*HEADER    TRANSFERASE                             08-APR-05   1ZBJ              
*TITLE     INFERENTIAL STRUCTURE DETERMINATION OF THE FYN SH3 DOMAIN             
*TITLE    2 USING NOESY DATA FROM A 15N,H2 ENRICHED PROTEIN                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTO-ONCOGENE TYROSINE-PROTEIN KINASE FYN;                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SH3 DOMAIN, RESIDUES 83-141;                               
*COMPND   5 SYNONYM: P59-FYN, SYN, SLK;                                          
*COMPND   6 EC: 2.7.1.112;                                                       
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: FYN;                                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    TRANSFERASE                                                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    W.RIEPING, M.HABECK, M.NILGES                                         
*REVDAT   1   03-MAY-05 1ZBJ    0                                                
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  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    VAL   1           H        VAL   1 -11.659  12.347   4.186
    2    HA   VAL   1           HA       VAL   1 -10.759   9.978   4.029
    3    HB   VAL   1           HB       VAL   1 -11.149  11.592   1.500
    4   1HG1  VAL   1          HG11      VAL   1 -12.230   9.241   0.889
    5   2HG1  VAL   1          HG12      VAL   1 -10.491   9.556   0.671
    6   3HG1  VAL   1          HG13      VAL   1 -11.061   8.661   2.101
    7   1HG2  VAL   1          HG21      VAL   1 -13.284  11.886   2.070
    8   2HG2  VAL   1          HG22      VAL   1 -13.486  10.138   2.343
    9   3HG2  VAL   1          HG23      VAL   1 -12.930  11.188   3.668
   10    H    THR   2           H        THR   2  -8.684   9.354   4.512
   11    HA   THR   2           HA       THR   2  -6.569  10.399   2.751
   12    HB   THR   2           HB       THR   2  -6.182   9.036   5.449
   13    HG1  THR   2           HG1      THR   2  -6.630  11.093   6.352
   14   1HG2  THR   2          HG21      THR   2  -4.179  10.416   5.537
   15   2HG2  THR   2          HG22      THR   2  -4.193   9.644   3.933
   16   3HG2  THR   2          HG23      THR   2  -4.690  11.344   4.107
   17    H    LEU   3           H        LEU   3  -8.604   8.163   2.270
   18    HA   LEU   3           HA       LEU   3  -6.999   5.792   2.374
   19   1HB   LEU   3          HB2       LEU   3  -9.750   6.539   1.533
   20   2HB   LEU   3          HB3       LEU   3  -9.047   5.115   0.790
   21    HG   LEU   3           HG       LEU   3  -8.571   4.260   3.139
   22   1HD1  LEU   3          HD11      LEU   3  -9.780   6.847   3.784
   23   2HD1  LEU   3          HD12      LEU   3 -10.535   5.480   4.637
   24   3HD1  LEU   3          HD13      LEU   3  -8.783   5.760   4.779
   25   1HD2  LEU   3          HD21      LEU   3 -10.978   4.261   1.582
   26   2HD2  LEU   3          HD22      LEU   3 -10.314   2.989   2.635
   27   3HD2  LEU   3          HD23      LEU   3 -11.397   4.229   3.312
   28    H    PHE   4           H        PHE   4  -5.854   4.807   0.713
   29    HA   PHE   4           HA       PHE   4  -5.423   6.534  -1.605
   30   1HB   PHE   4          HB2       PHE   4  -3.865   4.045  -0.733
   31   2HB   PHE   4          HB3       PHE   4  -3.273   5.378  -1.704
   32    HD1  PHE   4           HD1      PHE   4  -3.444   4.007   1.556
   33    HD2  PHE   4           HD2      PHE   4  -3.122   7.688  -0.532
   34    HE1  PHE   4           HE1      PHE   4  -2.504   5.092   3.614
   35    HE2  PHE   4           HE2      PHE   4  -2.182   8.773   1.528
   36    HZ   PHE   4           HZ       PHE   4  -1.885   7.462   3.577
   37    H    VAL   5           H        VAL   5  -5.676   5.786  -3.729
   38    HA   VAL   5           HA       VAL   5  -7.140   3.260  -3.923
   39    HB   VAL   5           HB       VAL   5  -6.940   5.663  -5.746
   40   1HG1  VAL   5          HG11      VAL   5  -7.422   3.036  -6.530
   41   2HG1  VAL   5          HG12      VAL   5  -9.049   3.738  -6.362
   42   3HG1  VAL   5          HG13      VAL   5  -7.853   4.508  -7.433
   43   1HG2  VAL   5          HG21      VAL   5  -9.204   6.128  -5.142
   44   2HG2  VAL   5          HG22      VAL   5  -9.358   4.585  -4.269
   45   3HG2  VAL   5          HG23      VAL   5  -8.305   5.869  -3.628
   46    H    ALA   6           H        ALA   6  -6.426   1.571  -5.229
   47    HA   ALA   6           HA       ALA   6  -3.626   1.584  -5.796
   48   1HB   ALA   6          HB1       ALA   6  -5.756  -0.474  -6.498
   49   2HB   ALA   6          HB2       ALA   6  -3.999  -0.738  -6.386
   50   3HB   ALA   6          HB3       ALA   6  -4.939  -0.375  -4.920
   51    H    LEU   7           H        LEU   7  -2.590   1.642  -7.807
   52    HA   LEU   7           HA       LEU   7  -4.284   2.641  -9.966
   53   1HB   LEU   7          HB2       LEU   7  -2.017   3.658  -8.913
   54   2HB   LEU   7          HB3       LEU   7  -1.334   2.671 -10.190
   55    HG   LEU   7           HG       LEU   7  -3.554   4.636 -10.749
   56   1HD1  LEU   7          HD11      LEU   7  -2.238   6.412 -10.541
   57   2HD1  LEU   7          HD12      LEU   7  -1.046   5.365  -9.736
   58   3HD1  LEU   7          HD13      LEU   7  -0.945   5.641 -11.490
   59   1HD2  LEU   7          HD21      LEU   7  -1.745   4.432 -12.894
   60   2HD2  LEU   7          HD22      LEU   7  -2.005   2.771 -12.309
   61   3HD2  LEU   7          HD23      LEU   7  -3.395   3.773 -12.787
   62    H    TYR   8           H        TYR   8  -1.371   0.491  -9.591
   63    HA   TYR   8           HA       TYR   8  -2.692  -1.416 -11.364
   64   1HB   TYR   8          HB2       TYR   8  -0.563   0.449 -12.015
   65   2HB   TYR   8          HB3       TYR   8   0.184  -1.132 -11.898
   66    HD1  TYR   8           HD1      TYR   8   0.638  -1.805 -14.086
   67    HD2  TYR   8           HD2      TYR   8  -3.204  -0.157 -13.177
   68    HE1  TYR   8           HE1      TYR   8  -0.159  -2.349 -16.438
   69    HE2  TYR   8           HE2      TYR   8  -3.989  -0.707 -15.532
   70    HH   TYR   8           HH       TYR   8  -3.512  -1.687 -17.402
   71    H    ASP   9           H        ASP   9  -0.621  -3.239 -11.664
   72    HA   ASP   9           HA       ASP   9  -0.420  -4.150  -8.944
   73   1HB   ASP   9          HB2       ASP   9   0.703  -6.162 -10.327
   74   2HB   ASP   9          HB3       ASP   9  -1.037  -5.975 -10.223
   75    HD2  ASP   9           HD2      ASP   9   1.160  -4.773 -13.222
   76    H    TYR  10           H        TYR  10   1.825  -5.400  -8.492
   77    HA   TYR  10           HA       TYR  10   4.068  -4.021  -9.743
   78   1HB   TYR  10          HB2       TYR  10   3.024  -2.987  -7.480
   79   2HB   TYR  10          HB3       TYR  10   3.799  -4.359  -6.714
   80    HD1  TYR  10           HD1      TYR  10   4.870  -1.970  -9.414
   81    HD2  TYR  10           HD2      TYR  10   5.718  -3.704  -5.596
   82    HE1  TYR  10           HE1      TYR  10   7.058  -0.680  -9.307
   83    HE2  TYR  10           HE2      TYR  10   7.904  -2.409  -5.501
   84    HH   TYR  10           HH       TYR  10   9.446  -1.378  -6.943
   85    H    GLU  11           H        GLU  11   6.059  -5.177  -9.606
   86    HA   GLU  11           HA       GLU  11   5.637  -7.937  -8.788
   87   1HB   GLU  11          HB2       GLU  11   6.664  -6.812 -11.167
   88   2HB   GLU  11          HB3       GLU  11   8.073  -7.444 -10.338
   89   1HG   GLU  11          HG2       GLU  11   7.305  -9.303 -11.586
   90   2HG   GLU  11          HG3       GLU  11   6.676  -9.615  -9.980
   91    HE2  GLU  11           HE2      GLU  11   3.375  -9.160 -10.894
   92    H    ALA  12           H        ALA  12   6.189  -7.948  -6.596
   93    HA   ALA  12           HA       ALA  12   8.756  -6.733  -5.889
   94   1HB   ALA  12          HB1       ALA  12   7.885  -7.105  -3.541
   95   2HB   ALA  12          HB2       ALA  12   6.905  -5.996  -4.529
   96   3HB   ALA  12          HB3       ALA  12   6.360  -7.670  -4.265
   97    H    ARG  13           H        ARG  13  10.523  -8.014  -5.723
   98    HA   ARG  13           HA       ARG  13   9.990 -10.848  -5.325
   99   1HB   ARG  13          HB2       ARG  13  12.049  -9.367  -6.982
  100   2HB   ARG  13          HB3       ARG  13  12.461 -10.954  -6.362
  101   1HG   ARG  13          HG2       ARG  13  10.532 -11.968  -7.479
  102   2HG   ARG  13          HG3       ARG  13   9.911 -10.398  -7.943
  103   1HD   ARG  13          HD2       ARG  13  12.520 -10.365  -8.973
  104   2HD   ARG  13          HD3       ARG  13  12.024 -12.028  -9.217
  105    HE   ARG  13           HE       ARG  13   9.824 -10.623 -10.101
  106   1HH1  ARG  13          HH22      ARG  13  13.277 -10.404 -10.864
  107   2HH1  ARG  13          HH21      ARG  13  13.010  -9.832 -12.478
  108   1HH2  ARG  13          HH11      ARG  13  10.766  -9.525 -13.259
  109    H    THR  14           H        THR  14  10.014  -9.402  -3.016
  110    HA   THR  14           HA       THR  14  12.601 -10.122  -1.854
  111    HB   THR  14           HB       THR  14  11.657  -7.665  -0.659
  112    HG1  THR  14           HG1      THR  14  11.713  -6.408  -2.676
  113   1HG2  THR  14          HG21      THR  14  13.793  -6.767  -1.823
  114   2HG2  THR  14          HG22      THR  14  14.035  -8.120  -0.693
  115   3HG2  THR  14          HG23      THR  14  14.018  -8.418  -2.447
  116    H    GLU  15           H        GLU  15  12.188  -9.402   0.748
  117    HA   GLU  15           HA       GLU  15   9.987 -11.176   1.376
  118   1HB   GLU  15          HB2       GLU  15  12.639 -10.762   2.432
  119   2HB   GLU  15          HB3       GLU  15  11.489 -10.442   3.715
  120   1HG   GLU  15          HG2       GLU  15  10.464 -12.750   2.474
  121   2HG   GLU  15          HG3       GLU  15  12.197 -13.003   2.439
  122    HE2  GLU  15           HE2      GLU  15  11.281 -14.678   4.761
  123    H    ASP  16           H        ASP  16  11.341  -7.921   2.169
  124    HA   ASP  16           HA       ASP  16   9.292  -7.294   3.967
  125   1HB   ASP  16          HB2       ASP  16  11.361  -5.706   2.418
  126   2HB   ASP  16          HB3       ASP  16  10.128  -4.857   3.328
  127    HD2  ASP  16           HD2      ASP  16  12.984  -5.440   3.433
  128    H    ASP  17           H        ASP  17  10.032  -6.327   0.529
  129    HA   ASP  17           HA       ASP  17   7.652  -4.894   0.226
  130   1HB   ASP  17          HB2       ASP  17   9.215  -6.199  -2.034
  131   2HB   ASP  17          HB3       ASP  17   8.284  -4.715  -2.094
  132    HD2  ASP  17           HD2      ASP  17  10.053  -3.394   0.321
  133    H    LEU  18           H        LEU  18   5.667  -5.555  -0.827
  134    HA   LEU  18           HA       LEU  18   5.496  -8.407  -1.486
  135   1HB   LEU  18          HB2       LEU  18   4.352  -7.165   0.757
  136   2HB   LEU  18          HB3       LEU  18   3.035  -7.383  -0.377
  137    HG   LEU  18           HG       LEU  18   3.920  -9.834  -0.566
  138   1HD1  LEU  18          HD11      LEU  18   4.776 -10.451   1.853
  139   2HD1  LEU  18          HD12      LEU  18   5.903  -9.956   0.567
  140   3HD1  LEU  18          HD13      LEU  18   5.400  -8.785   1.810
  141   1HD2  LEU  18          HD21      LEU  18   2.065  -8.510   1.222
  142   2HD2  LEU  18          HD22      LEU  18   1.919 -10.066   0.370
  143   3HD2  LEU  18          HD23      LEU  18   2.722  -9.992   1.957
  144    H    SER  19           H        SER  19   3.694  -8.913  -2.993
  145    HA   SER  19           HA       SER  19   3.454  -6.724  -4.856
  146   1HB   SER  19          HB2       SER  19   2.582  -9.625  -5.193
  147   2HB   SER  19          HB3       SER  19   2.750  -8.432  -6.466
  148    HG   SER  19           HG       SER  19   5.077  -8.734  -4.938
  149    H    PHE  20           H        PHE  20   1.397  -5.969  -5.666
  150    HA   PHE  20           HA       PHE  20  -0.963  -7.018  -4.323
  151   1HB   PHE  20          HB2       PHE  20   0.451  -4.469  -3.839
  152   2HB   PHE  20          HB3       PHE  20  -1.167  -4.151  -4.433
  153    HD1  PHE  20           HD1      PHE  20  -3.135  -5.032  -3.168
  154    HD2  PHE  20           HD2      PHE  20   0.812  -5.262  -1.627
  155    HE1  PHE  20           HE1      PHE  20  -4.056  -5.416  -0.865
  156    HE2  PHE  20           HE2      PHE  20  -0.109  -5.645   0.677
  157    HZ   PHE  20           HZ       PHE  20  -2.532  -5.718   1.030
  158    H    HIS  21           H        HIS  21  -3.009  -5.851  -5.274
  159    HA   HIS  21           HA       HIS  21  -2.493  -5.254  -8.093
  160   1HB   HIS  21          HB2       HIS  21  -3.527  -7.617  -7.312
  161   2HB   HIS  21          HB3       HIS  21  -5.006  -6.681  -7.378
  162    HD1  HIS  21           HD1      HIS  21  -4.970  -8.835  -9.378
  163    HD2  HIS  21           HD2      HIS  21  -3.144  -5.140 -10.155
  164    HE1  HIS  21           HE1      HIS  21  -4.806  -8.639 -11.917
  165    H    LYS  22           H        LYS  22  -4.676  -4.275  -9.077
  166    HA   LYS  22           HA       LYS  22  -5.279  -2.040  -7.347
  167   1HB   LYS  22          HB2       LYS  22  -6.260  -1.051  -9.348
  168   2HB   LYS  22          HB3       LYS  22  -4.636  -1.626  -9.664
  169   1HG   LYS  22          HG2       LYS  22  -5.394  -3.491 -10.925
  170   2HG   LYS  22          HG3       LYS  22  -6.994  -3.450 -10.211
  171   1HD   LYS  22          HD2       LYS  22  -7.626  -2.354 -12.109
  172   2HD   LYS  22          HD3       LYS  22  -6.867  -0.946 -11.391
  173   1HE   LYS  22          HE2       LYS  22  -4.646  -1.890 -12.465
  174   2HE   LYS  22          HE3       LYS  22  -5.723  -2.851 -13.459
  175   1HZ   LYS  22          HZ1       LYS  22  -5.482  -0.894 -14.675
  176   2HZ   LYS  22          HZ2       LYS  22  -6.875  -0.581 -13.890
  177    H    GLY  23           H        GLY  23  -7.726  -1.247  -7.564
  178   1HA   GLY  23          HA3       GLY  23  -9.966  -1.743  -7.414
  179   2HA   GLY  23          HA2       GLY  23  -9.616  -3.457  -7.518
  180    H    GLU  24           H        GLU  24  -7.349  -2.531  -5.345
  181    HA   GLU  24           HA       GLU  24  -9.151  -3.114  -3.144
  182   1HB   GLU  24          HB2       GLU  24  -6.124  -3.160  -2.978
  183   2HB   GLU  24          HB3       GLU  24  -7.283  -4.026  -1.988
  184   1HG   GLU  24          HG2       GLU  24  -7.980  -5.325  -4.069
  185   2HG   GLU  24          HG3       GLU  24  -6.670  -4.548  -4.932
  186    HE2  GLU  24           HE2      GLU  24  -6.461  -6.081  -1.587
  187    H    LYS  25           H        LYS  25  -8.321  -2.074  -0.936
  188    HA   LYS  25           HA       LYS  25  -7.505   0.690  -1.476
  189   1HB   LYS  25          HB2       LYS  25 -10.036  -0.283  -0.336
  190   2HB   LYS  25          HB3       LYS  25  -9.230   0.905   0.670
  191   1HG   LYS  25          HG2       LYS  25  -9.240   2.560  -1.051
  192   2HG   LYS  25          HG3       LYS  25  -9.507   1.378  -2.317
  193   1HD   LYS  25          HD2       LYS  25 -11.793   1.223  -1.897
  194   2HD   LYS  25          HD3       LYS  25 -11.615   1.548  -0.184
  195   1HE   LYS  25          HE2       LYS  25 -10.758   3.865  -1.759
  196   2HE   LYS  25          HE3       LYS  25 -12.386   3.391  -2.203
  197   1HZ   LYS  25          HZ1       LYS  25 -12.698   4.772  -0.362
  198   2HZ   LYS  25          HZ2       LYS  25 -12.758   3.304   0.341
  199    H    PHE  26           H        PHE  26  -6.243   1.674   0.179
  200    HA   PHE  26           HA       PHE  26  -5.278  -0.260   2.167
  201   1HB   PHE  26          HB2       PHE  26  -3.778   2.150   1.014
  202   2HB   PHE  26          HB3       PHE  26  -3.083   0.757   1.820
  203    HD1  PHE  26           HD1      PHE  26  -3.155  -1.484   0.625
  204    HD2  PHE  26           HD2      PHE  26  -4.034   2.181  -1.324
  205    HE1  PHE  26           HE1      PHE  26  -2.749  -2.570  -1.601
  206    HE2  PHE  26           HE2      PHE  26  -3.628   1.095  -3.549
  207    HZ   PHE  26           HZ       PHE  26  -2.990  -1.268  -3.661
  208    H    GLN  27           H        GLN  27  -5.383   0.342   4.295
  209    HA   GLN  27           HA       GLN  27  -6.415   2.999   4.780
  210   1HB   GLN  27          HB2       GLN  27  -6.543   0.366   6.164
  211   2HB   GLN  27          HB3       GLN  27  -6.415   1.749   7.233
  212   1HG   GLN  27          HG2       GLN  27  -8.718   1.720   6.975
  213   2HG   GLN  27          HG3       GLN  27  -8.312   2.749   5.615
  214   1HE2  GLN  27          HE21      GLN  27  -9.606  -0.229   6.668
  215   2HE2  GLN  27          HE22      GLN  27  -9.985  -0.933   5.131
  216    H    ILE  28           H        ILE  28  -5.469   4.411   6.424
  217    HA   ILE  28           HA       ILE  28  -2.644   4.405   6.319
  218    HB   ILE  28           HB       ILE  28  -2.921   6.333   7.917
  219   1HG1  ILE  28          HG12      ILE  28  -5.878   6.083   7.367
  220   2HG1  ILE  28          HG13      ILE  28  -5.151   5.378   8.798
  221   1HG2  ILE  28          HG21      ILE  28  -3.961   6.110   5.150
  222   2HG2  ILE  28          HG22      ILE  28  -4.401   7.584   6.046
  223   3HG2  ILE  28          HG23      ILE  28  -2.687   7.153   5.827
  224   1HD1  ILE  28          HD11      ILE  28  -4.629   8.281   8.070
  225   2HD1  ILE  28          HD12      ILE  28  -6.088   7.804   8.971
  226   3HD1  ILE  28          HD13      ILE  28  -4.475   7.489   9.657
  227    H    LEU  29           H        LEU  29  -1.138   4.246   8.121
  228    HA   LEU  29           HA       LEU  29  -2.045   3.216  10.609
  229   1HB   LEU  29          HB2       LEU  29  -1.886   1.316   8.627
  230   2HB   LEU  29          HB3       LEU  29  -0.308   1.199   9.380
  231    HG   LEU  29           HG       LEU  29  -1.617   1.062  11.619
  232   1HD1  LEU  29          HD11      LEU  29  -3.842  -0.214  10.163
  233   2HD1  LEU  29          HD12      LEU  29  -3.843   0.765  11.650
  234   3HD1  LEU  29          HD13      LEU  29  -3.789   1.563  10.060
  235   1HD2  LEU  29          HD21      LEU  29  -0.955  -1.055  11.543
  236   2HD2  LEU  29          HD22      LEU  29  -2.219  -1.464  10.358
  237   3HD2  LEU  29          HD23      LEU  29  -0.643  -0.848   9.803
  238    H    ASN  30           H        ASN  30   0.660   3.543   8.237
  239    HA   ASN  30           HA       ASN  30   2.486   3.932  10.412
  240   1HB   ASN  30          HB2       ASN  30   2.718   2.991   7.775
  241   2HB   ASN  30          HB3       ASN  30   3.440   4.585   7.676
  242   1HD2  ASN  30          HD21      ASN  30   3.578   1.425   9.145
  243   2HD2  ASN  30          HD22      ASN  30   5.191   1.507   9.767
  244    H    SER  31           H        SER  31   3.799   5.971  10.578
  245    HA   SER  31           HA       SER  31   2.915   8.201   9.030
  246   1HB   SER  31          HB2       SER  31   2.125   7.833  11.909
  247   2HB   SER  31          HB3       SER  31   2.595   9.444  11.404
  248    HG   SER  31           HG       SER  31   0.955   9.404   9.777
  249    H    SER  32           H        SER  32   5.320   7.505   8.613
  250    HA   SER  32           HA       SER  32   7.075   8.403  10.714
  251   1HB   SER  32          HB2       SER  32   7.478   6.998   8.056
  252   2HB   SER  32          HB3       SER  32   8.841   7.698   8.905
  253    HG   SER  32           HG       SER  32   7.576   6.338  10.787
