53   3.292   7.448 -10.547
  376    HZ2  TRP  53          2HZ       TRP  53  -0.105  10.615  -8.730
  377    HZ3  TRP  53          3HZ       TRP  53   3.744   9.863 -10.411
  378    HH2  TRP  53          2HH       TRP  53   2.080  11.411  -9.521
  379    H    SER  54           HN       SER  54   0.078   2.684 -12.869
  380    HA   SER  54           HA       SER  54  -2.721   3.100 -12.364
  381    HB2  SER  54          2HB       SER  54  -2.300   0.543 -13.523
  382    HB3  SER  54          3HB       SER  54  -2.865   2.013 -14.317
  383    HG   SER  54           HG       SER  54  -1.056   1.620 -15.398
  384    H    CYS  55           HN       CYS  55  -4.142   1.661 -11.313
  385    HA   CYS  55           HA       CYS  55  -3.093  -0.552  -9.787
  386    HB2  CYS  55          2HB       CYS  55  -4.503   1.419  -8.076
  387    HB3  CYS  55          3HB       CYS  55  -3.204   0.300  -7.672
  388    H    HIS  56           HN       HIS  56  -4.792  -1.746  -8.662
  389    HA   HIS  56           HA       HIS  56  -6.917  -2.479 -10.107
  390    HB2  HIS  56          2HB       HIS  56  -6.419  -3.642  -8.071
  391    HB3  HIS  56          3HB       HIS  56  -6.789  -2.220  -7.100
  392    HD1  HIS  56          1HD       HIS  56  -8.413  -4.044  -5.894
  393    HD2  HIS  56          2HD       HIS  56  -9.506  -2.767  -9.693
  394    HE1  HIS  56          1HE       HIS  56 -10.843  -4.648  -6.132
  395    H    TYR  57           HN       TYR  57  -7.437  -0.227  -7.391
  396    HA   TYR  57           HA       TYR  57  -9.680   0.929  -8.899
  397    HB2  TYR  57          2HB       TYR  57 -10.401   1.806  -6.652
  398    HB3  TYR  57          3HB       TYR  57 -10.409   0.052  -6.796
  399    HD1  TYR  57          1HD       TYR  57  -9.349   2.793  -4.835
  400    HD2  TYR  57          2HD       TYR  57  -8.254  -1.163  -5.955
  401    HE1  TYR  57          1HE       TYR  57  -7.924   2.628  -2.838
  402    HE2  TYR  57          2HE       TYR  57  -6.826  -1.339  -3.959
  403    HH   TYR  57           HH       TYR  57  -6.778   1.179  -1.506
  404    H    CYS  58           HN       CYS  58  -7.391   1.852  -9.850
  405    HA   CYS  58           HA       CYS  58  -6.675   4.309  -8.446
  406    HB2  CYS  58          2HB       CYS  58  -5.071   2.603  -9.689
  407    HB3  CYS  58          3HB       CYS  58  -5.502   3.577 -11.092
  408    H    ASP  59           HN       ASP  59  -8.921   3.321 -10.690
  409    HA   ASP  59           HA       ASP  59 -10.491   4.548 -11.828
  410    HB2  ASP  59          2HB       ASP  59  -8.929   7.084 -11.535
  411    HB3  ASP  59          3HB       ASP  59 -10.674   6.841 -11.553
  412    H    ASN  60           HN       ASN  60 -10.270   3.813 -13.854
  413    HA   ASN  60           HA       ASN  60  -8.210   5.072 -15.544
  414    HB2  ASN  60          2HB       ASN  60  -8.416   2.896 -16.913
  415    HB3  ASN  60          3HB       ASN  60  -7.520   2.832 -15.398
  416   HD21  ASN  60          1HD2      ASN  60  -8.974   0.765 -16.948
  417   HD22  ASN  60          2HD2      ASN  60 -10.077   0.053 -15.825
  Start of MODEL   16
    1    H1   GLU   1           HN       GLU   1   3.136   5.042   6.105
    2    HA   GLU   1           HA       GLU   1   1.854   3.209   5.688
    3    HB2  GLU   1          2HB       GLU   1   1.907   4.723   3.197
    4    HB3  GLU   1          3HB       GLU   1   1.637   3.006   2.931
    5    HG2  GLU   1          2HG       GLU   1  -0.391   4.551   3.259
    6    HG3  GLU   1          3HG       GLU   1  -0.355   3.001   4.099
    7    H    MET   2           HN       MET   2   2.622   1.239   6.018
    8    HA   MET   2           HA       MET   2   4.797   0.264   4.289
    9    HB2  MET   2          2HB       MET   2   4.324  -1.231   6.758
   10    HB3  MET   2          3HB       MET   2   5.826  -0.604   6.093
   11    HG2  MET   2          2HG       MET   2   4.886   1.693   6.895
   12    HG3  MET   2          3HG       MET   2   3.888   0.689   7.947
   13    HE1  MET   2          1HE       MET   2   7.916   1.916   7.597
   14    HE2  MET   2          2HE       MET   2   8.384   0.218   7.694
   15    HE3  MET   2          3HE       MET   2   7.274   0.756   6.432
   16    H    CYS   3           HN       CYS   3   4.393  -1.399   2.988
   17    HA   CYS   3           HA       CYS   3   2.044  -2.439   2.285
   18    HB2  CYS   3          2HB       CYS   3   4.211  -3.047   1.244
   19    HB3  CYS   3          3HB       CYS   3   4.536  -4.126   2.597
   20    H    ASP   4           HN       ASP   4   0.489  -3.751   3.040
   21    HA   ASP   4           HA       ASP   4   0.566  -4.541   5.797
   22    HB2  ASP   4          2HB       ASP   4  -1.449  -3.834   4.138
   23    HB3  ASP   4          3HB       ASP   4  -1.592  -5.588   4.063
   24    H    VAL   5           HN       VAL   5   2.102  -5.859   3.334
   25    HA   VAL   5           HA       VAL   5   1.692  -8.611   4.307
   26    HB   VAL   5           HB       VAL   5   2.257  -7.739   1.471
   27   HG11  VAL   5          1HG1      VAL   5   3.537  -9.669   1.692
   28   HG12  VAL   5          2HG1      VAL   5   2.384 -10.425   2.792
   29   HG13  VAL   5          3HG1      VAL   5   2.000 -10.275   1.078
   30   HG21  VAL   5          1HG2      VAL   5  -0.119  -8.932   2.855
   31   HG22  VAL   5          2HG2      VAL   5  -0.040  -7.514   1.809
   32   HG23  VAL   5          3HG2      VAL   5   0.121  -9.128   1.119
   33    H    CYS   6           HN       CYS   6   3.763  -6.085   4.239
   34    HA   CYS   6           HA       CYS   6   6.079  -7.848   4.577
   35    HB2  CYS   6          2HB       CYS   6   6.109  -5.300   2.947
   36    HB3  CYS   6          3HB       CYS   6   7.515  -6.288   3.329
   37    H    GLU   7           HN       GLU   7   4.657  -4.647   5.037
   38    HA   GLU   7           HA       GLU   7   4.649  -3.343   6.934
   39    HB2  GLU   7          2HB       GLU   7   6.854  -4.957   8.164
   40    HB3  GLU   7          3HB       GLU   7   5.556  -4.070   8.952
   41    HG2  GLU   7          2HG       GLU   7   4.347  -6.064   7.369
   42    HG3  GLU   7          3HG       GLU   7   5.678  -6.824   8.241
   43    H    VAL   8           HN       VAL   8   6.979  -3.819   4.732
   44    HA   VAL   8           HA       VAL   8   8.628  -1.598   5.752
   45    HB   VAL   8           HB       VAL   8   9.986  -3.074   3.696
   46   HG11  VAL   8          1HG1      VAL   8  11.024  -1.563   5.325
   47   HG12  VAL   8          2HG1      VAL   8  10.612  -2.688   6.622
   48   HG13  VAL   8          3HG1      VAL   8  11.753  -3.168   5.365
   49   HG21  VAL   8          1HG2      VAL   8  10.381  -5.118   5.205
   50   HG22  VAL   8          2HG2      VAL   8   8.857  -4.670   5.971
   51   HG23  VAL   8          3HG2      VAL   8   8.898  -5.063   4.252
   52    H    TRP   9           HN       TRP   9   8.112   0.195   4.689
   53    HA   TRP   9           HA       TRP   9   7.030   0.102   2.012
   54    HB2  TRP   9          2HB       TRP   9   6.500   2.371   2.289
   55    HB3  TRP   9          3HB       TRP   9   6.329   1.700   3.909
   56    HD1  TRP   9          1HD       TRP   9   8.551   2.133   5.570
   57    HE1  TRP   9          1HE       TRP   9  10.023   4.238   5.737
   58    HE3  TRP   9          3HE       TRP   9   7.406   4.283   1.075
   59    HZ2  TRP   9          2HZ       TRP   9  10.619   6.510   4.172
   60    HZ3  TRP   9          3HZ       TRP   9   8.470   6.422   0.486
   61    HH2  TRP   9          2HH       TRP   9  10.042   7.512   2.004
   62    H    THR  10           HN       THR  10   9.911  -0.606   2.688
   63    HA   THR  10           HA       THR  10  12.060  -0.074   2.003
   64    HB   THR  10           HB       THR  10  11.914   0.222  -0.657
   65    HG1  THR  10          1HG       THR  10   9.849  -1.291  -0.932
   66   HG21  THR  10          1HG2      THR  10  11.756  -2.282  -0.789
   67   HG22  THR  10          2HG2      THR  10  11.394  -2.285   0.937
   68   HG23  THR  10          3HG2      THR  10  12.946  -1.677   0.362
   69    H    ALA  11           HN       ALA  11  10.705   1.786  -0.619
   70    HA   ALA  11           HA       ALA  11  10.616   4.342   0.240
   71    HB1  ALA  11          1HB       ALA  11  13.438   3.408   0.111
   72    HB2  ALA  11          2HB       ALA  11  13.068   5.061  -0.381
   73    HB3  ALA  11          3HB       ALA  11  12.664   4.513   1.246
   74    H    GLU  12           HN       GLU  12  12.469   2.502  -2.181
   75    HA   GLU  12           HA       GLU  12  12.588   4.107  -4.310
   76    HB2  GLU  12          2HB       GLU  12  11.945   1.212  -4.068
   77    HB3  GLU  12          3HB       GLU  12  11.743   1.959  -5.647
   78    HG2  GLU  12          2HG       GLU  12  14.244   1.665  -4.026
   79    HG3  GLU  12          3HG       GLU  12  13.907   1.076  -5.652
   80    H    SER  13           HN       SER  13   9.927   1.875  -4.697
   81    HA   SER  13           HA       SER  13   8.013   4.076  -4.906
   82    HB2  SER  13          2HB       SER  13   9.136   3.443  -7.179
   83    HB3  SER  13          3HB       SER  13   8.090   2.025  -7.100
   84    HG   SER  13           HG       SER  13   6.467   3.905  -6.572
   85    H    LEU  14           HN       LEU  14   6.393   3.533  -3.616
   86    HA   LEU  14           HA       LEU  14   5.821   0.746  -3.047
   87    HB2  LEU  14          2HB       LEU  14   5.390   3.291  -1.755
   88    HB3  LEU  14          3HB       LEU  14   3.905   2.344  -1.794
   89    HG   LEU  14           HG       LEU  14   6.522   1.638  -0.488
   90   HD11  LEU  14          1HD1      LEU  14   5.186   2.988   0.913
   91   HD12  LEU  14          2HD1      LEU  14   4.954   1.330   1.467
   92   HD13  LEU  14          3HD1      LEU  14   3.717   2.112   0.483
   93   HD21  LEU  14          1HD2      LEU  14   5.944  -0.411  -1.420
   94   HD22  LEU  14          2HD2      LEU  14   4.215  -0.112  -1.253
   95   HD23  LEU  14          3HD2      LEU  14   5.189  -0.470   0.172
   96    H    PHE  15           HN       PHE  15   3.537  -0.003  -3.030
   97    HA   PHE  15           HA       PHE  15   1.829   1.276  -5.026
   98    HB2  PHE  15          2HB       PHE  15   2.139  -1.681  -5.239
   99    HB3  PHE  15          3HB       PHE  15   1.724  -0.504  -6.480
  100    HD1  PHE  15          1HD       PHE  15   3.618   1.117  -7.194
  101    HD2  PHE  15          2HD       PHE  15   4.266  -2.570  -5.168
  102    HE1  PHE  15          1HE       PHE  15   5.943   1.086  -8.001
  103    HE2  PHE  15          2HE       PHE  15   6.592  -2.607  -5.971
  104    HZ   PHE  15           HZ       PHE  15   7.433  -0.777  -7.389
  105    HA   PRO  16           HA       PRO  16  -0.109   1.100  -5.883
  106    HB2  PRO  16          2HB       PRO  16  -2.214   2.653  -5.158
  107    HB3  PRO  16          3HB       PRO  16  -2.394   0.976  -5.686
  108    HG2  PRO  16          2HG       PRO  16  -2.348   2.093  -2.910
  109    HG3  PRO  16          3HG       PRO  16  -3.414   0.857  -3.600
  110    HD2  PRO  16          2HD       PRO  16  -1.280   0.240  -2.051
  111    HD3  PRO  16          3HD       PRO  16  -1.840  -0.811  -3.368
  112    H    CYS  17           HN       CYS  17  -0.850   3.706  -6.013
  113    HA   CYS  17           HA       CYS  17   1.299   5.232  -5.741
  114    HB2  CYS  17          2HB       CYS  17  -1.333   6.350  -4.792
  115    HB3  CYS  17          3HB       CYS  17  -0.059   7.169  -5.690
  116    H    ARG  18           HN       ARG  18  -1.123   5.447  -3.135
  117    HA   ARG  18           HA       ARG  18   0.911   5.127  -1.106
  118    HB2  ARG  18          2HB       ARG  18   1.048   7.256  -0.321
  119    HB3  ARG  18          3HB       ARG  18   0.673   7.645  -1.995
  120    HG2  ARG  18          2HG       ARG  18  -1.388   7.412   0.186
  121    HG3  ARG  18          3HG       ARG  18  -0.641   8.927  -0.324
  122    HD2  ARG  18          2HD       ARG  18  -1.645   7.437  -2.586
  123    HD3  ARG  18          3HD       ARG  18  -2.915   7.722  -1.396
  124    HE   ARG  18           HE       ARG  18  -1.375  10.067  -2.003
  125   HH11  ARG  18          1HH1      ARG  18  -4.066   8.088  -2.986
  126   HH12  ARG  18          2HH1      ARG  18  -4.874   9.373  -3.821
  127   HH21  ARG  18          1HH2      ARG  18  -2.430  11.766  -3.099
  128   HH22  ARG  18          2HH2      ARG  18  -3.942  11.464  -3.885
  129    H    VAL  19           HN       VAL  19  -2.423   5.825  -1.971
  130    HA   VAL  19           HA       VAL  19  -3.283   4.539   0.540
  131    HB   VAL  19           HB       VAL  19  -4.615   6.732  -1.044
  132   HG11  VAL  19          1HG1      VAL  19  -6.536   5.673  -0.535
  133   HG12  VAL  19          2HG1      VAL  19  -5.787   4.697   0.729
  134   HG13  VAL  19          3HG1      VAL  19  -6.262   6.362   1.065
  135   HG21  VAL  19          1HG2      VAL  19  -2.955   6.665   1.270
  136   HG22  VAL  19          2HG2      VAL  19  -3.689   8.059   0.477
  137   HG23  VAL  19          3HG2      VAL  19  -4.566   7.203   1.745
  138    H    CYS  20           HN       CYS  20  -5.387   5.374  -2.122
  139    HA   CYS  20           HA       CYS  20  -6.974   4.011  -3.115
  140    HB2  CYS  20          2HB       CYS  20  -4.849   2.261  -4.164
  141    HB3  CYS  20          3HB       CYS  20  -6.030   3.244  -5.025
  142    H    THR  21           HN       THR  21  -6.936   3.200  -0.555
  143    HA   THR  21           HA       THR  21  -7.723   1.451   0.696
  144    HB   THR  21           HB       THR  21  -7.263  -0.694  -1.257
  145    HG1  THR  21          1HG       THR  21  -9.310   0.306  -2.346
  146   HG21  THR  21          1HG2      THR  21  -8.676  -1.338   0.436
  147   HG22  THR  21          2HG2      THR  21  -9.854  -0.806  -0.764
  148   HG23  THR  21          3HG2      THR  21  -9.414   0.257   0.573
  149    H    ARG  22           HN       ARG  22  -6.234   1.135   2.232
  150    HA   ARG  22           HA       ARG  22  -4.214   0.596   3.204
  151    HB2  ARG  22          2HB       ARG  22  -5.761  -1.622   2.591
  152    HB3  ARG  22          3HB       ARG  22  -4.156  -2.071   2.031
  153    HG2  ARG  22          2HG       ARG  22  -3.316  -2.203   4.117
  154    HG3  ARG  22          3HG       ARG  22  -4.285  -0.852   4.708
  155    HD2  ARG  22          2HD       ARG  22  -6.276  -2.351   4.661
  156    HD3  ARG  22          3HD       ARG  22  -5.201  -3.686   4.246
  157    HE   ARG  22           HE       ARG  22  -4.268  -2.423   6.581
  158   HH11  ARG  22          1HH1      ARG  22  -6.873  -4.443   5.461
  159   HH12  ARG  22          2HH1      ARG  22  -7.129  -5.191   7.002
  160   HH21  ARG  22          1HH2      ARG  22  -4.595  -3.403   8.615
  161   HH22  ARG  22          2HH2      ARG  22  -5.833  -4.599   8.796
  162    H    VAL  23           HN       VAL  23  -2.365  -1.436   2.324
  163    HA   VAL  23           HA       VAL  23  -1.252  -0.268  -0.129
  164    HB   VAL  23           HB       VAL  23   1.022  -0.338   0.901
  165   HG11  VAL  23          1HG1      VAL  23  -0.845   1.641   0.959
  166   HG12  VAL  23          2HG1      VAL  23  -0.384   1.539   2.659
  167   HG13  VAL  23          3HG1      VAL  23   0.844   1.837   1.428
  168   HG21  VAL  23          1HG2      VAL  23   0.183  -1.897   2.773
  169   HG22  VAL  23          2HG2      VAL  23   1.369  -0.657   3.182
  170   HG23  VAL  23          3HG2      VAL  23  -0.334  -0.412   3.573
  171    H    PHE  24           HN       PHE  24  -0.318  -1.703  -1.484
  172    HA   PHE  24           HA       PHE  24   0.478  -4.328  -0.530
  173    HB2  PHE  24          2HB       PHE  24  -1.017  -4.924  -2.828
  174    HB3  PHE  24          3HB       PHE  24  -1.400  -5.365  -1.167
  175    HD1  PHE  24          1HD       PHE  24  -3.079  -4.187   0.078
  176    HD2  PHE  24          2HD       PHE  24  -2.071  -3.002  -3.884
  177    HE1  PHE  24          1HE       PHE  24  -5.104  -2.791  -0.016
  178    HE2  PHE  24          2HE       PHE  24  -4.094  -1.604  -3.983
  179    HZ   PHE  24           HZ       PHE  24  -5.613  -1.497  -2.048
  180    H    HIS  25           HN       HIS  25   2.444  -4.572  -1.345
  181    HA   HIS  25           HA       HIS  25   3.626  -3.109  -3.352
  182    HB2  HIS  25          2HB       HIS  25   4.201  -5.889  -2.340
  183    HB3  HIS  25          3HB       HIS  25   5.207  -5.116  -3.561
  184    HD2  HIS  25          2HD       HIS  25   4.674  -2.175  -1.611
  185    HE1  HIS  25          1HE       HIS  25   7.535  -4.263   0.722
  186    HE2  HIS  25          2HE       HIS  25   6.351  -2.071   0.355
  187    H    ASP  26           HN       ASP  26   4.659  -4.419  -5.358
  188    HA   ASP  26           HA       ASP  26   2.360  -5.057  -7.026
  189    HB2  ASP  26          2HB       ASP  26   4.256  -3.453  -7.683
  190    HB3  ASP  26          3HB       ASP  26   5.225  -4.902  -7.945
  191    H    GLY  27           HN       GLY  27   5.107  -6.610  -5.562
  192    HA2  GLY  27          1HA       GLY  27   4.732  -9.038  -7.141
  193    HA3  GLY  27          2HA       GLY  27   6.006  -8.748  -5.965
  194    H    CYS  28           HN       CYS  28   3.951  -7.775  -4.003
  195    HA   CYS  28           HA       CYS  28   3.547 -10.231  -2.663
  196    HB2  CYS  28          2HB       CYS  28   2.660  -7.407  -2.208
  197    HB3  CYS  28          3HB       CYS  28   1.948  -8.701  -1.250
  198    H    LEU  29           HN       LEU  29   1.058  -7.937  -3.795
  199    HA   LEU  29           HA       LEU  29  -1.204  -9.329  -3.507
  200    HB2  LEU  29          2HB       LEU  29  -0.427  -7.875  -6.031
  201    HB3  LEU  29          3HB       LEU  29  -2.073  -8.294  -5.558
  202    HG   LEU  29           HG       LEU  29  -0.380  -6.549  -3.805
  203   HD11  LEU  29          1HD1      LEU  29  -0.675  -5.824  -6.351
  204   HD12  LEU  29          2HD1      LEU  29  -0.735  -4.669  -5.020
  205   HD13  LEU  29          3HD1      LEU  29  -2.232  -5.274  -5.731
  206   HD21  LEU  29          1HD2      LEU  29  -2.923  -5.656  -3.662
  207   HD22  LEU  29          2HD2      LEU  29  -2.255  -6.902  -2.607
  208   HD23  LEU  29          3HD2      LEU  29  -3.203  -7.359  -4.024
  209    H    ARG  30           HN       ARG  30   1.197  -9.938  -6.022
  210    HA   ARG  30           HA       ARG  30  -0.301 -11.930  -7.382
  211    HB2  ARG  30          2HB       ARG  30   2.452 -10.873  -7.470
  212    HB3  ARG  30          3HB       ARG  30   2.274 -12.543  -7.993
  213    HG2  ARG  30          2HG       ARG  30   0.702 -11.910  -9.686
  214    HG3  ARG  30          3HG       ARG  30   0.663 -10.251  -9.089
  215    HD2  ARG  30          2HD       ARG  30   2.897  -9.857  -9.778
  216    HD3  ARG  30          3HD       ARG  30   3.177 -11.570 -10.083
  217    HE   ARG  30           HE       ARG  30   1.936  -9.678 -11.848
  218   HH11  ARG  30          1HH1      ARG  30   2.173 -13.042 -10.982
  219   HH12  ARG  30          2HH1      ARG  30   1.695 -13.613 -12.546
  220   HH21  ARG  30          1HH2      ARG  30   1.305 -10.418 -13.911
  221   HH22  ARG  30          2HH2      ARG  30   1.201 -12.120 -14.211
  222    H    ARG  31           HN       ARG  31   2.552 -12.228  -5.256
  223    HA   ARG  31           HA       ARG  31   2.640 -14.970  -5.048
  224    HB2  ARG  31          2HB       ARG  31   3.645 -12.710  -3.509
  225    HB3  ARG  31          3HB       ARG  31   3.310 -14.109  -2.496
  226    HG2  ARG  31          2HG       ARG  31   5.202 -15.049  -3.140
  227    HG3  ARG  31          3HG       ARG  31   4.675 -14.997  -4.824
  228    HD2  ARG  31          2HD       ARG  31   6.662 -13.788  -4.846
  229    HD3  ARG  31          3HD       ARG  31   5.424 -12.536  -4.757
  230    HE   ARG  31           HE       ARG  31   6.342 -13.325  -2.174
  231   HH11  ARG  31          1HH1      ARG  31   7.109 -11.364  -4.947
  232   HH12  ARG  31          2HH1      ARG  31   8.071 -10.238  -4.048
  233   HH21  ARG  31          1HH2      ARG  31   7.608 -11.850  -0.980
  234   HH22  ARG  31          2HH2      ARG  31   8.355 -10.516  -1.792
  235    H    MET  32           HN       MET  32   1.231 -12.898  -2.508
  236    HA   MET  32           HA       MET  32  -0.023 -14.791  -1.010
  237    HB2  MET  32          2HB       MET  32  -1.083 -12.048  -1.714
  238    HB3  MET  32          3HB       MET  32  -1.679 -13.043  -0.391
  239    HG2  MET  32          2HG       MET  32   1.111 -11.948  -0.665
  240    HG3  MET  32          3HG       MET  32  -0.149 -11.338   0.406
  241    HE1  MET  32          1HE       MET  32  -1.493 -13.279   1.914
  242    HE2  MET  32          2HE       MET  32  -0.445 -13.940   3.169
  243    HE3  MET  32          3HE       MET  32  -0.464 -12.203   2.860
  244    H    GLY  33           HN       GLY  33  -1.027 -13.564  -4.127
  245    HA2  GLY  33          1HA       GLY  33  -2.344 -14.933  -5.591
  246    HA3  GLY  33          2HA       GLY  33  -3.126 -15.625  -4.178
  247    H    TYR  34           HN       TYR  34  -2.736 -12.266  -3.970
  248    HA   TYR  34           HA       TYR  34  -5.518 -11.787  -3.911
  249    HB2  TYR  34          2HB       TYR  34  -3.060 -10.127  -3.758
  250    HB3  TYR  34          3HB       TYR  34  -4.550  -9.300  -4.196
  251    HD1  TYR  34          1HD       TYR  34  -6.626 -10.062  -2.625
  252    HD2  TYR  34          2HD       TYR  34  -2.516 -10.121  -1.524
  253    HE1  TYR  34          1HE       TYR  34  -7.267  -9.953  -0.253
  254    HE2  TYR  34          2HE       TYR  34  -3.145 -10.013   0.852
  255    HH   TYR  34           HH       TYR  34  -5.858  -9.017   1.991
  256    H    ILE  35           HN       ILE  35  -3.606  -9.654  -5.896
  257    HA   ILE  35           HA       ILE  35  -5.582  -9.571  -7.933
  258    HB   ILE  35           HB       ILE  35  -4.160  -8.044  -9.087
  259   HG12  ILE  35          2HG1      ILE  35  -1.791  -7.820  -7.674
  260   HG13  ILE  35          3HG1      ILE  35  -2.048  -9.560  -7.752
  261   HG21  ILE  35          1HG2      ILE  35  -3.475  -6.494  -7.204
  262   HG22  ILE  35          2HG2      ILE  35  -5.160  -7.014  -7.218
  263   HG23  ILE  35          3HG2      ILE  35  -4.017  -7.758  -6.100
  264   HD11  ILE  35          1HD1      ILE  35  -1.570  -9.645  -9.929
  265   HD12  ILE  35          2HD1      ILE  35  -2.479  -8.177 -10.288
  266   HD13  ILE  35          3HD1      ILE  35  -0.832  -8.065  -9.665
  267    H    GLN  36           HN       GLN  36  -4.480  -9.614 -10.334
  268    HA   GLN  36           HA       GLN  36  -3.393 -12.338 -10.613
  269    HB2  GLN  36          2HB       GLN  36  -5.355 -10.821 -12.323
  270    HB3  GLN  36          3HB       GLN  36  -4.489 -12.230 -12.923
  271    HG2  GLN  36          2HG       GLN  36  -5.478 -13.182 -10.586
  272    HG3  GLN  36          3HG       GLN  36  -6.742 -12.048 -11.061
  273   HE21  GLN  36          1HE2      GLN  36  -4.740 -14.660 -12.371
  274   HE22  GLN  36          2HE2      GLN  36  -5.967 -15.324 -13.390
  275    H    GLY  37           HN       GLY  37  -3.787  -9.853 -13.088
  276    HA2  GLY  37          1HA       GLY  37  -0.859  -9.914 -13.469
  277    HA3  GLY  37          2HA       GLY  37  -2.021  -9.687 -14.768
  278    H    ASP  38           HN       ASP  38   0.041  -7.934 -14.526
  279    HA   ASP  38           HA       ASP  38  -1.384  -5.463 -14.021
  280    HB2  ASP  38          2HB       ASP  38   0.570  -4.568 -12.658
  281    HB3  ASP  38          3HB       ASP  38  -0.487  -5.715 -11.840
  282    H    SER  39           HN       SER  39   0.508  -3.612 -14.311
  283    HA   SER  39           HA       SER  39   1.316  -3.967 -17.057
  284    HB2  SER  39          2HB       SER  39   1.898  -1.597 -15.275
  285    HB3  SER  39          3HB       SER  39   1.849  -1.633 -17.038
  286    HG   SER  39           HG       SER  39  -0.383  -2.017 -16.908
  287    H    ALA  40           HN       ALA  40   3.633  -2.294 -16.998
  288    HA   ALA  40           HA       ALA  40   5.589  -3.803 -15.436
  289    HB1  ALA  40          1HB       ALA  40   5.883  -3.451 -18.414
  290    HB2  ALA  40          2HB       ALA  40   6.971  -4.315 -17.328
  291    HB3  ALA  40          3HB       ALA  40   5.352  -4.942 -17.635
  292    H    ALA  41           HN       ALA  41   7.155  -2.539 -14.645
  293    HA   ALA  41           HA       ALA  41   8.300  -0.334 -15.965
  294    HB1  ALA  41          1HB       ALA  41   7.410   1.468 -14.455
  295    HB2  ALA  41          2HB       ALA  41   6.262   0.840 -15.639
  296    HB3  ALA  41          3HB       ALA  41   6.160   0.328 -13.954
  297    H    GLU  42           HN       GLU  42   7.542   0.171 -12.631
  298    HA   GLU  42           HA       GLU  42   8.975   0.389 -10.848
  299    HB2  GLU  42          2HB       GLU  42   8.567  -2.347 -11.556
  300    HB3  GLU  42          3HB       GLU  42  10.205  -2.172 -10.942
  301    HG2  GLU  42          2HG       GLU  42   7.943  -0.955  -9.434
  302    HG3  GLU  42          3HG       GLU  42   8.228  -2.692  -9.327
  303    H    VAL  43           HN       VAL  43  10.487   1.899 -11.505
  304    HA   VAL  43           HA       VAL  43  13.093   0.779 -12.285
  305    HB   VAL  43           HB       VAL  43  12.938   3.419 -13.305
  306   HG11  VAL  43          1HG1      VAL  43  13.422   2.319 -15.426
  307   HG12  VAL  43          2HG1      VAL  43  14.381   1.617 -14.121
  308   HG13  VAL  43          3HG1      VAL  43  12.965   0.763 -14.733
  309   HG21  VAL  43          1HG2      VAL  43  10.467   3.021 -13.242
  310   HG22  VAL  43          2HG2      VAL  43  11.117   3.344 -14.849
  311   HG23  VAL  43          3HG2      VAL  43  10.712   1.694 -14.377
  312    H    THR  44           HN       THR  44  11.501   3.762 -11.151
  313    HA   THR  44           HA       THR  44  12.994   3.922  -8.769
  314    HB   THR  44           HB       THR  44  14.908   4.464 -10.111
  315    HG1  THR  44          1HG       THR  44  13.756   6.824  -8.997
  316   HG21  THR  44          1HG2      THR  44  14.296   6.899 -11.354
  317   HG22  THR  44          2HG2      THR  44  12.959   5.818 -11.748
  318   HG23  THR  44          3HG2      THR  44  14.614   5.351 -12.137
  319    H    GLU  45           HN       GLU  45  11.853   5.138  -7.404
  320    HA   GLU  45           HA       GLU  45  10.590   7.587  -8.213
  321    HB2  GLU  45          2HB       GLU  45   9.068   5.454  -8.771
  322    HB3  GLU  45          3HB       GLU  45   8.630   5.662  -7.081
  323    HG2  GLU  45          2HG       GLU  45   8.488   8.218  -8.143
  324    HG3  GLU  45          3HG       GLU  45   7.823   7.178  -9.401
  325    H    MET  46           HN       MET  46   8.600   7.387  -6.043
  326    HA   MET  46           HA       MET  46  10.079   6.950  -3.616
  327    HB2  MET  46          2HB       MET  46   9.468   9.743  -4.567
  328    HB3  MET  46          3HB       MET  46   9.731   9.367  -2.870
  329    HG2  MET  46          2HG       MET  46  11.936   8.285  -3.756
  330    HG3  MET  46          3HG       MET  46  11.657   9.341  -5.139
  331    HE1  MET  46          1HE       MET  46  10.908  10.467  -1.158
  332    HE2  MET  46          2HE       MET  46  11.829   8.989  -1.435
  333    HE3  MET  46          3HE       MET  46  12.643  10.438  -0.844
  334    H    ALA  47           HN       ALA  47   7.650   5.954  -4.717
  335    HA   ALA  47           HA       ALA  47   5.535   5.433  -4.062
  336    HB1  ALA  47          1HB       ALA  47   5.000   5.521  -1.791
  337    HB2  ALA  47          2HB       ALA  47   6.760   5.403  -1.810
  338    HB3  ALA  47          3HB       ALA  47   5.984   6.960  -1.520
  339    H    HIS  48           HN       HIS  48   4.164   6.486  -5.376
  340    HA   HIS  48           HA       HIS  48   2.876   8.150  -6.275
  341    HB2  HIS  48          2HB       HIS  48   1.363   9.198  -4.699
  342    HB3  HIS  48          3HB       HIS  48   1.624   7.522  -4.223
  343    HD1  HIS  48          1HD       HIS  48   3.066   7.117  -2.075
  344    HD2  HIS  48          2HD       HIS  48   2.191  11.101  -2.863
  345    HE1  HIS  48          1HE       HIS  48   3.606   8.356   0.045
  346    H    THR  49           HN       THR  49   5.025   9.115  -6.962
  347    HA   THR  49           HA       THR  49   5.126  11.886  -6.003
  348    HB   THR  49           HB       THR  49   7.765  11.011  -6.779
  349    HG1  THR  49          1HG       THR  49   6.592   9.673  -4.548
  350   HG21  THR  49          1HG2      THR  49   8.423  12.285  -4.975
  351   HG22  THR  49          2HG2      THR  49   7.018  11.836  -4.008
  352   HG23  THR  49          3HG2      THR  49   6.849  12.997  -5.325
  353    H    GLU  50           HN       GLU  50   7.128  10.079  -8.311
  354    HA   GLU  50           HA       GLU  50   7.023  12.089 -10.278
  355    HB2  GLU  50          2HB       GLU  50   8.082   9.352 -10.066
  356    HB3  GLU  50          3HB       GLU  50   7.652   9.842 -11.699
  357    HG2  GLU  50          2HG       GLU  50   9.195  11.591 -11.709
  358    HG3  GLU  50          3HG       GLU  50   9.365  11.569  -9.954
  359    H    THR  51           HN       THR  51   4.808  12.587 -10.548
  360    HA   THR  51           HA       THR  51   2.921  12.572 -11.847
  361    HB   THR  51           HB       THR  51   3.630   9.868 -12.951
  362    HG1  THR  51          1HG       THR  51   5.397  10.731 -13.722
  363   HG21  THR  51          1HG2      THR  51   1.563  10.524 -13.776
  364   HG22  THR  51          2HG2      THR  51   2.662  11.113 -15.024
  365   HG23  THR  51          3HG2      THR  51   2.009  12.228 -13.825
  366    H    GLY  52           HN       GLY  52   3.739   9.318 -10.639
  367    HA2  GLY  52          1HA       GLY  52   2.284   8.726  -8.633
  368    HA3  GLY  52          2HA       GLY  52   0.946   9.061  -9.722
  369    H    TRP  53           HN       TRP  53   1.815   6.583  -8.290
  370    HA   TRP  53           HA       TRP  53   2.626   4.782 -10.398
  371    HB2  TRP  53          2HB       TRP  53   3.428   4.375  -8.137
  372    HB3  TRP  53          3HB       TRP  53   1.774   4.262  -7.543
  373    HD1  TRP  53          1HD       TRP  53   0.721   1.911  -7.512
  374    HE1  TRP  53          1HE       TRP  53   1.394  -0.401  -8.421
  375    HE3  TRP  53          3HE       TRP  53   4.791   3.283 -10.286
  376    HZ2  TRP  53          2HZ       TRP  53   3.386  -1.498 -10.093
  377    HZ3  TRP  53          3HZ       TRP  53   6.025   1.541 -11.510
  378    HH2  TRP  53          2HH       TRP  53   5.336  -0.800 -11.413
  379    H    SER  54           HN       SER  54   1.381   3.038 -11.196
  380    HA   SER  54           HA       SER  54  -1.436   3.678 -11.444
  381    HB2  SER  54          2HB       SER  54  -0.926   1.284 -12.814
  382    HB3  SER  54          3HB       SER  54  -1.035   2.901 -13.509
  383    HG   SER  54           HG       SER  54   1.011   1.479 -13.703
  384    H    CYS  55           HN       CYS  55  -3.137   2.233 -10.983
  385    HA   CYS  55           HA       CYS  55  -2.586  -0.197  -9.510
  386    HB2  CYS  55          2HB       CYS  55  -4.426   1.580  -8.034
  387    HB3  CYS  55          3HB       CYS  55  -3.221   0.449  -7.428
  388    H    HIS  56           HN       HIS  56  -4.612  -1.360  -8.950
  389    HA   HIS  56           HA       HIS  56  -6.237  -1.837 -11.062
  390    HB2  HIS  56          2HB       HIS  56  -6.101  -2.970  -8.704
  391    HB3  HIS  56          3HB       HIS  56  -7.461  -1.917  -8.327
  392    HD1  HIS  56          1HD       HIS  56  -6.538  -4.969 -10.224
  393    HD2  HIS  56          2HD       HIS  56  -9.853  -2.515  -9.724
  394    HE1  HIS  56          1HE       HIS  56  -8.476  -6.252 -11.185
  395    H    TYR  57           HN       TYR  57  -7.418   0.057  -8.279
  396    HA   TYR  57           HA       TYR  57  -9.589   1.154  -9.752
  397    HB2  TYR  57          2HB       TYR  57  -8.454   2.263  -7.185
  398    HB3  TYR  57          3HB       TYR  57 -10.106   2.388  -7.779
  399    HD1  TYR  57          1HD       TYR  57 -11.390   0.137  -8.060
  400    HD2  TYR  57          2HD       TYR  57  -7.912   0.604  -5.654
  401    HE1  TYR  57          1HE       TYR  57 -12.003  -1.880  -6.793
  402    HE2  TYR  57          2HE       TYR  57  -8.514  -1.412  -4.381
  403    HH   TYR  57           HH       TYR  57 -11.425  -2.721  -4.281
  404    H    CYS  58           HN       CYS  58  -6.387   1.769 -10.013
  405    HA   CYS  58           HA       CYS  58  -6.786   4.617 -10.647
  406    HB2  CYS  58          2HB       CYS  58  -4.361   3.060  -9.787
  407    HB3  CYS  58          3HB       CYS  58  -4.197   4.606 -10.613
  408    H    ASP  59           HN       ASP  59  -7.398   2.202 -12.311
  409    HA   ASP  59           HA       ASP  59  -7.338   1.659 -14.520
  410    HB2  ASP  59          2HB       ASP  59  -6.836   4.399 -14.463
  411    HB3  ASP  59          3HB       ASP  59  -5.559   3.745 -15.484
  412    H    ASN  60           HN       ASN  60  -5.797   1.032 -16.309
  413    HA   ASN  60           HA       ASN  60  -3.021   0.848 -15.840
  414    HB2  ASN  60          2HB       ASN  60  -2.962  -1.668 -15.497
  415    HB3  ASN  60          3HB       ASN  60  -3.478  -0.717 -14.107
  416   HD21  ASN  60          1HD2      ASN  60  -4.870  -1.952 -13.057
  417   HD22  ASN  60          2HD2      ASN  60  -6.249  -2.729 -13.751
  Start of MODEL   17
    1    H1   GLU   1           HN       GLU   1   3.133   4.506   5.551
    2    HA   GLU   1           HA       GLU   1   1.014   2.824   4.394
    3    HB2  GLU   1          2HB       GLU   1   3.159   3.985   2.656
    4    HB3  GLU   1          3HB       GLU   1   1.564   3.394   2.208
    5    HG2  GLU   1          2HG       GLU   1   0.885   5.496   2.166
    6    HG3  GLU   1          3HG       GLU   1   1.075   5.532   3.918
    7    H    MET   2           HN       MET   2   1.554   0.789   4.814
    8    HA   MET   2           HA       MET   2   4.228  -0.133   4.100
    9    HB2  MET   2          2HB       MET   2   3.191  -1.245   6.638
   10    HB3  MET   2          3HB       MET   2   4.845  -0.901   6.152
   11    HG2  MET   2          2HG       MET   2   4.185   1.568   6.409
   12    HG3  MET   2          3HG       MET   2   2.804   0.949   7.312
   13    HE1  MET   2          1HE       MET   2   6.318   1.496   6.835
   14    HE2  MET   2          2HE       MET   2   6.526   2.297   8.392
   15    HE3  MET   2          3HE       MET   2   7.201   0.688   8.131
   16    H    CYS   3           HN       CYS   3   3.961  -1.779   2.758
   17    HA   CYS   3           HA       CYS   3   1.759  -3.017   1.913
   18    HB2  CYS   3          2HB       CYS   3   3.987  -3.519   1.025
   19    HB3  CYS   3          3HB       CYS   3   4.372  -4.434   2.478
   20    H    ASP   4           HN       ASP   4   0.095  -3.924   2.904
   21    HA   ASP   4           HA       ASP   4   0.048  -4.741   5.575
   22    HB2  ASP   4          2HB       ASP   4  -1.875  -4.242   3.805
   23    HB3  ASP   4          3HB       ASP   4  -1.854  -5.996   3.652
   24    H    VAL   5           HN       VAL   5   1.370  -6.294   2.883
   25    HA   VAL   5           HA       VAL   5   1.146  -8.960   4.077
   26    HB   VAL   5           HB       VAL   5   2.285  -8.144   1.400
   27   HG11  VAL   5          1HG1      VAL   5   1.887 -10.812   2.719
   28   HG12  VAL   5          2HG1      VAL   5   2.001 -10.643   0.967
   29   HG13  VAL   5          3HG1      VAL   5   3.349 -10.149   1.991
   30   HG21  VAL   5          1HG2      VAL   5  -0.021  -7.760   1.259
   31   HG22  VAL   5          2HG2      VAL   5   0.191  -9.381   0.594
   32   HG23  VAL   5          3HG2      VAL   5  -0.408  -9.174   2.240
   33    H    CYS   6           HN       CYS   6   3.250  -6.330   3.978
   34    HA   CYS   6           HA       CYS   6   5.426  -7.997   5.025
   35    HB2  CYS   6          2HB       CYS   6   5.778  -5.743   3.038
   36    HB3  CYS   6          3HB       CYS   6   7.082  -6.635   3.815
   37    H    GLU   7           HN       GLU   7   4.627  -4.565   4.447
   38    HA   GLU   7           HA       GLU   7   4.349  -2.855   5.963
   39    HB2  GLU   7          2HB       GLU   7   5.376  -4.528   8.221
   40    HB3  GLU   7          3HB       GLU   7   4.184  -3.236   8.245
   41    HG2  GLU   7          2HG       GLU   7   3.110  -5.259   6.626
   42    HG3  GLU   7          3HG       GLU   7   3.795  -6.061   8.038
   43    H    VAL   8           HN       VAL   8   6.229  -2.222   4.608
   44    HA   VAL   8           HA       VAL   8   8.347  -1.277   6.257
   45    HB   VAL   8           HB       VAL   8   9.964  -2.535   4.413
   46   HG11  VAL   8          1HG1      VAL   8  10.954  -3.552   6.260
   47   HG12  VAL   8          2HG1      VAL   8  10.156  -2.138   6.950
   48   HG13  VAL   8          3HG1      VAL   8   9.418  -3.733   7.105
   49   HG21  VAL   8          1HG2      VAL   8   8.167  -4.682   5.493
   50   HG22  VAL   8          2HG2      VAL   8   7.888  -3.953   3.912
   51   HG23  VAL   8          3HG2      VAL   8   9.400  -4.799   4.237
   52    H    TRP   9           HN       TRP   9   8.029   0.738   5.451
   53    HA   TRP   9           HA       TRP   9   7.887   1.181   2.589
   54    HB2  TRP   9          2HB       TRP   9   6.515   2.760   3.449
   55    HB3  TRP   9          3HB       TRP   9   7.312   2.730   5.020
   56    HD1  TRP   9          1HD       TRP   9   9.304   4.458   5.423
   57    HE1  TRP   9          1HE       TRP   9  10.012   6.597   4.181
   58    HE3  TRP   9          3HE       TRP   9   6.642   3.810   1.107
   59    HZ2  TRP   9          2HZ       TRP   9   9.509   7.846   1.700
   60    HZ3  TRP   9          3HZ       TRP   9   6.809   5.523  -0.651
   61    HH2  TRP   9          2HH       TRP   9   8.214   7.499  -0.359
   62    H    THR  10           HN       THR  10   9.259   2.894   1.597
   63    HA   THR  10           HA       THR  10  11.899   3.203   2.797
   64    HB   THR  10           HB       THR  10  12.499   2.624   0.132
   65    HG1  THR  10          1HG       THR  10  11.538   0.250   0.525
   66   HG21  THR  10          1HG2      THR  10  13.579   2.064   2.487
   67   HG22  THR  10          2HG2      THR  10  13.978   1.131   1.045
   68   HG23  THR  10          3HG2      THR  10  12.802   0.508   2.202
   69    H    ALA  11           HN       ALA  11  11.004   3.589  -0.591
   70    HA   ALA  11           HA       ALA  11  10.176   6.210  -0.657
   71    HB1  ALA  11          1HB       ALA  11  13.033   5.971  -0.104
   72    HB2  ALA  11          2HB       ALA  11  12.662   6.998  -1.490