  254    H    GLU  33           H        GLU  33   6.882   8.938   7.111
  255    HA   GLU  33           HA       GLU  33   6.848  11.742   7.479
  256   1HB   GLU  33          HB2       GLU  33   9.349  10.888   7.756
  257   2HB   GLU  33          HB3       GLU  33   9.305  10.774   6.008
  258   1HG   GLU  33          HG2       GLU  33   8.219  13.319   7.137
  259   2HG   GLU  33          HG3       GLU  33   9.936  13.068   7.388
  260    HE2  GLU  33           HE2      GLU  33  10.818  14.248   4.745
  261    H    GLY  34           H        GLY  34   8.013   9.271   5.066
  262   1HA   GLY  34          HA3       GLY  34   5.848   9.179   3.425
  263   2HA   GLY  34          HA2       GLY  34   6.686  10.628   2.903
  264    H    ASP  35           H        ASP  35   6.994   7.083   3.377
  265    HA   ASP  35           HA       ASP  35   8.826   7.061   1.166
  266   1HB   ASP  35          HB2       ASP  35   9.607   6.551   3.967
  267   2HB   ASP  35          HB3       ASP  35   9.974   5.190   2.926
  268    HD2  ASP  35           HD2      ASP  35  12.147   8.387   3.089
  269    H    TRP  36           H        TRP  36   8.757   4.383   3.479
  270    HA   TRP  36           HA       TRP  36   6.961   2.928   1.670
  271   1HB   TRP  36          HB2       TRP  36   8.996   1.847   3.629
  272   2HB   TRP  36          HB3       TRP  36   8.004   0.906   2.532
  273    HD1  TRP  36           HD1      TRP  36   8.444   2.009  -0.255
  274    HE1  TRP  36           HE1      TRP  36  10.762   2.236  -1.497
  275    HE3  TRP  36           HE3      TRP  36  11.298   1.991   3.954
  276    HZ2  TRP  36           HZ2      TRP  36  13.466   2.380  -0.601
  277    HZ3  TRP  36           HZ3      TRP  36  13.769   2.180   3.682
  278    HH2  TRP  36           HH2      TRP  36  14.859   2.370   1.502
  279    H    TRP  37           H        TRP  37   4.885   3.067   2.444
  280    HA   TRP  37           HA       TRP  37   4.538   2.976   5.354
  281   1HB   TRP  37          HB2       TRP  37   2.900   4.109   3.107
  282   2HB   TRP  37          HB3       TRP  37   2.149   3.696   4.636
  283    HD1  TRP  37           HD1      TRP  37   5.616   4.985   5.226
  284    HE1  TRP  37           HE1      TRP  37   5.651   7.480   6.084
  285    HE3  TRP  37           HE3      TRP  37   0.738   5.964   4.179
  286    HZ2  TRP  37           HZ2      TRP  37   3.678   9.538   6.225
  287    HZ3  TRP  37           HZ3      TRP  37  -0.129   8.242   4.707
  288    HH2  TRP  37           HH2      TRP  37   1.256   9.998   5.695
  289    H    GLU  38           H        GLU  38   2.613   1.637   6.100
  290    HA   GLU  38           HA       GLU  38   2.816  -0.914   4.876
  291   1HB   GLU  38          HB2       GLU  38   2.184   0.080   7.437
  292   2HB   GLU  38          HB3       GLU  38   0.692  -0.652   6.882
  293   1HG   GLU  38          HG2       GLU  38   1.621  -2.796   6.744
  294   2HG   GLU  38          HG3       GLU  38   3.239  -2.197   6.439
  295    HE2  GLU  38           HE2      GLU  38   3.895  -3.602   8.339
  296    H    ALA  39           H        ALA  39   0.869  -2.233   4.233
  297    HA   ALA  39           HA       ALA  39  -1.228  -0.503   3.113
  298   1HB   ALA  39          HB1       ALA  39   0.115  -2.934   1.863
  299   2HB   ALA  39          HB2       ALA  39  -1.270  -2.055   1.172
  300   3HB   ALA  39          HB3       ALA  39   0.304  -1.242   1.345
  301    H    ARG  40           H        ARG  40  -2.748  -0.858   4.749
  302    HA   ARG  40           HA       ARG  40  -3.227  -3.596   5.492
  303   1HB   ARG  40          HB2       ARG  40  -3.236  -1.351   6.999
  304   2HB   ARG  40          HB3       ARG  40  -4.919  -1.312   6.515
  305   1HG   ARG  40          HG2       ARG  40  -4.479  -4.006   7.236
  306   2HG   ARG  40          HG3       ARG  40  -3.574  -3.096   8.428
  307   1HD   ARG  40          HD2       ARG  40  -6.080  -1.734   8.083
  308   2HD   ARG  40          HD3       ARG  40  -6.449  -3.442   8.220
  309    HE   ARG  40           HE       ARG  40  -4.702  -3.168  10.274
  310   1HH1  ARG  40          HH22      ARG  40  -7.432  -1.118   9.326
  311   2HH1  ARG  40          HH21      ARG  40  -7.747  -0.577  10.941
  312   1HH2  ARG  40          HH11      ARG  40  -6.373  -1.374  12.736
  313    H    SER  41           H        SER  41  -4.805  -4.815   4.494
  314    HA   SER  41           HA       SER  41  -6.881  -3.313   3.098
  315   1HB   SER  41          HB2       SER  41  -6.911  -5.755   1.857
  316   2HB   SER  41          HB3       SER  41  -6.014  -4.367   1.273
  317    HG   SER  41           HG       SER  41  -4.247  -5.531   1.541
  318    H    LEU  42           H        LEU  42  -9.044  -3.916   3.474
  319    HA   LEU  42           HA       LEU  42  -9.413  -5.739   5.700
  320   1HB   LEU  42          HB2       LEU  42 -10.407  -3.440   5.605
  321   2HB   LEU  42          HB3       LEU  42 -11.427  -3.988   4.290
  322    HG   LEU  42           HG       LEU  42 -12.097  -5.873   6.045
  323   1HD1  LEU  42          HD11      LEU  42 -12.181  -4.069   8.211
  324   2HD1  LEU  42          HD12      LEU  42 -11.285  -5.603   8.090
  325   3HD1  LEU  42          HD13      LEU  42 -10.501  -4.073   7.623
  326   1HD2  LEU  42          HD21      LEU  42 -13.873  -4.145   6.899
  327   2HD2  LEU  42          HD22      LEU  42 -13.129  -3.082   5.680
  328   3HD2  LEU  42          HD23      LEU  42 -13.839  -4.639   5.188
  329    H    THR  43           H        THR  43  -8.580  -6.666   2.950
  330    HA   THR  43           HA       THR  43 -10.941  -8.336   2.382
  331    HB   THR  43           HB       THR  43  -9.331  -8.456   0.133
  332    HG1  THR  43           HG1      THR  43  -9.253  -5.729   0.402
  333   1HG2  THR  43          HG21      THR  43 -11.239  -6.124   0.657
  334   2HG2  THR  43          HG22      THR  43 -10.859  -6.884  -0.908
  335   3HG2  THR  43          HG23      THR  43 -11.818  -7.770   0.302
  336    H    THR  44           H        THR  44  -7.461  -8.650   1.494
  337    HA   THR  44           HA       THR  44  -7.572 -11.416   2.308
  338    HB   THR  44           HB       THR  44  -5.314 -11.446   1.265
  339    HG1  THR  44           HG1      THR  44  -5.881  -8.571   1.089
  340   1HG2  THR  44          HG21      THR  44  -7.245 -11.401  -0.343
  341   2HG2  THR  44          HG22      THR  44  -7.218  -9.623  -0.298
  342   3HG2  THR  44          HG23      THR  44  -5.841 -10.517  -0.984
  343    H    GLY  45           H        GLY  45  -6.072  -8.358   3.441
  344   1HA   GLY  45          HA3       GLY  45  -5.497  -7.857   5.593
  345   2HA   GLY  45          HA2       GLY  45  -5.804  -9.511   6.081
  346    H    GLU  46           H        GLU  46  -3.656  -8.220   3.459
  347    HA   GLU  46           HA       GLU  46  -1.459  -9.515   4.879
  348   1HB   GLU  46          HB2       GLU  46  -1.610  -9.076   1.871
  349   2HB   GLU  46          HB3       GLU  46  -0.459 -10.068   2.744
  350   1HG   GLU  46          HG2       GLU  46  -3.403 -10.676   3.052
  351   2HG   GLU  46          HG3       GLU  46  -2.606 -11.151   1.565
  352    HE2  GLU  46           HE2      GLU  46  -1.637 -13.704   2.281
  353    H    THR  47           H        THR  47   0.280  -8.240   5.433
  354    HA   THR  47           HA       THR  47   0.140  -5.443   4.620
  355    HB   THR  47           HB       THR  47   2.031  -5.409   6.460
  356    HG1  THR  47           HG1      THR  47   1.794  -7.404   7.775
  357   1HG2  THR  47          HG21      THR  47  -0.578  -6.522   7.536
  358   2HG2  THR  47          HG22      THR  47   0.430  -5.206   8.188
  359   3HG2  THR  47          HG23      THR  47  -0.577  -4.926   6.747
  360    H    GLY  48           H        GLY  48   2.380  -4.351   4.296
  361   1HA   GLY  48          HA3       GLY  48   4.596  -5.648   3.341
  362   2HA   GLY  48          HA2       GLY  48   3.515  -5.563   1.964
  363    H    TYR  49           H        TYR  49   6.151  -4.118   2.816
  364    HA   TYR  49           HA       TYR  49   5.247  -1.359   2.872
  365   1HB   TYR  49          HB2       TYR  49   8.038  -2.648   2.685
  366   2HB   TYR  49          HB3       TYR  49   7.707  -1.005   3.195
  367    HD1  TYR  49           HD1      TYR  49   6.080  -0.811   5.310
  368    HD2  TYR  49           HD2      TYR  49   8.411  -4.258   4.319
  369    HE1  TYR  49           HE1      TYR  49   5.967  -1.591   7.727
  370    HE2  TYR  49           HE2      TYR  49   8.290  -5.027   6.739
  371    HH   TYR  49           HH       TYR  49   7.242  -2.983   9.228
  372    H    ILE  50           H        ILE  50   5.045  -0.097   1.089
  373    HA   ILE  50           HA       ILE  50   6.751  -0.599  -1.182
  374    HB   ILE  50           HB       ILE  50   4.477  -0.459  -2.573
  375   1HG1  ILE  50          HG12      ILE  50   3.257  -2.470  -1.026
  376   2HG1  ILE  50          HG13      ILE  50   3.623  -1.181   0.103
  377   1HG2  ILE  50          HG21      ILE  50   4.741  -2.792  -3.052
  378   2HG2  ILE  50          HG22      ILE  50   6.354  -2.093  -2.773
  379   3HG2  ILE  50          HG23      ILE  50   5.576  -3.071  -1.506
  380   1HD1  ILE  50          HD11      ILE  50   2.558   0.461  -1.512
  381   2HD1  ILE  50          HD12      ILE  50   2.060  -0.930  -2.506
  382   3HD1  ILE  50          HD13      ILE  50   1.429  -0.745  -0.851
  383    HA   PRO  51           HA       PRO  51   5.960   3.662  -1.547
  384   1HB   PRO  51          HB2       PRO  51   6.960   4.180  -4.037
  385   2HB   PRO  51          HB3       PRO  51   7.974   3.926  -2.631
  386   1HG   PRO  51          HG2       PRO  51   7.434   2.088  -4.883
  387   2HG   PRO  51          HG3       PRO  51   8.740   2.039  -3.715
  388   1HD   PRO  51          HD2       PRO  51   6.401   0.379  -3.747
  389   2HD   PRO  51          HD3       PRO  51   7.648   0.409  -2.516
  390    H    SER  52           H        SER  52   3.759   3.969  -1.315
  391    HA   SER  52           HA       SER  52   2.315   3.817  -3.819
  392   1HB   SER  52          HB2       SER  52   0.959   4.563  -1.243
  393   2HB   SER  52          HB3       SER  52   0.370   3.569  -2.561
  394    HG   SER  52           HG       SER  52   2.016   1.937  -1.857
  395    H    ASN  53           H        ASN  53   4.105   5.868  -3.965
  396    HA   ASN  53           HA       ASN  53   2.713   8.238  -3.057
  397   1HB   ASN  53          HB2       ASN  53   5.520   7.557  -3.872
  398   2HB   ASN  53          HB3       ASN  53   4.983   9.163  -4.321
  399   1HD2  ASN  53          HD21      ASN  53   4.718   6.922  -1.560
  400   2HD2  ASN  53          HD22      ASN  53   5.063   8.071  -0.311
  401    H    TYR  54           H        TYR  54   2.937   6.144  -5.740
  402    HA   TYR  54           HA       TYR  54   2.687   8.230  -7.750
  403   1HB   TYR  54          HB2       TYR  54   3.048   5.217  -7.524
  404   2HB   TYR  54          HB3       TYR  54   2.340   5.817  -9.010
  405    HD1  TYR  54           HD1      TYR  54   3.666   7.025 -10.638
  406    HD2  TYR  54           HD2      TYR  54   5.378   5.808  -6.911
  407    HE1  TYR  54           HE1      TYR  54   5.992   7.523 -11.536
  408    HE2  TYR  54           HE2      TYR  54   7.698   6.310  -7.821
  409    HH   TYR  54           HH       TYR  54   8.556   6.384 -10.622
  410    H    VAL  55           H        VAL  55   0.655   6.724  -5.530
  411    HA   VAL  55           HA       VAL  55  -1.583   6.551  -7.394
  412    HB   VAL  55           HB       VAL  55  -2.738   5.447  -5.590
  413   1HG1  VAL  55          HG11      VAL  55  -1.701   3.690  -6.536
  414   2HG1  VAL  55          HG12      VAL  55  -0.130   4.525  -6.588
  415   3HG1  VAL  55          HG13      VAL  55  -0.657   3.712  -5.095
  416   1HG2  VAL  55          HG21      VAL  55  -1.759   6.825  -3.743
  417   2HG2  VAL  55          HG22      VAL  55  -1.792   5.078  -3.403
  418   3HG2  VAL  55          HG23      VAL  55  -0.266   5.863  -3.877
  419    H    ALA  56           H        ALA  56  -3.725   7.240  -5.790
  420    HA   ALA  56           HA       ALA  56  -3.250   9.735  -4.487
  421   1HB   ALA  56          HB1       ALA  56  -4.893   9.869  -7.030
  422   2HB   ALA  56          HB2       ALA  56  -4.239  11.205  -6.052
  423   3HB   ALA  56          HB3       ALA  56  -3.143  10.201  -7.032
  424    HA   PRO  57           HA       PRO  57  -7.051   8.491  -2.825
  425   1HB   PRO  57          HB2       PRO  57  -7.886  10.781  -1.588
  426   2HB   PRO  57          HB3       PRO  57  -6.677   9.711  -0.909
  427   1HG   PRO  57          HG2       PRO  57  -6.306  12.342  -2.203
  428   2HG   PRO  57          HG3       PRO  57  -5.204  11.469  -1.158
  429   1HD   PRO  57          HD2       PRO  57  -5.038  11.708  -4.012
  430   2HD   PRO  57          HD3       PRO  57  -4.005  10.740  -2.980
  431    H    VAL  58           H        VAL  58  -9.465   9.612  -2.369
  432    HA   VAL  58           HA       VAL  58 -10.256  10.435  -5.075
  433    HB   VAL  58           HB       VAL  58 -12.447   9.134  -4.148
  434   1HG1  VAL  58          HG11      VAL  58 -11.960   7.445  -5.763
  435   2HG1  VAL  58          HG12      VAL  58 -11.246   8.959  -6.369
  436   3HG1  VAL  58          HG13      VAL  58 -10.206   7.721  -5.623
  437   1HG2  VAL  58          HG21      VAL  58 -10.048   7.901  -2.836
  438   2HG2  VAL  58          HG22      VAL  58 -11.706   8.105  -2.223
  439   3HG2  VAL  58          HG23      VAL  58 -11.352   6.843  -3.426
  440    H    ASP  59           H        ASP  59 -11.333  12.344  -5.126
  441    HA   ASP  59           HA       ASP  59 -12.259  13.323  -2.548
  442   1HB   ASP  59          HB2       ASP  59 -10.653  14.495  -4.557
  443   2HB   ASP  59          HB3       ASP  59 -12.214  15.266  -4.759
  444    HD2  ASP  59           HD2      ASP  59 -12.619  16.856  -2.292
  Start of MODEL    2
    1   1H    VAL   1           H        VAL   1  -9.871  11.393   5.506
    2    HA   VAL   1           HA       VAL   1  -9.157  10.983   3.435
    3    HB   VAL   1           HB       VAL   1  -6.423  11.642   4.513
    4   1HG1  VAL   1          HG11      VAL   1  -6.057  12.692   2.411
    5   2HG1  VAL   1          HG12      VAL   1  -6.811  11.119   2.057
    6   3HG1  VAL   1          HG13      VAL   1  -7.783  12.608   1.984
    7   1HG2  VAL   1          HG21      VAL   1  -6.982  13.969   4.609
    8   2HG2  VAL   1          HG22      VAL   1  -8.611  13.667   3.956
    9   3HG2  VAL   1          HG23      VAL   1  -8.184  13.091   5.586
   10    H    THR   2           H        THR   2  -9.612   8.579   4.450
   11    HA   THR   2           HA       THR   2  -7.164   7.027   3.923
   12    HB   THR   2           HB       THR   2  -9.667   6.229   5.495
   13    HG1  THR   2           HG1      THR   2  -8.164   8.107   6.216
   14   1HG2  THR   2          HG21      THR   2  -6.876   5.059   5.113
   15   2HG2  THR   2          HG22      THR   2  -7.841   4.697   6.565
   16   3HG2  THR   2          HG23      THR   2  -8.443   4.230   4.956
   17    H    LEU   3           H        LEU   3  -8.499   8.096   1.720
   18    HA   LEU   3           HA       LEU   3  -9.607   5.622   0.610
   19   1HB   LEU   3          HB2       LEU   3 -10.889   8.265   0.834
   20   2HB   LEU   3          HB3       LEU   3 -10.958   7.548  -0.764
   21    HG   LEU   3           HG       LEU   3 -11.684   5.456   0.934
   22   1HD1  LEU   3          HD11      LEU   3 -13.588   6.475   2.230
   23   2HD1  LEU   3          HD12      LEU   3 -11.959   6.833   2.852
   24   3HD1  LEU   3          HD13      LEU   3 -12.849   8.066   1.925
   25   1HD2  LEU   3          HD21      LEU   3 -12.609   6.609  -1.343
   26   2HD2  LEU   3          HD22      LEU   3 -13.465   5.341  -0.433
   27   3HD2  LEU   3          HD23      LEU   3 -13.896   7.052  -0.196
   28    H    PHE   4           H        PHE   4  -7.563   5.149  -0.316
   29    HA   PHE   4           HA       PHE   4  -6.924   6.928  -2.551
   30   1HB   PHE   4          HB2       PHE   4  -5.141   5.624  -0.420
   31   2HB   PHE   4          HB3       PHE   4  -4.470   6.158  -1.949
   32    HD1  PHE   4           HD1      PHE   4  -5.137   7.097   1.359
   33    HD2  PHE   4           HD2      PHE   4  -5.022   8.667  -2.581
   34    HE1  PHE   4           HE1      PHE   4  -4.858   9.411   2.290
   35    HE2  PHE   4           HE2      PHE   4  -4.744  10.981  -1.651
   36    HZ   PHE   4           HZ       PHE   4  -4.665  11.326   0.774
   37    H    VAL   5           H        VAL   5  -6.967   5.841  -4.458
   38    HA   VAL   5           HA       VAL   5  -6.826   2.924  -4.317
   39    HB   VAL   5           HB       VAL   5  -7.575   4.403  -6.792
   40   1HG1  VAL   5          HG11      VAL   5  -7.491   1.805  -6.287
   41   2HG1  VAL   5          HG12      VAL   5  -9.102   2.116  -5.596
   42   3HG1  VAL   5          HG13      VAL   5  -8.775   2.506  -7.302
   43   1HG2  VAL   5          HG21      VAL   5  -8.752   5.132  -4.355
   44   2HG2  VAL   5          HG22      VAL   5  -9.377   5.453  -5.990
   45   3HG2  VAL   5          HG23      VAL   5  -9.906   4.003  -5.104
   46    H    ALA   6           H        ALA   6  -5.424   1.733  -5.731
   47    HA   ALA   6           HA       ALA   6  -3.119   3.338  -6.576
   48   1HB   ALA   6          HB1       ALA   6  -2.688   0.468  -6.529
   49   2HB   ALA   6          HB2       ALA   6  -1.869   1.746  -5.599
   50   3HB   ALA   6          HB3       ALA   6  -3.370   1.018  -4.979
   51    H    LEU   7           H        LEU   7  -2.901   3.692  -8.724
   52    HA   LEU   7           HA       LEU   7  -4.399   1.937 -10.516
   53   1HB   LEU   7          HB2       LEU   7  -4.178   4.692 -10.336
   54   2HB   LEU   7          HB3       LEU   7  -3.123   4.289 -11.676
   55    HG   LEU   7           HG       LEU   7  -6.011   3.398 -11.470
   56   1HD1  LEU   7          HD11      LEU   7  -5.058   5.997 -11.942
   57   2HD1  LEU   7          HD12      LEU   7  -5.503   5.349 -13.538
   58   3HD1  LEU   7          HD13      LEU   7  -6.701   5.369 -12.222
   59   1HD2  LEU   7          HD21      LEU   7  -5.574   3.185 -14.037
   60   2HD2  LEU   7          HD22      LEU   7  -3.868   3.082 -13.545
   61   3HD2  LEU   7          HD23      LEU   7  -5.045   1.898 -12.928
   62    H    TYR   8           H        TYR   8  -1.578   1.670  -9.053
   63    HA   TYR   8           HA       TYR   8  -0.371   0.354 -11.316
   64   1HB   TYR   8          HB2       TYR   8   0.248   3.029 -10.805
   65   2HB   TYR   8          HB3       TYR   8   1.410   2.234  -9.763
   66    HD1  TYR   8           HD1      TYR   8   3.213   0.846 -10.710
   67    HD2  TYR   8           HD2      TYR   8   0.431   2.897 -13.232
   68    HE1  TYR   8           HE1      TYR   8   4.751   0.496 -12.705
   69    HE2  TYR   8           HE2      TYR   8   1.978   2.540 -15.217
   70    HH   TYR   8           HH       TYR   8   5.200   1.350 -14.800
   71    H    ASP   9           H        ASP   9   0.042  -1.622 -10.461
   72    HA   ASP   9           HA       ASP   9   0.524  -1.824  -7.654
   73   1HB   ASP   9          HB2       ASP   9   0.978  -4.347  -8.679
   74   2HB   ASP   9          HB3       ASP   9  -0.589  -3.747  -8.174
   75    HD2  ASP   9           HD2      ASP   9   0.712  -4.267 -11.808
   76    H    TYR  10           H        TYR  10   2.468  -3.269  -6.916
   77    HA   TYR  10           HA       TYR  10   4.804  -2.650  -8.595
   78   1HB   TYR  10          HB2       TYR  10   4.122  -1.784  -6.034