   73    HB3  ALA  11          3HB       ALA  11  11.950   7.352   0.085
   74    H    GLU  12           HN       GLU  12  12.026   3.654  -2.117
   75    HA   GLU  12           HA       GLU  12  12.356   4.483  -4.708
   76    HB2  GLU  12          2HB       GLU  12  11.732   1.805  -3.516
   77    HB3  GLU  12          3HB       GLU  12  11.822   1.985  -5.263
   78    HG2  GLU  12          2HG       GLU  12  14.116   3.139  -4.687
   79    HG3  GLU  12          3HG       GLU  12  13.969   2.173  -3.220
   80    H    SER  13           HN       SER  13   9.876   2.055  -4.428
   81    HA   SER  13           HA       SER  13   7.765   3.850  -5.280
   82    HB2  SER  13          2HB       SER  13   7.282   2.522  -7.335
   83    HB3  SER  13          3HB       SER  13   8.821   3.379  -7.413
   84    HG   SER  13           HG       SER  13   9.877   1.528  -7.341
   85    H    LEU  14           HN       LEU  14   6.422   3.264  -3.663
   86    HA   LEU  14           HA       LEU  14   5.981   0.433  -3.105
   87    HB2  LEU  14          2HB       LEU  14   5.973   2.782  -1.553
   88    HB3  LEU  14          3HB       LEU  14   4.314   2.185  -1.565
   89    HG   LEU  14           HG       LEU  14   6.766   0.704  -0.621
   90   HD11  LEU  14          1HD1      LEU  14   6.247   1.393   1.426
   91   HD12  LEU  14          2HD1      LEU  14   4.553   0.955   1.216
   92   HD13  LEU  14          3HD1      LEU  14   5.128   2.534   0.681
   93   HD21  LEU  14          1HD2      LEU  14   5.198  -1.082   0.009
   94   HD22  LEU  14          2HD2      LEU  14   5.267  -0.840  -1.737
   95   HD23  LEU  14          3HD2      LEU  14   3.900  -0.216  -0.812
   96    H    PHE  15           HN       PHE  15   3.857  -0.474  -3.042
   97    HA   PHE  15           HA       PHE  15   2.042   0.785  -4.982
   98    HB2  PHE  15          2HB       PHE  15   2.615  -2.072  -4.270
   99    HB3  PHE  15          3HB       PHE  15   1.074  -1.641  -5.003
  100    HD1  PHE  15          1HD       PHE  15   4.662  -0.760  -5.557
  101    HD2  PHE  15          2HD       PHE  15   0.971  -2.034  -7.251
  102    HE1  PHE  15          1HE       PHE  15   5.709  -0.827  -7.783
  103    HE2  PHE  15          2HE       PHE  15   2.012  -2.103  -9.478
  104    HZ   PHE  15           HZ       PHE  15   4.384  -1.499  -9.747
  105    HA   PRO  16           HA       PRO  16  -0.082  -0.020  -5.699
  106    HB2  PRO  16          2HB       PRO  16  -2.157   1.721  -5.878
  107    HB3  PRO  16          3HB       PRO  16  -2.360   0.029  -5.409
  108    HG2  PRO  16          2HG       PRO  16  -2.220   2.470  -3.681
  109    HG3  PRO  16          3HG       PRO  16  -3.312   1.078  -3.564
  110    HD2  PRO  16          2HD       PRO  16  -1.133   1.356  -1.983
  111    HD3  PRO  16          3HD       PRO  16  -1.736  -0.229  -2.506
  112    H    CYS  17           HN       CYS  17  -0.466   3.110  -4.018
  113    HA   CYS  17           HA       CYS  17   1.700   4.256  -5.544
  114    HB2  CYS  17          2HB       CYS  17   0.456   5.979  -6.635
  115    HB3  CYS  17          3HB       CYS  17  -0.332   4.454  -7.029
  116    H    ARG  18           HN       ARG  18   0.834   6.979  -5.078
  117    HA   ARG  18           HA       ARG  18   1.964   7.488  -2.612
  118    HB2  ARG  18          2HB       ARG  18   1.834   9.530  -3.505
  119    HB3  ARG  18          3HB       ARG  18   0.607   8.999  -4.647
  120    HG2  ARG  18          2HG       ARG  18  -0.330  10.791  -3.436
  121    HG3  ARG  18          3HG       ARG  18  -1.083   9.323  -2.811
  122    HD2  ARG  18          2HD       ARG  18  -0.496  10.024  -0.780
  123    HD3  ARG  18          3HD       ARG  18   1.167   9.655  -1.230
  124    HE   ARG  18           HE       ARG  18   1.589  11.906  -1.422
  125   HH11  ARG  18          1HH1      ARG  18  -1.842  11.374  -1.167
  126   HH12  ARG  18          2HH1      ARG  18  -2.219  13.052  -0.963
  127   HH21  ARG  18          1HH2      ARG  18   1.106  14.119  -1.154
  128   HH22  ARG  18          2HH2      ARG  18  -0.542  14.614  -0.957
  129    H    VAL  19           HN       VAL  19  -1.423   6.937  -3.425
  130    HA   VAL  19           HA       VAL  19  -1.983   6.568  -0.569
  131    HB   VAL  19           HB       VAL  19  -2.938   8.657  -0.732
  132   HG11  VAL  19          1HG1      VAL  19  -2.856   8.135  -3.536
  133   HG12  VAL  19          2HG1      VAL  19  -4.457   8.741  -3.110
  134   HG13  VAL  19          3HG1      VAL  19  -3.021   9.679  -2.700
  135   HG21  VAL  19          1HG2      VAL  19  -4.640   6.577  -0.483
  136   HG22  VAL  19          2HG2      VAL  19  -5.120   8.266  -0.311
  137   HG23  VAL  19          3HG2      VAL  19  -5.374   7.428  -1.843
  138    H    CYS  20           HN       CYS  20  -4.305   6.669  -3.209
  139    HA   CYS  20           HA       CYS  20  -5.816   5.116  -3.925
  140    HB2  CYS  20          2HB       CYS  20  -3.151   4.105  -4.345
  141    HB3  CYS  20          3HB       CYS  20  -4.258   2.768  -4.050
  142    H    THR  21           HN       THR  21  -6.045   2.378  -3.536
  143    HA   THR  21           HA       THR  21  -7.163   2.317  -0.891
  144    HB   THR  21           HB       THR  21  -7.803  -0.034  -1.491
  145    HG1  THR  21          1HG       THR  21  -6.726   0.645  -4.041
  146   HG21  THR  21          1HG2      THR  21  -9.343   0.661  -3.374
  147   HG22  THR  21          2HG2      THR  21  -8.532   2.227  -3.345
  148   HG23  THR  21          3HG2      THR  21  -9.409   1.662  -1.924
  149    H    ARG  22           HN       ARG  22  -6.185   1.666   0.904
  150    HA   ARG  22           HA       ARG  22  -4.377   1.054   2.215
  151    HB2  ARG  22          2HB       ARG  22  -6.004  -1.001   1.590
  152    HB3  ARG  22          3HB       ARG  22  -4.483  -1.636   0.980
  153    HG2  ARG  22          2HG       ARG  22  -3.668  -1.996   3.032
  154    HG3  ARG  22          3HG       ARG  22  -4.309  -0.476   3.660
  155    HD2  ARG  22          2HD       ARG  22  -6.236  -2.644   3.020
  156    HD3  ARG  22          3HD       ARG  22  -5.230  -2.832   4.456
  157    HE   ARG  22           HE       ARG  22  -7.452  -1.084   4.147
  158   HH11  ARG  22          1HH1      ARG  22  -4.346  -1.390   5.687
  159   HH12  ARG  22          2HH1      ARG  22  -4.745  -0.327   6.996
  160   HH21  ARG  22          1HH2      ARG  22  -7.989   0.318   5.865
  161   HH22  ARG  22          2HH2      ARG  22  -6.818   0.643   7.097
  162    H    VAL  23           HN       VAL  23  -2.650  -1.256   1.560
  163    HA   VAL  23           HA       VAL  23  -1.026  -0.214  -0.639
  164    HB   VAL  23           HB       VAL  23   1.035  -0.399   0.734
  165   HG11  VAL  23          1HG1      VAL  23  -0.449   1.580   2.283
  166   HG12  VAL  23          2HG1      VAL  23   0.913   1.791   1.182
  167   HG13  VAL  23          3HG1      VAL  23  -0.729   1.690   0.546
  168   HG21  VAL  23          1HG2      VAL  23   0.189  -1.901   2.458
  169   HG22  VAL  23          2HG2      VAL  23   0.843  -0.430   3.176
  170   HG23  VAL  23          3HG2      VAL  23  -0.902  -0.640   3.035
  171    H    PHE  24           HN       PHE  24  -0.266  -1.798  -1.882
  172    HA   PHE  24           HA       PHE  24   0.272  -4.427  -0.736
  173    HB2  PHE  24          2HB       PHE  24  -1.060  -4.799  -3.259
  174    HB3  PHE  24          3HB       PHE  24  -1.465  -5.471  -1.683
  175    HD1  PHE  24          1HD       PHE  24  -3.218  -4.558  -0.361
  176    HD2  PHE  24          2HD       PHE  24  -2.042  -2.666  -3.988
  177    HE1  PHE  24          1HE       PHE  24  -5.241  -3.160  -0.283
  178    HE2  PHE  24          2HE       PHE  24  -4.064  -1.264  -3.916
  179    HZ   PHE  24           HZ       PHE  24  -5.665  -1.510  -2.062
  180    H    HIS  25           HN       HIS  25   2.315  -4.788  -1.280
  181    HA   HIS  25           HA       HIS  25   3.859  -3.534  -3.138
  182    HB2  HIS  25          2HB       HIS  25   3.978  -6.293  -1.975
  183    HB3  HIS  25          3HB       HIS  25   5.131  -5.826  -3.222
  184    HD2  HIS  25          2HD       HIS  25   4.646  -2.746  -1.201
  185    HE1  HIS  25          1HE       HIS  25   7.755  -4.860   0.764
  186    HE2  HIS  25          2HE       HIS  25   6.489  -2.688   0.612
  187    H    ASP  26           HN       ASP  26   4.883  -4.572  -5.135
  188    HA   ASP  26           HA       ASP  26   2.734  -5.175  -6.985
  189    HB2  ASP  26          2HB       ASP  26   4.044  -4.201  -8.525
  190    HB3  ASP  26          3HB       ASP  26   5.098  -3.747  -7.190
  191    H    GLY  27           HN       GLY  27   5.347  -6.811  -5.386
  192    HA2  GLY  27          1HA       GLY  27   5.122  -9.148  -7.123
  193    HA3  GLY  27          2HA       GLY  27   6.284  -8.926  -5.824
  194    H    CYS  28           HN       CYS  28   4.533  -8.262  -3.743
  195    HA   CYS  28           HA       CYS  28   3.858 -10.736  -2.718
  196    HB2  CYS  28          2HB       CYS  28   2.875  -7.964  -2.075
  197    HB3  CYS  28          3HB       CYS  28   2.293  -9.371  -1.190
  198    H    LEU  29           HN       LEU  29   1.675  -8.353  -4.216
  199    HA   LEU  29           HA       LEU  29  -0.733  -9.586  -4.011
  200    HB2  LEU  29          2HB       LEU  29   0.357  -8.249  -6.484
  201    HB3  LEU  29          3HB       LEU  29  -1.348  -8.557  -6.156
  202    HG   LEU  29           HG       LEU  29   0.283  -6.867  -4.293
  203   HD11  LEU  29          1HD1      LEU  29  -0.414  -4.890  -5.545
  204   HD12  LEU  29          2HD1      LEU  29  -1.108  -5.922  -6.796
  205   HD13  LEU  29          3HD1      LEU  29   0.633  -5.928  -6.515
  206   HD21  LEU  29          1HD2      LEU  29  -2.374  -5.979  -4.691
  207   HD22  LEU  29          2HD2      LEU  29  -1.668  -6.711  -3.249
  208   HD23  LEU  29          3HD2      LEU  29  -2.425  -7.728  -4.476
  209    H    ARG  30           HN       ARG  30   1.985 -10.671  -5.844
  210    HA   ARG  30           HA       ARG  30   0.402 -12.606  -7.343
  211    HB2  ARG  30          2HB       ARG  30   2.028 -12.347  -8.847
  212    HB3  ARG  30          3HB       ARG  30   2.903 -11.300  -7.738
  213    HG2  ARG  30          2HG       ARG  30   3.952 -13.288  -6.730
  214    HG3  ARG  30          3HG       ARG  30   3.120 -14.298  -7.915
  215    HD2  ARG  30          2HD       ARG  30   4.408 -13.537  -9.665
  216    HD3  ARG  30          3HD       ARG  30   4.783 -12.013  -8.864
  217    HE   ARG  30           HE       ARG  30   6.041 -13.797  -7.303
  218   HH11  ARG  30          1HH1      ARG  30   6.000 -13.331 -10.753
  219   HH12  ARG  30          2HH1      ARG  30   7.609 -13.929 -10.984
  220   HH21  ARG  30          1HH2      ARG  30   8.161 -14.587  -7.595
  221   HH22  ARG  30          2HH2      ARG  30   8.837 -14.644  -9.187
  222    H    ARG  31           HN       ARG  31   2.896 -12.521  -4.834
  223    HA   ARG  31           HA       ARG  31   3.317 -15.263  -4.559
  224    HB2  ARG  31          2HB       ARG  31   3.692 -12.882  -2.824
  225    HB3  ARG  31          3HB       ARG  31   3.704 -14.453  -2.033
  226    HG2  ARG  31          2HG       ARG  31   5.443 -15.144  -3.739
  227    HG3  ARG  31          3HG       ARG  31   5.550 -13.437  -4.171
  228    HD2  ARG  31          2HD       ARG  31   5.815 -14.311  -1.319
  229    HD3  ARG  31          3HD       ARG  31   7.191 -14.406  -2.417
  230    HE   ARG  31           HE       ARG  31   6.269 -11.859  -2.714
  231   HH11  ARG  31          1HH1      ARG  31   7.295 -13.797  -0.010
  232   HH12  ARG  31          2HH1      ARG  31   7.879 -12.446   0.905
  233   HH21  ARG  31          1HH2      ARG  31   7.036 -10.072  -1.521
  234   HH22  ARG  31          2HH2      ARG  31   7.730 -10.328   0.045
  235    H    MET  32           HN       MET  32   1.277 -13.226  -2.451
  236    HA   MET  32           HA       MET  32   0.050 -15.292  -1.063
  237    HB2  MET  32          2HB       MET  32  -1.206 -12.639  -1.783
  238    HB3  MET  32          3HB       MET  32  -1.656 -13.680  -0.439
  239    HG2  MET  32          2HG       MET  32   1.154 -12.755  -0.566
  240    HG3  MET  32          3HG       MET  32  -0.082 -11.569  -0.149
  241    HE1  MET  32          1HE       MET  32  -1.948 -13.558   2.619
  242    HE2  MET  32          2HE       MET  32  -1.434 -11.873   2.676
  243    HE3  MET  32          3HE       MET  32  -2.102 -12.540   1.186
  244    H    GLY  33           HN       GLY  33  -1.058 -13.622  -4.004
  245    HA2  GLY  33          1HA       GLY  33  -1.999 -15.167  -5.728
  246    HA3  GLY  33          2HA       GLY  33  -2.950 -15.855  -4.420
  247    H    TYR  34           HN       TYR  34  -2.464 -12.453  -4.375
  248    HA   TYR  34           HA       TYR  34  -5.243 -11.922  -4.500
  249    HB2  TYR  34          2HB       TYR  34  -2.761 -10.303  -4.294
  250    HB3  TYR  34          3HB       TYR  34  -4.202  -9.478  -4.877
  251    HD1  TYR  34          1HD       TYR  34  -2.406 -10.529  -2.009
  252    HD2  TYR  34          2HD       TYR  34  -6.341  -9.740  -3.422
  253    HE1  TYR  34          1HE       TYR  34  -3.178 -10.259   0.310
  254    HE2  TYR  34          2HE       TYR  34  -7.124  -9.466  -1.107
  255    HH   TYR  34           HH       TYR  34  -5.380  -8.827   1.362
  256    H    ILE  35           HN       ILE  35  -2.748 -12.097  -6.890
  257    HA   ILE  35           HA       ILE  35  -4.718 -11.385  -8.950
  258    HB   ILE  35           HB       ILE  35  -2.941 -10.289 -10.272
  259   HG12  ILE  35          2HG1      ILE  35  -1.244 -10.060  -7.826
  260   HG13  ILE  35          3HG1      ILE  35  -1.145 -11.539  -8.774
  261   HG21  ILE  35          1HG2      ILE  35  -3.654  -8.362  -9.428
  262   HG22  ILE  35          2HG2      ILE  35  -4.357  -9.273  -8.092
  263   HG23  ILE  35          3HG2      ILE  35  -2.730  -8.607  -7.946
  264   HD11  ILE  35          1HD1      ILE  35   0.206 -10.550 -10.210
  265   HD12  ILE  35          2HD1      ILE  35  -1.003  -9.305 -10.533
  266   HD13  ILE  35          3HD1      ILE  35   0.157  -9.090  -9.222
  267    H    GLN  36           HN       GLN  36  -4.640 -12.582 -10.814
  268    HA   GLN  36           HA       GLN  36  -3.448 -15.147 -10.667
  269    HB2  GLN  36          2HB       GLN  36  -4.567 -13.817 -13.135
  270    HB3  GLN  36          3HB       GLN  36  -4.401 -15.542 -12.836
  271    HG2  GLN  36          2HG       GLN  36  -6.031 -15.326 -10.982
  272    HG3  GLN  36          3HG       GLN  36  -6.261 -13.638 -11.436
  273   HE21  GLN  36          1HE2      GLN  36  -8.156 -15.869 -11.396
  274   HE22  GLN  36          2HE2      GLN  36  -8.793 -15.975 -12.998
  275    H    GLY  37           HN       GLY  37  -2.710 -12.261 -12.603
  276    HA2  GLY  37          1HA       GLY  37  -0.342 -11.714 -12.914
  277    HA3  GLY  37          2HA       GLY  37  -0.049 -13.434 -13.123
  278    H    ASP  38           HN       ASP  38   0.668 -13.631 -15.153
  279    HA   ASP  38           HA       ASP  38   0.448 -13.873 -17.428
  280    HB2  ASP  38          2HB       ASP  38  -2.138 -13.699 -16.756
  281    HB3  ASP  38          3HB       ASP  38  -1.982 -12.171 -17.619
  282    H    SER  39           HN       SER  39   1.625 -12.755 -18.846
  283    HA   SER  39           HA       SER  39   2.570 -11.014 -19.984
  284    HB2  SER  39          2HB       SER  39   0.040  -9.978 -19.192
  285    HB3  SER  39          3HB       SER  39   1.244  -8.720 -18.911
  286    HG   SER  39           HG       SER  39   1.961  -9.393 -21.161
  287    H    ALA  40           HN       ALA  40   3.138  -8.408 -19.148
  288    HA   ALA  40           HA       ALA  40   4.134  -8.298 -16.492
  289    HB1  ALA  40          1HB       ALA  40   5.840  -9.769 -16.987
  290    HB2  ALA  40          2HB       ALA  40   5.997  -9.196 -18.649
  291    HB3  ALA  40          3HB       ALA  40   6.601  -8.212 -17.316
  292    H    ALA  41           HN       ALA  41   5.268  -6.314 -16.041
  293    HA   ALA  41           HA       ALA  41   5.634  -4.357 -18.108
  294    HB1  ALA  41          1HB       ALA  41   3.381  -3.896 -18.074
  295    HB2  ALA  41          2HB       ALA  41   3.221  -4.269 -16.357
  296    HB3  ALA  41          3HB       ALA  41   3.984  -2.763 -16.864
  297    H    GLU  42           HN       GLU  42   4.564  -3.264 -15.011
  298    HA   GLU  42           HA       GLU  42   5.705  -1.904 -13.535
  299    HB2  GLU  42          2HB       GLU  42   7.767  -3.852 -12.956
  300    HB3  GLU  42          3HB       GLU  42   6.420  -3.321 -11.958
  301    HG2  GLU  42          2HG       GLU  42   4.960  -4.928 -12.966
  302    HG3  GLU  42          3HG       GLU  42   6.195  -5.379 -14.138
  303    H    VAL  43           HN       VAL  43   6.592  -1.446 -16.194
  304    HA   VAL  43           HA       VAL  43   9.306  -1.525 -16.664
  305    HB   VAL  43           HB       VAL  43   7.387   0.694 -17.387
  306   HG11  VAL  43          1HG1      VAL  43  10.246   0.281 -17.944
  307   HG12  VAL  43          2HG1      VAL  43   9.254   0.697 -19.343
  308   HG13  VAL  43          3HG1      VAL  43   9.292   1.764 -17.938
  309   HG21  VAL  43          1HG2      VAL  43   6.583  -1.320 -18.319
  310   HG22  VAL  43          2HG2      VAL  43   7.449  -0.505 -19.621
  311   HG23  VAL  43          3HG2      VAL  43   8.204  -1.851 -18.767
  312    H    THR  44           HN       THR  44   7.695   1.458 -15.573
  313    HA   THR  44           HA       THR  44   9.849   1.894 -13.639
  314    HB   THR  44           HB       THR  44  10.367   3.053 -15.863
  315    HG1  THR  44          1HG       THR  44  11.404   3.691 -13.960
  316   HG21  THR  44          1HG2      THR  44   9.234   5.129 -16.325
  317   HG22  THR  44          2HG2      THR  44   8.228   4.948 -14.887
  318   HG23  THR  44          3HG2      THR  44   8.034   3.839 -16.245
  319    H    GLU  45           HN       GLU  45   9.078   2.584 -11.751
  320    HA   GLU  45           HA       GLU  45   6.636   4.188 -11.679
  321    HB2  GLU  45          2HB       GLU  45   6.506   1.489 -11.209
  322    HB3  GLU  45          3HB       GLU  45   6.716   2.132  -9.587
  323    HG2  GLU  45          2HG       GLU  45   4.795   3.669 -10.043
  324    HG3  GLU  45          3HG       GLU  45   4.531   2.783 -11.545
  325    H    MET  46           HN       MET  46   6.390   5.444  -9.793
  326    HA   MET  46           HA       MET  46   8.776   5.554  -8.068
  327    HB2  MET  46          2HB       MET  46   7.141   7.954  -8.887
  328    HB3  MET  46          3HB       MET  46   8.687   7.943  -8.048
  329    HG2  MET  46          2HG       MET  46   9.521   6.738 -10.206
  330    HG3  MET  46          3HG       MET  46   8.089   7.473 -10.926
  331    HE1  MET  46          1HE       MET  46   7.594  10.202 -10.343
  332    HE2  MET  46          2HE       MET  46   8.224  10.044  -8.704
  333    HE3  MET  46          3HE       MET  46   8.878  11.276  -9.785
  334    H    ALA  47           HN       ALA  47   7.145   7.955  -6.892
  335    HA   ALA  47           HA       ALA  47   4.888   6.785  -5.622
  336    HB1  ALA  47          1HB       ALA  47   6.354   7.204  -3.317
  337    HB2  ALA  47          2HB       ALA  47   5.913   5.642  -4.008
  338    HB3  ALA  47          3HB       ALA  47   7.478   6.363  -4.386
  339    H    HIS  48           HN       HIS  48   5.799   9.249  -6.974
  340    HA   HIS  48           HA       HIS  48   4.636  11.129  -5.091
  341    HB2  HIS  48          2HB       HIS  48   7.329  11.023  -5.091
  342    HB3  HIS  48          3HB       HIS  48   7.081  12.156  -6.416
  343    HD1  HIS  48          1HD       HIS  48   8.210  13.959  -4.839
  344    HD2  HIS  48          2HD       HIS  48   4.541  12.501  -3.544
  345    HE1  HIS  48          1HE       HIS  48   7.429  15.573  -3.075
  346    H    THR  49           HN       THR  49   5.321  13.454  -6.576
  347    HA   THR  49           HA       THR  49   4.803  14.636  -8.470
  348    HB   THR  49           HB       THR  49   3.836  12.356 -10.072
  349    HG1  THR  49          1HG       THR  49   6.152  11.755 -10.387
  350   HG21  THR  49          1HG2      THR  49   4.622  14.884 -10.615
  351   HG22  THR  49          2HG2      THR  49   4.659  13.572 -11.793
  352   HG23  THR  49          3HG2      THR  49   6.125  14.012 -10.919
  353    H    GLU  50           HN       GLU  50   2.694  13.917 -10.346
  354    HA   GLU  50           HA       GLU  50   0.375  14.153  -8.541
  355    HB2  GLU  50          2HB       GLU  50   1.137  16.123 -10.108
  356    HB3  GLU  50          3HB       GLU  50   0.322  15.184 -11.350
  357    HG2  GLU  50          2HG       GLU  50  -1.743  15.248 -10.055
  358    HG3  GLU  50          3HG       GLU  50  -0.928  16.180  -8.800
  359    H    THR  51           HN       THR  51   1.582  12.801 -11.562
  360    HA   THR  51           HA       THR  51  -0.457  10.711 -11.386
  361    HB   THR  51           HB       THR  51  -0.951  10.835 -13.786
  362    HG1  THR  51          1HG       THR  51   0.535  11.875 -14.894
  363   HG21  THR  51          1HG2      THR  51  -1.431  13.337 -12.176
  364   HG22  THR  51          2HG2      THR  51  -2.518  11.967 -12.411
  365   HG23  THR  51          3HG2      THR  51  -2.170  13.057 -13.753
  366    H    GLY  52           HN       GLY  52   0.016   8.991 -13.158
  367    HA2  GLY  52          1HA       GLY  52   1.735   7.953 -14.522
  368    HA3  GLY  52          2HA       GLY  52   2.935   8.700 -13.478
  369    H    TRP  53           HN       TRP  53   0.333   7.539 -11.696
  370    HA   TRP  53           HA       TRP  53   1.708   4.983 -11.190
  371    HB2  TRP  53          2HB       TRP  53   0.781   5.371  -8.766
  372    HB3  TRP  53          3HB       TRP  53   2.285   6.138  -9.269
  373    HD1  TRP  53          1HD       TRP  53  -1.074   7.577 -10.389
  374    HE1  TRP  53          1HE       TRP  53  -1.400   9.874  -9.274
  375    HE3  TRP  53          3HE       TRP  53   2.930   7.512  -7.211
  376    HZ2  TRP  53          2HZ       TRP  53  -0.128  11.450  -7.309
  377    HZ3  TRP  53          3HZ       TRP  53   3.304   9.453  -5.747
  378    HH2  TRP  53          2HH       TRP  53   1.807  11.381  -5.797
  379    H    SER  54           HN       SER  54   0.273   3.760 -12.382
  380    HA   SER  54           HA       SER  54  -2.573   4.001 -11.999
  381    HB2  SER  54          2HB       SER  54  -1.902   1.550 -13.299
  382    HB3  SER  54          3HB       SER  54  -2.601   3.007 -14.004
  383    HG   SER  54           HG       SER  54   0.135   2.333 -13.732
  384    H    CYS  55           HN       CYS  55  -3.944   2.499 -11.030
  385    HA   CYS  55           HA       CYS  55  -2.856   0.205  -9.651
  386    HB2  CYS  55          2HB       CYS  55  -4.354   2.003  -7.831
  387    HB3  CYS  55          3HB       CYS  55  -3.021   0.906  -7.487
  388    H    HIS  56           HN       HIS  56  -4.486  -1.197  -8.806
  389    HA   HIS  56           HA       HIS  56  -6.628  -1.727 -10.345
  390    HB2  HIS  56          2HB       HIS  56  -5.724  -2.979  -8.260
  391    HB3  HIS  56          3HB       HIS  56  -6.918  -2.038  -7.370
  392    HD1  HIS  56          1HD       HIS  56  -6.750  -5.257  -8.186
  393    HD2  HIS  56          2HD       HIS  56  -9.432  -2.349  -9.455
  394    HE1  HIS  56          1HE       HIS  56  -8.799  -6.512  -8.929
  395    H    TYR  57           HN       TYR  57  -6.951   0.084  -7.285
  396    HA   TYR  57           HA       TYR  57  -9.481   1.185  -8.268
  397    HB2  TYR  57          2HB       TYR  57  -8.364   1.562  -5.498
  398    HB3  TYR  57          3HB       TYR  57 -10.040   1.662  -6.026
  399    HD1  TYR  57          1HD       TYR  57  -7.237  -0.700  -5.458
  400    HD2  TYR  57          2HD       TYR  57 -11.433  -0.240  -5.994
  401    HE1  TYR  57          1HE       TYR  57  -7.571  -3.051  -4.818
  402    HE2  TYR  57          2HE       TYR  57 -11.779  -2.589  -5.355
  403    HH   TYR  57           HH       TYR  57  -9.425  -4.847  -5.313
  404    H    CYS  58           HN       CYS  58  -7.077   2.140  -9.428
  405    HA   CYS  58           HA       CYS  58  -6.554   4.730  -8.215
  406    HB2  CYS  58          2HB       CYS  58  -4.874   3.092  -9.454
  407    HB3  CYS  58          3HB       CYS  58  -5.441   3.961 -10.875
  408    H    ASP  59           HN       ASP  59  -7.695   3.505 -11.360
  409    HA   ASP  59           HA       ASP  59  -9.294   5.953 -11.638
  410    HB2  ASP  59          2HB       ASP  59  -7.838   4.718 -13.972
  411    HB3  ASP  59          3HB       ASP  59  -8.647   6.280 -13.900
  412    H    ASN  60           HN       ASN  60 -10.707   5.587 -13.797
  413    HA   ASN  60           HA       ASN  60 -11.696   2.847 -13.916
  414    HB2  ASN  60          2HB       ASN  60 -13.675   5.067 -13.467
  415    HB3  ASN  60          3HB       ASN  60 -13.904   3.330 -13.281
  416   HD21  ASN  60          1HD2      ASN  60 -12.089   6.058 -11.952
  417   HD22  ASN  60          2HD2      ASN  60 -12.081   5.484 -10.323
  Start of MODEL   18
    1    H1   GLU   1           HN       GLU   1   3.152   5.322   4.018
    2    HA   GLU   1           HA       GLU   1   1.846   3.478   3.763
    3    HB2  GLU   1          2HB       GLU   1   3.141   3.617   1.051
    4    HB3  GLU   1          3HB       GLU   1   2.013   2.331   1.461
    5    HG2  GLU   1          2HG       GLU   1   0.610   3.837   0.479
    6    HG3  GLU   1          3HG       GLU   1   0.469   4.313   2.171
    7    H    MET   2           HN       MET   2   1.962   1.400   4.430
    8    HA   MET   2           HA       MET   2   4.543   0.012   4.147
    9    HB2  MET   2          2HB       MET   2   2.941  -0.444   6.612
   10    HB3  MET   2          3HB       MET   2   4.683  -0.497   6.378
   11    HG2  MET   2          2HG       MET   2   4.332   2.100   5.998
   12    HG3  MET   2          3HG       MET   2   2.916   1.795   7.001
   13    HE1  MET   2          1HE       MET   2   7.255   0.950   8.074
   14    HE2  MET   2          2HE       MET   2   6.529   1.135   6.477
   15    HE3  MET   2          3HE       MET   2   6.916   2.562   7.441
   16    H    CYS   3           HN       CYS   3   4.130  -1.633   2.814
   17    HA   CYS   3           HA       CYS   3   1.839  -2.800   2.051
   18    HB2  CYS   3          2HB       CYS   3   4.029  -3.447   1.162
   19    HB3  CYS   3          3HB       CYS   3   4.400  -4.289   2.663
   20    H    ASP   4           HN       ASP   4   0.155  -3.560   3.131
   21    HA   ASP   4           HA       ASP   4   0.129  -4.216   5.845
   22    HB2  ASP   4          2HB       ASP   4  -1.802  -3.747   4.059
   23    HB3  ASP   4          3HB       ASP   4  -1.874  -5.507   4.062
   24    H    VAL   5           HN       VAL   5   1.349  -5.975   3.242
   25    HA   VAL   5           HA       VAL   5   1.021  -8.556   4.595
   26    HB   VAL   5           HB       VAL   5   2.142  -7.965   1.851
   27   HG11  VAL   5          1HG1      VAL   5   1.797 -10.432   1.536
   28   HG12  VAL   5          2HG1      VAL   5   3.088  -9.996   2.658
   29   HG13  VAL   5          3HG1      VAL   5   1.530 -10.548   3.275
   30   HG21  VAL   5          1HG2      VAL   5  -0.006  -9.032   1.093
   31   HG22  VAL   5          2HG2      VAL   5  -0.581  -8.885   2.753
   32   HG23  VAL   5          3HG2      VAL   5  -0.177  -7.439   1.830
   33    H    CYS   6           HN       CYS   6   3.242  -6.037   4.270
   34    HA   CYS   6           HA       CYS   6   5.365  -7.735   5.379
   35    HB2  CYS   6          2HB       CYS   6   5.780  -5.617   3.257
   36    HB3  CYS   6          3HB       CYS   6   7.051  -6.546   4.046
   37    H    GLU   7           HN       GLU   7   4.671  -4.316   4.615
   38    HA   GLU   7           HA       GLU   7   4.505  -2.510   6.032
   39    HB2  GLU   7          2HB       GLU   7   5.552  -4.110   8.340
   40    HB3  GLU   7          3HB       GLU   7   4.447  -2.743   8.350
   41    HG2  GLU   7          2HG       GLU   7   3.197  -4.799   6.883
   42    HG3  GLU   7          3HG       GLU   7   3.859  -5.528   8.345
   43    H    VAL   8           HN       VAL   8   6.408  -2.182   4.512
   44    HA   VAL   8           HA       VAL   8   8.554  -1.049   5.976
   45    HB   VAL   8           HB       VAL   8  10.025  -2.791   4.309
   46   HG11  VAL   8          1HG1      VAL   8  11.183  -3.328   6.304
   47   HG12  VAL   8          2HG1      VAL   8  10.653  -1.654   6.473
   48   HG13  VAL   8          3HG1      VAL   8   9.783  -2.944   7.305
   49   HG21  VAL   8          1HG2      VAL   8   8.397  -4.423   6.225
   50   HG22  VAL   8          2HG2      VAL   8   7.879  -4.190   4.556
   51   HG23  VAL   8          3HG2      VAL   8   9.425  -4.967   4.899
   52    H    TRP   9           HN       TRP   9   8.903   0.741   4.857
   53    HA   TRP   9           HA       TRP   9   8.500   0.734   1.961
   54    HB2  TRP   9          2HB       TRP   9   7.431   2.631   2.558
   55    HB3  TRP   9          3HB       TRP   9   8.272   2.727   4.101
   56    HD1  TRP   9          1HD       TRP   9  10.354   4.318   4.259
   57    HE1  TRP   9          1HE       TRP   9  11.387   6.047   2.655
   58    HE3  TRP   9          3HE       TRP   9   7.840   3.067  -0.012
   59    HZ2  TRP   9          2HZ       TRP   9  11.164   6.783  -0.061
   60    HZ3  TRP   9          3HZ       TRP   9   8.307   4.333  -2.071
   61    HH2  TRP   9          2HH       TRP   9   9.935   6.152  -2.092
   62    H    THR  10           HN       THR  10  10.033   2.029   0.631
   63    HA   THR  10           HA       THR  10  12.729   2.314   1.631
   64    HB   THR  10           HB       THR  10  12.978   0.772  -0.776
   65    HG1  THR  10          1HG       THR  10  11.059  -0.265  -0.178
   66   HG21  THR  10          1HG2      THR  10  14.381  -0.648   0.697
   67   HG22  THR  10          2HG2      THR  10  13.817   0.285   2.083
   68   HG23  THR  10          3HG2      THR  10  14.768   1.067   0.822
   69    H    ALA  11           HN       ALA  11  11.580   1.704  -1.666
   70    HA   ALA  11           HA       ALA  11  11.160   4.299  -2.519
   71    HB1  ALA  11          1HB       ALA  11  13.969   3.698  -2.133
   72    HB2  ALA  11          2HB       ALA  11  13.614   4.177  -3.793
   73    HB3  ALA  11          3HB       ALA  11  13.177   5.241  -2.457
   74    H    GLU  12           HN       GLU  12  12.369   1.106  -3.236
   75    HA   GLU  12           HA       GLU  12  12.509   0.848  -5.885
   76    HB2  GLU  12          2HB       GLU  12  10.616  -1.029  -4.533
   77    HB3  GLU  12          3HB       GLU  12  11.900  -1.377  -5.682
   78    HG2  GLU  12          2HG       GLU  12  13.482  -0.620  -3.787
   79    HG3  GLU  12          3HG       GLU  12  12.085  -0.876  -2.743
   80    H    SER  13           HN       SER  13   9.335   0.572  -4.274
   81    HA   SER  13           HA       SER  13   7.851   2.366  -5.633
   82    HB2  SER  13          2HB       SER  13   8.578   0.103  -7.396
   83    HB3  SER  13          3HB       SER  13   6.879   0.574  -7.422
   84    HG   SER  13           HG       SER  13   7.430   2.240  -8.559
   85    H    LEU  14           HN       LEU  14   6.800   2.130  -3.636
   86    HA   LEU  14           HA       LEU  14   5.611  -0.294  -2.769
   87    HB2  LEU  14          2HB       LEU  14   5.886   2.376  -1.817
   88    HB3  LEU  14          3HB       LEU  14   4.188   1.916  -1.707
   89    HG   LEU  14           HG       LEU  14   6.475   0.368  -0.491
   90   HD11  LEU  14          1HD1      LEU  14   5.920   2.704   0.442
   91   HD12  LEU  14          2HD1      LEU  14   6.004   1.346   1.562
   92   HD13  LEU  14          3HD1      LEU  14   4.437   1.951   1.028
   93   HD21  LEU  14          1HD2      LEU  14   5.010  -1.244  -0.061
   94   HD22  LEU  14          2HD2      LEU  14   3.863  -0.414  -1.114
   95   HD23  LEU  14          3HD2      LEU  14   3.862  -0.092   0.621
   96    H    PHE  15           HN       PHE  15   3.500  -1.012  -2.882
   97    HA   PHE  15           HA       PHE  15   1.833   0.311  -4.919
   98    HB2  PHE  15          2HB       PHE  15   2.328  -2.568  -4.277
   99    HB3  PHE  15          3HB       PHE  15   0.771  -2.103  -4.955
  100    HD1  PHE  15          1HD       PHE  15   4.410  -1.546  -5.564
  101    HD2  PHE  15          2HD       PHE  15   0.542  -2.150  -7.236
  102    HE1  PHE  15          1HE       PHE  15   5.393  -1.573  -7.819
  103    HE2  PHE  15          2HE       PHE  15   1.519  -2.180  -9.494
  104    HZ   PHE  15           HZ       PHE  15   3.947  -1.891  -9.788
  105    HA   PRO  16           HA       PRO  16  -0.299  -0.394  -5.710
  106    HB2  PRO  16          2HB       PRO  16  -2.298   1.431  -5.914
  107    HB3  PRO  16          3HB       PRO  16  -2.581  -0.260  -5.483
  108    HG2  PRO  16          2HG       PRO  16  -2.395   2.142  -3.707
  109    HG3  PRO  16          3HG       PRO  16  -3.544   0.794  -3.647
  110    HD2  PRO  16          2HD       PRO  16  -1.402   0.955  -2.000
  111    HD3  PRO  16          3HD       PRO  16  -2.054  -0.596  -2.570
  112    H    CYS  17           HN       CYS  17  -0.603   2.714  -3.977
  113    HA   CYS  17           HA       CYS  17   1.632   3.800  -5.464
  114    HB2  CYS  17          2HB       CYS  17  -0.845   5.459  -5.588
  115    HB3  CYS  17          3HB       CYS  17   0.536   5.419  -6.682
  116    H    ARG  18           HN       ARG  18   0.726   6.553  -4.864
  117    HA   ARG  18           HA       ARG  18   1.805   6.728  -2.224
  118    HB2  ARG  18          2HB       ARG  18   2.423   8.558  -3.475
  119    HB3  ARG  18          3HB       ARG  18   0.865   8.664  -4.285
  120    HG2  ARG  18          2HG       ARG  18   1.363  10.540  -2.725
  121    HG3  ARG  18          3HG       ARG  18  -0.143   9.684  -2.387
  122    HD2  ARG  18          2HD       ARG  18   0.586   9.495  -0.289
  123    HD3  ARG  18          3HD       ARG  18   1.738   8.309  -0.904
  124    HE   ARG  18           HE       ARG  18   2.919  10.765  -1.284
  125   HH11  ARG  18          1HH1      ARG  18   1.709   8.933   1.418
  126   HH12  ARG  18          2HH1      ARG  18   2.831   9.614   2.549
  127   HH21  ARG  18          1HH2      ARG  18   4.401  11.668   0.197
  128   HH22  ARG  18          2HH2      ARG  18   4.361  11.170   1.855
  129    H    VAL  19           HN       VAL  19  -1.375   7.513  -3.627
  130    HA   VAL  19           HA       VAL  19  -2.559   7.071  -0.973
  131    HB   VAL  19           HB       VAL  19  -4.164   8.917  -1.416
  132   HG11  VAL  19          1HG1      VAL  19  -1.314   9.205  -0.839
  133   HG12  VAL  19          2HG1      VAL  19  -2.089  10.700  -1.367
  134   HG13  VAL  19          3HG1      VAL  19  -2.716   9.826   0.031
  135   HG21  VAL  19          1HG2      VAL  19  -2.585  10.403  -3.280
  136   HG22  VAL  19          2HG2      VAL  19  -3.002   8.840  -3.984
  137   HG23  VAL  19          3HG2      VAL  19  -4.274   9.912  -3.399
  138    H    CYS  20           HN       CYS  20  -3.849   5.368  -1.157
  139    HA   CYS  20           HA       CYS  20  -5.928   5.327  -3.154
  140    HB2  CYS  20          2HB       CYS  20  -4.185   2.884  -3.073
  141    HB3  CYS  20          3HB       CYS  20  -5.333   3.387  -4.311
  142    H    THR  21           HN       THR  21  -6.275   2.411  -2.798
  143    HA   THR  21           HA       THR  21  -7.602   2.538  -0.201
  144    HB   THR  21           HB       THR  21  -8.352   0.132  -1.160
  145    HG1  THR  21          1HG       THR  21  -7.850  -0.033  -3.201
  146   HG21  THR  21          1HG2      THR  21 -10.380   1.101  -1.318
  147   HG22  THR  21          2HG2      THR  21  -9.813   2.331  -2.448
  148   HG23  THR  21          3HG2      THR  21  -9.551   2.536  -0.716
  149    H    ARG  22           HN       ARG  22  -5.645   2.344   1.049
  150    HA   ARG  22           HA       ARG  22  -4.454   1.033   2.518
  151    HB2  ARG  22          2HB       ARG  22  -6.218  -0.809   1.517
  152    HB3  ARG  22          3HB       ARG  22  -4.671  -1.496   1.038
  153    HG2  ARG  22          2HG       ARG  22  -4.013  -1.060   3.515
  154    HG3  ARG  22          3HG       ARG  22  -5.758  -1.002   3.771
  155    HD2  ARG  22          2HD       ARG  22  -4.008  -3.280   3.188
  156    HD3  ARG  22          3HD       ARG  22  -5.560  -3.226   4.024
  157    HE   ARG  22           HE       ARG  22  -5.120  -3.904   1.302
  158   HH11  ARG  22          1HH1      ARG  22  -7.367  -2.311   3.430
  159   HH12  ARG  22          2HH1      ARG  22  -8.742  -2.616   2.421
  160   HH21  ARG  22          1HH2      ARG  22  -6.921  -4.311  -0.036
  161   HH22  ARG  22          2HH2      ARG  22  -8.487  -3.754   0.449
  162    H    VAL  23           HN       VAL  23  -2.793  -1.187   1.818
  163    HA   VAL  23           HA       VAL  23  -1.154  -0.240  -0.402
  164    HB   VAL  23           HB       VAL  23   0.907  -0.284   0.957
  165   HG11  VAL  23          1HG1      VAL  23  -1.283   1.663   1.534
  166   HG12  VAL  23          2HG1      VAL  23   0.266   1.815   2.366
  167   HG13  VAL  23          3HG1      VAL  23   0.198   1.883   0.604
  168   HG21  VAL  23          1HG2      VAL  23   0.605  -0.097   3.459
  169   HG22  VAL  23          2HG2      VAL  23  -1.041  -0.684   3.217
  170   HG23  VAL  23          3HG2      VAL  23   0.330  -1.697   2.769
  171    H    PHE  24           HN       PHE  24  -0.420  -1.901  -1.553
  172    HA   PHE  24           HA       PHE  24   0.259  -4.414  -0.263
  173    HB2  PHE  24          2HB       PHE  24  -1.218  -5.250  -2.489
  174    HB3  PHE  24          3HB       PHE  24  -1.658  -5.437  -0.795
  175    HD1  PHE  24          1HD       PHE  24  -1.969  -3.169  -3.706
  176    HD2  PHE  24          2HD       PHE  24  -3.499  -4.308   0.100
  177    HE1  PHE  24          1HE       PHE  24  -3.922  -1.716  -4.060
  178    HE2  PHE  24          2HE       PHE  24  -5.454  -2.857  -0.249
  179    HZ   PHE  24           HZ       PHE  24  -5.669  -1.559  -2.329
  180    H    HIS  25           HN       HIS  25   2.241  -4.788  -0.992
  181    HA   HIS  25           HA       HIS  25   3.539  -3.651  -3.104
  182    HB2  HIS  25          2HB       HIS  25   3.888  -6.295  -1.733
  183    HB3  HIS  25          3HB       HIS  25   4.899  -5.885  -3.116
  184    HD2  HIS  25          2HD       HIS  25   4.869  -2.595  -1.787
  185    HE1  HIS  25          1HE       HIS  25   7.523  -4.556   0.879
  186    HE2  HIS  25          2HE       HIS  25   6.634  -2.336   0.085
  187    H    ASP  26           HN       ASP  26   4.401  -4.858  -5.091