   79   2HB   TYR  10          HB3       TYR  10   4.983  -3.258  -5.640
   80    HD1  TYR  10           HD1      TYR  10   5.362  -0.111  -7.638
   81    HD2  TYR  10           HD2      TYR  10   7.312  -3.220  -5.438
   82    HE1  TYR  10           HE1      TYR  10   7.577   1.119  -7.851
   83    HE2  TYR  10           HE2      TYR  10   9.521  -1.979  -5.659
   84    HH   TYR  10           HH       TYR  10   9.961   0.545  -7.829
   85    H    GLU  11           H        GLU  11   6.449  -4.241  -8.800
   86    HA   GLU  11           HA       GLU  11   5.516  -6.887  -8.012
   87   1HB   GLU  11          HB2       GLU  11   6.349  -5.864 -10.531
   88   2HB   GLU  11          HB3       GLU  11   7.645  -6.921 -10.003
   89   1HG   GLU  11          HG2       GLU  11   6.216  -8.820  -9.862
   90   2HG   GLU  11          HG3       GLU  11   4.763  -7.845  -9.783
   91    HE2  GLU  11           HE2      GLU  11   4.371  -8.279 -13.178
   92    H    ALA  12           H        ALA  12   6.632  -7.859  -6.380
   93    HA   ALA  12           HA       ALA  12   9.500  -7.371  -6.212
   94   1HB   ALA  12          HB1       ALA  12   7.559  -6.147  -4.494
   95   2HB   ALA  12          HB2       ALA  12   8.439  -7.371  -3.549
   96   3HB   ALA  12          HB3       ALA  12   9.334  -6.080  -4.384
   97    H    ARG  13           H        ARG  13  10.653  -9.159  -5.426
   98    HA   ARG  13           HA       ARG  13   8.955 -11.443  -4.811
   99   1HB   ARG  13          HB2       ARG  13  11.187 -11.107  -6.738
  100   2HB   ARG  13          HB3       ARG  13  11.381 -12.514  -5.711
  101   1HG   ARG  13          HG2       ARG  13   8.753 -12.822  -6.339
  102   2HG   ARG  13          HG3       ARG  13   9.263 -11.933  -7.761
  103   1HD   ARG  13          HD2       ARG  13  11.311 -13.805  -7.484
  104   2HD   ARG  13          HD3       ARG  13   9.913 -14.713  -6.942
  105    HE   ARG  13           HE       ARG  13   8.934 -13.588  -9.222
  106   1HH1  ARG  13          HH22      ARG  13  11.992 -15.269  -8.604
  107   2HH1  ARG  13          HH21      ARG  13  12.136 -15.863 -10.226
  108   1HH2  ARG  13          HH11      ARG  13  10.439 -15.322 -11.829
  109    H    THR  14           H        THR  14   9.736  -9.756  -2.736
  110    HA   THR  14           HA       THR  14  12.165 -10.924  -1.595
  111    HB   THR  14           HB       THR  14  10.864  -8.895   0.032
  112    HG1  THR  14           HG1      THR  14  10.248  -7.520  -1.603
  113   1HG2  THR  14          HG21      THR  14  13.441  -9.487  -0.584
  114   2HG2  THR  14          HG22      THR  14  13.152  -8.235  -1.817
  115   3HG2  THR  14          HG23      THR  14  12.950  -7.848  -0.092
  116    H    GLU  15           H        GLU  15  11.997 -11.233   0.918
  117    HA   GLU  15           HA       GLU  15   9.775 -13.064   1.230
  118   1HB   GLU  15          HB2       GLU  15  12.438 -13.419   1.710
  119   2HB   GLU  15          HB3       GLU  15  11.924 -12.904   3.305
  120   1HG   GLU  15          HG2       GLU  15   9.925 -14.715   2.618
  121   2HG   GLU  15          HG3       GLU  15  11.333 -15.426   1.855
  122    HE2  GLU  15           HE2      GLU  15  11.584 -14.791   5.819
  123    H    ASP  16           H        ASP  16   9.772  -9.972   1.513
  124    HA   ASP  16           HA       ASP  16   8.617 -10.000   4.188
  125   1HB   ASP  16          HB2       ASP  16  10.841  -8.493   3.321
  126   2HB   ASP  16          HB3       ASP  16   9.511  -7.353   3.254
  127    HD2  ASP  16           HD2      ASP  16  10.571  -6.642   6.338
  128    H    ASP  17           H        ASP  17   8.924  -7.747   1.329
  129    HA   ASP  17           HA       ASP  17   6.182  -7.034   1.595
  130   1HB   ASP  17          HB2       ASP  17   7.741  -6.296  -0.860
  131   2HB   ASP  17          HB3       ASP  17   6.681  -5.303   0.118
  132    HD2  ASP  17           HD2      ASP  17   7.707  -5.565   2.430
  133    H    LEU  18           H        LEU  18   4.481  -7.658   0.146
  134    HA   LEU  18           HA       LEU  18   5.221  -9.787  -1.733
  135   1HB   LEU  18          HB2       LEU  18   3.603 -10.067   0.322
  136   2HB   LEU  18          HB3       LEU  18   2.433  -9.329  -0.754
  137    HG   LEU  18           HG       LEU  18   2.899 -11.128  -2.428
  138   1HD1  LEU  18          HD11      LEU  18   4.225 -12.759  -0.303
  139   2HD1  LEU  18          HD12      LEU  18   4.315 -12.891  -2.075
  140   3HD1  LEU  18          HD13      LEU  18   5.203 -11.600  -1.232
  141   1HD2  LEU  18          HD21      LEU  18   1.208 -11.138  -0.304
  142   2HD2  LEU  18          HD22      LEU  18   1.241 -12.383  -1.576
  143   3HD2  LEU  18          HD23      LEU  18   2.093 -12.659  -0.037
  144    H    SER  19           H        SER  19   3.293  -9.892  -3.535
  145    HA   SER  19           HA       SER  19   3.504  -7.294  -4.780
  146   1HB   SER  19          HB2       SER  19   3.712  -9.956  -5.715
  147   2HB   SER  19          HB3       SER  19   2.201  -9.372  -6.383
  148    HG   SER  19           HG       SER  19   4.309  -7.522  -6.564
  149    H    PHE  20           H        PHE  20   1.669  -6.084  -5.485
  150    HA   PHE  20           HA       PHE  20  -0.882  -7.091  -4.434
  151   1HB   PHE  20          HB2       PHE  20   0.276  -4.258  -4.768
  152   2HB   PHE  20          HB3       PHE  20  -1.361  -4.571  -4.223
  153    HD1  PHE  20           HD1      PHE  20  -1.809  -5.210  -1.968
  154    HD2  PHE  20           HD2      PHE  20   2.200  -4.900  -3.327
  155    HE1  PHE  20           HE1      PHE  20  -0.995  -5.342   0.402
  156    HE2  PHE  20           HE2      PHE  20   3.013  -5.033  -0.957
  157    HZ   PHE  20           HZ       PHE  20   1.406  -5.252   0.880
  158    H    HIS  21           H        HIS  21  -2.761  -5.617  -5.547
  159    HA   HIS  21           HA       HIS  21  -2.157  -5.227  -8.350
  160   1HB   HIS  21          HB2       HIS  21  -3.598  -7.545  -7.303
  161   2HB   HIS  21          HB3       HIS  21  -4.559  -6.633  -8.449
  162    HD1  HIS  21           HD1      HIS  21  -2.343  -9.381  -8.416
  163    HD2  HIS  21           HD2      HIS  21  -2.720  -6.018 -10.896
  164    HE1  HIS  21           HE1      HIS  21  -1.173  -9.972 -10.605
  165    H    LYS  22           H        LYS  22  -3.894  -4.012  -9.471
  166    HA   LYS  22           HA       LYS  22  -4.918  -1.998  -7.777
  167   1HB   LYS  22          HB2       LYS  22  -6.052  -1.271  -9.952
  168   2HB   LYS  22          HB3       LYS  22  -4.300  -1.301  -9.920
  169   1HG   LYS  22          HG2       LYS  22  -4.301  -3.538 -11.019
  170   2HG   LYS  22          HG3       LYS  22  -6.053  -3.550 -11.018
  171   1HD   LYS  22          HD2       LYS  22  -4.934  -1.090 -12.221
  172   2HD   LYS  22          HD3       LYS  22  -4.421  -2.542 -13.058
  173   1HE   LYS  22          HE2       LYS  22  -7.260  -1.559 -12.582
  174   2HE   LYS  22          HE3       LYS  22  -6.477  -1.897 -14.112
  175   1HZ   LYS  22          HZ1       LYS  22  -6.850  -4.128 -13.878
  176   2HZ   LYS  22          HZ2       LYS  22  -6.666  -4.141 -12.260
  177    H    GLY  23           H        GLY  23  -7.342  -1.339  -7.927
  178   1HA   GLY  23          HA3       GLY  23  -9.572  -1.933  -7.907
  179   2HA   GLY  23          HA2       GLY  23  -9.147  -3.626  -8.070
  180    H    GLU  24           H        GLU  24  -7.061  -2.313  -5.754
  181    HA   GLU  24           HA       GLU  24  -8.872  -3.192  -3.644
  182   1HB   GLU  24          HB2       GLU  24  -5.961  -3.621  -4.156
  183   2HB   GLU  24          HB3       GLU  24  -6.396  -3.323  -2.485
  184   1HG   GLU  24          HG2       GLU  24  -8.226  -5.126  -2.780
  185   2HG   GLU  24          HG3       GLU  24  -7.460  -5.525  -4.304
  186    HE2  GLU  24           HE2      GLU  24  -5.900  -4.725  -1.208
  187    H    LYS  25           H        LYS  25  -7.518  -2.218  -1.396
  188    HA   LYS  25           HA       LYS  25  -7.359   0.667  -1.905
  189   1HB   LYS  25          HB2       LYS  25  -9.086  -0.808   0.066
  190   2HB   LYS  25          HB3       LYS  25  -8.492   0.793   0.458
  191   1HG   LYS  25          HG2       LYS  25  -9.363   1.281  -2.074
  192   2HG   LYS  25          HG3       LYS  25 -10.433  -0.047  -1.675
  193   1HD   LYS  25          HD2       LYS  25 -11.001   1.210   0.498
  194   2HD   LYS  25          HD3       LYS  25 -10.121   2.578  -0.154
  195   1HE   LYS  25          HE2       LYS  25 -12.638   2.628  -0.571
  196   2HE   LYS  25          HE3       LYS  25 -11.651   2.818  -2.006
  197   1HZ   LYS  25          HZ1       LYS  25 -12.159   0.670  -2.712
  198   2HZ   LYS  25          HZ2       LYS  25 -12.530   0.116  -1.227
  199    H    PHE  26           H        PHE  26  -6.378   1.782   0.168
  200    HA   PHE  26           HA       PHE  26  -4.454   0.025   1.457
  201   1HB   PHE  26          HB2       PHE  26  -3.965   2.353  -0.452
  202   2HB   PHE  26          HB3       PHE  26  -2.817   2.093   0.845
  203    HD1  PHE  26           HD1      PHE  26  -1.764  -0.261   1.017
  204    HD2  PHE  26           HD2      PHE  26  -3.763   1.162  -2.446
  205    HE1  PHE  26           HE1      PHE  26  -0.583  -1.986  -0.374
  206    HE2  PHE  26           HE2      PHE  26  -2.583  -0.562  -3.836
  207    HZ   PHE  26           HZ       PHE  26  -1.008  -2.116  -2.784
  208    H    GLN  27           H        GLN  27  -4.494   0.460   3.607
  209    HA   GLN  27           HA       GLN  27  -5.534   3.054   4.377
  210   1HB   GLN  27          HB2       GLN  27  -5.442   0.332   5.637
  211   2HB   GLN  27          HB3       GLN  27  -5.389   1.705   6.725
  212   1HG   GLN  27          HG2       GLN  27  -7.433   2.626   5.413
  213   2HG   GLN  27          HG3       GLN  27  -7.551   1.035   4.687
  214   1HE2  GLN  27          HE21      GLN  27  -9.459   2.341   6.364
  215   2HE2  GLN  27          HE22      GLN  27  -9.697   1.376   7.783
  216    H    ILE  28           H        ILE  28  -4.365   4.517   5.676
  217    HA   ILE  28           HA       ILE  28  -1.512   4.051   5.690
  218    HB   ILE  28           HB       ILE  28  -1.529   6.437   6.568
  219   1HG1  ILE  28          HG12      ILE  28  -4.065   7.181   5.505
  220   2HG1  ILE  28          HG13      ILE  28  -4.347   5.903   6.669
  221   1HG2  ILE  28          HG21      ILE  28  -1.606   5.373   4.017
  222   2HG2  ILE  28          HG22      ILE  28  -2.840   6.654   3.968
  223   3HG2  ILE  28          HG23      ILE  28  -1.172   7.043   4.453
  224   1HD1  ILE  28          HD11      ILE  28  -2.862   8.523   7.134
  225   2HD1  ILE  28          HD12      ILE  28  -4.378   7.981   7.895
  226   3HD1  ILE  28          HD13      ILE  28  -2.842   7.177   8.299
  227    H    LEU  29           H        LEU  29  -0.204   4.434   7.666
  228    HA   LEU  29           HA       LEU  29  -1.669   4.065  10.148
  229   1HB   LEU  29          HB2       LEU  29  -0.959   1.828   8.951
  230   2HB   LEU  29          HB3       LEU  29   0.618   2.218   9.609
  231    HG   LEU  29           HG       LEU  29  -1.829   2.140  11.372
  232   1HD1  LEU  29          HD11      LEU  29  -1.109  -0.216  11.949
  233   2HD1  LEU  29          HD12      LEU  29  -1.896  -0.002  10.367
  234   3HD1  LEU  29          HD13      LEU  29  -0.128  -0.188  10.464
  235   1HD2  LEU  29          HD21      LEU  29  -0.392   2.164  13.148
  236   2HD2  LEU  29          HD22      LEU  29   0.927   1.384  12.243
  237   3HD2  LEU  29          HD23      LEU  29   0.559   3.104  11.973
  238    H    ASN  30           H        ASN  30   1.789   3.687   9.125
  239    HA   ASN  30           HA       ASN  30   2.558   5.437  11.212
  240   1HB   ASN  30          HB2       ASN  30   3.860   3.400  10.164
  241   2HB   ASN  30          HB3       ASN  30   4.338   4.526   8.909
  242   1HD2  ASN  30          HD21      ASN  30   4.074   4.356  12.458
  243   2HD2  ASN  30          HD22      ASN  30   5.580   5.130  12.827
  244    H    SER  31           H        SER  31   3.940   7.441  10.770
  245    HA   SER  31           HA       SER  31   3.696   8.537   8.135
  246   1HB   SER  31          HB2       SER  31   1.540   9.174   9.229
  247   2HB   SER  31          HB3       SER  31   2.430   9.943  10.529
  248    HG   SER  31           HG       SER  31   2.404  11.692   9.304
  249    H    SER  32           H        SER  32   6.079   7.987   8.726
  250    HA   SER  32           HA       SER  32   7.262   9.758  10.623
  251   1HB   SER  32          HB2       SER  32   8.273   7.607  10.503
  252   2HB   SER  32          HB3       SER  32   8.300   7.612   8.750
  253    HG   SER  32           HG       SER  32  10.322   8.226  10.273
  254    H    GLU  33           H        GLU  33   8.749   9.094   7.435
  255    HA   GLU  33           HA       GLU  33   8.779  11.973   7.010
  256   1HB   GLU  33          HB2       GLU  33  10.883  10.192   7.069
  257   2HB   GLU  33          HB3       GLU  33  10.553  10.258   5.349
  258   1HG   GLU  33          HG2       GLU  33  11.342  12.394   5.159
  259   2HG   GLU  33          HG3       GLU  33  10.494  12.932   6.595
  260    HE2  GLU  33           HE2      GLU  33  13.027  13.260   8.378
  261    H    GLY  34           H        GLY  34   9.237   9.221   4.705
  262   1HA   GLY  34          HA3       GLY  34   6.849   9.038   3.471
  263   2HA   GLY  34          HA2       GLY  34   7.497  10.519   2.795
  264    H    ASP  35           H        ASP  35   8.060   7.001   3.205
  265    HA   ASP  35           HA       ASP  35   9.513   7.076   0.717
  266   1HB   ASP  35          HB2       ASP  35  11.062   7.106   2.872
  267   2HB   ASP  35          HB3       ASP  35  10.612   5.419   3.007
  268    HD2  ASP  35           HD2      ASP  35  13.086   4.510   0.887
  269    H    TRP  36           H        TRP  36   9.227   4.599   3.362
  270    HA   TRP  36           HA       TRP  36   7.535   3.014   1.552
  271   1HB   TRP  36          HB2       TRP  36   9.911   2.299   3.187
  272   2HB   TRP  36          HB3       TRP  36   8.599   1.137   3.142
  273    HD1  TRP  36           HD1      TRP  36   7.809   1.651  -0.011
  274    HE1  TRP  36           HE1      TRP  36   9.320   0.692  -1.951
  275    HE3  TRP  36           HE3      TRP  36  12.011   1.142   2.805
  276    HZ2  TRP  36           HZ2      TRP  36  12.042  -0.152  -2.087
  277    HZ3  TRP  36           HZ3      TRP  36  14.053   0.243   1.692
  278    HH2  TRP  36           HH2      TRP  36  14.113  -0.395  -0.667
  279    H    TRP  37           H        TRP  37   5.468   2.884   2.310
  280    HA   TRP  37           HA       TRP  37   5.075   3.293   5.187
  281   1HB   TRP  37          HB2       TRP  37   3.390   3.818   2.763
  282   2HB   TRP  37          HB3       TRP  37   2.630   3.575   4.322
  283    HD1  TRP  37           HD1      TRP  37   3.927   5.323   6.346
  284    HE1  TRP  37           HE1      TRP  37   4.364   7.920   6.193
  285    HE3  TRP  37           HE3      TRP  37   3.711   5.589   1.274
  286    HZ2  TRP  37           HZ2      TRP  37   4.567   9.753   4.016
  287    HZ3  TRP  37           HZ3      TRP  37   4.040   7.822   0.213
  288    HH2  TRP  37           HH2      TRP  37   4.455   9.858   1.498
  289    H    GLU  38           H        GLU  38   3.033   1.977   5.993
  290    HA   GLU  38           HA       GLU  38   3.653  -0.746   5.416
  291   1HB   GLU  38          HB2       GLU  38   2.517   0.736   7.599
  292   2HB   GLU  38          HB3       GLU  38   1.345  -0.479   7.129
  293   1HG   GLU  38          HG2       GLU  38   2.943  -2.276   7.422
  294   2HG   GLU  38          HG3       GLU  38   4.286  -1.157   7.543
  295    HE2  GLU  38           HE2      GLU  38   2.739  -3.070   9.525
  296    H    ALA  39           H        ALA  39   1.410  -2.228   5.497
  297    HA   ALA  39           HA       ALA  39  -0.437  -1.073   3.541
  298   1HB   ALA  39          HB1       ALA  39   0.159  -3.907   3.069
  299   2HB   ALA  39          HB2       ALA  39   0.107  -2.547   1.922
  300   3HB   ALA  39          HB3       ALA  39   1.587  -2.865   2.858
  301    H    ARG  40           H        ARG  40  -2.469  -1.228   4.336
  302    HA   ARG  40           HA       ARG  40  -3.001  -3.544   6.014
  303   1HB   ARG  40          HB2       ARG  40  -2.994  -0.816   6.838
  304   2HB   ARG  40          HB3       ARG  40  -4.687  -1.245   6.700
  305   1HG   ARG  40          HG2       ARG  40  -3.891  -3.453   8.004
  306   2HG   ARG  40          HG3       ARG  40  -2.574  -2.414   8.511
  307   1HD   ARG  40          HD2       ARG  40  -4.202  -0.744   9.390
  308   2HD   ARG  40          HD3       ARG  40  -5.537  -1.734   8.838
  309    HE   ARG  40           HE       ARG  40  -3.702  -3.196  10.582
  310   1HH1  ARG  40          HH22      ARG  40  -6.501  -1.023  10.534
  311   2HH1  ARG  40          HH21      ARG  40  -7.060  -1.507  12.100
  312   1HH2  ARG  40          HH11      ARG  40  -5.833  -3.163  13.326
  313    H    SER  41           H        SER  41  -4.319  -4.783   4.685
  314    HA   SER  41           HA       SER  41  -6.236  -3.382   3.040
  315   1HB   SER  41          HB2       SER  41  -5.603  -6.364   3.137
  316   2HB   SER  41          HB3       SER  41  -6.537  -5.540   1.904
  317    HG   SER  41           HG       SER  41  -4.695  -4.517   1.126
  318    H    LEU  42           H        LEU  42  -8.537  -3.901   3.101
  319    HA   LEU  42           HA       LEU  42  -9.343  -4.854   5.744
  320   1HB   LEU  42          HB2       LEU  42 -10.362  -2.882   3.799
  321   2HB   LEU  42          HB3       LEU  42 -11.591  -3.847   4.596
  322    HG   LEU  42           HG       LEU  42  -9.457  -2.333   6.116
  323   1HD1  LEU  42          HD11      LEU  42 -11.699  -0.869   6.528
  324   2HD1  LEU  42          HD12      LEU  42 -10.456  -0.483   5.314
  325   3HD1  LEU  42          HD13      LEU  42 -11.932  -1.352   4.831
  326   1HD2  LEU  42          HD21      LEU  42 -11.445  -2.488   7.846
  327   2HD2  LEU  42          HD22      LEU  42 -11.894  -3.899   6.857
  328   3HD2  LEU  42          HD23      LEU  42 -10.293  -3.828   7.632
  329    H    THR  43           H        THR  43  -8.887  -5.970   2.583
  330    HA   THR  43           HA       THR  43 -11.226  -7.674   2.521
  331    HB   THR  43           HB       THR  43 -10.004  -8.463   0.388
  332    HG1  THR  43           HG1      THR  43  -8.089  -7.070   1.787
  333   1HG2  THR  43          HG21      THR  43  -9.969  -5.477   0.208
  334   2HG2  THR  43          HG22      THR  43 -10.812  -6.660  -0.820
  335   3HG2  THR  43          HG23      THR  43 -11.511  -6.184   0.746
  336    H    THR  44           H        THR  44  -7.989  -8.884   1.703
  337    HA   THR  44           HA       THR  44  -8.499 -11.176   3.387
  338    HB   THR  44           HB       THR  44  -6.233 -11.836   2.269
  339    HG1  THR  44           HG1      THR  44  -5.634 -10.330   0.603
  340   1HG2  THR  44          HG21      THR  44  -7.637 -11.332  -0.147
  341   2HG2  THR  44          HG22      THR  44  -7.685 -12.833   0.809
  342   3HG2  THR  44          HG23      THR  44  -8.903 -11.564   1.083
  343    H    GLY  45           H        GLY  45  -6.179  -8.423   3.243
  344   1HA   GLY  45          HA3       GLY  45  -5.447  -7.426   5.263
  345   2HA   GLY  45          HA2       GLY  45  -5.566  -8.976   6.072
  346    H    GLU  46           H        GLU  46  -3.971  -7.727   3.041
  347    HA   GLU  46           HA       GLU  46  -1.637  -9.263   3.843