  188    HA   ASP  26           HA       ASP  26   2.086  -5.766  -6.609
  189    HB2  ASP  26          2HB       ASP  26   3.544  -3.996  -7.541
  190    HB3  ASP  26          3HB       ASP  26   4.890  -5.132  -7.551
  191    H    GLY  27           HN       GLY  27   5.007  -6.999  -5.218
  192    HA2  GLY  27          1HA       GLY  27   4.875  -9.469  -6.771
  193    HA3  GLY  27          2HA       GLY  27   6.121  -9.035  -5.610
  194    H    CYS  28           HN       CYS  28   4.098  -8.283  -3.581
  195    HA   CYS  28           HA       CYS  28   3.937 -10.748  -2.237
  196    HB2  CYS  28          2HB       CYS  28   2.854  -8.008  -1.791
  197    HB3  CYS  28          3HB       CYS  28   2.135  -9.329  -0.876
  198    H    LEU  29           HN       LEU  29   1.356  -8.795  -3.734
  199    HA   LEU  29           HA       LEU  29  -0.705 -10.657  -3.316
  200    HB2  LEU  29          2HB       LEU  29  -0.512  -8.658  -5.560
  201    HB3  LEU  29          3HB       LEU  29  -1.979  -9.381  -4.906
  202    HG   LEU  29           HG       LEU  29  -0.176  -7.565  -3.316
  203   HD11  LEU  29          1HD1      LEU  29  -2.495  -6.180  -3.859
  204   HD12  LEU  29          2HD1      LEU  29  -2.098  -6.936  -5.401
  205   HD13  LEU  29          3HD1      LEU  29  -0.918  -5.901  -4.597
  206   HD21  LEU  29          1HD2      LEU  29  -2.536  -7.322  -2.165
  207   HD22  LEU  29          2HD2      LEU  29  -1.444  -8.644  -1.751
  208   HD23  LEU  29          3HD2      LEU  29  -2.784  -8.921  -2.864
  209    H    ARG  30           HN       ARG  30   1.668 -10.314  -5.872
  210    HA   ARG  30           HA       ARG  30   0.451 -12.128  -7.692
  211    HB2  ARG  30          2HB       ARG  30   2.029 -11.290  -9.025
  212    HB3  ARG  30          3HB       ARG  30   2.737 -10.450  -7.651
  213    HG2  ARG  30          2HG       ARG  30   4.210 -12.258  -7.199
  214    HG3  ARG  30          3HG       ARG  30   3.377 -13.302  -8.351
  215    HD2  ARG  30          2HD       ARG  30   4.044 -11.186  -9.923
  216    HD3  ARG  30          3HD       ARG  30   5.401 -11.224  -8.798
  217    HE   ARG  30           HE       ARG  30   4.896 -13.052 -10.911
  218   HH11  ARG  30          1HH1      ARG  30   6.160 -12.843  -7.674
  219   HH12  ARG  30          2HH1      ARG  30   7.210 -14.209  -7.855
  220   HH21  ARG  30          1HH2      ARG  30   6.272 -14.853 -11.163
  221   HH22  ARG  30          2HH2      ARG  30   7.273 -15.352  -9.841
  222    H    ARG  31           HN       ARG  31   3.280 -12.489  -5.546
  223    HA   ARG  31           HA       ARG  31   3.641 -15.235  -5.995
  224    HB2  ARG  31          2HB       ARG  31   4.923 -13.249  -4.525
  225    HB3  ARG  31          3HB       ARG  31   4.394 -14.407  -3.311
  226    HG2  ARG  31          2HG       ARG  31   5.855 -15.977  -3.979
  227    HG3  ARG  31          3HG       ARG  31   5.671 -15.573  -5.687
  228    HD2  ARG  31          2HD       ARG  31   7.208 -13.813  -5.553
  229    HD3  ARG  31          3HD       ARG  31   7.111 -13.747  -3.793
  230    HE   ARG  31           HE       ARG  31   8.168 -16.210  -4.883
  231   HH11  ARG  31          1HH1      ARG  31   8.867 -13.035  -3.638
  232   HH12  ARG  31          2HH1      ARG  31  10.504 -13.416  -3.219
  233   HH21  ARG  31          1HH2      ARG  31  10.322 -16.725  -4.336
  234   HH22  ARG  31          2HH2      ARG  31  11.331 -15.516  -3.617
  235    H    MET  32           HN       MET  32   2.060 -13.571  -3.264
  236    HA   MET  32           HA       MET  32   1.239 -15.754  -1.810
  237    HB2  MET  32          2HB       MET  32  -0.133 -13.106  -2.265
  238    HB3  MET  32          3HB       MET  32  -0.712 -14.292  -1.103
  239    HG2  MET  32          2HG       MET  32   2.049 -13.102  -1.058
  240    HG3  MET  32          3HG       MET  32   0.684 -12.475  -0.136
  241    HE1  MET  32          1HE       MET  32   0.519 -14.516   2.928
  242    HE2  MET  32          2HE       MET  32   0.414 -12.937   2.150
  243    HE3  MET  32          3HE       MET  32  -0.695 -14.226   1.681
  244    H    GLY  33           HN       GLY  33   0.133 -14.725  -4.901
  245    HA2  GLY  33          1HA       GLY  33  -1.089 -16.142  -6.352
  246    HA3  GLY  33          2HA       GLY  33  -1.738 -16.978  -4.949
  247    H    TYR  34           HN       TYR  34  -1.809 -13.613  -4.614
  248    HA   TYR  34           HA       TYR  34  -4.659 -13.562  -4.609
  249    HB2  TYR  34          2HB       TYR  34  -2.473 -11.640  -4.058
  250    HB3  TYR  34          3HB       TYR  34  -4.012 -10.942  -4.550
  251    HD1  TYR  34          1HD       TYR  34  -2.179 -11.532  -1.779
  252    HD2  TYR  34          2HD       TYR  34  -6.051 -12.425  -3.300
  253    HE1  TYR  34          1HE       TYR  34  -3.018 -11.778   0.519
  254    HE2  TYR  34          2HE       TYR  34  -6.901 -12.673  -1.005
  255    HH   TYR  34           HH       TYR  34  -4.983 -13.063   1.634
  256    H    ILE  35           HN       ILE  35  -2.250 -12.996  -6.995
  257    HA   ILE  35           HA       ILE  35  -4.277 -12.554  -9.001
  258    HB   ILE  35           HB       ILE  35  -3.189 -10.507  -9.910
  259   HG12  ILE  35          2HG1      ILE  35  -2.005  -9.374  -7.669
  260   HG13  ILE  35          3HG1      ILE  35  -1.399 -11.027  -7.668
  261   HG21  ILE  35          1HG2      ILE  35  -4.434  -9.037  -8.602
  262   HG22  ILE  35          2HG2      ILE  35  -5.230 -10.590  -8.351
  263   HG23  ILE  35          3HG2      ILE  35  -4.137  -9.952  -7.123
  264   HD11  ILE  35          1HD1      ILE  35  -0.464  -8.865  -9.164
  265   HD12  ILE  35          2HD1      ILE  35   0.025 -10.555  -9.288
  266   HD13  ILE  35          3HD1      ILE  35  -1.268  -9.934 -10.313
  267    H    GLN  36           HN       GLN  36  -3.105 -12.154 -11.212
  268    HA   GLN  36           HA       GLN  36  -0.496 -13.410 -11.379
  269    HB2  GLN  36          2HB       GLN  36  -2.132 -14.740 -13.309
  270    HB3  GLN  36          3HB       GLN  36  -1.168 -15.438 -12.014
  271    HG2  GLN  36          2HG       GLN  36  -3.043 -15.120 -10.465
  272    HG3  GLN  36          3HG       GLN  36  -4.008 -14.470 -11.790
  273   HE21  GLN  36          1HE2      GLN  36  -4.941 -16.589 -10.395
  274   HE22  GLN  36          2HE2      GLN  36  -4.884 -18.019 -11.363
  275    H    GLY  37           HN       GLY  37   0.614 -12.161 -12.721
  276    HA2  GLY  37          1HA       GLY  37  -0.199 -11.632 -15.376
  277    HA3  GLY  37          2HA       GLY  37  -0.472 -10.206 -14.386
  278    H    ASP  38           HN       ASP  38   1.373 -10.578 -16.618
  279    HA   ASP  38           HA       ASP  38   3.951 -10.254 -15.236
  280    HB2  ASP  38          2HB       ASP  38   4.390 -11.900 -16.779
  281    HB3  ASP  38          3HB       ASP  38   3.186 -11.304 -17.918
  282    H    SER  39           HN       SER  39   3.063  -9.145 -18.462
  283    HA   SER  39           HA       SER  39   2.895  -7.058 -19.377
  284    HB2  SER  39          2HB       SER  39   3.134  -5.780 -16.668
  285    HB3  SER  39          3HB       SER  39   2.241  -5.223 -18.083
  286    HG   SER  39           HG       SER  39   1.063  -7.386 -17.630
  287    H    ALA  40           HN       ALA  40   4.165  -4.681 -18.726
  288    HA   ALA  40           HA       ALA  40   6.804  -4.866 -17.853
  289    HB1  ALA  40          1HB       ALA  40   7.709  -6.107 -19.489
  290    HB2  ALA  40          2HB       ALA  40   6.368  -5.809 -20.596
  291    HB3  ALA  40          3HB       ALA  40   7.651  -4.611 -20.421
  292    H    ALA  41           HN       ALA  41   8.017  -2.927 -18.210
  293    HA   ALA  41           HA       ALA  41   7.549  -0.810 -19.819
  294    HB1  ALA  41          1HB       ALA  41   5.347  -1.113 -17.934
  295    HB2  ALA  41          2HB       ALA  41   6.076   0.493 -17.903
  296    HB3  ALA  41          3HB       ALA  41   5.449  -0.162 -19.416
  297    H    GLU  42           HN       GLU  42   9.257   0.443 -19.477
  298    HA   GLU  42           HA       GLU  42  10.022   1.165 -16.759
  299    HB2  GLU  42          2HB       GLU  42  12.489   0.668 -17.636
  300    HB3  GLU  42          3HB       GLU  42  11.529  -0.546 -16.801
  301    HG2  GLU  42          2HG       GLU  42  10.908  -1.568 -18.878
  302    HG3  GLU  42          3HG       GLU  42  11.690  -0.279 -19.792
  303    H    VAL  43           HN       VAL  43   9.039   3.126 -17.808
  304    HA   VAL  43           HA       VAL  43  10.908   4.517 -19.593
  305    HB   VAL  43           HB       VAL  43   8.249   5.649 -18.816
  306   HG11  VAL  43          1HG1      VAL  43   9.649   7.073 -20.120
  307   HG12  VAL  43          2HG1      VAL  43   9.998   5.777 -21.267
  308   HG13  VAL  43          3HG1      VAL  43   8.377   6.467 -21.181
  309   HG21  VAL  43          1HG2      VAL  43   7.619   4.371 -21.103
  310   HG22  VAL  43          2HG2      VAL  43   8.716   3.194 -20.381
  311   HG23  VAL  43          3HG2      VAL  43   7.285   3.724 -19.497
  312    H    THR  44           HN       THR  44   9.752   4.459 -16.357
  313    HA   THR  44           HA       THR  44  11.654   6.413 -15.523
  314    HB   THR  44           HB       THR  44   9.828   7.889 -16.386
  315    HG1  THR  44          1HG       THR  44  11.274   8.333 -14.475
  316   HG21  THR  44          1HG2      THR  44   7.729   8.030 -15.256
  317   HG22  THR  44          2HG2      THR  44   8.240   6.863 -14.036
  318   HG23  THR  44          3HG2      THR  44   7.971   6.340 -15.699
  319    H    GLU  45           HN       GLU  45  11.479   6.835 -13.134
  320    HA   GLU  45           HA       GLU  45  10.027   4.743 -11.690
  321    HB2  GLU  45          2HB       GLU  45  12.107   4.322 -10.320
  322    HB3  GLU  45          3HB       GLU  45  12.145   3.709 -11.967
  323    HG2  GLU  45          2HG       GLU  45  13.409   5.753 -12.623
  324    HG3  GLU  45          3HG       GLU  45  13.491   6.185 -10.916
  325    H    MET  46           HN       MET  46   9.072   5.504  -9.915
  326    HA   MET  46           HA       MET  46  10.245   7.586  -8.317
  327    HB2  MET  46          2HB       MET  46   8.003   8.151 -10.190
  328    HB3  MET  46          3HB       MET  46   7.924   8.875  -8.589
  329    HG2  MET  46          2HG       MET  46  10.439   9.516  -9.229
  330    HG3  MET  46          3HG       MET  46   9.737   9.443 -10.844
  331    HE1  MET  46          1HE       MET  46  11.165  11.596  -9.652
  332    HE2  MET  46          2HE       MET  46  10.259  12.982 -10.260
  333    HE3  MET  46          3HE       MET  46  10.372  12.695  -8.523
  334    H    ALA  47           HN       ALA  47   6.790   7.268  -8.554
  335    HA   ALA  47           HA       ALA  47   6.119   5.134  -7.042
  336    HB1  ALA  47          1HB       ALA  47   7.396   7.213  -5.364
  337    HB2  ALA  47          2HB       ALA  47   5.954   6.429  -4.717
  338    HB3  ALA  47          3HB       ALA  47   7.358   5.461  -5.169
  339    H    HIS  48           HN       HIS  48   5.670   8.545  -7.577
  340    HA   HIS  48           HA       HIS  48   3.006   8.385  -8.285
  341    HB2  HIS  48          2HB       HIS  48   2.015   8.005  -6.288
  342    HB3  HIS  48          3HB       HIS  48   3.432   8.524  -5.379
  343    HD1  HIS  48          1HD       HIS  48   0.204   9.758  -6.770
  344    HD2  HIS  48          2HD       HIS  48   3.472  11.253  -4.686
  345    HE1  HIS  48          1HE       HIS  48  -0.504  12.026  -5.948
  346    H    THR  49           HN       THR  49   2.187  10.355  -8.976
  347    HA   THR  49           HA       THR  49   3.143  12.881  -8.207
  348    HB   THR  49           HB       THR  49   4.137  12.691 -10.919
  349    HG1  THR  49          1HG       THR  49   5.304  10.943 -10.750
  350   HG21  THR  49          1HG2      THR  49   4.564  14.232  -8.691
  351   HG22  THR  49          2HG2      THR  49   5.558  14.250 -10.149
  352   HG23  THR  49          3HG2      THR  49   6.035  13.262  -8.767
  353    H    GLU  50           HN       GLU  50   2.533  11.548 -11.456
  354    HA   GLU  50           HA       GLU  50  -0.176  12.246 -11.597
  355    HB2  GLU  50          2HB       GLU  50   1.299  14.523 -11.582
  356    HB3  GLU  50          3HB       GLU  50   1.243  14.190 -13.308
  357    HG2  GLU  50          2HG       GLU  50  -1.236  14.040 -13.129
  358    HG3  GLU  50          3HG       GLU  50  -1.094  14.572 -11.454
  359    H    THR  51           HN       THR  51  -1.014  11.112 -13.222
  360    HA   THR  51           HA       THR  51  -1.117   9.687 -15.003
  361    HB   THR  51           HB       THR  51   0.493  10.828 -16.952
  362    HG1  THR  51          1HG       THR  51  -0.377  12.776 -15.078
  363   HG21  THR  51          1HG2      THR  51  -1.560  10.575 -17.812
  364   HG22  THR  51          2HG2      THR  51  -1.908  12.175 -17.159
  365   HG23  THR  51          3HG2      THR  51  -2.328  10.734 -16.233
  366    H    GLY  52           HN       GLY  52  -0.023   7.897 -14.173
  367    HA2  GLY  52          1HA       GLY  52   2.232   7.029 -15.612
  368    HA3  GLY  52          2HA       GLY  52   2.762   7.599 -14.037
  369    H    TRP  53           HN       TRP  53   2.688   6.221 -12.379
  370    HA   TRP  53           HA       TRP  53   1.632   3.561 -12.854
  371    HB2  TRP  53          2HB       TRP  53   3.764   4.641 -11.338
  372    HB3  TRP  53          3HB       TRP  53   2.651   3.899 -10.192
  373    HD1  TRP  53          1HD       TRP  53   2.865   1.356  -9.888
  374    HE1  TRP  53          1HE       TRP  53   4.093  -0.538 -11.125
  375    HE3  TRP  53          3HE       TRP  53   4.548   3.987 -13.936
  376    HZ2  TRP  53          2HZ       TRP  53   5.580  -0.872 -13.501
  377    HZ3  TRP  53          3HZ       TRP  53   5.867   2.806 -15.645
  378    HH2  TRP  53          2HH       TRP  53   6.371   0.427 -15.430
  379    H    SER  54           HN       SER  54  -0.574   3.653 -12.725
  380    HA   SER  54           HA       SER  54  -1.681   4.424 -10.105
  381    HB2  SER  54          2HB       SER  54  -3.743   4.615 -12.030
  382    HB3  SER  54          3HB       SER  54  -2.983   5.929 -11.134
  383    HG   SER  54           HG       SER  54  -2.852   6.176 -13.432
  384    H    CYS  55           HN       CYS  55  -2.471   2.734  -9.061
  385    HA   CYS  55           HA       CYS  55  -2.756   0.175 -10.139
  386    HB2  CYS  55          2HB       CYS  55  -3.881  -0.406  -8.048
  387    HB3  CYS  55          3HB       CYS  55  -2.483   0.617  -7.731
  388    H    HIS  56           HN       HIS  56  -4.651  -1.103 -10.503
  389    HA   HIS  56           HA       HIS  56  -6.456  -0.160 -12.292
  390    HB2  HIS  56          2HB       HIS  56  -6.759  -2.353 -10.248
  391    HB3  HIS  56          3HB       HIS  56  -7.995  -2.029 -11.459
  392    HD1  HIS  56          1HD       HIS  56  -4.800  -3.746 -10.953
  393    HD2  HIS  56          2HD       HIS  56  -7.087  -2.461 -14.175
  394    HE1  HIS  56          1HE       HIS  56  -3.887  -4.965 -12.955
  395    H    TYR  57           HN       TYR  57  -6.780  -0.090  -8.775
  396    HA   TYR  57           HA       TYR  57  -9.419   0.780  -8.593
  397    HB2  TYR  57          2HB       TYR  57  -7.099   1.465  -6.777
  398    HB3  TYR  57          3HB       TYR  57  -8.801   1.644  -6.370
  399    HD1  TYR  57          1HD       TYR  57 -10.214  -0.604  -6.712
  400    HD2  TYR  57          2HD       TYR  57  -6.020  -0.424  -6.016
  401    HE1  TYR  57          1HE       TYR  57 -10.261  -2.914  -5.871
  402    HE2  TYR  57          2HE       TYR  57  -6.054  -2.734  -5.176
  403    HH   TYR  57           HH       TYR  57  -9.032  -4.431  -4.588
  404    H    CYS  58           HN       CYS  58  -6.467   2.781  -8.477
  405    HA   CYS  58           HA       CYS  58  -7.982   5.207  -8.800
  406    HB2  CYS  58          2HB       CYS  58  -5.765   6.307  -8.817
  407    HB3  CYS  58          3HB       CYS  58  -5.970   5.235  -7.435
  408    H    ASP  59           HN       ASP  59  -7.278   2.861 -10.915
  409    HA   ASP  59           HA       ASP  59  -6.328   4.423 -13.138
  410    HB2  ASP  59          2HB       ASP  59  -6.098   1.835 -12.643
  411    HB3  ASP  59          3HB       ASP  59  -7.631   1.760 -13.507
  412    H    ASN  60           HN       ASN  60  -7.821   3.644 -15.266
  413    HA   ASN  60           HA       ASN  60 -10.582   4.445 -14.708
  414    HB2  ASN  60          2HB       ASN  60  -8.854   5.769 -16.811
  415    HB3  ASN  60          3HB       ASN  60 -10.558   6.098 -16.514
  416   HD21  ASN  60          1HD2      ASN  60 -10.528   8.142 -15.832
  417   HD22  ASN  60          2HD2      ASN  60  -9.637   8.719 -14.469
  Start of MODEL   19
    1    H1   GLU   1           HN       GLU   1   1.724   4.499   6.084
    2    HA   GLU   1           HA       GLU   1   0.217   3.208   3.906
    3    HB2  GLU   1          2HB       GLU   1   2.422   5.263   3.816
    4    HB3  GLU   1          3HB       GLU   1   1.950   4.322   2.408
    5    HG2  GLU   1          2HG       GLU   1   0.839   6.404   2.265
    6    HG3  GLU   1          3HG       GLU   1  -0.371   5.199   2.704
    7    H    MET   2           HN       MET   2   0.938   1.239   5.172
    8    HA   MET   2           HA       MET   2   3.609   0.418   4.236
    9    HB2  MET   2          2HB       MET   2   2.456  -0.931   6.614
   10    HB3  MET   2          3HB       MET   2   4.131  -0.549   6.239
   11    HG2  MET   2          2HG       MET   2   2.080   1.476   7.097
   12    HG3  MET   2          3HG       MET   2   3.215   0.680   8.184
   13    HE1  MET   2          1HE       MET   2   6.393   2.531   7.894
   14    HE2  MET   2          2HE       MET   2   5.065   2.356   9.042
   15    HE3  MET   2          3HE       MET   2   5.687   0.942   8.190
   16    H    CYS   3           HN       CYS   3   3.686  -1.370   3.023
   17    HA   CYS   3           HA       CYS   3   1.575  -2.528   1.786
   18    HB2  CYS   3          2HB       CYS   3   3.910  -2.962   1.166
   19    HB3  CYS   3          3HB       CYS   3   4.116  -3.947   2.610
   20    H    ASP   4           HN       ASP   4  -0.205  -3.399   2.603
   21    HA   ASP   4           HA       ASP   4  -0.506  -4.394   5.194
   22    HB2  ASP   4          2HB       ASP   4  -2.270  -3.695   3.370
   23    HB3  ASP   4          3HB       ASP   4  -2.241  -5.413   2.978
   24    H    VAL   5           HN       VAL   5   1.066  -5.783   2.567
   25    HA   VAL   5           HA       VAL   5   0.655  -8.523   3.533
   26    HB   VAL   5           HB       VAL   5   2.055  -7.561   1.033
   27   HG11  VAL   5          1HG1      VAL   5   1.790 -10.001   0.391
   28   HG12  VAL   5          2HG1      VAL   5   3.008  -9.640   1.616
   29   HG13  VAL   5          3HG1      VAL   5   1.446 -10.309   2.093
   30   HG21  VAL   5          1HG2      VAL   5  -0.031  -8.805   0.043
   31   HG22  VAL   5          2HG2      VAL   5  -0.743  -8.419   1.609
   32   HG23  VAL   5          3HG2      VAL   5  -0.153  -7.124   0.566
   33    H    CYS   6           HN       CYS   6   2.824  -5.949   3.784
   34    HA   CYS   6           HA       CYS   6   4.855  -7.740   4.919
   35    HB2  CYS   6          2HB       CYS   6   5.430  -5.385   3.107
   36    HB3  CYS   6          3HB       CYS   6   6.643  -6.338   3.955
   37    H    GLU   7           HN       GLU   7   4.122  -4.271   4.504
   38    HA   GLU   7           HA       GLU   7   3.742  -2.660   6.105
   39    HB2  GLU   7          2HB       GLU   7   4.608  -4.496   8.307
   40    HB3  GLU   7          3HB       GLU   7   3.439  -3.184   8.350
   41    HG2  GLU   7          2HG       GLU   7   2.455  -5.085   6.524
   42    HG3  GLU   7          3HG       GLU   7   3.006  -5.973   7.945
   43    H    VAL   8           HN       VAL   8   5.814  -2.175   4.815
   44    HA   VAL   8           HA       VAL   8   7.775  -1.237   6.684
   45    HB   VAL   8           HB       VAL   8   9.372  -2.590   4.759
   46   HG11  VAL   8          1HG1      VAL   8  10.537  -3.366   6.641
   47   HG12  VAL   8          2HG1      VAL   8   9.854  -1.819   7.145
   48   HG13  VAL   8          3HG1      VAL   8   9.096  -3.327   7.657
   49   HG21  VAL   8          1HG2      VAL   8   7.347  -4.087   4.615
   50   HG22  VAL   8          2HG2      VAL   8   8.853  -4.883   5.073
   51   HG23  VAL   8          3HG2      VAL   8   7.643  -4.512   6.301
   52    H    TRP   9           HN       TRP   9   7.778   0.800   5.960
   53    HA   TRP   9           HA       TRP   9   8.048   1.260   3.066
   54    HB2  TRP   9          2HB       TRP   9   6.191   2.491   3.625
   55    HB3  TRP   9          3HB       TRP   9   6.743   2.778   5.272
   56    HD1  TRP   9          1HD       TRP   9   8.109   4.972   5.736
   57    HE1  TRP   9          1HE       TRP   9   8.673   7.041   4.311
   58    HE3  TRP   9          3HE       TRP   9   6.745   3.190   1.142
   59    HZ2  TRP   9          2HZ       TRP   9   8.556   7.814   1.599
   60    HZ3  TRP   9          3HZ       TRP   9   7.003   4.659  -0.816
   61    HH2  TRP   9          2HH       TRP   9   7.890   6.923  -0.590
   62    H    THR  10           HN       THR  10   9.387   3.140   2.430
   63    HA   THR  10           HA       THR  10  11.462   3.944   4.292
   64    HB   THR  10           HB       THR  10  12.720   3.062   1.822
   65    HG1  THR  10          1HG       THR  10  12.491   0.847   2.188
   66   HG21  THR  10          1HG2      THR  10  14.199   1.900   3.528
   67   HG22  THR  10          2HG2      THR  10  13.169   2.620   4.766
   68   HG23  THR  10          3HG2      THR  10  14.081   3.653   3.667
   69    H    ALA  11           HN       ALA  11  11.146   3.839   0.742
   70    HA   ALA  11           HA       ALA  11  10.238   6.341   0.200
   71    HB1  ALA  11          1HB       ALA  11  12.714   7.328  -0.286
   72    HB2  ALA  11          2HB       ALA  11  11.761   7.690   1.154
   73    HB3  ALA  11          3HB       ALA  11  12.994   6.431   1.207
   74    H    GLU  12           HN       GLU  12  12.516   3.834  -0.579
   75    HA   GLU  12           HA       GLU  12  13.406   4.261  -3.061
   76    HB2  GLU  12          2HB       GLU  12  12.547   1.757  -3.488
   77    HB3  GLU  12          3HB       GLU  12  13.920   2.133  -2.457
   78    HG2  GLU  12          2HG       GLU  12  12.791   1.658  -0.534
   79    HG3  GLU  12          3HG       GLU  12  11.220   2.065  -1.224
   80    H    SER  13           HN       SER  13  10.414   2.375  -2.926
   81    HA   SER  13           HA       SER  13   8.779   4.152  -4.352
   82    HB2  SER  13          2HB       SER  13  10.494   3.675  -6.137
   83    HB3  SER  13          3HB       SER  13   9.957   1.995  -6.116
   84    HG   SER  13           HG       SER  13   7.764   3.106  -6.428
   85    H    LEU  14           HN       LEU  14   7.085   3.464  -3.157
   86    HA   LEU  14           HA       LEU  14   6.539   0.657  -2.778
   87    HB2  LEU  14          2HB       LEU  14   6.104   2.560  -1.120
   88    HB3  LEU  14          3HB       LEU  14   4.688   2.921  -2.104
   89    HG   LEU  14           HG       LEU  14   3.795   0.687  -1.627
   90   HD11  LEU  14          1HD1      LEU  14   6.477   0.302  -0.551
   91   HD12  LEU  14          2HD1      LEU  14   5.294  -0.882  -1.104
   92   HD13  LEU  14          3HD1      LEU  14   5.197  -0.240   0.535
   93   HD21  LEU  14          1HD2      LEU  14   3.373   1.041   0.801
   94   HD22  LEU  14          2HD2      LEU  14   3.091   2.471  -0.193
   95   HD23  LEU  14          3HD2      LEU  14   4.564   2.343   0.771
   96    H    PHE  15           HN       PHE  15   4.382  -0.253  -3.271
   97    HA   PHE  15           HA       PHE  15   3.093   0.929  -5.619
   98    HB2  PHE  15          2HB       PHE  15   3.469  -2.007  -5.721
   99    HB3  PHE  15          3HB       PHE  15   3.472  -0.825  -7.025
  100    HD1  PHE  15          1HD       PHE  15   5.532  -1.841  -4.088
  101    HD2  PHE  15          2HD       PHE  15   5.458  -0.372  -8.082
  102    HE1  PHE  15          1HE       PHE  15   7.990  -1.943  -4.167
  103    HE2  PHE  15          2HE       PHE  15   7.915  -0.472  -8.167
  104    HZ   PHE  15           HZ       PHE  15   9.184  -1.260  -6.209
  105    HA   PRO  16           HA       PRO  16   1.566  -0.098  -7.129
  106    HB2  PRO  16          2HB       PRO  16  -0.866   1.041  -7.523
  107    HB3  PRO  16          3HB       PRO  16  -0.608  -0.707  -7.558
  108    HG2  PRO  16          2HG       PRO  16  -1.663   1.007  -5.342
  109    HG3  PRO  16          3HG       PRO  16  -2.239  -0.572  -5.907
  110    HD2  PRO  16          2HD       PRO  16  -0.683  -0.289  -3.709
  111    HD3  PRO  16          3HD       PRO  16  -0.605  -1.720  -4.756
  112    H    CYS  17           HN       CYS  17  -0.175   2.129  -4.945
  113    HA   CYS  17           HA       CYS  17   1.385   4.344  -6.095
  114    HB2  CYS  17          2HB       CYS  17  -1.294   4.374  -4.689
  115    HB3  CYS  17          3HB       CYS  17  -0.428   5.812  -5.220
  116    H    ARG  18           HN       ARG  18   1.951   6.105  -4.591
  117    HA   ARG  18           HA       ARG  18   3.410   5.172  -2.398
  118    HB2  ARG  18          2HB       ARG  18   4.122   7.334  -2.136
  119    HB3  ARG  18          3HB       ARG  18   3.501   7.430  -3.778
  120    HG2  ARG  18          2HG       ARG  18   2.008   8.248  -1.295
  121    HG3  ARG  18          3HG       ARG  18   2.815   9.341  -2.422
  122    HD2  ARG  18          2HD       ARG  18   0.988   7.513  -3.752
  123    HD3  ARG  18          3HD       ARG  18   0.181   8.507  -2.539
  124    HE   ARG  18           HE       ARG  18   1.149   9.365  -5.066
  125   HH11  ARG  18          1HH1      ARG  18   0.762  10.389  -1.761
  126   HH12  ARG  18          2HH1      ARG  18   0.671  12.074  -2.157
  127   HH21  ARG  18          1HH2      ARG  18   1.031  11.580  -5.599
  128   HH22  ARG  18          2HH2      ARG  18   0.824  12.750  -4.340
  129    H    VAL  19           HN       VAL  19   0.112   6.225  -2.667
  130    HA   VAL  19           HA       VAL  19  -0.283   5.592   0.169
  131    HB   VAL  19           HB       VAL  19  -1.260   8.077  -1.228
  132   HG11  VAL  19          1HG1      VAL  19  -3.166   7.871  -0.089
  133   HG12  VAL  19          2HG1      VAL  19  -2.545   6.518   0.859
  134   HG13  VAL  19          3HG1      VAL  19  -2.214   8.175   1.364
  135   HG21  VAL  19          1HG2      VAL  19   0.280   9.155  -0.033
  136   HG22  VAL  19          2HG2      VAL  19  -0.218   8.355   1.457
  137   HG23  VAL  19          3HG2      VAL  19   0.949   7.579   0.386
  138    H    CYS  20           HN       CYS  20  -2.733   7.044  -1.828
  139    HA   CYS  20           HA       CYS  20  -4.812   6.286  -2.401
  140    HB2  CYS  20          2HB       CYS  20  -3.024   4.082  -3.435
  141    HB3  CYS  20          3HB       CYS  20  -4.740   4.191  -3.817
  142    H    THR  21           HN       THR  21  -6.098   3.948  -2.513
  143    HA   THR  21           HA       THR  21  -6.679   3.376   0.184
  144    HB   THR  21           HB       THR  21  -7.654   1.214  -1.307
  145    HG1  THR  21          1HG       THR  21  -8.641   2.486  -3.078
  146   HG21  THR  21          1HG2      THR  21  -8.693   2.883   0.432
  147   HG22  THR  21          2HG2      THR  21  -9.723   2.066  -0.744
  148   HG23  THR  21          3HG2      THR  21  -9.228   3.735  -1.017
  149    H    ARG  22           HN       ARG  22  -4.666   2.765   1.115
  150    HA   ARG  22           HA       ARG  22  -3.221   1.232   1.977
  151    HB2  ARG  22          2HB       ARG  22  -5.472  -0.318   1.085
  152    HB3  ARG  22          3HB       ARG  22  -3.988  -1.220   0.806
  153    HG2  ARG  22          2HG       ARG  22  -3.372  -0.916   3.158
  154    HG3  ARG  22          3HG       ARG  22  -4.882  -0.043   3.430
  155    HD2  ARG  22          2HD       ARG  22  -5.241  -2.642   2.145
  156    HD3  ARG  22          3HD       ARG  22  -4.514  -2.742   3.748
  157    HE   ARG  22           HE       ARG  22  -7.214  -2.257   3.199
  158   HH11  ARG  22          1HH1      ARG  22  -4.653  -1.030   5.213
  159   HH12  ARG  22          2HH1      ARG  22  -5.720  -0.491   6.467
  160   HH21  ARG  22          1HH2      ARG  22  -8.630  -1.551   4.843
  161   HH22  ARG  22          2HH2      ARG  22  -7.982  -0.789   6.256
  162    H    VAL  23           HN       VAL  23  -1.496  -0.336   1.333
  163    HA   VAL  23           HA       VAL  23  -0.729   0.065  -1.487
  164    HB   VAL  23           HB       VAL  23   1.626   0.058  -0.758
  165   HG11  VAL  23          1HG1      VAL  23   1.061   2.232  -1.031
  166   HG12  VAL  23          2HG1      VAL  23  -0.325   2.122   0.055
  167   HG13  VAL  23          3HG1      VAL  23   1.304   2.275   0.715
  168   HG21  VAL  23          1HG2      VAL  23   2.199  -0.654   1.265
  169   HG22  VAL  23          2HG2      VAL  23   1.316   0.687   1.995
  170   HG23  VAL  23          3HG2      VAL  23   0.497  -0.844   1.685
  171    H    PHE  24           HN       PHE  24   0.240  -1.635  -2.569
  172    HA   PHE  24           HA       PHE  24   0.647  -4.150  -1.148
  173    HB2  PHE  24          2HB       PHE  24  -0.671  -4.860  -3.546
  174    HB3  PHE  24          3HB       PHE  24  -1.236  -5.093  -1.895
  175    HD1  PHE  24          1HD       PHE  24  -1.905  -3.562  -4.992
  176    HD2  PHE  24          2HD       PHE  24  -2.392  -3.031  -0.797
  177    HE1  PHE  24          1HE       PHE  24  -3.749  -1.988  -5.409
  178    HE2  PHE  24          2HE       PHE  24  -4.238  -1.458  -1.208
  179    HZ   PHE  24           HZ       PHE  24  -4.919  -0.934  -3.515
  180    H    HIS  25           HN       HIS  25   2.661  -4.682  -1.653
  181    HA   HIS  25           HA       HIS  25   4.194  -3.702  -3.724
  182    HB2  HIS  25          2HB       HIS  25   4.416  -6.360  -2.300
  183    HB3  HIS  25          3HB       HIS  25   5.664  -5.693  -3.348
  184    HD2  HIS  25          2HD       HIS  25   4.337  -2.822  -1.351
  185    HE1  HIS  25          1HE       HIS  25   7.518  -4.423   0.956
  186    HE2  HIS  25          2HE       HIS  25   5.888  -2.518   0.696
  187    H    ASP  26           HN       ASP  26   4.779  -4.430  -5.764
  188    HA   ASP  26           HA       ASP  26   2.752  -5.618  -7.312
  189    HB2  ASP  26          2HB       ASP  26   4.159  -4.210  -8.521
  190    HB3  ASP  26          3HB       ASP  26   5.619  -4.899  -7.815
  191    H    GLY  27           HN       GLY  27   5.389  -6.961  -5.517
  192    HA2  GLY  27          1HA       GLY  27   5.209  -9.533  -6.884
  193    HA3  GLY  27          2HA       GLY  27   6.347  -9.106  -5.615
  194    H    CYS  28           HN       CYS  28   4.075  -8.005  -3.983
  195    HA   CYS  28           HA       CYS  28   3.511 -10.419  -2.556
  196    HB2  CYS  28          2HB       CYS  28   2.780  -7.529  -2.197
  197    HB3  CYS  28          3HB       CYS  28   1.993  -8.768  -1.225
  198    H    LEU  29           HN       LEU  29   1.677  -8.261  -4.654
  199    HA   LEU  29           HA       LEU  29  -0.867  -9.380  -4.219
  200    HB2  LEU  29          2HB       LEU  29   0.309  -7.922  -6.574
  201    HB3  LEU  29          3HB       LEU  29  -1.384  -8.407  -6.489
  202    HG   LEU  29           HG       LEU  29  -0.070  -6.571  -4.491
  203   HD11  LEU  29          1HD1      LEU  29  -0.291  -4.861  -5.883
  204   HD12  LEU  29          2HD1      LEU  29  -1.966  -5.294  -6.226
  205   HD13  LEU  29          3HD1      LEU  29  -0.659  -6.010  -7.170
  206   HD21  LEU  29          1HD2      LEU  29  -2.968  -7.143  -5.103
  207   HD22  LEU  29          2HD2      LEU  29  -2.359  -6.024  -3.883
  208   HD23  LEU  29          3HD2      LEU  29  -2.073  -7.757  -3.713
  209    H    ARG  30           HN       ARG  30   1.751 -10.245  -6.401
  210    HA   ARG  30           HA       ARG  30   0.183 -12.249  -7.765
  211    HB2  ARG  30          2HB       ARG  30   1.741 -11.864  -9.317
  212    HB3  ARG  30          3HB       ARG  30   2.695 -10.924  -8.177
  213    HG2  ARG  30          2HG       ARG  30   3.731 -12.998  -7.361
  214    HG3  ARG  30          3HG       ARG  30   2.807 -13.908  -8.558
  215    HD2  ARG  30          2HD       ARG  30   4.429 -13.542 -10.030
  216    HD3  ARG  30          3HD       ARG  30   4.069 -11.817  -9.950
  217    HE   ARG  30           HE       ARG  30   6.027 -11.541  -8.825
  218   HH11  ARG  30          1HH1      ARG  30   4.983 -14.838  -8.415
  219   HH12  ARG  30          2HH1      ARG  30   6.397 -15.312  -7.531
  220   HH21  ARG  30          1HH2      ARG  30   7.892 -12.153  -7.663
  221   HH22  ARG  30          2HH2      ARG  30   8.049 -13.784  -7.103
  222    H    ARG  31           HN       ARG  31   2.236 -12.075  -4.999
  223    HA   ARG  31           HA       ARG  31   2.931 -14.841  -4.885
  224    HB2  ARG  31          2HB       ARG  31   4.401 -13.537  -3.664
  225    HB3  ARG  31          3HB       ARG  31   3.122 -12.517  -3.018
  226    HG2  ARG  31          2HG       ARG  31   2.622 -13.975  -1.324
  227    HG3  ARG  31          3HG       ARG  31   3.220 -15.379  -2.211
  228    HD2  ARG  31          2HD       ARG  31   5.045 -15.215  -0.934
  229    HD3  ARG  31          3HD       ARG  31   5.468 -13.823  -1.929
  230    HE   ARG  31           HE       ARG  31   3.831 -12.839   0.043
  231   HH11  ARG  31          1HH1      ARG  31   6.851 -14.565  -0.083
  232   HH12  ARG  31          2HH1      ARG  31   7.457 -13.873   1.386
  233   HH21  ARG  31          1HH2      ARG  31   4.618 -11.920   1.977
  234   HH22  ARG  31          2HH2      ARG  31   6.186 -12.370   2.556
  235    H    MET  32           HN       MET  32   0.555 -12.845  -3.140
  236    HA   MET  32           HA       MET  32  -0.591 -15.064  -1.761
  237    HB2  MET  32          2HB       MET  32  -1.886 -12.382  -2.247
  238    HB3  MET  32          3HB       MET  32  -2.216 -13.513  -0.941
  239    HG2  MET  32          2HG       MET  32   0.478 -12.249  -1.285
  240    HG3  MET  32          3HG       MET  32  -0.825 -11.446  -0.411
  241    HE1  MET  32          1HE       MET  32  -2.127 -12.382   1.261
  242    HE2  MET  32          2HE       MET  32  -1.875 -13.892   2.137
  243    HE3  MET  32          3HE       MET  32  -1.080 -12.414   2.682
  244    H    GLY  33           HN       GLY  33  -1.061 -13.631  -4.870
  245    HA2  GLY  33          1HA       GLY  33  -2.157 -14.865  -6.606
  246    HA3  GLY  33          2HA       GLY  33  -3.204 -15.578  -5.388
  247    H    TYR  34           HN       TYR  34  -3.072 -12.480  -4.483
  248    HA   TYR  34           HA       TYR  34  -5.628 -11.759  -4.889
  249    HB2  TYR  34          2HB       TYR  34  -3.116 -10.164  -4.741
  250    HB3  TYR  34          3HB       TYR  34  -4.593  -9.326  -5.198
  251    HD1  TYR  34          1HD       TYR  34  -6.679 -10.222  -3.594
  252    HD2  TYR  34          2HD       TYR  34  -2.574  -9.908  -2.523
  253    HE1  TYR  34          1HE       TYR  34  -7.316 -10.046  -1.225
  254    HE2  TYR  34          2HE       TYR  34  -3.200  -9.731  -0.151
  255    HH   TYR  34           HH       TYR  34  -4.915  -9.417   1.281
  256    H    ILE  35           HN       ILE  35  -3.076 -11.640  -7.290
  257    HA   ILE  35           HA       ILE  35  -5.100 -11.262  -9.364
  258    HB   ILE  35           HB       ILE  35  -3.534  -9.663 -10.554
  259   HG12  ILE  35          2HG1      ILE  35  -2.346  -8.391  -8.385
  260   HG13  ILE  35          3HG1      ILE  35  -2.058 -10.101  -8.083
  261   HG21  ILE  35          1HG2      ILE  35  -5.601  -8.883  -9.617
  262   HG22  ILE  35          2HG2      ILE  35  -4.892  -8.810  -8.004
  263   HG23  ILE  35          3HG2      ILE  35  -4.342  -7.702  -9.259
  264   HD11  ILE  35          1HD1      ILE  35  -0.216  -9.136  -9.303
  265   HD12  ILE  35          2HD1      ILE  35  -1.063 -10.304 -10.316
  266   HD13  ILE  35          3HD1      ILE  35  -1.311  -8.575 -10.566
  267    H    GLN  36           HN       GLN  36  -4.001 -11.486 -11.602
  268    HA   GLN  36           HA       GLN  36  -2.015 -13.657 -11.436
  269    HB2  GLN  36          2HB       GLN  36  -4.535 -13.399 -12.955
  270    HB3  GLN  36          3HB       GLN  36  -3.177 -14.064 -13.852
  271    HG2  GLN  36          2HG       GLN  36  -3.398 -16.029 -12.864
  272    HG3  GLN  36          3HG       GLN  36  -3.364 -15.292 -11.262
  273   HE21  GLN  36          1HE2      GLN  36  -5.129 -17.209 -13.180
  274   HE22  GLN  36          2HE2      GLN  36  -6.714 -16.887 -12.572
  275    H    GLY  37           HN       GLY  37  -0.168 -13.426 -12.541
  276    HA2  GLY  37          1HA       GLY  37   0.885 -12.713 -14.660
  277    HA3  GLY  37          2HA       GLY  37  -0.021 -11.216 -14.498
  278    H    ASP  38           HN       ASP  38   2.898 -11.753 -14.704
  279    HA   ASP  38           HA       ASP  38   3.686 -10.139 -12.390
  280    HB2  ASP  38          2HB       ASP  38   5.543 -11.483 -11.836
  281    HB3  ASP  38          3HB       ASP  38   4.219 -12.623 -12.058
  282    H    SER  39           HN       SER  39   5.850  -9.128 -12.701
  283    HA   SER  39           HA       SER  39   6.742  -8.900 -15.461
  284    HB2  SER  39          2HB       SER  39   6.424  -6.252 -14.252
  285    HB3  SER  39          3HB       SER  39   6.006  -6.808 -15.873
  286    HG   SER  39           HG       SER  39   4.127  -7.792 -14.889
  287    H    ALA  40           HN       ALA  40   8.526  -6.980 -15.408
  288    HA   ALA  40           HA       ALA  40  10.330  -7.720 -13.205
  289    HB1  ALA  40          1HB       ALA  40  11.056  -6.658 -15.931
  290    HB2  ALA  40          2HB       ALA  40  12.173  -7.219 -14.687
  291    HB3  ALA  40          3HB       ALA  40  11.075  -8.359 -15.466
  292    H    ALA  41           HN       ALA  41   8.402  -5.237 -14.271
  293    HA   ALA  41           HA       ALA  41   8.320  -2.976 -13.929
  294    HB1  ALA  41          1HB       ALA  41   8.693  -2.303 -11.664
  295    HB2  ALA  41          2HB       ALA  41   8.035  -3.940 -11.649
  296    HB3  ALA  41          3HB       ALA  41   9.757  -3.680 -11.377
  297    H    GLU  42           HN       GLU  42   9.620  -2.079 -15.489
  298    HA   GLU  42           HA       GLU  42  12.217  -1.116 -14.556
  299    HB2  GLU  42          2HB       GLU  42  11.756  -2.907 -16.886
  300    HB3  GLU  42          3HB       GLU  42  12.923  -1.609 -17.084
  301    HG2  GLU  42          2HG       GLU  42  13.883  -2.513 -14.835
  302    HG3  GLU  42          3HG       GLU  42  13.014  -3.979 -15.283