  348   1HB   GLU  46          HB2       GLU  46  -2.690  -8.280   1.183
  349   2HB   GLU  46          HB3       GLU  46  -0.983  -8.640   1.351
  350   1HG   GLU  46          HG2       GLU  46  -1.389 -10.938   1.865
  351   2HG   GLU  46          HG3       GLU  46  -3.067 -10.647   2.275
  352    HE2  GLU  46           HE2      GLU  46  -3.812 -12.044  -0.471
  353    H    THR  47           H        THR  47   0.007  -8.161   4.807
  354    HA   THR  47           HA       THR  47   0.115  -5.262   4.400
  355    HB   THR  47           HB       THR  47   1.049  -5.196   6.558
  356    HG1  THR  47           HG1      THR  47   1.963  -7.818   5.671
  357   1HG2  THR  47          HG21      THR  47  -0.398  -6.399   7.887
  358   2HG2  THR  47          HG22      THR  47  -1.135  -6.911   6.350
  359   3HG2  THR  47          HG23      THR  47   0.076  -7.945   7.145
  360    H    GLY  48           H        GLY  48   2.595  -4.482   4.698
  361   1HA   GLY  48          HA3       GLY  48   4.774  -5.739   3.828
  362   2HA   GLY  48          HA2       GLY  48   3.898  -5.545   2.323
  363    H    TYR  49           H        TYR  49   6.238  -4.271   2.301
  364    HA   TYR  49           HA       TYR  49   5.616  -1.485   3.015
  365   1HB   TYR  49          HB2       TYR  49   8.092  -3.263   2.853
  366   2HB   TYR  49          HB3       TYR  49   8.304  -1.542   2.599
  367    HD1  TYR  49           HD1      TYR  49   8.980  -0.332   4.451
  368    HD2  TYR  49           HD2      TYR  49   6.497  -3.766   5.038
  369    HE1  TYR  49           HE1      TYR  49   9.077   0.020   6.966
  370    HE2  TYR  49           HE2      TYR  49   6.602  -3.403   7.552
  371    HH   TYR  49           HH       TYR  49   7.144  -1.972   9.140
  372    H    ILE  50           H        ILE  50   4.799  -0.481   1.225
  373    HA   ILE  50           HA       ILE  50   6.451  -0.603  -1.169
  374    HB   ILE  50           HB       ILE  50   4.224  -0.706  -2.477
  375   1HG1  ILE  50          HG12      ILE  50   2.919  -2.561  -0.827
  376   2HG1  ILE  50          HG13      ILE  50   3.306  -1.222   0.235
  377   1HG2  ILE  50          HG21      ILE  50   4.385  -3.388  -1.952
  378   2HG2  ILE  50          HG22      ILE  50   5.440  -2.489  -3.068
  379   3HG2  ILE  50          HG23      ILE  50   5.973  -2.806  -1.399
  380   1HD1  ILE  50          HD11      ILE  50   2.301  -0.368  -2.422
  381   2HD1  ILE  50          HD12      ILE  50   1.129  -1.306  -1.465
  382   3HD1  ILE  50          HD13      ILE  50   1.832   0.187  -0.797
  383    HA   PRO  51           HA       PRO  51   5.737   3.646  -1.058
  384   1HB   PRO  51          HB2       PRO  51   6.147   4.337  -3.670
  385   2HB   PRO  51          HB3       PRO  51   7.453   4.077  -2.532
  386   1HG   PRO  51          HG2       PRO  51   6.522   2.320  -4.720
  387   2HG   PRO  51          HG3       PRO  51   8.051   2.291  -3.863
  388   1HD   PRO  51          HD2       PRO  51   5.840   0.501  -3.490
  389   2HD   PRO  51          HD3       PRO  51   7.322   0.546  -2.556
  390    H    SER  52           H        SER  52   4.259   5.355  -1.411
  391    HA   SER  52           HA       SER  52   1.969   4.438  -2.956
  392   1HB   SER  52          HB2       SER  52   1.886   5.753  -0.205
  393   2HB   SER  52          HB3       SER  52   0.476   5.477  -1.209
  394    HG   SER  52           HG       SER  52   1.575   3.107  -1.154
  395    H    ASN  53           H        ASN  53   3.912   6.059  -4.072
  396    HA   ASN  53           HA       ASN  53   2.968   8.769  -3.685
  397   1HB   ASN  53          HB2       ASN  53   5.492   8.064  -3.766
  398   2HB   ASN  53          HB3       ASN  53   5.259   7.870  -5.493
  399   1HD2  ASN  53          HD21      ASN  53   4.902  10.142  -2.805
  400   2HD2  ASN  53          HD22      ASN  53   5.159  11.602  -3.701
  401    H    TYR  54           H        TYR  54   1.179   6.906  -4.968
  402    HA   TYR  54           HA       TYR  54   0.894   8.202  -7.527
  403   1HB   TYR  54          HB2       TYR  54   2.244   5.690  -7.211
  404   2HB   TYR  54          HB3       TYR  54   0.624   5.252  -7.721
  405    HD1  TYR  54           HD1      TYR  54  -0.206   5.857  -9.948
  406    HD2  TYR  54           HD2      TYR  54   3.754   6.899  -8.709
  407    HE1  TYR  54           HE1      TYR  54   0.428   6.347 -12.361
  408    HE2  TYR  54           HE2      TYR  54   4.375   7.386 -11.126
  409    HH   TYR  54           HH       TYR  54   3.673   7.549 -13.163
  410    H    VAL  55           H        VAL  55  -0.586   8.229  -5.020
  411    HA   VAL  55           HA       VAL  55  -2.996   6.772  -5.863
  412    HB   VAL  55           HB       VAL  55  -3.583   7.127  -3.370
  413   1HG1  VAL  55          HG11      VAL  55  -2.779   4.979  -2.849
  414   2HG1  VAL  55          HG12      VAL  55  -2.950   4.970  -4.620
  415   3HG1  VAL  55          HG13      VAL  55  -1.342   5.166  -3.883
  416   1HG2  VAL  55          HG21      VAL  55  -2.076   8.060  -2.020
  417   2HG2  VAL  55          HG22      VAL  55  -0.863   6.844  -2.487
  418   3HG2  VAL  55          HG23      VAL  55  -1.021   8.349  -3.424
  419    H    ALA  56           H        ALA  56  -5.043   7.981  -4.820
  420    HA   ALA  56           HA       ALA  56  -4.849  10.787  -4.584
  421   1HB   ALA  56          HB1       ALA  56  -4.656  11.221  -6.812
  422   2HB   ALA  56          HB2       ALA  56  -5.255   9.612  -7.284
  423   3HB   ALA  56          HB3       ALA  56  -6.405  10.892  -6.825
  424    HA   PRO  57           HA       PRO  57  -8.663   9.707  -2.818
  425   1HB   PRO  57          HB2       PRO  57  -9.480  12.183  -1.994
  426   2HB   PRO  57          HB3       PRO  57  -8.348  11.196  -1.090
  427   1HG   PRO  57          HG2       PRO  57  -7.814  13.587  -2.744
  428   2HG   PRO  57          HG3       PRO  57  -6.801  12.854  -1.516
  429   1HD   PRO  57          HD2       PRO  57  -6.473  12.647  -4.357
  430   2HD   PRO  57          HD3       PRO  57  -5.532  11.822  -3.131
  431    H    VAL  58           H        VAL  58 -10.590   9.120  -3.600
  432    HA   VAL  58           HA       VAL  58 -11.603  10.916  -5.697
  433    HB   VAL  58           HB       VAL  58 -12.665   8.785  -6.584
  434   1HG1  VAL  58          HG11      VAL  58  -9.749   9.480  -6.690
  435   2HG1  VAL  58          HG12      VAL  58 -10.317   8.006  -7.509
  436   3HG1  VAL  58          HG13      VAL  58 -10.996   9.590  -7.955
  437   1HG2  VAL  58          HG21      VAL  58 -12.455   6.922  -5.375
  438   2HG2  VAL  58          HG22      VAL  58 -10.716   6.927  -5.759
  439   3HG2  VAL  58          HG23      VAL  58 -11.301   7.708  -4.270
  440    H    ASP  59           H        ASP  59 -14.147   9.821  -6.000
  441    HA   ASP  59           HA       ASP  59 -15.234  10.313  -3.341
  442   1HB   ASP  59          HB2       ASP  59 -16.289  10.936  -6.129
  443   2HB   ASP  59          HB3       ASP  59 -17.348  10.939  -4.733
  444    HD2  ASP  59           HD2      ASP  59 -17.276  13.583  -5.572
  Start of MODEL    3
    1   1H    VAL   1           H        VAL   1  -5.552   8.857   4.819
    2    HA   VAL   1           HA       VAL   1  -6.947  10.508   5.591
    3    HB   VAL   1           HB       VAL   1  -8.361  10.599   2.938
    4   1HG1  VAL   1          HG11      VAL   1  -8.054  13.096   4.388
    5   2HG1  VAL   1          HG12      VAL   1  -9.535  12.261   3.862
    6   3HG1  VAL   1          HG13      VAL   1  -8.781  11.840   5.418
    7   1HG2  VAL   1          HG21      VAL   1  -6.810  11.934   1.946
    8   2HG2  VAL   1          HG22      VAL   1  -6.265  12.639   3.488
    9   3HG2  VAL   1          HG23      VAL   1  -5.701  11.023   2.999
   10    H    THR   2           H        THR   2  -9.206   9.170   3.161
   11    HA   THR   2           HA       THR   2 -10.446   7.639   5.344
   12    HB   THR   2           HB       THR   2 -12.466   7.814   3.744
   13    HG1  THR   2           HG1      THR   2 -10.368   8.735   2.251
   14   1HG2  THR   2          HG21      THR   2 -11.867  10.651   4.018
   15   2HG2  THR   2          HG22      THR   2 -13.051   9.680   4.925
   16   3HG2  THR   2          HG23      THR   2 -11.370   9.797   5.499
   17    H    LEU   3           H        LEU   3 -10.062   7.413   1.739
   18    HA   LEU   3           HA       LEU   3  -9.129   4.694   2.107
   19   1HB   LEU   3          HB2       LEU   3 -10.827   4.040   0.246
   20   2HB   LEU   3          HB3       LEU   3 -11.281   4.009   1.938
   21    HG   LEU   3           HG       LEU   3 -11.823   6.584   0.614
   22   1HD1  LEU   3          HD11      LEU   3 -13.920   4.737  -0.174
   23   2HD1  LEU   3          HD12      LEU   3 -13.048   5.958  -1.132
   24   3HD1  LEU   3          HD13      LEU   3 -12.363   4.327  -0.933
   25   1HD2  LEU   3          HD21      LEU   3 -13.054   4.772   2.617
   26   2HD2  LEU   3          HD22      LEU   3 -12.856   6.541   2.625
   27   3HD2  LEU   3          HD23      LEU   3 -14.163   5.796   1.672
   28    H    PHE   4           H        PHE   4  -7.635   4.115   0.557
   29    HA   PHE   4           HA       PHE   4  -7.036   6.215  -1.378
   30   1HB   PHE   4          HB2       PHE   4  -5.621   4.031   0.146
   31   2HB   PHE   4          HB3       PHE   4  -5.013   4.305  -1.475
   32    HD1  PHE   4           HD1      PHE   4  -6.152   6.518   1.321
   33    HD2  PHE   4           HD2      PHE   4  -3.117   5.597  -1.498
   34    HE1  PHE   4           HE1      PHE   4  -4.786   8.450   2.160
   35    HE2  PHE   4           HE2      PHE   4  -1.752   7.530  -0.660
   36    HZ   PHE   4           HZ       PHE   4  -2.603   8.932   1.159
   37    H    VAL   5           H        VAL   5  -6.267   5.507  -3.584
   38    HA   VAL   5           HA       VAL   5  -7.727   3.099  -4.428
   39    HB   VAL   5           HB       VAL   5  -7.301   5.587  -6.080
   40   1HG1  VAL   5          HG11      VAL   5  -9.086   3.151  -6.360
   41   2HG1  VAL   5          HG12      VAL   5  -9.245   4.618  -7.356
   42   3HG1  VAL   5          HG13      VAL   5  -7.751   3.655  -7.424
   43   1HG2  VAL   5          HG21      VAL   5  -8.749   5.734  -3.843
   44   2HG2  VAL   5          HG22      VAL   5  -9.241   6.551  -5.346
   45   3HG2  VAL   5          HG23      VAL   5  -9.979   4.995  -4.895
   46    H    ALA   6           H        ALA   6  -6.814   2.132  -6.492
   47    HA   ALA   6           HA       ALA   6  -3.893   2.485  -6.490
   48   1HB   ALA   6          HB1       ALA   6  -3.822   0.300  -5.965
   49   2HB   ALA   6          HB2       ALA   6  -5.588   0.154  -6.120
   50   3HB   ALA   6          HB3       ALA   6  -4.550  -0.050  -7.551
   51    H    LEU   7           H        LEU   7  -2.855   1.952  -8.637
   52    HA   LEU   7           HA       LEU   7  -4.687   2.417 -10.870
   53   1HB   LEU   7          HB2       LEU   7  -3.242   4.455  -9.832
   54   2HB   LEU   7          HB3       LEU   7  -2.082   3.813 -10.978
   55    HG   LEU   7           HG       LEU   7  -3.821   4.024 -12.775
   56   1HD1  LEU   7          HD11      LEU   7  -5.437   5.973 -11.317
   57   2HD1  LEU   7          HD12      LEU   7  -5.929   4.642 -12.392
   58   3HD1  LEU   7          HD13      LEU   7  -5.593   4.321 -10.674
   59   1HD2  LEU   7          HD21      LEU   7  -2.518   5.797 -13.135
   60   2HD2  LEU   7          HD22      LEU   7  -3.788   6.751 -12.330
   61   3HD2  LEU   7          HD23      LEU   7  -2.388   6.166 -11.397
   62    H    TYR   8           H        TYR   8  -1.183   1.862 -10.058
   63    HA   TYR   8           HA       TYR   8  -1.220  -0.243 -12.115
   64   1HB   TYR   8          HB2       TYR   8   0.758   1.846 -11.085
   65   2HB   TYR   8          HB3       TYR   8   1.403   0.372 -11.779
   66    HD1  TYR   8           HD1      TYR   8   1.935   0.398 -14.037
   67    HD2  TYR   8           HD2      TYR   8  -1.151   2.999 -12.617
   68    HE1  TYR   8           HE1      TYR   8   1.695   1.396 -16.363
   69    HE2  TYR   8           HE2      TYR   8  -1.379   3.989 -14.948
   70    HH   TYR   8           HH       TYR   8  -0.844   2.978 -17.391
   71    H    ASP   9           H        ASP   9   0.388  -2.048 -11.700
   72    HA   ASP   9           HA       ASP   9   0.273  -2.668  -8.863
   73   1HB   ASP   9          HB2       ASP   9   0.632  -5.045  -9.646
   74   2HB   ASP   9          HB3       ASP   9  -0.856  -4.322 -10.224
   75    HD2  ASP   9           HD2      ASP   9  -0.777  -5.658 -12.494
   76    H    TYR  10           H        TYR  10   2.231  -3.614  -7.855
   77    HA   TYR  10           HA       TYR  10   4.676  -2.934  -9.340
   78   1HB   TYR  10          HB2       TYR  10   3.746  -1.931  -6.983
   79   2HB   TYR  10          HB3       TYR  10   4.420  -3.415  -6.338
   80    HD1  TYR  10           HD1      TYR  10   6.886  -3.861  -6.556
   81    HD2  TYR  10           HD2      TYR  10   5.151  -0.098  -7.620
   82    HE1  TYR  10           HE1      TYR  10   9.180  -2.768  -6.460
   83    HE2  TYR  10           HE2      TYR  10   7.450   0.982  -7.520
   84    HH   TYR  10           HH       TYR  10   9.565   0.616  -6.481
   85    H    GLU  11           H        GLU  11   5.471  -4.772 -10.279
   86    HA   GLU  11           HA       GLU  11   5.061  -7.280  -8.990
   87   1HB   GLU  11          HB2       GLU  11   6.355  -6.365 -11.566
   88   2HB   GLU  11          HB3       GLU  11   6.636  -7.997 -10.994
   89   1HG   GLU  11          HG2       GLU  11   4.007  -8.093 -10.729
   90   2HG   GLU  11          HG3       GLU  11   4.012  -6.710 -11.805
   91    HE2  GLU  11           HE2      GLU  11   6.162  -9.765 -12.836
   92    H    ALA  12           H        ALA  12   6.389  -8.185  -7.477
   93    HA   ALA  12           HA       ALA  12   9.232  -7.634  -7.622
   94   1HB   ALA  12          HB1       ALA  12   9.131  -6.047  -6.025
   95   2HB   ALA  12          HB2       ALA  12   7.413  -6.382  -5.701
   96   3HB   ALA  12          HB3       ALA  12   8.675  -7.345  -4.896
   97    H    ARG  13           H        ARG  13  10.013  -8.847  -5.241
   98    HA   ARG  13           HA       ARG  13   8.548 -11.183  -4.758
   99   1HB   ARG  13          HB2       ARG  13  10.347 -11.273  -7.013
  100   2HB   ARG  13          HB3       ARG  13  11.059 -12.246  -5.742
  101   1HG   ARG  13          HG2       ARG  13   8.145 -12.687  -6.034
  102   2HG   ARG  13          HG3       ARG  13   9.041 -13.073  -7.489
  103   1HD   ARG  13          HD2       ARG  13   8.763 -14.980  -5.765
  104   2HD   ARG  13          HD3       ARG  13  10.383 -14.713  -6.379
  105    HE   ARG  13           HE       ARG  13  11.013 -13.714  -4.281
  106   1HH1  ARG  13          HH22      ARG  13   7.645 -14.815  -4.294
  107   2HH1  ARG  13          HH21      ARG  13   7.492 -14.765  -2.569
  108   1HH2  ARG  13          HH11      ARG  13   9.366 -14.074  -1.245
  109    H    THR  14           H        THR  14   9.098  -9.790  -2.737
  110    HA   THR  14           HA       THR  14  11.566 -10.861  -1.576
  111    HB   THR  14           HB       THR  14  11.386  -8.281  -0.529
  112    HG1  THR  14           HG1      THR  14  10.234  -7.200  -2.077
  113   1HG2  THR  14          HG21      THR  14  13.500  -9.282  -1.380
  114   2HG2  THR  14          HG22      THR  14  12.882  -9.187  -3.046
  115   3HG2  THR  14          HG23      THR  14  13.226  -7.695  -2.139
  116    H    GLU  15           H        GLU  15  11.573 -10.615   0.859
  117    HA   GLU  15           HA       GLU  15   9.020 -11.522   1.742
  118   1HB   GLU  15          HB2       GLU  15  11.423 -12.355   2.424
  119   2HB   GLU  15          HB3       GLU  15  11.395 -11.015   3.553
  120   1HG   GLU  15          HG2       GLU  15   8.880 -12.199   3.919
  121   2HG   GLU  15          HG3       GLU  15   9.927 -13.578   3.647
  122    HE2  GLU  15           HE2      GLU  15  11.158 -13.845   6.381
  123    H    ASP  16           H        ASP  16  11.058  -8.602   2.022
  124    HA   ASP  16           HA       ASP  16   9.536  -7.476   4.103
  125   1HB   ASP  16          HB2       ASP  16  11.150  -5.887   2.080
  126   2HB   ASP  16          HB3       ASP  16  10.886  -5.525   3.774
  127    HD2  ASP  16           HD2      ASP  16  12.150  -6.984   5.286
  128    H    ASP  17           H        ASP  17   9.944  -6.669   0.563
  129    HA   ASP  17           HA       ASP  17   7.408  -5.282   0.685
  130   1HB   ASP  17          HB2       ASP  17   9.723  -4.500  -0.448
  131   2HB   ASP  17          HB3       ASP  17   9.110  -5.426  -1.803
  132    HD2  ASP  17           HD2      ASP  17   9.530  -2.882  -2.070
  133    H    LEU  18           H        LEU  18   5.569  -6.241  -0.230
  134    HA   LEU  18           HA       LEU  18   6.009  -8.708  -1.740
  135   1HB   LEU  18          HB2       LEU  18   3.353  -8.652  -1.211
  136   2HB   LEU  18          HB3       LEU  18   4.567  -9.450  -0.230
  137    HG   LEU  18           HG       LEU  18   4.723  -7.247   1.086
  138   1HD1  LEU  18          HD11      LEU  18   3.463  -5.507   0.536
  139   2HD1  LEU  18          HD12      LEU  18   2.942  -6.391  -0.918
  140   3HD1  LEU  18          HD13      LEU  18   1.986  -6.500   0.579
  141   1HD2  LEU  18          HD21      LEU  18   3.476  -8.254   2.644
  142   2HD2  LEU  18          HD22      LEU  18   2.020  -8.250   1.619
  143   3HD2  LEU  18          HD23      LEU  18   3.238  -9.534   1.431
  144    H    SER  19           H        SER  19   3.996  -9.052  -3.369
  145    HA   SER  19           HA       SER  19   3.871  -6.568  -4.897
  146   1HB   SER  19          HB2       SER  19   5.270  -8.099  -6.113
  147   2HB   SER  19          HB3       SER  19   4.192  -9.448  -5.815
  148    HG   SER  19           HG       SER  19   3.909  -8.677  -7.967
  149    H    PHE  20           H        PHE  20   1.835  -5.975  -5.769
  150    HA   PHE  20           HA       PHE  20  -0.364  -7.818  -5.165
  151   1HB   PHE  20          HB2       PHE  20   0.260  -5.038  -4.282
  152   2HB   PHE  20          HB3       PHE  20  -1.333  -5.158  -5.003
  153    HD1  PHE  20           HD1      PHE  20  -2.793  -7.181  -4.106
  154    HD2  PHE  20           HD2      PHE  20   0.472  -5.450  -2.021
  155    HE1  PHE  20           HE1      PHE  20  -3.707  -8.065  -1.941
  156    HE2  PHE  20           HE2      PHE  20  -0.442  -6.333   0.144
  157    HZ   PHE  20           HZ       PHE  20  -2.519  -7.631   0.158
  158    H    HIS  21           H        HIS  21  -2.435  -6.132  -6.177
  159    HA   HIS  21           HA       HIS  21  -1.589  -5.664  -8.931
  160   1HB   HIS  21          HB2       HIS  21  -2.576  -7.955  -8.706
  161   2HB   HIS  21          HB3       HIS  21  -4.072  -7.222  -8.161
  162    HD1  HIS  21           HD1      HIS  21  -5.683  -7.477 -10.057
  163    HD2  HIS  21           HD2      HIS  21  -1.898  -6.218 -11.357
  164    HE1  HIS  21           HE1      HIS  21  -5.894  -7.050 -12.564
  165    H    LYS  22           H        LYS  22  -3.269  -4.337 -10.153
  166    HA   LYS  22           HA       LYS  22  -4.044  -2.167  -8.462
  167   1HB   LYS  22          HB2       LYS  22  -4.854  -1.207 -10.657
  168   2HB   LYS  22          HB3       LYS  22  -3.144  -1.578 -10.563
  169   1HG   LYS  22          HG2       LYS  22  -3.766  -3.888 -11.603
  170   2HG   LYS  22          HG3       LYS  22  -5.320  -3.168 -11.976
  171   1HD   LYS  22          HD2       LYS  22  -3.860  -1.213 -13.025
  172   2HD   LYS  22          HD3       LYS  22  -2.584  -2.416 -13.041