  303    H    VAL  43           HN       VAL  43  10.502   0.681 -14.407
  304    HA   VAL  43           HA       VAL  43  10.346   2.105 -16.983
  305    HB   VAL  43           HB       VAL  43   8.648   3.288 -15.000
  306   HG11  VAL  43          1HG1      VAL  43   8.337   2.020 -17.690
  307   HG12  VAL  43          2HG1      VAL  43   6.911   2.487 -16.759
  308   HG13  VAL  43          3HG1      VAL  43   8.109   3.701 -17.210
  309   HG21  VAL  43          1HG2      VAL  43   7.033   1.295 -14.926
  310   HG22  VAL  43          2HG2      VAL  43   8.445   0.309 -15.306
  311   HG23  VAL  43          3HG2      VAL  43   8.416   1.276 -13.832
  312    H    THR  44           HN       THR  44  10.315   2.948 -13.516
  313    HA   THR  44           HA       THR  44  12.693   4.495 -13.662
  314    HB   THR  44           HB       THR  44  11.086   5.991 -14.889
  315    HG1  THR  44          1HG       THR  44  12.159   7.642 -14.063
  316   HG21  THR  44          1HG2      THR  44   9.455   7.240 -13.509
  317   HG22  THR  44          2HG2      THR  44   9.797   6.153 -12.163
  318   HG23  THR  44          3HG2      THR  44   9.062   5.526 -13.639
  319    H    GLU  45           HN       GLU  45   9.640   3.873 -12.013
  320    HA   GLU  45           HA       GLU  45   9.171   3.449  -9.823
  321    HB2  GLU  45          2HB       GLU  45  12.113   3.595  -9.203
  322    HB3  GLU  45          3HB       GLU  45  10.864   2.683  -8.366
  323    HG2  GLU  45          2HG       GLU  45  11.572   2.084 -11.211
  324    HG3  GLU  45          3HG       GLU  45  12.508   1.420  -9.872
  325    H    MET  46           HN       MET  46   8.162   5.118  -8.919
  326    HA   MET  46           HA       MET  46   9.637   7.070  -7.428
  327    HB2  MET  46          2HB       MET  46   8.211   7.863  -9.957
  328    HB3  MET  46          3HB       MET  46   8.458   9.006  -8.644
  329    HG2  MET  46          2HG       MET  46  10.957   8.168  -8.882
  330    HG3  MET  46          3HG       MET  46  10.414   7.811 -10.520
  331    HE1  MET  46          1HE       MET  46  12.359  10.619  -8.754
  332    HE2  MET  46          2HE       MET  46  12.719   9.451 -10.025
  333    HE3  MET  46          3HE       MET  46  12.575  11.165 -10.418
  334    H    ALA  47           HN       ALA  47   8.484   6.557  -5.631
  335    HA   ALA  47           HA       ALA  47   5.678   6.143  -5.590
  336    HB1  ALA  47          1HB       ALA  47   7.850   6.008  -3.730
  337    HB2  ALA  47          2HB       ALA  47   6.503   6.889  -3.008
  338    HB3  ALA  47          3HB       ALA  47   6.255   5.261  -3.639
  339    H    HIS  48           HN       HIS  48   7.341   8.652  -3.707
  340    HA   HIS  48           HA       HIS  48   5.074  10.346  -3.663
  341    HB2  HIS  48          2HB       HIS  48   7.925  10.589  -2.809
  342    HB3  HIS  48          3HB       HIS  48   6.955  12.055  -2.920
  343    HD1  HIS  48          1HD       HIS  48   4.439  11.585  -1.623
  344    HD2  HIS  48          2HD       HIS  48   7.853   9.619  -0.301
  345    HE1  HIS  48          1HE       HIS  48   3.938  10.880   0.739
  346    H    THR  49           HN       THR  49   4.354  10.945  -5.657
  347    HA   THR  49           HA       THR  49   5.727  13.071  -6.972
  348    HB   THR  49           HB       THR  49   5.365  11.398  -9.182
  349    HG1  THR  49          1HG       THR  49   5.639   9.462  -8.356
  350   HG21  THR  49          1HG2      THR  49   7.599  12.694  -7.757
  351   HG22  THR  49          2HG2      THR  49   7.151  12.757  -9.462
  352   HG23  THR  49          3HG2      THR  49   8.046  11.373  -8.835
  353    H    GLU  50           HN       GLU  50   4.511  13.125  -9.401
  354    HA   GLU  50           HA       GLU  50   1.792  13.730  -8.673
  355    HB2  GLU  50          2HB       GLU  50   2.855  13.828 -11.479
  356    HB3  GLU  50          3HB       GLU  50   1.626  14.837 -10.729
  357    HG2  GLU  50          2HG       GLU  50   4.049  15.192  -9.298
  358    HG3  GLU  50          3HG       GLU  50   4.395  15.341 -11.019
  359    H    THR  51           HN       THR  51   0.626  13.181 -11.254
  360    HA   THR  51           HA       THR  51  -0.411  10.606 -10.763
  361    HB   THR  51           HB       THR  51  -0.650  11.621 -13.525
  362    HG1  THR  51          1HG       THR  51  -2.127  13.059 -11.642
  363   HG21  THR  51          1HG2      THR  51  -2.304  10.327 -11.451
  364   HG22  THR  51          2HG2      THR  51  -2.265  10.069 -13.196
  365   HG23  THR  51          3HG2      THR  51  -3.151  11.438 -12.526
  366    H    GLY  52           HN       GLY  52   0.804   8.822 -10.912
  367    HA2  GLY  52          1HA       GLY  52   2.116   8.275 -13.471
  368    HA3  GLY  52          2HA       GLY  52   3.105   8.203 -12.020
  369    H    TRP  53           HN       TRP  53   2.184   6.764 -10.251
  370    HA   TRP  53           HA       TRP  53   1.656   4.182 -11.431
  371    HB2  TRP  53          2HB       TRP  53   2.871   5.129  -9.048
  372    HB3  TRP  53          3HB       TRP  53   1.510   4.119  -8.570
  373    HD1  TRP  53          1HD       TRP  53   1.581   1.521  -9.363
  374    HE1  TRP  53          1HE       TRP  53   3.574  -0.007  -9.921
  375    HE3  TRP  53          3HE       TRP  53   5.176   5.092 -10.043
  376    HZ2  TRP  53          2HZ       TRP  53   6.310   0.264 -10.564
  377    HZ3  TRP  53          3HZ       TRP  53   7.455   4.374 -10.628
  378    HH2  TRP  53          2HH       TRP  53   8.009   2.010 -10.882
  379    H    SER  54           HN       SER  54  -0.117   2.836 -10.949
  380    HA   SER  54           HA       SER  54  -2.466   4.201  -9.816
  381    HB2  SER  54          2HB       SER  54  -3.642   2.589 -11.636
  382    HB3  SER  54          3HB       SER  54  -3.200   4.263 -11.972
  383    HG   SER  54           HG       SER  54  -1.143   3.360 -12.725
  384    H    CYS  55           HN       CYS  55  -3.986   2.875  -8.774
  385    HA   CYS  55           HA       CYS  55  -2.847   0.510  -7.585
  386    HB2  CYS  55          2HB       CYS  55  -5.586   1.741  -7.216
  387    HB3  CYS  55          3HB       CYS  55  -4.875   0.487  -6.206
  388    H    HIS  56           HN       HIS  56  -4.144  -1.509  -7.396
  389    HA   HIS  56           HA       HIS  56  -4.638  -2.635  -9.897
  390    HB2  HIS  56          2HB       HIS  56  -4.106  -4.081  -8.075
  391    HB3  HIS  56          3HB       HIS  56  -5.471  -3.498  -7.127
  392    HD1  HIS  56          1HD       HIS  56  -4.706  -5.625 -10.151
  393    HD2  HIS  56          2HD       HIS  56  -7.832  -4.845  -7.526
  394    HE1  HIS  56          1HE       HIS  56  -6.472  -7.336 -10.681
  395    H    TYR  57           HN       TYR  57  -6.596  -0.585  -8.039
  396    HA   TYR  57           HA       TYR  57  -8.680  -0.603  -9.980
  397    HB2  TYR  57          2HB       TYR  57 -10.475  -1.517  -8.754
  398    HB3  TYR  57          3HB       TYR  57  -9.157  -2.664  -8.541
  399    HD1  TYR  57          1HD       TYR  57 -11.781  -1.527  -6.848
  400    HD2  TYR  57          2HD       TYR  57  -7.547  -1.549  -6.433
  401    HE1  TYR  57          1HE       TYR  57 -12.026  -1.343  -4.408
  402    HE2  TYR  57          2HE       TYR  57  -7.780  -1.367  -3.992
  403    HH   TYR  57           HH       TYR  57 -10.485  -0.412  -2.470
  404    H    CYS  58           HN       CYS  58  -6.919   1.303  -8.796
  405    HA   CYS  58           HA       CYS  58  -7.822   2.874  -6.765
  406    HB2  CYS  58          2HB       CYS  58  -5.876   3.156  -8.599
  407    HB3  CYS  58          3HB       CYS  58  -7.019   4.346  -9.215
  408    H    ASP  59           HN       ASP  59  -8.785   3.287 -10.176
  409    HA   ASP  59           HA       ASP  59 -11.491   3.883  -9.437
  410    HB2  ASP  59          2HB       ASP  59 -11.609   6.158 -10.081
  411    HB3  ASP  59          3HB       ASP  59 -10.200   6.046  -9.029
  412    H    ASN  60           HN       ASN  60 -12.398   5.134 -11.682
  413    HA   ASN  60           HA       ASN  60 -12.634   3.088 -13.533
  414    HB2  ASN  60          2HB       ASN  60 -14.295   4.689 -13.732
  415    HB3  ASN  60          3HB       ASN  60 -13.159   6.031 -13.623
  416   HD21  ASN  60          1HD2      ASN  60 -12.111   6.742 -15.451
  417   HD22  ASN  60          2HD2      ASN  60 -12.568   6.246 -17.042
  Start of MODEL   20
    1    H1   GLU   1           HN       GLU   1   3.606   4.581   3.938
    2    HA   GLU   1           HA       GLU   1   1.171   2.932   3.893
    3    HB2  GLU   1          2HB       GLU   1   1.587   2.739   1.374
    4    HB3  GLU   1          3HB       GLU   1   0.891   4.240   1.966
    5    HG2  GLU   1          2HG       GLU   1   3.401   4.998   2.047
    6    HG3  GLU   1          3HG       GLU   1   3.600   3.707   0.864
    7    H    MET   2           HN       MET   2   1.950   1.126   4.842
    8    HA   MET   2           HA       MET   2   4.405  -0.052   3.717
    9    HB2  MET   2          2HB       MET   2   3.365  -1.117   6.268
   10    HB3  MET   2          3HB       MET   2   5.019  -0.778   5.777
   11    HG2  MET   2          2HG       MET   2   4.602   1.623   6.134
   12    HG3  MET   2          3HG       MET   2   2.982   1.231   6.705
   13    HE1  MET   2          1HE       MET   2   6.699  -0.391   7.626
   14    HE2  MET   2          2HE       MET   2   6.647   1.320   7.202
   15    HE3  MET   2          3HE       MET   2   6.948   0.834   8.871
   16    H    CYS   3           HN       CYS   3   4.218  -1.878   2.597
   17    HA   CYS   3           HA       CYS   3   2.031  -3.019   1.602
   18    HB2  CYS   3          2HB       CYS   3   4.309  -3.773   1.062
   19    HB3  CYS   3          3HB       CYS   3   4.407  -4.595   2.615
   20    H    ASP   4           HN       ASP   4   0.185  -3.674   2.462
   21    HA   ASP   4           HA       ASP   4  -0.165  -4.298   5.189
   22    HB2  ASP   4          2HB       ASP   4  -1.873  -3.558   3.304
   23    HB3  ASP   4          3HB       ASP   4  -2.107  -5.298   3.152
   24    H    VAL   5           HN       VAL   5   1.264  -6.094   2.797
   25    HA   VAL   5           HA       VAL   5   0.491  -8.659   4.013
   26    HB   VAL   5           HB       VAL   5   1.823  -8.115   1.356
   27   HG11  VAL   5          1HG1      VAL   5   1.254 -10.612   1.050
   28   HG12  VAL   5          2HG1      VAL   5   2.680 -10.180   1.997
   29   HG13  VAL   5          3HG1      VAL   5   1.189 -10.654   2.812
   30   HG21  VAL   5          1HG2      VAL   5  -0.369  -9.224   0.566
   31   HG22  VAL   5          2HG2      VAL   5  -0.980  -8.797   2.164
   32   HG23  VAL   5          3HG2      VAL   5  -0.412  -7.535   1.072
   33    H    CYS   6           HN       CYS   6   2.805  -6.377   4.306
   34    HA   CYS   6           HA       CYS   6   4.707  -8.294   5.400
   35    HB2  CYS   6          2HB       CYS   6   5.471  -6.216   3.339
   36    HB3  CYS   6          3HB       CYS   6   6.619  -7.154   4.288
   37    H    GLU   7           HN       GLU   7   4.166  -4.831   4.752
   38    HA   GLU   7           HA       GLU   7   3.988  -3.095   6.257
   39    HB2  GLU   7          2HB       GLU   7   5.063  -4.803   8.476
   40    HB3  GLU   7          3HB       GLU   7   3.963  -3.434   8.565
   41    HG2  GLU   7          2HG       GLU   7   2.703  -5.431   7.014
   42    HG3  GLU   7          3HG       GLU   7   3.360  -6.208   8.454
   43    H    VAL   8           HN       VAL   8   5.901  -2.758   4.708
   44    HA   VAL   8           HA       VAL   8   8.047  -1.652   6.208
   45    HB   VAL   8           HB       VAL   8   9.667  -3.177   4.625
   46   HG11  VAL   8          1HG1      VAL   8   9.083  -4.291   7.300
   47   HG12  VAL   8          2HG1      VAL   8  10.617  -3.783   6.590
   48   HG13  VAL   8          3HG1      VAL   8   9.499  -2.579   7.232
   49   HG21  VAL   8          1HG2      VAL   8   7.806  -5.189   5.829
   50   HG22  VAL   8          2HG2      VAL   8   7.512  -4.563   4.206
   51   HG23  VAL   8          3HG2      VAL   8   9.020  -5.402   4.567
   52    H    TRP   9           HN       TRP   9   7.566   0.210   5.074
   53    HA   TRP   9           HA       TRP   9   7.339   0.325   2.248
   54    HB2  TRP   9          2HB       TRP   9   6.381   2.223   3.004
   55    HB3  TRP   9          3HB       TRP   9   7.338   2.222   4.484
   56    HD1  TRP   9          1HD       TRP   9   9.925   3.239   4.195
   57    HE1  TRP   9          1HE       TRP   9  10.716   5.208   2.740
   58    HE3  TRP   9          3HE       TRP   9   5.993   3.470   0.934
   59    HZ2  TRP   9          2HZ       TRP   9   9.795   6.668   0.505
   60    HZ3  TRP   9          3HZ       TRP   9   6.025   5.182  -0.832
   61    HH2  TRP   9          2HH       TRP   9   7.889   6.748  -1.040
   62    H    THR  10           HN       THR  10   8.799   1.617   0.847
   63    HA   THR  10           HA       THR  10  11.624   1.338   1.626
   64    HB   THR  10           HB       THR  10  10.370   0.540  -1.002
   65    HG1  THR  10          1HG       THR  10  10.684  -1.413  -0.251
   66   HG21  THR  10          1HG2      THR  10  13.154   1.324  -0.339
   67   HG22  THR  10          2HG2      THR  10  12.271   1.460  -1.860
   68   HG23  THR  10          3HG2      THR  10  12.937  -0.095  -1.362
   69    H    ALA  11           HN       ALA  11  10.349   2.381  -1.479
   70    HA   ALA  11           HA       ALA  11  10.070   5.058  -1.259
   71    HB1  ALA  11          1HB       ALA  11  12.004   5.854  -0.486
   72    HB2  ALA  11          2HB       ALA  11  12.841   4.328  -0.774
   73    HB3  ALA  11          3HB       ALA  11  12.664   5.499  -2.082
   74    H    GLU  12           HN       GLU  12  12.187   2.883  -3.131
   75    HA   GLU  12           HA       GLU  12  12.254   3.936  -5.576
   76    HB2  GLU  12          2HB       GLU  12  11.341   1.082  -5.265
   77    HB3  GLU  12          3HB       GLU  12  12.367   1.764  -6.519
   78    HG2  GLU  12          2HG       GLU  12  13.827   2.309  -4.304
   79    HG3  GLU  12          3HG       GLU  12  13.048   0.798  -3.838
   80    H    SER  13           HN       SER  13   9.488   1.922  -4.559
   81    HA   SER  13           HA       SER  13   7.467   3.599  -5.418
   82    HB2  SER  13          2HB       SER  13   8.809   2.250  -7.615
   83    HB3  SER  13          3HB       SER  13   7.096   1.835  -7.550
   84    HG   SER  13           HG       SER  13   6.575   3.845  -8.015
   85    H    LEU  14           HN       LEU  14   6.228   2.807  -3.811
   86    HA   LEU  14           HA       LEU  14   5.773  -0.082  -3.657
   87    HB2  LEU  14          2HB       LEU  14   6.154   1.872  -1.718
   88    HB3  LEU  14          3HB       LEU  14   4.430   1.513  -1.646
   89    HG   LEU  14           HG       LEU  14   6.633  -0.532  -1.382
   90   HD11  LEU  14          1HD1      LEU  14   6.088  -0.575   0.975
   91   HD12  LEU  14          2HD1      LEU  14   4.875   0.684   0.743
   92   HD13  LEU  14          3HD1      LEU  14   6.583   1.049   0.498
   93   HD21  LEU  14          1HD2      LEU  14   4.608  -1.494  -2.276
   94   HD22  LEU  14          2HD2      LEU  14   3.644  -0.714  -1.022
   95   HD23  LEU  14          3HD2      LEU  14   4.796  -1.980  -0.591
   96    H    PHE  15           HN       PHE  15   3.782  -1.003  -3.914
   97    HA   PHE  15           HA       PHE  15   1.827   0.551  -5.363
   98    HB2  PHE  15          2HB       PHE  15   1.994  -2.365  -4.603
   99    HB3  PHE  15          3HB       PHE  15   0.608  -1.680  -5.446
  100    HD1  PHE  15          1HD       PHE  15   4.316  -1.392  -5.784
  101    HD2  PHE  15          2HD       PHE  15   0.587  -2.195  -7.672
  102    HE1  PHE  15          1HE       PHE  15   5.475  -1.703  -7.933
  103    HE2  PHE  15          2HE       PHE  15   1.740  -2.510  -9.823
  104    HZ   PHE  15           HZ       PHE  15   4.187  -2.265  -9.956
  105    HA   PRO  16           HA       PRO  16  -0.428  -0.033  -5.881
  106    HB2  PRO  16          2HB       PRO  16  -2.321   1.912  -5.892
  107    HB3  PRO  16          3HB       PRO  16  -2.654   0.251  -5.389
  108    HG2  PRO  16          2HG       PRO  16  -2.108   2.666  -3.706
  109    HG3  PRO  16          3HG       PRO  16  -3.324   1.395  -3.479
  110    HD2  PRO  16          2HD       PRO  16  -0.993   1.445  -2.101
  111    HD3  PRO  16          3HD       PRO  16  -1.803  -0.069  -2.553
  112    H    CYS  17           HN       CYS  17  -0.400   3.144  -4.245
  113    HA   CYS  17           HA       CYS  17   1.861   4.095  -5.646
  114    HB2  CYS  17          2HB       CYS  17   0.953   5.531  -7.265
  115    HB3  CYS  17          3HB       CYS  17   0.022   4.047  -7.449
  116    H    ARG  18           HN       ARG  18   0.808   6.862  -5.784
  117    HA   ARG  18           HA       ARG  18   1.304   7.565  -3.044
  118    HB2  ARG  18          2HB       ARG  18   2.119   9.358  -4.097
  119    HB3  ARG  18          3HB       ARG  18   1.346   8.884  -5.603
  120    HG2  ARG  18          2HG       ARG  18   0.658  11.113  -4.910
  121    HG3  ARG  18          3HG       ARG  18  -0.708   9.994  -4.917
  122    HD2  ARG  18          2HD       ARG  18  -1.102  10.392  -2.767
  123    HD3  ARG  18          3HD       ARG  18   0.555   9.957  -2.347
  124    HE   ARG  18           HE       ARG  18   0.577  12.545  -3.396
  125   HH11  ARG  18          1HH1      ARG  18  -0.639  10.835  -0.618
  126   HH12  ARG  18          2HH1      ARG  18  -0.560  12.213   0.428
  127   HH21  ARG  18          1HH2      ARG  18   0.687  14.367  -2.028
  128   HH22  ARG  18          2HH2      ARG  18   0.194  14.222  -0.375
  129    H    VAL  19           HN       VAL  19  -1.425   8.082  -5.278
  130    HA   VAL  19           HA       VAL  19  -3.149   9.095  -3.246
  131    HB   VAL  19           HB       VAL  19  -4.874   9.113  -4.882
  132   HG11  VAL  19          1HG1      VAL  19  -3.913  10.417  -6.593
  133   HG12  VAL  19          2HG1      VAL  19  -2.869  10.646  -5.188
  134   HG13  VAL  19          3HG1      VAL  19  -2.375   9.562  -6.489
  135   HG21  VAL  19          1HG2      VAL  19  -5.172   7.380  -6.237
  136   HG22  VAL  19          2HG2      VAL  19  -3.758   7.883  -7.163
  137   HG23  VAL  19          3HG2      VAL  19  -3.578   6.748  -5.825
  138    H    CYS  20           HN       CYS  20  -5.438   7.438  -4.358
  139    HA   CYS  20           HA       CYS  20  -6.730   5.776  -3.456
  140    HB2  CYS  20          2HB       CYS  20  -5.315   3.511  -3.487
  141    HB3  CYS  20          3HB       CYS  20  -5.899   4.273  -4.963
  142    H    THR  21           HN       THR  21  -6.337   3.608  -1.915
  143    HA   THR  21           HA       THR  21  -5.139   4.688   0.554
  144    HB   THR  21           HB       THR  21  -6.884   3.202   1.726
  145    HG1  THR  21          1HG       THR  21  -8.634   2.606   0.534
  146   HG21  THR  21          1HG2      THR  21  -8.438   5.320   0.440
  147   HG22  THR  21          2HG2      THR  21  -6.868   5.858   1.037
  148   HG23  THR  21          3HG2      THR  21  -8.017   5.096   2.137
  149    H    ARG  22           HN       ARG  22  -6.589   1.520   0.156
  150    HA   ARG  22           HA       ARG  22  -4.977  -0.094   1.428
  151    HB2  ARG  22          2HB       ARG  22  -5.591  -0.766  -1.447