  173   1HE   LYS  22          HE2       LYS  22  -4.509  -3.938 -14.150
  174   2HE   LYS  22          HE3       LYS  22  -5.178  -2.377 -14.582
  175   1HZ   LYS  22          HZ1       LYS  22  -3.027  -3.697 -15.801
  176   2HZ   LYS  22          HZ2       LYS  22  -3.662  -2.255 -16.215
  177    H    GLY  23           H        GLY  23  -6.035  -1.685  -7.636
  178   1HA   GLY  23          HA3       GLY  23  -8.425  -1.741  -7.917
  179   2HA   GLY  23          HA2       GLY  23  -8.289  -3.379  -8.524
  180    H    GLU  24           H        GLU  24  -7.496  -1.379  -5.598
  181    HA   GLU  24           HA       GLU  24  -8.789  -3.268  -3.947
  182   1HB   GLU  24          HB2       GLU  24  -5.995  -3.701  -4.450
  183   2HB   GLU  24          HB3       GLU  24  -6.142  -3.128  -2.800
  184   1HG   GLU  24          HG2       GLU  24  -8.096  -4.875  -2.595
  185   2HG   GLU  24          HG3       GLU  24  -7.435  -5.572  -4.061
  186    HE2  GLU  24           HE2      GLU  24  -5.366  -7.400  -2.685
  187    H    LYS  25           H        LYS  25  -8.828  -2.517  -1.634
  188    HA   LYS  25           HA       LYS  25  -8.652   0.385  -1.599
  189   1HB   LYS  25          HB2       LYS  25 -10.400  -1.611  -0.456
  190   2HB   LYS  25          HB3       LYS  25  -9.746  -0.600   0.817
  191   1HG   LYS  25          HG2       LYS  25 -10.326   1.377  -0.898
  192   2HG   LYS  25          HG3       LYS  25 -11.439   0.194  -1.556
  193   1HD   LYS  25          HD2       LYS  25 -12.047  -0.113   1.068
  194   2HD   LYS  25          HD3       LYS  25 -11.464   1.538   1.135
  195   1HE   LYS  25          HE2       LYS  25 -13.587   2.110   0.509
  196   2HE   LYS  25          HE3       LYS  25 -13.077   1.653  -1.104
  197   1HZ   LYS  25          HZ1       LYS  25 -14.217  -0.332   0.776
  198   2HZ   LYS  25          HZ2       LYS  25 -15.158   0.530  -0.236
  199    H    PHE  26           H        PHE  26  -7.412   1.565  -0.100
  200    HA   PHE  26           HA       PHE  26  -5.571  -0.048   1.509
  201   1HB   PHE  26          HB2       PHE  26  -5.082   2.296  -0.410
  202   2HB   PHE  26          HB3       PHE  26  -3.905   1.874   0.818
  203    HD1  PHE  26           HD1      PHE  26  -3.801  -1.007   0.776
  204    HD2  PHE  26           HD2      PHE  26  -4.245   1.689  -2.470
  205    HE1  PHE  26           HE1      PHE  26  -2.795  -2.707  -0.774
  206    HE2  PHE  26           HE2      PHE  26  -3.239  -0.009  -4.020
  207    HZ   PHE  26           HZ       PHE  26  -2.526  -2.187  -3.153
  208    H    GLN  27           H        GLN  27  -5.561   0.568   3.621
  209    HA   GLN  27           HA       GLN  27  -6.801   3.124   4.203
  210   1HB   GLN  27          HB2       GLN  27  -6.574   0.503   5.606
  211   2HB   GLN  27          HB3       GLN  27  -6.475   1.910   6.646
  212   1HG   GLN  27          HG2       GLN  27  -8.631   2.063   4.600
  213   2HG   GLN  27          HG3       GLN  27  -8.834   0.760   5.755
  214   1HE2  GLN  27          HE21      GLN  27  -8.249   1.447   8.089
  215   2HE2  GLN  27          HE22      GLN  27  -8.968   2.918   8.653
  216    H    ILE  28           H        ILE  28  -5.830   4.526   5.911
  217    HA   ILE  28           HA       ILE  28  -2.991   4.681   5.518
  218    HB   ILE  28           HB       ILE  28  -3.367   6.685   7.120
  219   1HG1  ILE  28          HG12      ILE  28  -5.939   7.363   6.521
  220   2HG1  ILE  28          HG13      ILE  28  -6.114   5.638   6.771
  221   1HG2  ILE  28          HG21      ILE  28  -3.072   6.551   4.530
  222   2HG2  ILE  28          HG22      ILE  28  -4.805   6.952   4.500
  223   3HG2  ILE  28          HG23      ILE  28  -3.651   8.055   5.286
  224   1HD1  ILE  28          HD11      ILE  28  -5.451   7.775   8.728
  225   2HD1  ILE  28          HD12      ILE  28  -6.259   6.208   8.983
  226   3HD1  ILE  28          HD13      ILE  28  -4.482   6.291   8.894
  227    H    LEU  29           H        LEU  29  -1.474   4.951   7.401
  228    HA   LEU  29           HA       LEU  29  -2.318   3.781   9.880
  229   1HB   LEU  29          HB2       LEU  29  -1.536   2.008   7.924
  230   2HB   LEU  29          HB3       LEU  29  -0.047   2.274   8.807
  231    HG   LEU  29           HG       LEU  29  -2.098   1.871  10.740
  232   1HD1  LEU  29          HD11      LEU  29  -2.268   0.025   8.372
  233   2HD1  LEU  29          HD12      LEU  29  -2.637  -0.557  10.014
  234   3HD1  LEU  29          HD13      LEU  29  -3.572   0.786   9.314
  235   1HD2  LEU  29          HD21      LEU  29  -0.616   0.381  11.629
  236   2HD2  LEU  29          HD22      LEU  29  -0.163  -0.293  10.044
  237   3HD2  LEU  29          HD23      LEU  29   0.481   1.285  10.558
  238    H    ASN  30           H        ASN  30   0.991   3.516   8.601
  239    HA   ASN  30           HA       ASN  30   1.810   5.379  10.607
  240   1HB   ASN  30          HB2       ASN  30   3.030   3.245   8.991
  241   2HB   ASN  30          HB3       ASN  30   4.041   4.676   8.983
  242   1HD2  ASN  30          HD21      ASN  30   4.087   1.930  10.315
  243   2HD2  ASN  30          HD22      ASN  30   4.471   2.242  11.975
  244    H    SER  31           H        SER  31   2.612   7.495  10.180
  245    HA   SER  31           HA       SER  31   2.909   8.205   7.381
  246   1HB   SER  31          HB2       SER  31   1.578  10.157   9.263
  247   2HB   SER  31          HB3       SER  31   1.498  10.086   7.514
  248    HG   SER  31           HG       SER  31  -0.487   9.340   8.366
  249    H    SER  32           H        SER  32   5.026   7.560   9.086
  250    HA   SER  32           HA       SER  32   6.363  10.076   9.158
  251   1HB   SER  32          HB2       SER  32   5.384   8.780  11.636
  252   2HB   SER  32          HB3       SER  32   7.099   9.140  11.673
  253    HG   SER  32           HG       SER  32   6.712  11.299  11.561
  254    H    GLU  33           H        GLU  33   7.249   8.550   7.377
  255    HA   GLU  33           HA       GLU  33   9.465   7.110   8.562
  256   1HB   GLU  33          HB2       GLU  33   7.248   5.908   7.027
  257   2HB   GLU  33          HB3       GLU  33   8.818   5.531   6.348
  258   1HG   GLU  33          HG2       GLU  33   9.384   5.113   8.981
  259   2HG   GLU  33          HG3       GLU  33   7.666   4.769   9.012
  260    HE2  GLU  33           HE2      GLU  33  10.602   3.425   7.202
  261    H    GLY  34           H        GLY  34   8.145   7.400   5.192
  262   1HA   GLY  34          HA3       GLY  34   9.796   9.500   4.359
  263   2HA   GLY  34          HA2       GLY  34  10.647   7.999   4.054
  264    H    ASP  35           H        ASP  35  10.252   6.981   2.134
  265    HA   ASP  35           HA       ASP  35   8.003   7.960   0.618
  266   1HB   ASP  35          HB2       ASP  35  10.582   6.533   0.029
  267   2HB   ASP  35          HB3       ASP  35   9.250   6.213  -1.064
  268    HD2  ASP  35           HD2      ASP  35   8.157   8.734  -1.072
  269    H    TRP  36           H        TRP  36   9.585   4.839   1.633
  270    HA   TRP  36           HA       TRP  36   7.347   3.278   0.761
  271   1HB   TRP  36          HB2       TRP  36   9.943   2.707   2.156
  272   2HB   TRP  36          HB3       TRP  36   8.686   1.488   2.085
  273    HD1  TRP  36           HD1      TRP  36   9.021   3.691  -1.013
  274    HE1  TRP  36           HE1      TRP  36  10.029   2.361  -3.058
  275    HE3  TRP  36           HE3      TRP  36  10.321  -0.445   1.644
  276    HZ2  TRP  36           HZ2      TRP  36  11.231  -0.213  -3.328
  277    HZ3  TRP  36           HZ3      TRP  36  11.408  -2.321   0.414
  278    HH2  TRP  36           HH2      TRP  36  11.866  -2.252  -1.986
  279    H    TRP  37           H        TRP  37   5.439   3.553   1.871
  280    HA   TRP  37           HA       TRP  37   5.630   3.779   4.792
  281   1HB   TRP  37          HB2       TRP  37   3.849   4.957   2.744
  282   2HB   TRP  37          HB3       TRP  37   3.064   4.419   4.215
  283    HD1  TRP  37           HD1      TRP  37   6.067   5.350   5.775
  284    HE1  TRP  37           HE1      TRP  37   6.269   7.862   6.555
  285    HE3  TRP  37           HE3      TRP  37   2.311   7.110   2.837
  286    HZ2  TRP  37           HZ2      TRP  37   4.865  10.251   5.871
  287    HZ3  TRP  37           HZ3      TRP  37   1.789   9.546   2.953
  288    HH2  TRP  37           HH2      TRP  37   2.997  11.098   4.403
  289    H    GLU  38           H        GLU  38   3.307   2.830   5.703
  290    HA   GLU  38           HA       GLU  38   3.225   0.134   4.601
  291   1HB   GLU  38          HB2       GLU  38   3.324   1.202   7.352
  292   2HB   GLU  38          HB3       GLU  38   2.055   0.012   7.136
  293   1HG   GLU  38          HG2       GLU  38   3.553  -1.693   7.023
  294   2HG   GLU  38          HG3       GLU  38   4.498  -0.872   5.797
  295    HE2  GLU  38           HE2      GLU  38   6.282   0.935   8.365
  296    H    ALA  39           H        ALA  39   1.115  -0.964   4.516
  297    HA   ALA  39           HA       ALA  39  -1.225   0.670   4.939
  298   1HB   ALA  39          HB1       ALA  39   0.029   0.706   2.421
  299   2HB   ALA  39          HB2       ALA  39  -1.327  -0.433   2.243
  300   3HB   ALA  39          HB3       ALA  39  -1.630   1.230   2.798
  301    H    ARG  40           H        ARG  40  -3.193  -0.619   4.918
  302    HA   ARG  40           HA       ARG  40  -2.544  -3.444   5.175
  303   1HB   ARG  40          HB2       ARG  40  -3.583  -1.894   7.121
  304   2HB   ARG  40          HB3       ARG  40  -5.088  -2.260   6.302
  305   1HG   ARG  40          HG2       ARG  40  -4.223  -4.767   6.394
  306   2HG   ARG  40          HG3       ARG  40  -3.164  -4.169   7.656
  307   1HD   ARG  40          HD2       ARG  40  -6.074  -3.415   7.838
  308   2HD   ARG  40          HD3       ARG  40  -5.658  -5.083   8.179
  309    HE   ARG  40           HE       ARG  40  -3.813  -3.474   9.612
  310   1HH1  ARG  40          HH22      ARG  40  -7.301  -4.098   9.606
  311   2HH1  ARG  40          HH21      ARG  40  -7.492  -3.746  11.290
  312   1HH2  ARG  40          HH11      ARG  40  -5.577  -3.107  12.582
  313    H    SER  41           H        SER  41  -5.297  -4.370   5.199
  314    HA   SER  41           HA       SER  41  -6.443  -3.403   2.753
  315   1HB   SER  41          HB2       SER  41  -5.078  -6.066   3.009
  316   2HB   SER  41          HB3       SER  41  -6.589  -6.031   2.120
  317    HG   SER  41           HG       SER  41  -5.632  -4.236   0.833
  318    H    LEU  42           H        LEU  42  -8.699  -4.064   2.521
  319    HA   LEU  42           HA       LEU  42  -9.803  -4.975   5.067
  320   1HB   LEU  42          HB2       LEU  42 -10.418  -2.837   3.482
  321   2HB   LEU  42          HB3       LEU  42 -11.610  -4.009   2.957
  322    HG   LEU  42           HG       LEU  42 -11.192  -3.355   5.877
  323   1HD1  LEU  42          HD11      LEU  42 -13.542  -2.097   4.783
  324   2HD1  LEU  42          HD12      LEU  42 -12.189  -1.382   5.694
  325   3HD1  LEU  42          HD13      LEU  42 -12.087  -1.536   3.923
  326   1HD2  LEU  42          HD21      LEU  42 -12.687  -5.321   4.586
  327   2HD2  LEU  42          HD22      LEU  42 -12.842  -4.791   6.278
  328   3HD2  LEU  42          HD23      LEU  42 -13.873  -4.068   5.020
  329    H    THR  43           H        THR  43  -8.540  -6.502   2.558
  330    HA   THR  43           HA       THR  43 -10.821  -8.323   2.181
  331    HB   THR  43           HB       THR  43  -8.277  -8.239   0.512
  332    HG1  THR  43           HG1      THR  43  -9.770  -6.709  -0.779
  333   1HG2  THR  43          HG21      THR  43 -11.211  -8.959   0.032
  334   2HG2  THR  43          HG22      THR  43 -10.043  -8.738  -1.293
  335   3HG2  THR  43          HG23      THR  43  -9.801 -10.038  -0.101
  336    H    THR  44           H        THR  44  -7.202  -8.423   2.485
  337    HA   THR  44           HA       THR  44  -7.494 -11.081   3.661
  338    HB   THR  44           HB       THR  44  -4.907 -10.930   3.387
  339    HG1  THR  44           HG1      THR  44  -4.935  -8.563   3.235
  340   1HG2  THR  44          HG21      THR  44  -5.354 -12.016   1.429
  341   2HG2  THR  44          HG22      THR  44  -6.980 -11.296   1.379
  342   3HG2  THR  44          HG23      THR  44  -5.603 -10.436   0.649
  343    H    GLY  45           H        GLY  45  -5.678  -8.023   4.401
  344   1HA   GLY  45          HA3       GLY  45  -5.933  -6.972   6.518
  345   2HA   GLY  45          HA2       GLY  45  -6.271  -8.530   7.245
  346    H    GLU  46           H        GLU  46  -3.667  -7.616   4.896
  347    HA   GLU  46           HA       GLU  46  -1.767  -8.275   7.009
  348   1HB   GLU  46          HB2       GLU  46  -1.892  -9.213   4.143
  349   2HB   GLU  46          HB3       GLU  46  -0.320  -9.016   4.892
  350   1HG   GLU  46          HG2       GLU  46  -1.749 -10.365   6.872
  351   2HG   GLU  46          HG3       GLU  46  -2.406 -11.060   5.402
  352    HE2  GLU  46           HE2      GLU  46   1.214 -10.848   4.674
  353    H    THR  47           H        THR  47  -0.007  -6.874   7.246
  354    HA   THR  47           HA       THR  47  -0.061  -4.530   5.471
  355    HB   THR  47           HB       THR  47   1.278  -4.674   8.194
  356    HG1  THR  47           HG1      THR  47  -1.281  -3.693   8.289
  357   1HG2  THR  47          HG21      THR  47  -0.210  -2.536   6.585
  358   2HG2  THR  47          HG22      THR  47   0.292  -2.319   8.279
  359   3HG2  THR  47          HG23      THR  47   1.518  -2.541   7.008
  360    H    GLY  48           H        GLY  48   1.687  -3.919   4.290
  361   1HA   GLY  48          HA3       GLY  48   4.270  -5.146   4.831
  362   2HA   GLY  48          HA2       GLY  48   3.506  -5.600   3.321
  363    H    TYR  49           H        TYR  49   5.942  -4.265   3.238
  364    HA   TYR  49           HA       TYR  49   5.800  -1.488   3.175
  365   1HB   TYR  49          HB2       TYR  49   7.435  -3.767   2.027
  366   2HB   TYR  49          HB3       TYR  49   7.681  -2.206   1.272
  367    HD1  TYR  49           HD1      TYR  49   8.557  -4.317   4.022
  368    HD2  TYR  49           HD2      TYR  49   8.313  -0.220   2.812
  369    HE1  TYR  49           HE1      TYR  49  10.174  -3.667   5.872
  370    HE2  TYR  49           HE2      TYR  49   9.931   0.416   4.668
  371    HH   TYR  49           HH       TYR  49  11.689  -0.659   5.967
  372    H    ILE  50           H        ILE  50   5.128   0.011   1.678
  373    HA   ILE  50           HA       ILE  50   4.716  -0.739  -1.045
  374    HB   ILE  50           HB       ILE  50   2.709  -1.686   0.045
  375   1HG1  ILE  50          HG12      ILE  50   1.067  -0.259  -1.445
  376   2HG1  ILE  50          HG13      ILE  50   2.545   0.490  -2.016
  377   1HG2  ILE  50          HG21      ILE  50   1.180  -0.477   1.254
  378   2HG2  ILE  50          HG22      ILE  50   2.695   0.309   1.758
  379   3HG2  ILE  50          HG23      ILE  50   1.660   1.076   0.529
  380   1HD1  ILE  50          HD11      ILE  50   1.630  -1.652  -3.244
  381   2HD1  ILE  50          HD12      ILE  50   3.377  -1.517  -2.933
  382   3HD1  ILE  50          HD13      ILE  50   2.362  -2.531  -1.880
  383    HA   PRO  51           HA       PRO  51   5.274   3.568  -1.147
  384   1HB   PRO  51          HB2       PRO  51   5.464   3.889  -3.854
  385   2HB   PRO  51          HB3       PRO  51   6.792   3.323  -2.862
  386   1HG   PRO  51          HG2       PRO  51   5.053   1.780  -4.687
  387   2HG   PRO  51          HG3       PRO  51   6.617   1.342  -4.028
  388   1HD   PRO  51          HD2       PRO  51   4.058   0.368  -3.170
  389   2HD   PRO  51          HD3       PRO  51   5.612   0.020  -2.437
  390    H    SER  52           H        SER  52   4.292   5.583  -1.380
  391    HA   SER  52           HA       SER  52   1.594   5.282  -2.449
  392   1HB   SER  52          HB2       SER  52   0.778   6.813  -0.749
  393   2HB   SER  52          HB3       SER  52   1.662   5.526   0.047
  394    HG   SER  52           HG       SER  52   3.567   7.201  -0.262
  395    H    ASN  53           H        ASN  53   3.963   6.033  -3.966
  396    HA   ASN  53           HA       ASN  53   3.729   8.902  -4.182
  397   1HB   ASN  53          HB2       ASN  53   5.853   7.039  -4.531
  398   2HB   ASN  53          HB3       ASN  53   5.492   7.608  -6.148
  399   1HD2  ASN  53          HD21      ASN  53   5.758   9.750  -6.697
  400   2HD2  ASN  53          HD22      ASN  53   6.654  10.880  -5.737
  401    H    TYR  54           H        TYR  54   2.473   5.970  -5.501
  402    HA   TYR  54           HA       TYR  54   1.596   7.398  -7.919
  403   1HB   TYR  54          HB2       TYR  54   2.549   4.540  -7.339
  404   2HB   TYR  54          HB3       TYR  54   1.546   4.857  -8.740
  405    HD1  TYR  54           HD1      TYR  54   4.808   5.690  -7.158
  406    HD2  TYR  54           HD2      TYR  54   2.472   5.750 -10.741
  407    HE1  TYR  54           HE1      TYR  54   6.873   6.323  -8.501
  408    HE2  TYR  54           HE2      TYR  54   4.543   6.383 -12.073
  409    HH   TYR  54           HH       TYR  54   6.622   7.211 -11.877
  410    H    VAL  55           H        VAL  55   0.287   7.298  -5.274
  411    HA   VAL  55           HA       VAL  55  -1.906   5.436  -5.766
  412    HB   VAL  55           HB       VAL  55  -2.583   6.177  -3.459
  413   1HG1  VAL  55          HG11      VAL  55  -0.423   5.024  -2.422
  414   2HG1  VAL  55          HG12      VAL  55  -1.597   4.107  -3.396
  415   3HG1  VAL  55          HG13      VAL  55  -0.083   4.680  -4.135
  416   1HG2  VAL  55          HG21      VAL  55  -0.799   8.237  -3.863
  417   2HG2  VAL  55          HG22      VAL  55  -1.475   7.746  -2.292
  418   3HG2  VAL  55          HG23      VAL  55   0.118   7.137  -2.806
  419    H    ALA  56           H        ALA  56  -4.143   6.520  -4.952
  420    HA   ALA  56           HA       ALA  56  -4.319   9.228  -6.026
  421   1HB   ALA  56          HB1       ALA  56  -6.006   8.675  -7.597
  422   2HB   ALA  56          HB2       ALA  56  -4.758   7.426  -7.821
  423   3HB   ALA  56          HB3       ALA  56  -6.236   7.051  -6.905
  424    HA   PRO  57           HA       PRO  57  -6.695   8.733  -2.255
  425   1HB   PRO  57          HB2       PRO  57  -5.765  10.953  -0.962
  426   2HB   PRO  57          HB3       PRO  57  -5.054   9.363  -0.768
  427   1HG   PRO  57          HG2       PRO  57  -4.031  11.678  -2.295
  428   2HG   PRO  57          HG3       PRO  57  -3.165  10.258  -1.742
  429   1HD   PRO  57          HD2       PRO  57  -4.062  10.787  -4.414
  430   2HD   PRO  57          HD3       PRO  57  -3.300   9.319  -3.835
  431    H    VAL  58           H        VAL  58  -8.498   9.012  -3.721
  432    HA   VAL  58           HA       VAL  58  -9.242  11.814  -4.011
  433    HB   VAL  58           HB       VAL  58 -11.106  10.732  -5.386
  434   1HG1  VAL  58          HG11      VAL  58  -9.854  11.164  -7.208
  435   2HG1  VAL  58          HG12      VAL  58  -8.592  11.613  -6.036
  436   3HG1  VAL  58          HG13      VAL  58  -8.603   9.982  -6.751
  437   1HG2  VAL  58          HG21      VAL  58  -9.497   8.339  -4.622
  438   2HG2  VAL  58          HG22      VAL  58 -11.243   8.498  -4.938
  439   3HG2  VAL  58          HG23      VAL  58 -10.095   8.424  -6.297
  440    H    ASP  59           H        ASP  59 -11.919  11.900  -3.890
  441    HA   ASP  59           HA       ASP  59 -12.353  11.504  -1.105
  442   1HB   ASP  59          HB2       ASP  59 -14.057  12.634  -3.367
  443   2HB   ASP  59          HB3       ASP  59 -14.650  12.517  -1.722
  444    HD2  ASP  59           HD2      ASP  59 -13.092  15.040  -0.433
  Start of MODEL    4
    1   1H    VAL   1           H        VAL   1  -6.339  10.822   1.414
    2    HA   VAL   1           HA       VAL   1  -5.261  10.109   3.209
    3    HB   VAL   1           HB       VAL   1  -6.967  11.939   4.893
    4   1HG1  VAL   1          HG11      VAL   1  -4.046  11.212   5.219
    5   2HG1  VAL   1          HG12      VAL   1  -5.134  11.978   6.401
    6   3HG1  VAL   1          HG13      VAL   1  -5.365  10.270   5.955
    7   1HG2  VAL   1          HG21      VAL   1  -6.298  13.491   3.330
    8   2HG2  VAL   1          HG22      VAL   1  -4.902  13.527   4.434
    9   3HG2  VAL   1          HG23      VAL   1  -4.813  12.602   2.916
   10    H    THR   2           H        THR   2  -8.525   9.694   2.594
   11    HA   THR   2           HA       THR   2  -9.100   8.079   4.930
   12    HB   THR   2           HB       THR   2 -10.690   8.577   2.359
   13    HG1  THR   2           HG1      THR   2 -11.693  10.060   4.203
   14   1HG2  THR   2          HG21      THR   2 -12.555   7.742   3.498
   15   2HG2  THR   2          HG22      THR   2 -11.300   6.716   4.231
   16   3HG2  THR   2          HG23      THR   2 -11.888   8.157   5.095
   17    H    LEU   3           H        LEU   3 -10.080   7.003   1.713
   18    HA   LEU   3           HA       LEU   3  -8.677   4.509   2.263
   19   1HB   LEU   3          HB2       LEU   3 -11.105   5.319   0.776
   20   2HB   LEU   3          HB3       LEU   3 -10.177   4.007   0.078
   21    HG   LEU   3           HG       LEU   3 -11.037   3.968   2.972
   22   1HD1  LEU   3          HD11      LEU   3 -12.614   2.648   0.768
   23   2HD1  LEU   3          HD12      LEU   3 -13.073   2.935   2.463
   24   3HD1  LEU   3          HD13      LEU   3 -12.977   4.300   1.325
   25   1HD2  LEU   3          HD21      LEU   3  -9.735   2.159   2.949
   26   2HD2  LEU   3          HD22      LEU   3 -11.007   1.389   1.971
   27   3HD2  LEU   3          HD23      LEU   3  -9.617   2.162   1.173
   28    H    PHE   4           H        PHE   4  -7.066   3.673   0.950
   29    HA   PHE   4           HA       PHE   4  -5.995   5.587  -0.971
   30   1HB   PHE   4          HB2       PHE   4  -5.045   3.368   0.831
   31   2HB   PHE   4          HB3       PHE   4  -4.207   3.461  -0.706
   32    HD1  PHE   4           HD1      PHE   4  -4.119   4.526   2.588
   33    HD2  PHE   4           HD2      PHE   4  -3.494   5.982  -1.348
   34    HE1  PHE   4           HE1      PHE   4  -2.654   6.351   3.497
   35    HE2  PHE   4           HE2      PHE   4  -2.030   7.808  -0.440
   36    HZ   PHE   4           HZ       PHE   4  -1.628   7.971   1.971
   37    H    VAL   5           H        VAL   5  -5.759   5.135  -3.155
   38    HA   VAL   5           HA       VAL   5  -6.684   2.476  -3.999
   39    HB   VAL   5           HB       VAL   5  -7.365   3.956  -6.100
   40   1HG1  VAL   5          HG11      VAL   5  -9.634   4.299  -4.630
   41   2HG1  VAL   5          HG12      VAL   5  -9.142   2.760  -5.376
   42   3HG1  VAL   5          HG13      VAL   5  -8.788   3.071  -3.660
   43   1HG2  VAL   5          HG21      VAL   5  -6.861   5.912  -4.003
   44   2HG2  VAL   5          HG22      VAL   5  -7.204   6.155  -5.733
   45   3HG2  VAL   5          HG23      VAL   5  -8.545   5.982  -4.575
   46    H    ALA   6           H        ALA   6  -5.521   1.485  -5.676
   47    HA   ALA   6           HA       ALA   6  -3.207   3.003  -6.652
   48   1HB   ALA   6          HB1       ALA   6  -2.282   1.624  -4.953
   49   2HB   ALA   6          HB2       ALA   6  -3.303   0.239  -5.407
   50   3HB   ALA   6          HB3       ALA   6  -1.973   0.751  -6.473
   51    H    LEU   7           H        LEU   7  -3.887   3.360  -8.743
   52    HA   LEU   7           HA       LEU   7  -5.382   1.389 -10.153
   53   1HB   LEU   7          HB2       LEU   7  -5.052   4.090 -10.332
   54   2HB   LEU   7          HB3       LEU   7  -4.057   3.541 -11.665
   55    HG   LEU   7           HG       LEU   7  -6.856   2.486 -11.379
   56   1HD1  LEU   7          HD11      LEU   7  -6.460   4.931 -13.030
   57   2HD1  LEU   7          HD12      LEU   7  -7.901   4.341 -12.168
   58   3HD1  LEU   7          HD13      LEU   7  -6.588   5.135 -11.266
   59   1HD2  LEU   7          HD21      LEU   7  -5.787   3.188 -14.023
   60   2HD2  LEU   7          HD22      LEU   7  -4.834   1.962 -13.154
   61   3HD2  LEU   7          HD23      LEU   7  -6.569   1.694 -13.453
   62    H    TYR   8           H        TYR   8  -2.108   1.665  -9.286
   63    HA   TYR   8           HA       TYR   8  -1.362  -0.058 -11.552
   64   1HB   TYR   8          HB2       TYR   8   0.056   2.169  -9.981
   65   2HB   TYR   8          HB3       TYR   8   0.986   1.008 -10.907
   66    HD1  TYR   8           HD1      TYR   8   0.569   0.844 -13.427
   67    HD2  TYR   8           HD2      TYR   8  -0.933   4.051 -11.027
   68    HE1  TYR   8           HE1      TYR   8   0.256   2.267 -15.511
   69    HE2  TYR   8           HE2      TYR   8  -1.240   5.463 -13.119
   70    HH   TYR   8           HH       TYR   8  -0.022   4.388 -16.213
   71    H    ASP   9           H        ASP   9  -0.398  -1.999 -11.053
   72    HA   ASP   9           HA       ASP   9  -0.291  -2.605  -8.243
   73   1HB   ASP   9          HB2       ASP   9   0.141  -4.961  -9.112
   74   2HB   ASP   9          HB3       ASP   9  -1.392  -4.263  -9.597
   75    HD2  ASP   9           HD2      ASP   9  -0.214  -6.299 -10.799
   76    H    TYR  10           H        TYR  10   1.693  -4.270  -7.726
   77    HA   TYR  10           HA       TYR  10   4.106  -3.640  -9.172
   78   1HB   TYR  10          HB2       TYR  10   3.411  -1.828  -7.300
   79   2HB   TYR  10          HB3       TYR  10   3.914  -3.070  -6.170
   80    HD1  TYR  10           HD1      TYR  10   6.197  -3.369  -5.634
   81    HD2  TYR  10           HD2      TYR  10   5.120  -0.995  -9.026
   82    HE1  TYR  10           HE1      TYR  10   8.608  -2.597  -5.868
   83    HE2  TYR  10           HE2      TYR  10   7.535  -0.231  -9.249
   84    HH   TYR  10           HH       TYR  10   9.962  -1.623  -8.251
   85    H    GLU  11           H        GLU  11   4.032  -5.959  -9.520
   86    HA   GLU  11           HA       GLU  11   3.856  -7.731  -7.376
   87   1HB   GLU  11          HB2       GLU  11   4.494  -7.858 -10.276
   88   2HB   GLU  11          HB3       GLU  11   5.224  -9.135  -9.324
   89   1HG   GLU  11          HG2       GLU  11   3.232 -10.215  -9.326
   90   2HG   GLU  11          HG3       GLU  11   2.570  -8.925  -8.342
   91    HE2  GLU  11           HE2      GLU  11   0.519  -9.602 -10.255
   92    H    ALA  12           H        ALA  12   5.494  -8.942  -6.261
   93    HA   ALA  12           HA       ALA  12   8.249  -8.136  -6.742
   94   1HB   ALA  12          HB1       ALA  12   7.840  -6.539  -5.103
   95   2HB   ALA  12          HB2       ALA  12   6.619  -7.541  -4.281
   96   3HB   ALA  12          HB3       ALA  12   8.348  -7.924  -4.106
   97    H    ARG  13           H        ARG  13   9.061  -9.396  -4.164
   98    HA   ARG  13           HA       ARG  13   7.984 -11.940  -3.997
   99   1HB   ARG  13          HB2       ARG  13   9.869 -11.591  -6.174
  100   2HB   ARG  13          HB3       ARG  13  10.614 -12.622  -4.968
  101   1HG   ARG  13          HG2       ARG  13   7.814 -13.073  -6.106
  102   2HG   ARG  13          HG3       ARG  13   9.254 -13.875  -6.703
  103   1HD   ARG  13          HD2       ARG  13   9.356 -15.312  -4.911
  104   2HD   ARG  13          HD3       ARG  13   8.933 -14.064  -3.755
  105    HE   ARG  13           HE       ARG  13   6.972 -15.591  -5.429
  106   1HH1  ARG  13          HH22      ARG  13   7.674 -13.543  -2.624
  107   2HH1  ARG  13          HH21      ARG  13   6.091 -13.721  -1.942
  108   1HH2  ARG  13          HH11      ARG  13   4.468 -15.067  -3.079
  109    H    THR  14           H        THR  14   8.402 -10.401  -1.934
  110    HA   THR  14           HA       THR  14  10.906 -11.363  -0.736
  111    HB   THR  14           HB       THR  14  10.209  -8.768   0.319
  112    HG1  THR  14           HG1      THR  14   9.428  -7.907  -1.563
  113   1HG2  THR  14          HG21      THR  14  12.528 -10.122  -0.495
  114   2HG2  THR  14          HG22      THR  14  12.362  -8.833  -1.713
  115   3HG2  THR  14          HG23      THR  14  12.458  -8.419   0.016
  116    H    GLU  15           H        GLU  15  10.545 -10.322   1.819
  117    HA   GLU  15           HA       GLU  15   8.389 -12.037   2.649
  118   1HB   GLU  15          HB2       GLU  15  10.752 -10.742   4.020
  119   2HB   GLU  15          HB3       GLU  15   9.419 -11.338   4.990
  120   1HG   GLU  15          HG2       GLU  15  10.079 -13.348   3.008
  121   2HG   GLU  15          HG3       GLU  15  11.559 -12.848   3.803
  122    HE2  GLU  15           HE2      GLU  15   8.658 -14.708   5.829
  123    H    ASP  16           H        ASP  16   9.347  -8.591   2.634
  124    HA   ASP  16           HA       ASP  16   7.013  -7.925   4.185
  125   1HB   ASP  16          HB2       ASP  16   8.866  -5.919   2.867
  126   2HB   ASP  16          HB3       ASP  16   7.938  -5.734   4.342
  127    HD2  ASP  16           HD2      ASP  16  10.860  -6.226   3.170
  128    H    ASP  17           H        ASP  17   8.554  -6.488   1.207
  129    HA   ASP  17           HA       ASP  17   6.126  -5.537   0.239
  130   1HB   ASP  17          HB2       ASP  17   8.878  -5.349  -0.422
  131   2HB   ASP  17          HB3       ASP  17   8.128  -6.034  -1.851
  132    HD2  ASP  17           HD2      ASP  17   5.714  -4.190  -0.765
  133    H    LEU  18           H        LEU  18   4.524  -7.131  -0.156
  134    HA   LEU  18           HA       LEU  18   5.308  -9.556  -1.542
  135   1HB   LEU  18          HB2       LEU  18   3.346  -8.831   0.372
  136   2HB   LEU  18          HB3       LEU  18   2.490  -9.332  -1.073
  137    HG   LEU  18           HG       LEU  18   4.234 -11.365  -0.928
  138   1HD1  LEU  18          HD11      LEU  18   4.090 -10.231   1.850
  139   2HD1  LEU  18          HD12      LEU  18   4.252 -11.985   1.596
  140   3HD1  LEU  18          HD13      LEU  18   5.488 -10.875   0.955
  141   1HD2  LEU  18          HD21      LEU  18   2.221 -12.307  -0.932
  142   2HD2  LEU  18          HD22      LEU  18   2.243 -12.189   0.844
  143   3HD2  LEU  18          HD23      LEU  18   1.485 -10.902  -0.126
  144    H    SER  19           H        SER  19   2.718  -9.913  -2.878
  145    HA   SER  19           HA       SER  19   3.146  -7.965  -5.007
  146   1HB   SER  19          HB2       SER  19   1.730 -10.531  -5.605
  147   2HB   SER  19          HB3       SER  19   2.867  -9.630  -6.587
  148    HG   SER  19           HG       SER  19   3.330 -11.688  -4.746
  149    H    PHE  20           H        PHE  20   1.430  -6.635  -5.522
  150    HA   PHE  20           HA       PHE  20  -1.181  -7.416  -4.427
  151   1HB   PHE  20          HB2       PHE  20   0.168  -4.689  -4.892
  152   2HB   PHE  20          HB3       PHE  20  -1.493  -4.858  -4.360
  153    HD1  PHE  20           HD1      PHE  20  -2.000  -5.111  -2.082
  154    HD2  PHE  20           HD2      PHE  20   2.005  -5.626  -3.388
  155    HE1  PHE  20           HE1      PHE  20  -1.230  -5.177   0.306
  156    HE2  PHE  20           HE2      PHE  20   2.775  -5.691  -1.000
  157    HZ   PHE  20           HZ       PHE  20   1.148  -5.466   0.818
  158    H    HIS  21           H        HIS  21  -2.905  -5.745  -5.630
  159    HA   HIS  21           HA       HIS  21  -2.292  -5.552  -8.433
  160   1HB   HIS  21          HB2       HIS  21  -3.155  -7.951  -7.833
  161   2HB   HIS  21          HB3       HIS  21  -4.720  -7.174  -7.714
  162    HD1  HIS  21           HD1      HIS  21  -3.089  -5.313 -10.271
  163    HD2  HIS  21           HD2      HIS  21  -4.811  -9.134 -10.102
  164    HE1  HIS  21           HE1      HIS  21  -3.582  -5.982 -12.683
  165    H    LYS  22           H        LYS  22  -4.008  -4.332  -9.613
  166    HA   LYS  22           HA       LYS  22  -4.940  -2.207  -8.007
  167   1HB   LYS  22          HB2       LYS  22  -6.009  -1.470 -10.164
  168   2HB   LYS  22          HB3       LYS  22  -4.275  -1.715 -10.225
  169   1HG   LYS  22          HG2       LYS  22  -4.681  -3.037 -12.035
  170   2HG   LYS  22          HG3       LYS  22  -5.217  -4.244 -10.884
  171   1HD   LYS  22          HD2       LYS  22  -7.370  -4.071 -11.587
  172   2HD   LYS  22          HD3       LYS  22  -7.366  -2.333 -11.370
  173   1HE   LYS  22          HE2       LYS  22  -5.771  -2.727 -13.663
  174   2HE   LYS  22          HE3       LYS  22  -7.061  -3.900 -13.843
  175   1HZ   LYS  22          HZ1       LYS  22  -7.806  -1.178 -13.042
  176   2HZ   LYS  22          HZ2       LYS  22  -7.397  -1.420 -14.600
  177    H    GLY  23           H        GLY  23  -7.282  -1.475  -7.976
  178   1HA   GLY  23          HA3       GLY  23  -9.464  -1.836  -7.538
  179   2HA   GLY  23          HA2       GLY  23  -9.353  -3.383  -8.355
  180    H    GLU  24           H        GLU  24  -7.771  -1.988  -5.386
  181    HA   GLU  24           HA       GLU  24  -8.932  -4.225  -3.929
  182   1HB   GLU  24          HB2       GLU  24  -6.182  -3.914  -4.535
  183   2HB   GLU  24          HB3       GLU  24  -6.329  -3.440  -2.853
  184   1HG   GLU  24          HG2       GLU  24  -6.749  -5.577  -2.170
  185   2HG   GLU  24          HG3       GLU  24  -7.918  -5.848  -3.447
  186    HE2  GLU  24           HE2      GLU  24  -5.638  -7.478  -2.529
  187    H    LYS  25           H        LYS  25  -7.731  -3.487  -1.387
  188    HA   LYS  25           HA       LYS  25  -8.672  -0.752  -0.995
  189   1HB   LYS  25          HB2       LYS  25 -10.266  -2.966  -0.389
  190   2HB   LYS  25          HB3       LYS  25  -9.557  -2.519   1.150
  191   1HG   LYS  25          HG2       LYS  25 -10.305  -0.171   0.845
  192   2HG   LYS  25          HG3       LYS  25 -10.951  -0.562  -0.737
  193   1HD   LYS  25          HD2       LYS  25 -12.576  -2.131   0.266
  194   2HD   LYS  25          HD3       LYS  25 -11.881  -1.883   1.856
  195   1HE   LYS  25          HE2       LYS  25 -12.571   0.470   1.865
  196   2HE   LYS  25          HE3       LYS  25 -13.083   0.378   0.192
  197   1HZ   LYS  25          HZ1       LYS  25 -14.768   0.013   2.199
  198   2HZ   LYS  25          HZ2       LYS  25 -14.981  -0.741   0.771
  199    H    PHE  26           H        PHE  26  -7.407   0.400   0.414
  200    HA   PHE  26           HA       PHE  26  -5.520  -1.158   2.023
  201   1HB   PHE  26          HB2       PHE  26  -5.011   1.412   0.407
  202   2HB   PHE  26          HB3       PHE  26  -3.804   0.567   1.357
  203    HD1  PHE  26           HD1      PHE  26  -3.289  -1.879   0.660
  204    HD2  PHE  26           HD2      PHE  26  -5.266   0.912  -1.851
  205    HE1  PHE  26           HE1      PHE  26  -2.665  -3.246  -1.350
  206    HE2  PHE  26           HE2      PHE  26  -4.644  -0.455  -3.862
  207    HZ   PHE  26           HZ       PHE  26  -3.350  -2.518  -3.587
  208    H    GLN  27           H        GLN  27  -5.606  -0.599   4.147
  209    HA   GLN  27           HA       GLN  27  -6.963   1.888   4.758
  210   1HB   GLN  27          HB2       GLN  27  -7.106  -0.721   5.838
  211   2HB   GLN  27          HB3       GLN  27  -6.287   0.222   7.067
  212   1HG   GLN  27          HG2       GLN  27  -8.452   0.739   7.675
  213   2HG   GLN  27          HG3       GLN  27  -8.241   1.994   6.471
  214   1HE2  GLN  27          HE21      GLN  27 -10.657   0.669   7.375
  215   2HE2  GLN  27          HE22      GLN  27 -11.412  -0.053   5.993
  216    H    ILE  28           H        ILE  28  -6.050   3.453   6.229
  217    HA   ILE  28           HA       ILE  28  -3.306   3.843   5.913
  218    HB   ILE  28           HB       ILE  28  -3.770   5.537   7.835
  219   1HG1  ILE  28          HG12      ILE  28  -6.582   5.642   7.150
  220   2HG1  ILE  28          HG13      ILE  28  -6.196   4.099   7.886
  221   1HG2  ILE  28          HG21      ILE  28  -3.553   5.904   5.314
  222   2HG2  ILE  28          HG22      ILE  28  -5.332   5.923   5.282
  223   3HG2  ILE  28          HG23      ILE  28  -4.446   7.128   6.248
  224   1HD1  ILE  28          HD11      ILE  28  -4.794   6.172   9.337
  225   2HD1  ILE  28          HD12      ILE  28  -6.508   6.628   9.183
  226   3HD1  ILE  28          HD13      ILE  28  -6.064   5.071   9.924
  227    H    LEU  29           H        LEU  29  -1.642   3.976   7.651
  228    HA   LEU  29           HA       LEU  29  -2.124   2.467  10.033
  229   1HB   LEU  29          HB2       LEU  29  -1.603   0.910   7.898
  230   2HB   LEU  29          HB3       LEU  29   0.037   1.264   8.403
  231    HG   LEU  29           HG       LEU  29  -0.884  -0.854   9.324
  232   1HD1  LEU  29          HD11      LEU  29   0.851  -0.333  10.656
  233   2HD1  LEU  29          HD12      LEU  29   0.290   1.336  10.920
  234   3HD1  LEU  29          HD13      LEU  29  -0.421  -0.000  11.858
  235   1HD2  LEU  29          HD21      LEU  29  -2.770   0.996  10.805
  236   2HD2  LEU  29          HD22      LEU  29  -3.196  -0.269   9.626
  237   3HD2  LEU  29          HD23      LEU  29  -2.505  -0.718  11.205
  238    H    ASN  30           H        ASN  30   0.713   3.206   7.883
  239    HA   ASN  30           HA       ASN  30   1.806   4.643  10.164
  240   1HB   ASN  30          HB2       ASN  30   2.933   2.701   8.424
  241   2HB   ASN  30          HB3       ASN  30   3.649   4.214   7.904
  242   1HD2  ASN  30          HD21      ASN  30   5.648   3.396   8.657
  243   2HD2  ASN  30          HD22      ASN  30   6.085   3.458  10.332
  244    H    SER  31           H        SER  31   2.416   6.858   9.883
  245    HA   SER  31           HA       SER  31   2.681   7.984   7.326
  246   1HB   SER  31          HB2       SER  31   0.022   7.762   8.128
  247   2HB   SER  31          HB3       SER  31   0.429   9.388   8.635
  248    HG   SER  31           HG       SER  31   1.473   9.130   6.182
  249    H    SER  32           H        SER  32   4.631   8.154   8.970
  250    HA   SER  32           HA       SER  32   4.229  10.332  10.821
  251   1HB   SER  32          HB2       SER  32   6.741   9.755  11.325
  252   2HB   SER  32          HB3       SER  32   5.485   8.662  11.870
  253    HG   SER  32           HG       SER  32   6.725   7.223  10.833
  254    H    GLU  33           H        GLU  33   4.395  10.405   7.683
  255    HA   GLU  33           HA       GLU  33   5.097  11.805   6.180
  256   1HB   GLU  33          HB2       GLU  33   5.548  13.313   8.680
  257   2HB   GLU  33          HB3       GLU  33   6.586  13.841   7.372
  258   1HG   GLU  33          HG2       GLU  33   4.365  13.786   5.928
  259   2HG   GLU  33          HG3       GLU  33   3.556  13.815   7.483
  260    HE2  GLU  33           HE2      GLU  33   6.523  16.010   7.268
  261    H    GLY  34           H        GLY  34   6.515   9.822   5.723
  262   1HA   GLY  34          HA3       GLY  34   9.369  10.541   6.037
  263   2HA   GLY  34          HA2       GLY  34   8.758   8.899   6.064
  264    H    ASP  35           H        ASP  35   8.724   7.759   4.164
  265    HA   ASP  35           HA       ASP  35   8.761   9.355   1.727