  152    HB3  ARG  22          3HB       ARG  22  -5.429  -1.873  -0.091
  153    HG2  ARG  22          2HG       ARG  22  -7.469  -0.128   0.648
  154    HG3  ARG  22          3HG       ARG  22  -7.754  -0.481  -1.058
  155    HD2  ARG  22          2HD       ARG  22  -7.679  -2.868  -0.593
  156    HD3  ARG  22          3HD       ARG  22  -7.325  -2.542   1.103
  157    HE   ARG  22           HE       ARG  22  -9.702  -1.237   0.476
  158   HH11  ARG  22          1HH1      ARG  22  -8.482  -4.492   0.678
  159   HH12  ARG  22          2HH1      ARG  22 -10.018  -5.181   1.088
  160   HH21  ARG  22          1HH2      ARG  22 -11.729  -2.133   1.017
  161   HH22  ARG  22          2HH2      ARG  22 -11.864  -3.839   1.280
  162    H    VAL  23           HN       VAL  23  -2.933  -0.882   1.443
  163    HA   VAL  23           HA       VAL  23  -1.123   0.026  -0.700
  164    HB   VAL  23           HB       VAL  23   0.316   0.924   0.752
  165   HG11  VAL  23          1HG1      VAL  23  -1.710   0.491   2.929
  166   HG12  VAL  23          2HG1      VAL  23  -0.606   1.850   2.707
  167   HG13  VAL  23          3HG1      VAL  23  -1.973   1.636   1.614
  168   HG21  VAL  23          1HG2      VAL  23   1.153  -1.233   1.433
  169   HG22  VAL  23          2HG2      VAL  23   1.027  -0.189   2.848
  170   HG23  VAL  23          3HG2      VAL  23  -0.186  -1.437   2.562
  171    H    PHE  24           HN       PHE  24   0.144  -1.476  -1.620
  172    HA   PHE  24           HA       PHE  24   0.676  -3.989  -0.251
  173    HB2  PHE  24          2HB       PHE  24   0.004  -4.847  -2.815
  174    HB3  PHE  24          3HB       PHE  24  -0.931  -5.104  -1.346
  175    HD1  PHE  24          1HD       PHE  24  -0.579  -3.052  -4.365
  176    HD2  PHE  24          2HD       PHE  24  -2.933  -3.868  -0.914
  177    HE1  PHE  24          1HE       PHE  24  -2.423  -1.727  -5.314
  178    HE2  PHE  24          2HE       PHE  24  -4.781  -2.545  -1.858
  179    HZ   PHE  24           HZ       PHE  24  -4.527  -1.473  -4.060
  180    H    HIS  25           HN       HIS  25   2.106  -5.415  -1.720
  181    HA   HIS  25           HA       HIS  25   4.228  -3.695  -2.743
  182    HB2  HIS  25          2HB       HIS  25   4.073  -6.405  -1.595
  183    HB3  HIS  25          3HB       HIS  25   5.229  -6.224  -2.911
  184    HD2  HIS  25          2HD       HIS  25   5.984  -3.035  -1.802
  185    HE1  HIS  25          1HE       HIS  25   7.635  -5.300   1.382
  186    HE2  HIS  25          2HE       HIS  25   7.521  -3.040   0.278
  187    H    ASP  26           HN       ASP  26   5.515  -4.846  -4.625
  188    HA   ASP  26           HA       ASP  26   3.639  -5.014  -6.831
  189    HB2  ASP  26          2HB       ASP  26   5.373  -4.407  -8.194
  190    HB3  ASP  26          3HB       ASP  26   5.999  -3.778  -6.673
  191    H    GLY  27           HN       GLY  27   5.825  -7.085  -5.052
  192    HA2  GLY  27          1HA       GLY  27   5.443  -9.280  -6.940
  193    HA3  GLY  27          2HA       GLY  27   6.505  -9.286  -5.540
  194    H    CYS  28           HN       CYS  28   4.615  -8.433  -3.609
  195    HA   CYS  28           HA       CYS  28   3.550 -10.851  -2.770
  196    HB2  CYS  28          2HB       CYS  28   2.938  -7.997  -2.064
  197    HB3  CYS  28          3HB       CYS  28   2.008  -9.310  -1.350
  198    H    LEU  29           HN       LEU  29   1.733  -8.095  -4.127
  199    HA   LEU  29           HA       LEU  29  -0.774  -9.060  -4.264
  200    HB2  LEU  29          2HB       LEU  29   0.650  -7.665  -6.526
  201    HB3  LEU  29          3HB       LEU  29  -1.097  -7.788  -6.337
  202    HG   LEU  29           HG       LEU  29   0.624  -6.438  -4.277
  203   HD11  LEU  29          1HD1      LEU  29  -0.807  -4.919  -6.416
  204   HD12  LEU  29          2HD1      LEU  29   0.829  -5.516  -6.693
  205   HD13  LEU  29          3HD1      LEU  29   0.510  -4.404  -5.362
  206   HD21  LEU  29          1HD2      LEU  29  -2.184  -6.982  -4.628
  207   HD22  LEU  29          2HD2      LEU  29  -1.888  -5.246  -4.519
  208   HD23  LEU  29          3HD2      LEU  29  -1.333  -6.319  -3.232
  209    H    ARG  30           HN       ARG  30   1.929 -10.134  -6.208
  210    HA   ARG  30           HA       ARG  30   0.227 -11.862  -7.820
  211    HB2  ARG  30          2HB       ARG  30   3.207 -11.361  -7.852
  212    HB3  ARG  30          3HB       ARG  30   2.387 -12.481  -8.931
  213    HG2  ARG  30          2HG       ARG  30   1.244 -10.751 -10.035
  214    HG3  ARG  30          3HG       ARG  30   1.634  -9.581  -8.772
  215    HD2  ARG  30          2HD       ARG  30   4.074 -10.635  -9.749
  216    HD3  ARG  30          3HD       ARG  30   3.084 -10.208 -11.144
  217    HE   ARG  30           HE       ARG  30   4.411  -8.413  -9.421
  218   HH11  ARG  30          1HH1      ARG  30   1.405  -8.817 -11.130
  219   HH12  ARG  30          2HH1      ARG  30   1.114  -7.116 -11.284
  220   HH21  ARG  30          1HH2      ARG  30   4.039  -6.171  -9.619
  221   HH22  ARG  30          2HH2      ARG  30   2.613  -5.612 -10.425
  222    H    ARG  31           HN       ARG  31   2.586 -12.055  -5.229
  223    HA   ARG  31           HA       ARG  31   2.760 -14.918  -5.272
  224    HB2  ARG  31          2HB       ARG  31   4.268 -12.897  -4.161
  225    HB3  ARG  31          3HB       ARG  31   3.479 -13.606  -2.758
  226    HG2  ARG  31          2HG       ARG  31   4.460 -15.699  -3.122
  227    HG3  ARG  31          3HG       ARG  31   4.912 -15.293  -4.779
  228    HD2  ARG  31          2HD       ARG  31   6.882 -14.541  -4.085
  229    HD3  ARG  31          3HD       ARG  31   6.088 -13.392  -3.008
  230    HE   ARG  31           HE       ARG  31   6.784 -14.707  -1.293
  231   HH11  ARG  31          1HH1      ARG  31   6.337 -16.727  -4.093
  232   HH12  ARG  31          2HH1      ARG  31   6.823 -18.180  -3.283
  233   HH21  ARG  31          1HH2      ARG  31   7.426 -16.613  -0.217
  234   HH22  ARG  31          2HH2      ARG  31   7.441 -18.114  -1.079
  235    H    MET  32           HN       MET  32   1.465 -12.656  -2.830
  236    HA   MET  32           HA       MET  32   0.174 -14.526  -1.249
  237    HB2  MET  32          2HB       MET  32  -0.760 -12.749  -0.147
  238    HB3  MET  32          3HB       MET  32   0.512 -11.907  -1.021
  239    HG2  MET  32          2HG       MET  32  -1.289 -10.556  -1.425
  240    HG3  MET  32          3HG       MET  32  -1.316 -11.601  -2.843
  241    HE1  MET  32          1HE       MET  32  -2.215 -11.538   0.758
  242    HE2  MET  32          2HE       MET  32  -3.968 -11.715   0.826
  243    HE3  MET  32          3HE       MET  32  -2.939 -13.146   0.733
  244    H    GLY  33           HN       GLY  33  -0.577 -13.571  -4.418
  245    HA2  GLY  33          1HA       GLY  33  -2.190 -14.436  -5.838
  246    HA3  GLY  33          2HA       GLY  33  -2.865 -15.319  -4.476
  247    H    TYR  34           HN       TYR  34  -2.440 -11.886  -5.356
  248    HA   TYR  34           HA       TYR  34  -5.157 -11.381  -4.376
  249    HB2  TYR  34          2HB       TYR  34  -2.676  -9.802  -4.539
  250    HB3  TYR  34          3HB       TYR  34  -4.137  -8.916  -4.966
  251    HD1  TYR  34          1HD       TYR  34  -6.114 -10.117  -3.142
  252    HD2  TYR  34          2HD       TYR  34  -2.074  -8.983  -2.443
  253    HE1  TYR  34          1HE       TYR  34  -6.623  -9.800  -0.757
  254    HE2  TYR  34          2HE       TYR  34  -2.570  -8.663  -0.055
  255    HH   TYR  34           HH       TYR  34  -4.822  -9.871   1.533
  256    H    ILE  35           HN       ILE  35  -3.081 -10.871  -7.197
  257    HA   ILE  35           HA       ILE  35  -5.504 -10.312  -8.780
  258    HB   ILE  35           HB       ILE  35  -3.531  -9.366 -10.370
  259   HG12  ILE  35          2HG1      ILE  35  -2.693  -8.719  -7.535
  260   HG13  ILE  35          3HG1      ILE  35  -1.815  -9.771  -8.640
  261   HG21  ILE  35          1HG2      ILE  35  -5.488  -8.225  -8.524
  262   HG22  ILE  35          2HG2      ILE  35  -4.160  -7.136  -8.923
  263   HG23  ILE  35          3HG2      ILE  35  -5.149  -7.827 -10.208
  264   HD11  ILE  35          1HD1      ILE  35  -2.244  -7.287  -9.938
  265   HD12  ILE  35          2HD1      ILE  35  -1.602  -6.974  -8.325
  266   HD13  ILE  35          3HD1      ILE  35  -0.724  -8.027  -9.435
  267    H    GLN  36           HN       GLN  36  -4.713 -10.630 -11.284
  268    HA   GLN  36           HA       GLN  36  -4.378 -13.470 -11.515
  269    HB2  GLN  36          2HB       GLN  36  -4.827 -11.225 -13.450
  270    HB3  GLN  36          3HB       GLN  36  -4.350 -12.810 -14.042
  271    HG2  GLN  36          2HG       GLN  36  -6.330 -13.785 -13.451
  272    HG3  GLN  36          3HG       GLN  36  -6.641 -12.626 -12.159
  273   HE21  GLN  36          1HE2      GLN  36  -8.736 -13.101 -13.604
  274   HE22  GLN  36          2HE2      GLN  36  -9.065 -11.849 -14.747
  275    H    GLY  37           HN       GLY  37  -2.522 -10.670 -12.725
  276    HA2  GLY  37          1HA       GLY  37  -0.046 -10.941 -12.158
  277    HA3  GLY  37          2HA       GLY  37  -0.200 -12.465 -13.019
  278    H    ASP  38           HN       ASP  38   1.628 -11.337 -14.205
  279    HA   ASP  38           HA       ASP  38   2.416 -10.403 -16.124
  280    HB2  ASP  38          2HB       ASP  38   0.921 -11.754 -17.360
  281    HB3  ASP  38          3HB       ASP  38  -0.477 -10.806 -16.861
  282    H    SER  39           HN       SER  39   3.064  -8.383 -16.488
  283    HA   SER  39           HA       SER  39   1.148  -6.183 -16.201
  284    HB2  SER  39          2HB       SER  39   3.783  -5.521 -15.120
  285    HB3  SER  39          3HB       SER  39   2.181  -5.216 -14.447
  286    HG   SER  39           HG       SER  39   2.165  -7.338 -13.662
  287    H    ALA  40           HN       ALA  40   3.055  -4.120 -16.461
  288    HA   ALA  40           HA       ALA  40   4.763  -4.541 -18.696
  289    HB1  ALA  40          1HB       ALA  40   2.706  -2.683 -19.605
  290    HB2  ALA  40          2HB       ALA  40   3.507  -4.000 -20.464
  291    HB3  ALA  40          3HB       ALA  40   2.125  -4.338 -19.419
  292    H    ALA  41           HN       ALA  41   5.207  -2.197 -19.733
  293    HA   ALA  41           HA       ALA  41   6.174  -0.165 -19.395
  294    HB1  ALA  41          1HB       ALA  41   4.715   0.670 -17.047
  295    HB2  ALA  41          2HB       ALA  41   4.686   1.326 -18.684
  296    HB3  ALA  41          3HB       ALA  41   3.641  -0.029 -18.258
  297    H    GLU  42           HN       GLU  42   8.199  -0.160 -18.679
  298    HA   GLU  42           HA       GLU  42   8.674  -0.397 -15.800
  299    HB2  GLU  42          2HB       GLU  42  10.349  -1.862 -17.843
  300    HB3  GLU  42          3HB       GLU  42  10.520  -1.921 -16.095
  301    HG2  GLU  42          2HG       GLU  42   7.958  -2.728 -16.368
  302    HG3  GLU  42          3HG       GLU  42   8.658  -3.343 -17.865
  303    H    VAL  43           HN       VAL  43   8.699   1.730 -17.951
  304    HA   VAL  43           HA       VAL  43  11.291   2.553 -18.553
  305    HB   VAL  43           HB       VAL  43   8.992   4.416 -17.962
  306   HG11  VAL  43          1HG1      VAL  43  10.919   5.700 -18.271
  307   HG12  VAL  43          2HG1      VAL  43  11.534   4.638 -19.539
  308   HG13  VAL  43          3HG1      VAL  43  10.154   5.688 -19.860
  309   HG21  VAL  43          1HG2      VAL  43   9.368   2.458 -20.114
  310   HG22  VAL  43          2HG2      VAL  43   7.899   3.249 -19.542
  311   HG23  VAL  43          3HG2      VAL  43   8.974   4.087 -20.661
  312    H    THR  44           HN       THR  44   9.217   3.781 -15.919
  313    HA   THR  44           HA       THR  44  11.499   3.916 -14.139
  314    HB   THR  44           HB       THR  44  11.545   6.076 -15.430
  315    HG1  THR  44          1HG       THR  44  12.145   5.690 -13.058
  316   HG21  THR  44          1HG2      THR  44   8.969   6.576 -13.932
  317   HG22  THR  44          2HG2      THR  44   9.134   6.396 -15.679
  318   HG23  THR  44          3HG2      THR  44   9.868   7.775 -14.861
  319    H    GLU  45           HN       GLU  45  10.811   4.779 -11.948
  320    HA   GLU  45           HA       GLU  45   8.001   4.691 -11.332
  321    HB2  GLU  45          2HB       GLU  45   8.901   2.772  -9.547
  322    HB3  GLU  45          3HB       GLU  45   7.875   2.491 -10.948
  323    HG2  GLU  45          2HG       GLU  45   9.626   0.936 -11.103
  324    HG3  GLU  45          3HG       GLU  45   9.989   2.192 -12.286
  325    H    MET  46           HN       MET  46   7.538   5.697  -9.428
  326    HA   MET  46           HA       MET  46   9.741   6.293  -7.591
  327    HB2  MET  46          2HB       MET  46   7.982   8.298  -8.981
  328    HB3  MET  46          3HB       MET  46   8.752   8.669  -7.444
  329    HG2  MET  46          2HG       MET  46  10.623   7.573  -9.363
  330    HG3  MET  46          3HG       MET  46   9.826   9.026  -9.961
  331    HE1  MET  46          1HE       MET  46   9.920  11.367  -7.355
  332    HE2  MET  46          2HE       MET  46  11.205  11.829  -8.470
  333    HE3  MET  46          3HE       MET  46   9.737  11.068  -9.084
  334    H    ALA  47           HN       ALA  47   6.384   7.435  -7.885
  335    HA   ALA  47           HA       ALA  47   5.035   5.806  -6.207
  336    HB1  ALA  47          1HB       ALA  47   6.404   5.939  -4.365
  337    HB2  ALA  47          2HB       ALA  47   6.808   7.632  -4.653
  338    HB3  ALA  47          3HB       ALA  47   5.225   7.202  -4.005
  339    H    HIS  48           HN       HIS  48   5.761   9.201  -6.807
  340    HA   HIS  48           HA       HIS  48   2.942   9.699  -7.310
  341    HB2  HIS  48          2HB       HIS  48   2.547  11.212  -5.651
  342    HB3  HIS  48          3HB       HIS  48   3.760  10.249  -4.813
  343    HD1  HIS  48          1HD       HIS  48   2.973  13.637  -5.575
  344    HD2  HIS  48          2HD       HIS  48   6.493  11.449  -5.282
  345    HE1  HIS  48          1HE       HIS  48   4.798  15.339  -5.264
  346    H    THR  49           HN       THR  49   2.626  11.144  -8.913
  347    HA   THR  49           HA       THR  49   4.524  13.178  -9.581
  348    HB   THR  49           HB       THR  49   4.400  11.842 -12.045
  349    HG1  THR  49          1HG       THR  49   3.994   9.869 -11.106
  350   HG21  THR  49          1HG2      THR  49   6.229  13.264 -11.182
  351   HG22  THR  49          2HG2      THR  49   6.815  11.730 -11.826
  352   HG23  THR  49          3HG2      THR  49   6.693  11.966 -10.083
  353    H    GLU  50           HN       GLU  50   3.885  14.252 -11.722
  354    HA   GLU  50           HA       GLU  50   1.338  15.230 -11.605
  355    HB2  GLU  50          2HB       GLU  50   3.470  15.203 -13.606
  356    HB3  GLU  50          3HB       GLU  50   1.866  15.349 -14.310
  357    HG2  GLU  50          2HG       GLU  50   2.362  17.544 -13.994
  358    HG3  GLU  50          3HG       GLU  50   1.573  17.187 -12.458
  359    H    THR  51           HN       THR  51   2.172  13.268 -14.429
  360    HA   THR  51           HA       THR  51  -0.234  12.532 -15.314
  361    HB   THR  51           HB       THR  51   0.750  10.253 -15.907
  362    HG1  THR  51          1HG       THR  51   3.290  10.877 -15.463
  363   HG21  THR  51          1HG2      THR  51   2.470  12.616 -16.647
  364   HG22  THR  51          2HG2      THR  51   0.868  12.329 -17.324
  365   HG23  THR  51          3HG2      THR  51   2.162  11.165 -17.600
  366    H    GLY  52           HN       GLY  52   1.473  10.265 -13.151
  367    HA2  GLY  52          1HA       GLY  52   0.283   9.677 -11.033
  368    HA3  GLY  52          2HA       GLY  52  -1.164   9.552 -12.022
  369    H    TRP  53           HN       TRP  53   0.134   7.544 -10.320
  370    HA   TRP  53           HA       TRP  53   1.024   5.573 -12.299
  371    HB2  TRP  53          2HB       TRP  53   2.385   5.979 -10.224
  372    HB3  TRP  53          3HB       TRP  53   1.046   5.323  -9.287
  373    HD1  TRP  53          1HD       TRP  53   0.905   2.740  -9.060
  374    HE1  TRP  53          1HE       TRP  53   2.301   0.773  -9.958
  375    HE3  TRP  53          3HE       TRP  53   3.820   5.275 -12.410
  376    HZ2  TRP  53          2HZ       TRP  53   4.366   0.352 -11.837
  377    HZ3  TRP  53          3HZ       TRP  53   5.481   4.017 -13.717
  378    HH2  TRP  53          2HH       TRP  53   5.747   1.606 -13.435
  379    H    SER  54           HN       SER  54  -0.109   3.760 -12.765
  380    HA   SER  54           HA       SER  54  -2.875   3.680 -11.987
  381    HB2  SER  54          2HB       SER  54  -2.109   1.291 -13.355
  382    HB3  SER  54          3HB       SER  54  -3.063   2.645 -13.963
  383    HG   SER  54           HG       SER  54  -0.381   2.049 -14.326
  384    H    CYS  55           HN       CYS  55  -3.938   1.972 -10.916
  385    HA   CYS  55           HA       CYS  55  -2.416  -0.124  -9.652
  386    HB2  CYS  55          2HB       CYS  55  -3.894   1.384  -7.610
  387    HB3  CYS  55          3HB       CYS  55  -2.298   0.644  -7.531
  388    H    HIS  56           HN       HIS  56  -3.730  -1.738  -8.704
  389    HA   HIS  56           HA       HIS  56  -6.043  -2.407  -9.979
  390    HB2  HIS  56          2HB       HIS  56  -4.822  -3.972  -8.558
  391    HB3  HIS  56          3HB       HIS  56  -5.299  -3.071  -7.122
  392    HD1  HIS  56          1HD       HIS  56  -8.120  -3.222  -9.343
  393    HD2  HIS  56          2HD       HIS  56  -6.397  -5.789  -6.568
  394    HE1  HIS  56          1HE       HIS  56  -9.898  -4.915  -8.799
  395    H    TYR  57           HN       TYR  57  -5.905  -0.914  -6.741
  396    HA   TYR  57           HA       TYR  57  -8.725  -0.421  -6.697
  397    HB2  TYR  57          2HB       TYR  57  -6.430   0.345  -4.911
  398    HB3  TYR  57          3HB       TYR  57  -8.037   1.018  -4.657
  399    HD1  TYR  57          1HD       TYR  57  -9.488  -0.098  -3.246
  400    HD2  TYR  57          2HD       TYR  57  -6.356  -2.287  -5.118
  401    HE1  TYR  57          1HE       TYR  57 -10.129  -2.098  -1.966
  402    HE2  TYR  57          2HE       TYR  57  -6.990  -4.293  -3.844
  403    HH   TYR  57           HH       TYR  57  -9.838  -4.711  -2.367
  404    H    CYS  58           HN       CYS  58  -6.256   1.041  -8.335
  405    HA   CYS  58           HA       CYS  58  -7.033   3.787  -8.036
  406    HB2  CYS  58          2HB       CYS  58  -4.839   2.421  -9.122
  407    HB3  CYS  58          3HB       CYS  58  -5.595   3.239 -10.486
  408    H    ASP  59           HN       ASP  59  -7.117   1.625 -10.874
  409    HA   ASP  59           HA       ASP  59  -8.502   1.540 -12.678
  410    HB2  ASP  59          2HB       ASP  59 -10.163   1.744 -10.341
  411    HB3  ASP  59          3HB       ASP  59 -10.934   2.582 -11.685
  412    H    ASN  60           HN       ASN  60  -7.995   2.945 -14.230
  413    HA   ASN  60           HA       ASN  60  -8.857   5.746 -13.907
  414    HB2  ASN  60          2HB       ASN  60  -6.971   5.597 -16.000
  415    HB3  ASN  60          3HB       ASN  60  -6.751   6.314 -14.406
  416   HD21  ASN  60          1HD2      ASN  60  -6.914   3.042 -15.782
  417   HD22  ASN  60          2HD2      ASN  60  -5.501   2.454 -14.980