  266   1HB   ASP  35          HB2       ASP  35  10.354   6.816   2.319
  267   2HB   ASP  35          HB3       ASP  35  10.281   7.593   0.750
  268    HD2  ASP  35           HD2      ASP  35  10.533  10.102   1.421
  269    H    TRP  36           H        TRP  36   8.823   5.816   2.603
  270    HA   TRP  36           HA       TRP  36   6.605   5.362   0.790
  271   1HB   TRP  36          HB2       TRP  36   8.155   3.336   2.402
  272   2HB   TRP  36          HB3       TRP  36   7.114   3.041   1.025
  273    HD1  TRP  36           HD1      TRP  36   8.143   3.685  -1.439
  274    HE1  TRP  36           HE1      TRP  36  10.591   3.995  -2.378
  275    HE3  TRP  36           HE3      TRP  36  10.385   4.181   3.098
  276    HZ2  TRP  36           HZ2      TRP  36  13.131   4.404  -1.145
  277    HZ3  TRP  36           HZ3      TRP  36  12.852   4.533   3.142
  278    HH2  TRP  36           HH2      TRP  36  14.217   4.646   1.119
  279    H    TRP  37           H        TRP  37   4.624   4.299   1.509
  280    HA   TRP  37           HA       TRP  37   4.124   4.746   4.374
  281   1HB   TRP  37          HB2       TRP  37   2.463   5.243   1.936
  282   2HB   TRP  37          HB3       TRP  37   1.667   4.817   3.438
  283    HD1  TRP  37           HD1      TRP  37   4.001   6.582   5.184
  284    HE1  TRP  37           HE1      TRP  37   3.707   9.196   5.389
  285    HE3  TRP  37           HE3      TRP  37   0.872   7.069   1.205
  286    HZ2  TRP  37           HZ2      TRP  37   2.231  11.131   3.898
  287    HZ3  TRP  37           HZ3      TRP  37   0.050   9.356   0.647
  288    HH2  TRP  37           HH2      TRP  37   0.681  11.345   1.920
  289    H    GLU  38           H        GLU  38   1.992   3.272   4.928
  290    HA   GLU  38           HA       GLU  38   2.854   0.608   4.181
  291   1HB   GLU  38          HB2       GLU  38   1.388   1.792   6.531
  292   2HB   GLU  38          HB3       GLU  38   1.090   0.109   6.141
  293   1HG   GLU  38          HG2       GLU  38   3.677  -0.166   6.085
  294   2HG   GLU  38          HG3       GLU  38   3.751   1.413   6.843
  295    HE2  GLU  38           HE2      GLU  38   3.151  -1.642   9.146
  296    H    ALA  39           H        ALA  39   1.286  -1.031   3.520
  297    HA   ALA  39           HA       ALA  39  -1.225   0.129   2.527
  298   1HB   ALA  39          HB1       ALA  39  -0.465  -0.250   0.444
  299   2HB   ALA  39          HB2       ALA  39   0.996  -1.053   1.066
  300   3HB   ALA  39          HB3       ALA  39  -0.496  -1.990   0.817
  301    H    ARG  40           H        ARG  40  -2.553  -0.661   4.164
  302    HA   ARG  40           HA       ARG  40  -2.259  -3.450   4.825
  303   1HB   ARG  40          HB2       ARG  40  -3.498  -1.048   6.089
  304   2HB   ARG  40          HB3       ARG  40  -4.405  -2.530   6.322
  305   1HG   ARG  40          HG2       ARG  40  -1.442  -2.718   6.744
  306   2HG   ARG  40          HG3       ARG  40  -2.329  -1.776   7.926
  307   1HD   ARG  40          HD2       ARG  40  -3.417  -4.488   7.145
  308   2HD   ARG  40          HD3       ARG  40  -2.030  -4.424   8.215
  309    HE   ARG  40           HE       ARG  40  -4.511  -2.867   8.851
  310   1HH1  ARG  40          HH22      ARG  40  -2.077  -5.274   9.762
  311   2HH1  ARG  40          HH21      ARG  40  -2.647  -5.416  11.391
  312   1HH2  ARG  40          HH11      ARG  40  -4.521  -4.100  12.098
  313    H    SER  41           H        SER  41  -3.391  -4.922   3.597
  314    HA   SER  41           HA       SER  41  -5.652  -3.984   2.105
  315   1HB   SER  41          HB2       SER  41  -3.897  -6.414   2.109
  316   2HB   SER  41          HB3       SER  41  -5.535  -6.641   1.527
  317    HG   SER  41           HG       SER  41  -4.783  -5.867  -0.322
  318    H    LEU  42           H        LEU  42  -7.814  -4.869   2.288
  319    HA   LEU  42           HA       LEU  42  -8.341  -5.906   4.962
  320   1HB   LEU  42          HB2       LEU  42  -9.503  -3.905   3.443
  321   2HB   LEU  42          HB3       LEU  42 -10.632  -5.235   3.284
  322    HG   LEU  42           HG       LEU  42 -10.334  -5.345   5.930
  323   1HD1  LEU  42          HD11      LEU  42 -10.258  -2.400   5.812
  324   2HD1  LEU  42          HD12      LEU  42  -9.550  -3.530   6.992
  325   3HD1  LEU  42          HD13      LEU  42  -8.713  -3.208   5.455
  326   1HD2  LEU  42          HD21      LEU  42 -12.356  -4.761   4.327
  327   2HD2  LEU  42          HD22      LEU  42 -12.443  -4.478   6.082
  328   3HD2  LEU  42          HD23      LEU  42 -12.093  -3.125   4.980
  329    H    THR  43           H        THR  43  -7.722  -7.043   1.854
  330    HA   THR  43           HA       THR  43  -9.639  -9.242   2.057
  331    HB   THR  43           HB       THR  43  -7.704  -9.072  -0.213
  332    HG1  THR  43           HG1      THR  43  -9.749  -7.228  -0.515
  333   1HG2  THR  43          HG21      THR  43  -9.539 -10.441  -0.753
  334   2HG2  THR  43          HG22      THR  43 -10.667  -9.487   0.239
  335   3HG2  THR  43          HG23      THR  43 -10.133  -8.871  -1.343
  336    H    THR  44           H        THR  44  -6.137  -9.036   1.142
  337    HA   THR  44           HA       THR  44  -5.693 -11.687   2.071
  338    HB   THR  44           HB       THR  44  -3.535  -9.613   1.550
  339    HG1  THR  44           HG1      THR  44  -5.025  -9.264  -0.153
  340   1HG2  THR  44          HG21      THR  44  -3.755 -12.305   0.211
  341   2HG2  THR  44          HG22      THR  44  -2.301 -11.430   0.749
  342   3HG2  THR  44          HG23      THR  44  -3.314 -12.288   1.935
  343    H    GLY  45           H        GLY  45  -5.208  -8.413   3.448
  344   1HA   GLY  45          HA3       GLY  45  -5.079  -7.856   5.650
  345   2HA   GLY  45          HA2       GLY  45  -5.122  -9.552   6.093
  346    H    GLU  46           H        GLU  46  -2.811  -8.638   3.609
  347    HA   GLU  46           HA       GLU  46  -0.710  -9.115   5.547
  348   1HB   GLU  46          HB2       GLU  46  -0.860 -10.489   3.422
  349   2HB   GLU  46          HB3       GLU  46  -0.526  -9.034   2.505
  350   1HG   GLU  46          HG2       GLU  46   1.669  -9.622   2.741
  351   2HG   GLU  46          HG3       GLU  46   1.521  -8.949   4.352
  352    HE2  GLU  46           HE2      GLU  46   3.132 -11.191   3.505
  353    H    THR  47           H        THR  47   1.297  -7.758   5.438
  354    HA   THR  47           HA       THR  47   0.658  -5.021   4.547
  355    HB   THR  47           HB       THR  47   2.069  -4.340   6.554
  356    HG1  THR  47           HG1      THR  47   2.442  -7.074   6.385
  357   1HG2  THR  47          HG21      THR  47  -0.606  -5.433   6.595
  358   2HG2  THR  47          HG22      THR  47   0.238  -5.987   8.061
  359   3HG2  THR  47          HG23      THR  47   0.106  -4.246   7.714
  360    H    GLY  48           H        GLY  48   2.820  -3.676   4.420
  361   1HA   GLY  48          HA3       GLY  48   5.265  -4.771   3.884
  362   2HA   GLY  48          HA2       GLY  48   4.376  -4.970   2.388
  363    H    TYR  49           H        TYR  49   5.958  -3.451   1.426
  364    HA   TYR  49           HA       TYR  49   5.569  -0.677   2.289
  365   1HB   TYR  49          HB2       TYR  49   7.646  -2.392   0.898
  366   2HB   TYR  49          HB3       TYR  49   7.560  -0.724   0.366
  367    HD1  TYR  49           HD1      TYR  49   9.438  -2.732   2.320
  368    HD2  TYR  49           HD2      TYR  49   7.180   0.884   2.688
  369    HE1  TYR  49           HE1      TYR  49  10.879  -2.023   4.291
  370    HE2  TYR  49           HE2      TYR  49   8.629   1.580   4.657
  371    HH   TYR  49           HH       TYR  49  10.952   1.095   5.440
  372    H    ILE  50           H        ILE  50   5.224   0.997   0.658
  373    HA   ILE  50           HA       ILE  50   4.430   0.092  -1.967
  374    HB   ILE  50           HB       ILE  50   2.381  -0.306  -0.892
  375   1HG1  ILE  50          HG12      ILE  50   1.750   2.444  -1.844
  376   2HG1  ILE  50          HG13      ILE  50   2.582   1.393  -2.974
  377   1HG2  ILE  50          HG21      ILE  50   1.703   2.240   0.259
  378   2HG2  ILE  50          HG22      ILE  50   1.776   0.634   1.023
  379   3HG2  ILE  50          HG23      ILE  50   3.234   1.652   0.952
  380   1HD1  ILE  50          HD11      ILE  50   0.521  -0.161  -1.688
  381   2HD1  ILE  50          HD12      ILE  50  -0.195   1.367  -2.255
  382   3HD1  ILE  50          HD13      ILE  50   0.650   0.301  -3.402
  383    HA   PRO  51           HA       PRO  51   6.044   4.046  -2.706
  384   1HB   PRO  51          HB2       PRO  51   5.757   4.122  -5.423
  385   2HB   PRO  51          HB3       PRO  51   7.081   3.300  -4.621
  386   1HG   PRO  51          HG2       PRO  51   4.690   2.138  -5.916
  387   2HG   PRO  51          HG3       PRO  51   6.201   1.356  -5.498
  388   1HD   PRO  51          HD2       PRO  51   3.710   1.141  -4.092
  389   2HD   PRO  51          HD3       PRO  51   5.248   0.452  -3.611
  390    H    SER  52           H        SER  52   5.461   6.159  -2.645
  391    HA   SER  52           HA       SER  52   2.615   6.498  -3.019
  392   1HB   SER  52          HB2       SER  52   4.475   7.457  -1.120
  393   2HB   SER  52          HB3       SER  52   4.071   8.863  -2.085
  394    HG   SER  52           HG       SER  52   1.961   8.770  -1.455
  395    H    ASN  53           H        ASN  53   4.724   6.263  -5.240
  396    HA   ASN  53           HA       ASN  53   4.584   8.938  -6.331
  397   1HB   ASN  53          HB2       ASN  53   6.253   6.486  -6.810
  398   2HB   ASN  53          HB3       ASN  53   5.920   7.459  -8.229
  399   1HD2  ASN  53          HD21      ASN  53   7.392   7.346  -5.070
  400   2HD2  ASN  53          HD22      ASN  53   8.382   8.760  -5.203
  401    H    TYR  54           H        TYR  54   2.917   5.934  -6.318
  402    HA   TYR  54           HA       TYR  54   1.493   6.685  -8.765
  403   1HB   TYR  54          HB2       TYR  54   2.939   4.133  -7.948
  404   2HB   TYR  54          HB3       TYR  54   1.449   3.947  -8.851
  405    HD1  TYR  54           HD1      TYR  54   4.958   4.442  -9.087
  406    HD2  TYR  54           HD2      TYR  54   1.279   5.287 -11.101
  407    HE1  TYR  54           HE1      TYR  54   6.224   4.806 -11.262
  408    HE2  TYR  54           HE2      TYR  54   2.557   5.648 -13.269
  409    HH   TYR  54           HH       TYR  54   4.765   6.244 -13.976
  410    H    VAL  55           H        VAL  55   0.619   7.371  -6.212
  411    HA   VAL  55           HA       VAL  55  -1.480   5.365  -5.752
  412    HB   VAL  55           HB       VAL  55  -1.515   6.140  -3.428
  413   1HG1  VAL  55          HG11      VAL  55  -0.262   4.229  -3.493
  414   2HG1  VAL  55          HG12      VAL  55   0.906   4.897  -4.659
  415   3HG1  VAL  55          HG13      VAL  55   0.997   5.360  -2.943
  416   1HG2  VAL  55          HG21      VAL  55   1.063   7.631  -3.937
  417   2HG2  VAL  55          HG22      VAL  55  -0.520   8.438  -4.053
  418   3HG2  VAL  55          HG23      VAL  55  -0.010   7.695  -2.518
  419    H    ALA  56           H        ALA  56  -3.255   6.808  -4.247
  420    HA   ALA  56           HA       ALA  56  -3.732   9.286  -5.713
  421   1HB   ALA  56          HB1       ALA  56  -4.955   6.946  -6.487
  422   2HB   ALA  56          HB2       ALA  56  -6.131   7.601  -5.321
  423   3HB   ALA  56          HB3       ALA  56  -5.633   8.574  -6.726
  424    HA   PRO  57           HA       PRO  57  -4.720   9.884  -1.429
  425   1HB   PRO  57          HB2       PRO  57  -2.993  11.932  -0.891
  426   2HB   PRO  57          HB3       PRO  57  -2.581  10.245  -0.655
  427   1HG   PRO  57          HG2       PRO  57  -1.711  12.084  -2.800
  428   2HG   PRO  57          HG3       PRO  57  -1.001  10.560  -2.304
  429   1HD   PRO  57          HD2       PRO  57  -2.634  11.022  -4.617
  430   2HD   PRO  57          HD3       PRO  57  -2.020   9.479  -4.058
  431    H    VAL  58           H        VAL  58  -6.837  10.450  -2.136
  432    HA   VAL  58           HA       VAL  58  -7.051  13.360  -2.479
  433    HB   VAL  58           HB       VAL  58  -9.214  12.833  -3.579
  434   1HG1  VAL  58          HG11      VAL  58  -8.227  12.052  -5.701
  435   2HG1  VAL  58          HG12      VAL  58  -7.214  13.284  -4.910
  436   3HG1  VAL  58          HG13      VAL  58  -6.752  11.567  -4.829
  437   1HG2  VAL  58          HG21      VAL  58  -9.859  10.728  -2.765
  438   2HG2  VAL  58          HG22      VAL  58  -9.384  10.410  -4.451
  439   3HG2  VAL  58          HG23      VAL  58  -8.274   9.999  -3.122
  440    H    ASP  59           H        ASP  59  -9.776  13.655  -1.929
  441    HA   ASP  59           HA       ASP  59  -9.893  12.715   0.829
  442   1HB   ASP  59          HB2       ASP  59  -9.900  15.413  -0.240
  443   2HB   ASP  59          HB3       ASP  59 -11.458  15.107   0.501
  444    HD2  ASP  59           HD2      ASP  59  -9.030  13.760   2.963
  Start of MODEL    5
    1   1H    VAL   1           H        VAL   1 -13.472  10.480   3.957
    2    HA   VAL   1           HA       VAL   1 -12.444   8.294   4.186
    3    HB   VAL   1           HB       VAL   1 -12.360   9.043   1.278
    4   1HG1  VAL   1          HG11      VAL   1 -12.772   6.860   0.885
    5   2HG1  VAL   1          HG12      VAL   1 -12.189   6.629   2.551
    6   3HG1  VAL   1          HG13      VAL   1 -13.936   6.731   2.225
    7   1HG2  VAL   1          HG21      VAL   1 -14.308  10.148   1.568
    8   2HG2  VAL   1          HG22      VAL   1 -15.006   8.515   1.687
    9   3HG2  VAL   1          HG23      VAL   1 -14.605   9.421   3.166
   10    H    THR   2           H        THR   2 -10.586   7.034   4.119
   11    HA   THR   2           HA       THR   2  -8.194   8.384   3.050
   12    HB   THR   2           HB       THR   2  -7.973   6.501   5.381
   13    HG1  THR   2           HG1      THR   2  -8.640   8.446   6.706
   14   1HG2  THR   2          HG21      THR   2  -6.348   8.161   6.149
   15   2HG2  THR   2          HG22      THR   2  -6.030   7.867   4.421
   16   3HG2  THR   2          HG23      THR   2  -6.903   9.333   4.930
   17    H    LEU   3           H        LEU   3 -10.205   6.346   1.929
   18    HA   LEU   3           HA       LEU   3  -8.602   3.961   1.773
   19   1HB   LEU   3          HB2       LEU   3 -11.319   4.817   1.042
   20   2HB   LEU   3          HB3       LEU   3 -10.587   3.695  -0.086
   21    HG   LEU   3           HG       LEU   3 -10.243   2.057   1.674
   22   1HD1  LEU   3          HD11      LEU   3 -11.600   3.942   3.612
   23   2HD1  LEU   3          HD12      LEU   3 -10.839   2.368   3.951
   24   3HD1  LEU   3          HD13      LEU   3  -9.833   3.761   3.486
   25   1HD2  LEU   3          HD21      LEU   3 -12.367   1.992   0.514
   26   2HD2  LEU   3          HD22      LEU   3 -12.598   1.554   2.223
   27   3HD2  LEU   3          HD23      LEU   3 -13.060   3.175   1.650
   28    H    PHE   4           H        PHE   4  -6.789   3.946   0.558
   29    HA   PHE   4           HA       PHE   4  -6.369   5.836  -1.495
   30   1HB   PHE   4          HB2       PHE   4  -5.075   3.358  -0.315
   31   2HB   PHE   4          HB3       PHE   4  -4.498   3.863  -1.891
   32    HD1  PHE   4           HD1      PHE   4  -4.839   4.896   1.633
   33    HD2  PHE   4           HD2      PHE   4  -3.091   5.770  -2.134
   34    HE1  PHE   4           HE1      PHE   4  -3.325   6.574   2.724
   35    HE2  PHE   4           HE2      PHE   4  -1.577   7.448  -1.043
   36    HZ   PHE   4           HZ       PHE   4  -1.712   7.831   1.374
   37    H    VAL   5           H        VAL   5  -6.563   5.684  -3.723
   38    HA   VAL   5           HA       VAL   5  -8.030   3.344  -4.663
   39    HB   VAL   5           HB       VAL   5  -7.507   6.019  -5.973
   40   1HG1  VAL   5          HG11      VAL   5  -8.892   3.537  -6.829
   41   2HG1  VAL   5          HG12      VAL   5  -9.754   5.062  -7.146
   42   3HG1  VAL   5          HG13      VAL   5  -8.116   4.814  -7.795
   43   1HG2  VAL   5          HG21      VAL   5  -9.503   6.829  -5.136
   44   2HG2  VAL   5          HG22      VAL   5 -10.173   5.204  -4.855
   45   3HG2  VAL   5          HG23      VAL   5  -8.928   5.854  -3.762
   46    H    ALA   6           H        ALA   6  -6.883   1.707  -5.540
   47    HA   ALA   6           HA       ALA   6  -4.194   2.237  -6.462
   48   1HB   ALA   6          HB1       ALA   6  -5.461  -0.452  -6.733
   49   2HB   ALA   6          HB2       ALA   6  -3.853  -0.002  -6.118
   50   3HB   ALA   6          HB3       ALA   6  -5.287   0.187  -5.081
   51    H    LEU   7           H        LEU   7  -3.523   2.284  -8.588
   52    HA   LEU   7           HA       LEU   7  -5.668   1.957 -10.567
   53   1HB   LEU   7          HB2       LEU   7  -4.264   4.204 -10.033
   54   2HB   LEU   7          HB3       LEU   7  -3.229   3.486 -11.250
   55    HG   LEU   7           HG       LEU   7  -5.895   3.313 -12.228
   56   1HD1  LEU   7          HD11      LEU   7  -6.928   5.295 -11.901
   57   2HD1  LEU   7          HD12      LEU   7  -5.983   5.277 -10.392
   58   3HD1  LEU   7          HD13      LEU   7  -5.401   6.205 -11.795
   59   1HD2  LEU   7          HD21      LEU   7  -4.532   5.398 -13.553
   60   2HD2  LEU   7          HD22      LEU   7  -3.293   4.225 -13.045
   61   3HD2  LEU   7          HD23      LEU   7  -4.672   3.690 -14.037
   62    H    TYR   8           H        TYR   8  -2.093   1.585 -10.044
   63    HA   TYR   8           HA       TYR   8  -2.250  -0.750 -11.832
   64   1HB   TYR   8          HB2       TYR   8  -0.749   1.753 -11.917
   65   2HB   TYR   8          HB3       TYR   8   0.399   0.470 -11.593
   66    HD1  TYR   8           HD1      TYR   8   0.172  -1.660 -13.178
   67    HD2  TYR   8           HD2      TYR   8  -1.269   2.254 -14.130
   68    HE1  TYR   8           HE1      TYR   8   0.216  -2.238 -15.654
   69    HE2  TYR   8           HE2      TYR   8  -1.219   1.664 -16.602
   70    HH   TYR   8           HH       TYR   8  -0.828   0.145 -18.079
   71    H    ASP   9           H        ASP   9  -0.371  -2.316 -11.448
   72    HA   ASP   9           HA       ASP   9  -0.075  -2.549  -8.572
   73   1HB   ASP   9          HB2       ASP   9   0.909  -4.902  -9.648
   74   2HB   ASP   9          HB3       ASP   9  -0.737  -4.666  -9.096
   75    HD2  ASP   9           HD2      ASP   9  -0.316  -3.662 -12.831
   76    H    TYR  10           H        TYR  10   2.183  -4.198  -8.383
   77    HA   TYR  10           HA       TYR  10   4.300  -2.904  -9.921
   78   1HB   TYR  10          HB2       TYR  10   3.533  -2.137  -7.325
   79   2HB   TYR  10          HB3       TYR  10   4.749  -3.350  -6.982
   80    HD1  TYR  10           HD1      TYR  10   4.351  -0.463  -9.362
   81    HD2  TYR  10           HD2      TYR  10   6.878  -2.534  -6.601
   82    HE1  TYR  10           HE1      TYR  10   6.183   1.260  -9.734
   83    HE2  TYR  10           HE2      TYR  10   8.701  -0.804  -6.982
   84    HH   TYR  10           HH       TYR  10   9.347   0.758  -8.795
   85    H    GLU  11           H        GLU  11   6.498  -4.019  -9.348
   86    HA   GLU  11           HA       GLU  11   5.916  -6.854  -8.971
   87   1HB   GLU  11          HB2       GLU  11   7.596  -5.407 -10.985
   88   2HB   GLU  11          HB3       GLU  11   8.239  -6.920 -10.380
   89   1HG   GLU  11          HG2       GLU  11   6.925  -7.907 -11.963
   90   2HG   GLU  11          HG3       GLU  11   5.602  -7.615 -10.851
   91    HE2  GLU  11           HE2      GLU  11   3.997  -5.627 -12.975
   92    H    ALA  12           H        ALA  12   6.904  -7.805  -7.236
   93    HA   ALA  12           HA       ALA  12   9.479  -6.789  -6.373
   94   1HB   ALA  12          HB1       ALA  12   8.819  -6.169  -4.210
   95   2HB   ALA  12          HB2       ALA  12   7.499  -5.528  -5.218
   96   3HB   ALA  12          HB3       ALA  12   7.277  -7.049  -4.320
   97    H    ARG  13           H        ARG  13  10.457  -8.289  -4.707
   98    HA   ARG  13           HA       ARG  13   9.162 -10.816  -4.470
   99   1HB   ARG  13          HB2       ARG  13  10.463 -10.759  -6.743
  100   2HB   ARG  13          HB3       ARG  13  11.921 -10.784  -5.770
  101   1HG   ARG  13          HG2       ARG  13  10.770 -12.856  -4.576
  102   2HG   ARG  13          HG3       ARG  13   9.778 -12.914  -6.018
  103   1HD   ARG  13          HD2       ARG  13  11.928 -12.940  -7.403
  104   2HD   ARG  13          HD3       ARG  13  12.827 -13.085  -5.906
  105    HE   ARG  13           HE       ARG  13  11.924 -15.287  -5.574
  106   1HH1  ARG  13          HH22      ARG  13  10.740 -13.794  -8.561
  107   2HH1  ARG  13          HH21      ARG  13  10.171 -15.288  -9.229
  108   1HH2  ARG  13          HH11      ARG  13  10.437 -17.311  -7.972
  109    H    THR  14           H        THR  14   9.751  -9.004  -2.467
  110    HA   THR  14           HA       THR  14  12.165 -10.142  -1.215
  111    HB   THR  14           HB       THR  14  11.200  -7.548  -0.180
  112    HG1  THR  14           HG1      THR  14  11.851  -6.493  -2.244
  113   1HG2  THR  14          HG21      THR  14  13.758  -7.595  -1.647
  114   2HG2  THR  14          HG22      THR  14  13.456  -7.217   0.066
  115   3HG2  THR  14          HG23      THR  14  13.658  -8.909  -0.449
  116    H    GLU  15           H        GLU  15  12.010  -9.859   1.307
  117    HA   GLU  15           HA       GLU  15   9.688 -11.357   1.997
  118   1HB   GLU  15          HB2       GLU  15  12.348 -11.003   3.019
  119   2HB   GLU  15          HB3       GLU  15  11.239 -10.583   4.310
  120   1HG   GLU  15          HG2       GLU  15  10.577 -13.057   2.743
  121   2HG   GLU  15          HG3       GLU  15  11.995 -13.146   3.770
  122    HE2  GLU  15           HE2      GLU  15  10.493 -13.943   6.313
  123    H    ASP  16           H        ASP  16  11.078  -8.106   2.740
  124    HA   ASP  16           HA       ASP  16   9.039  -7.438   4.540
  125   1HB   ASP  16          HB2       ASP  16  10.859  -5.636   2.873
  126   2HB   ASP  16          HB3       ASP  16   9.918  -5.107   4.255
  127    HD2  ASP  16           HD2      ASP  16  12.533  -7.543   3.676
  128    H    ASP  17           H        ASP  17   9.790  -6.534   1.088
  129    HA   ASP  17           HA       ASP  17   7.280  -5.212   0.832
  130   1HB   ASP  17          HB2       ASP  17   9.042  -6.004  -1.501
  131   2HB   ASP  17          HB3       ASP  17   8.042  -4.576  -1.327
  132    HD2  ASP  17           HD2      ASP  17   9.029  -4.157   1.276
  133    H    LEU  18           H        LEU  18   5.721  -5.875  -0.991
  134    HA   LEU  18           HA       LEU  18   5.925  -8.604  -1.891
  135   1HB   LEU  18          HB2       LEU  18   4.648  -8.138   0.527
  136   2HB   LEU  18          HB3       LEU  18   3.331  -8.193  -0.629
  137    HG   LEU  18           HG       LEU  18   5.218 -10.374  -1.058
  138   1HD1  LEU  18          HD11      LEU  18   4.236 -11.541   1.110
  139   2HD1  LEU  18          HD12      LEU  18   5.753 -10.609   1.149
  140   3HD1  LEU  18          HD13      LEU  18   4.237  -9.867   1.717
  141   1HD2  LEU  18          HD21      LEU  18   2.248 -10.144  -0.546
  142   2HD2  LEU  18          HD22      LEU  18   3.087 -10.465  -2.083
  143   3HD2  LEU  18          HD23      LEU  18   3.077 -11.700  -0.800
  144    H    SER  19           H        SER  19   4.347  -9.078  -3.594
  145    HA   SER  19           HA       SER  19   3.916  -6.789  -5.162
  146   1HB   SER  19          HB2       SER  19   2.563  -9.437  -5.710
  147   2HB   SER  19          HB3       SER  19   3.237  -8.291  -6.852
  148    HG   SER  19           HG       SER  19   5.273  -9.070  -5.265
  149    H    PHE  20           H        PHE  20   1.746  -6.131  -6.077
  150    HA   PHE  20           HA       PHE  20  -0.485  -6.807  -4.327
  151   1HB   PHE  20          HB2       PHE  20   0.900  -4.157  -4.815
  152   2HB   PHE  20          HB3       PHE  20  -0.850  -4.108  -4.738
  153    HD1  PHE  20           HD1      PHE  20  -1.824  -5.520  -2.645
  154    HD2  PHE  20           HD2      PHE  20   2.026  -3.748  -2.854
  155    HE1  PHE  20           HE1      PHE  20  -1.713  -5.468  -0.138
  156    HE2  PHE  20           HE2      PHE  20   2.138  -3.695  -0.347
  157    HZ   PHE  20           HZ       PHE  20   0.267  -4.555   0.982
  158    H    HIS  21           H        HIS  21  -2.575  -5.628  -5.279
  159    HA   HIS  21           HA       HIS  21  -2.377  -5.569  -8.187
  160   1HB   HIS  21          HB2       HIS  21  -3.594  -7.664  -6.631
  161   2HB   HIS  21          HB3       HIS  21  -4.838  -6.823  -7.533
  162    HD1  HIS  21           HD1      HIS  21  -3.364  -9.783  -7.992
  163    HD2  HIS  21           HD2      HIS  21  -3.133  -6.316 -10.342
  164    HE1  HIS  21           HE1      HIS  21  -2.700 -10.550 -10.333
  165    H    LYS  22           H        LYS  22  -4.155  -4.376  -9.216
  166    HA   LYS  22           HA       LYS  22  -4.954  -2.177  -7.560
  167   1HB   LYS  22          HB2       LYS  22  -5.955  -1.357  -9.724
  168   2HB   LYS  22          HB3       LYS  22  -4.225  -1.625  -9.741
  169   1HG   LYS  22          HG2       LYS  22  -4.374  -3.476 -11.147
  170   2HG   LYS  22          HG3       LYS  22  -5.944  -3.957 -10.533
  171   1HD   LYS  22          HD2       LYS  22  -7.087  -2.275 -11.825
  172   2HD   LYS  22          HD3       LYS  22  -5.600  -1.416 -12.174
  173   1HE   LYS  22          HE2       LYS  22  -4.991  -3.890 -13.214
  174   2HE   LYS  22          HE3       LYS  22  -6.725  -3.864 -13.467
  175   1HZ   LYS  22          HZ1       LYS  22  -4.943  -2.673 -15.104
  176   2HZ   LYS  22          HZ2       LYS  22  -6.516  -2.256 -15.032
  177    H    GLY  23           H        GLY  23  -7.188  -1.463  -7.269
  178   1HA   GLY  23          HA3       GLY  23  -9.516  -1.919  -7.454
  179   2HA   GLY  23          HA2       GLY  23  -9.167  -3.635  -7.536
  180    H    GLU  24           H        GLU  24  -7.001  -3.262  -5.353
  181    HA   GLU  24           HA       GLU  24  -8.825  -3.686  -3.201
  182   1HB   GLU  24          HB2       GLU  24  -5.775  -3.726  -3.287
  183   2HB   GLU  24          HB3       GLU  24  -6.741  -4.230  -1.915
  184   1HG   GLU  24          HG2       GLU  24  -7.864  -5.954  -3.378
  185   2HG   GLU  24          HG3       GLU  24  -6.820  -5.479  -4.703
  186    HE2  GLU  24           HE2      GLU  24  -5.520  -5.583  -1.471
  187    H    LYS  25           H        LYS  25  -8.629  -2.552  -1.078
  188    HA   LYS  25           HA       LYS  25  -7.955   0.262  -1.533
  189   1HB   LYS  25          HB2       LYS  25  -9.545  -0.481   0.845
  190   2HB   LYS  25          HB3       LYS  25  -9.748   0.844  -0.283
  191   1HG   LYS  25          HG2       LYS  25 -11.296  -0.311  -1.476
  192   2HG   LYS  25          HG3       LYS  25 -10.215  -1.677  -1.665
  193   1HD   LYS  25          HD2       LYS  25 -10.855  -2.182   0.865
  194   2HD   LYS  25          HD3       LYS  25 -12.233  -1.152   0.533
  195   1HE   LYS  25          HE2       LYS  25 -11.470  -3.731  -0.904
  196   2HE   LYS  25          HE3       LYS  25 -12.901  -3.442   0.067
  197   1HZ   LYS  25          HZ1       LYS  25 -13.818  -2.964  -1.938
  198   2HZ   LYS  25          HZ2       LYS  25 -13.107  -1.506  -1.795
  199    H    PHE  26           H        PHE  26  -6.415   1.292  -0.305
  200    HA   PHE  26           HA       PHE  26  -5.142  -0.383   1.745
  201   1HB   PHE  26          HB2       PHE  26  -3.964   1.822  -0.048
  202   2HB   PHE  26          HB3       PHE  26  -3.045   0.790   1.029
  203    HD1  PHE  26           HD1      PHE  26  -3.819  -1.874   0.513
  204    HD2  PHE  26           HD2      PHE  26  -3.548   1.332  -2.253
  205    HE1  PHE  26           HE1      PHE  26  -3.471  -3.515  -1.355
  206    HE2  PHE  26           HE2      PHE  26  -3.201  -0.309  -4.121
  207    HZ   PHE  26           HZ       PHE  26  -3.168  -2.712  -3.649
  208    H    GLN  27           H        GLN  27  -5.265   0.421   3.784
  209    HA   GLN  27           HA       GLN  27  -6.103   3.169   4.049
  210   1HB   GLN  27          HB2       GLN  27  -6.292   0.697   5.674
  211   2HB   GLN  27          HB3       GLN  27  -5.944   2.132   6.619
  212   1HG   GLN  27          HG2       GLN  27  -8.056   2.933   6.353
  213   2HG   GLN  27          HG3       GLN  27  -8.003   2.702   4.617
  214   1HE2  GLN  27          HE21      GLN  27  -8.426   1.023   7.703
  215   2HE2  GLN  27          HE22      GLN  27  -9.493  -0.221   7.144
  216    H    ILE  28           H        ILE  28  -5.056   3.811   6.595
  217    HA   ILE  28           HA       ILE  28  -2.180   3.881   5.997
  218    HB   ILE  28           HB       ILE  28  -2.164   6.037   7.195
  219   1HG1  ILE  28          HG12      ILE  28  -5.185   5.970   7.043
  220   2HG1  ILE  28          HG13      ILE  28  -4.300   5.527   8.490
  221   1HG2  ILE  28          HG21      ILE  28  -3.378   5.484   4.596
  222   2HG2  ILE  28          HG22      ILE  28  -3.879   7.049   5.279
  223   3HG2  ILE  28          HG23      ILE  28  -2.151   6.686   5.063
  224   1HD1  ILE  28          HD11      ILE  28  -3.279   8.043   7.403
  225   2HD1  ILE  28          HD12      ILE  28  -5.033   8.133   7.692
  226   3HD1  ILE  28          HD13      ILE  28  -3.933   7.699   9.022
  227    H    LEU  29           H        LEU  29  -0.736   3.942   7.913
  228    HA   LEU  29           HA       LEU  29  -1.896   3.133  10.414
  229   1HB   LEU  29          HB2       LEU  29  -1.716   1.062   8.902
  230   2HB   LEU  29          HB3       LEU  29   0.017   1.210   9.115
  231    HG   LEU  29           HG       LEU  29  -0.488   1.175  11.655
  232   1HD1  LEU  29          HD11      LEU  29  -2.570  -0.265  12.107
  233   2HD1  LEU  29          HD12      LEU  29  -2.799   1.472  11.798
  234   3HD1  LEU  29          HD13      LEU  29  -3.132   0.289  10.511
  235   1HD2  LEU  29          HD21      LEU  29   0.157  -0.985  11.659
  236   2HD2  LEU  29          HD22      LEU  29  -1.144  -1.493  10.556
  237   3HD2  LEU  29          HD23      LEU  29   0.322  -0.721   9.906
  238    H    ASN  30           H        ASN  30   1.325   2.680   8.805
  239    HA   ASN  30           HA       ASN  30   2.469   4.146  11.003
  240   1HB   ASN  30          HB2       ASN  30   3.315   1.921   9.591
  241   2HB   ASN  30          HB3       ASN  30   4.220   3.179   8.773
  242   1HD2  ASN  30          HD21      ASN  30   3.930   1.219  11.527
  243   2HD2  ASN  30          HD22      ASN  30   5.225   1.862  12.480
  244    H    SER  31           H        SER  31   3.997   5.980  10.559
  245    HA   SER  31           HA       SER  31   4.147   7.004   7.928
  246   1HB   SER  31          HB2       SER  31   2.073   8.031   9.787
  247   2HB   SER  31          HB3       SER  31   3.092   9.284   9.106
  248    HG   SER  31           HG       SER  31   1.978   7.265   7.392
  249    H    SER  32           H        SER  32   6.418   6.858   8.425
  250    HA   SER  32           HA       SER  32   7.325   8.402  10.683
  251   1HB   SER  32          HB2       SER  32   9.593   7.461   9.372
  252   2HB   SER  32          HB3       SER  32   8.792   6.676  10.718
  253    HG   SER  32           HG       SER  32   7.452   5.523   9.121
  254    H    GLU  33           H        GLU  33   9.550   8.194   8.014
  255    HA   GLU  33           HA       GLU  33   9.447  11.040   7.754
  256   1HB   GLU  33          HB2       GLU  33  11.593   9.690   7.903
  257   2HB   GLU  33          HB3       GLU  33  11.245   9.047   6.310
  258   1HG   GLU  33          HG2       GLU  33  10.933  11.803   5.939
  259   2HG   GLU  33          HG3       GLU  33  12.263  11.717   7.076
  260    HE2  GLU  33           HE2      GLU  33  14.538  10.730   4.975
  261    H    GLY  34           H        GLY  34   9.853   8.529   5.168
  262   1HA   GLY  34          HA3       GLY  34   7.484   8.804   3.827
  263   2HA   GLY  34          HA2       GLY  34   8.453  10.153   3.268
  264    H    ASP  35           H        ASP  35   8.378   6.570   3.614
  265    HA   ASP  35           HA       ASP  35   9.935   6.443   1.187
  266   1HB   ASP  35          HB2       ASP  35  11.033   5.874   3.755
  267   2HB   ASP  35          HB3       ASP  35  10.735   4.311   3.022
  268    HD2  ASP  35           HD2      ASP  35  14.044   5.720   2.336
  269    H    TRP  36           H        TRP  36   9.355   3.798   3.554
  270    HA   TRP  36           HA       TRP  36   7.505   2.588   1.635
  271   1HB   TRP  36          HB2       TRP  36   9.147   1.409   3.880
  272   2HB   TRP  36          HB3       TRP  36   7.960   0.511   2.955
  273    HD1  TRP  36           HD1      TRP  36   8.680   1.416  -0.004
  274    HE1  TRP  36           HE1      TRP  36  10.932   0.748  -1.205
  275    HE3  TRP  36           HE3      TRP  36  11.291   0.493   4.261
  276    HZ2  TRP  36           HZ2      TRP  36  13.496  -0.071  -0.257
  277    HZ3  TRP  36           HZ3      TRP  36  13.664  -0.237   4.034
  278    HH2  TRP  36           HH2      TRP  36  14.769  -0.523   1.873
  279    H    TRP  37           H        TRP  37   5.432   3.274   2.082
  280    HA   TRP  37           HA       TRP  37   4.684   3.646   4.872
  281   1HB   TRP  37          HB2       TRP  37   3.523   4.468   2.232
  282   2HB   TRP  37          HB3       TRP  37   2.503   4.408   3.656
  283    HD1  TRP  37           HD1      TRP  37   4.962   5.532   5.649
  284    HE1  TRP  37           HE1      TRP  37   5.518   8.112   5.688
  285    HE3  TRP  37           HE3      TRP  37   2.830   6.597   1.156
  286    HZ2  TRP  37           HZ2      TRP  37   5.016  10.259   3.877
  287    HZ3  TRP  37           HZ3      TRP  37   2.907   8.959   0.365
  288    HH2  TRP  37           HH2      TRP  37   3.952  10.759   1.647
  289    H    GLU  38           H        GLU  38   2.770   2.543   5.740
  290    HA   GLU  38           HA       GLU  38   2.691  -0.148   4.851
  291   1HB   GLU  38          HB2       GLU  38   2.516   0.813   7.283
  292   2HB   GLU  38          HB3       GLU  38   0.823   1.065   6.909
  293   1HG   GLU  38          HG2       GLU  38   0.710  -1.089   7.781
  294   2HG   GLU  38          HG3       GLU  38   0.936  -1.472   6.085
  295    HE2  GLU  38           HE2      GLU  38   3.376  -3.511   7.440
  296    H    ALA  39           H        ALA  39   0.847  -1.311   4.024
  297    HA   ALA  39           HA       ALA  39  -1.361   0.387   3.114
  298   1HB   ALA  39          HB1       ALA  39  -1.102  -1.322   1.022
  299   2HB   ALA  39          HB2       ALA  39  -0.343   0.287   1.071
  300   3HB   ALA  39          HB3       ALA  39   0.606  -1.158   1.495
  301    H    ARG  40           H        ARG  40  -2.669  -0.476   4.800
  302    HA   ARG  40           HA       ARG  40  -2.865  -3.326   4.956
  303   1HB   ARG  40          HB2       ARG  40  -3.014  -1.563   6.914
  304   2HB   ARG  40          HB3       ARG  40  -4.675  -1.350   6.399
  305   1HG   ARG  40          HG2       ARG  40  -4.855  -3.957   6.551
  306   2HG   ARG  40          HG3       ARG  40  -3.355  -3.879   7.452
  307   1HD   ARG  40          HD2       ARG  40  -4.399  -2.356   9.116
  308   2HD   ARG  40          HD3       ARG  40  -5.888  -2.335   8.193
  309    HE   ARG  40           HE       ARG  40  -4.923  -5.009   9.023
  310   1HH1  ARG  40          HH22      ARG  40  -7.113  -2.300   9.678
  311   2HH1  ARG  40          HH21      ARG  40  -8.164  -3.234  10.690
  312   1HH2  ARG  40          HH11      ARG  40  -7.673  -5.548  11.076
  313    H    SER  41           H        SER  41  -4.769  -4.559   4.420
  314    HA   SER  41           HA       SER  41  -6.652  -3.060   2.770
  315   1HB   SER  41          HB2       SER  41  -7.018  -5.477   1.758
  316   2HB   SER  41          HB3       SER  41  -5.664  -4.499   1.231
  317    HG   SER  41           HG       SER  41  -4.535  -6.250   1.776
  318    H    LEU  42           H        LEU  42  -8.867  -3.312   3.196
  319    HA   LEU  42           HA       LEU  42  -9.489  -4.633   5.684
  320   1HB   LEU  42          HB2       LEU  42 -10.275  -2.316   4.819
  321   2HB   LEU  42          HB3       LEU  42 -11.447  -3.231   3.893
  322    HG   LEU  42           HG       LEU  42 -12.387  -4.180   5.936
  323   1HD1  LEU  42          HD11      LEU  42 -11.025  -2.452   7.850
  324   2HD1  LEU  42          HD12      LEU  42 -11.384  -4.194   7.924
  325   3HD1  LEU  42          HD13      LEU  42  -9.927  -3.620   7.078
  326   1HD2  LEU  42          HD21      LEU  42 -12.965  -1.825   7.042
  327   2HD2  LEU  42          HD22      LEU  42 -12.214  -1.233   5.540
  328   3HD2  LEU  42          HD23      LEU  42 -13.616  -2.327   5.462
  329    H    THR  43           H        THR  43  -8.688  -6.096   3.086
  330    HA   THR  43           HA       THR  43 -11.106  -7.774   2.928
  331    HB   THR  43           HB       THR  43  -9.085  -7.897   0.736
  332    HG1  THR  43           HG1      THR  43 -10.899  -5.657   0.823
  333   1HG2  THR  43          HG21      THR  43 -12.102  -7.359   0.827
  334   2HG2  THR  43          HG22      THR  43 -11.149  -7.615  -0.654
  335   3HG2  THR  43          HG23      THR  43 -11.345  -8.940   0.518
  336    H    THR  44           H        THR  44  -7.551  -8.071   2.251
  337    HA   THR  44           HA       THR  44  -7.678 -10.744   3.409
  338    HB   THR  44           HB       THR  44  -5.069  -9.958   2.422
  339    HG1  THR  44           HG1      THR  44  -7.488  -9.338   0.879
  340   1HG2  THR  44          HG21      THR  44  -6.609 -12.199   2.242
  341   2HG2  THR  44          HG22      THR  44  -7.005 -11.456   0.673
  342   3HG2  THR  44          HG23      THR  44  -5.314 -11.843   1.073
  343    H    GLY  45           H        GLY  45  -6.310  -7.504   4.014
  344   1HA   GLY  45          HA3       GLY  45  -5.772  -6.691   6.099
  345   2HA   GLY  45          HA2       GLY  45  -5.786  -8.313   6.761
  346    H    GLU  46           H        GLU  46  -4.092  -8.493   3.848
  347    HA   GLU  46           HA       GLU  46  -1.646  -8.775   5.241
  348   1HB   GLU  46          HB2       GLU  46  -2.326  -8.888   2.270
  349   2HB   GLU  46          HB3       GLU  46  -0.745  -9.272   2.922
  350   1HG   GLU  46          HG2       GLU  46  -3.036 -10.665   4.243
  351   2HG   GLU  46          HG3       GLU  46  -2.753 -11.116   2.574
  352    HE2  GLU  46           HE2      GLU  46  -1.744 -12.649   5.303
  353    H    THR  47           H        THR  47   0.078  -7.353   5.400
  354    HA   THR  47           HA       THR  47  -0.247  -4.794   3.973
  355    HB   THR  47           HB       THR  47   0.808  -3.774   5.967
  356    HG1  THR  47           HG1      THR  47   1.441  -5.273   7.668
  357   1HG2  THR  47          HG21      THR  47  -0.943  -5.561   7.520
  358   2HG2  THR  47          HG22      THR  47  -1.120  -3.818   7.203
  359   3HG2  THR  47          HG23      THR  47  -1.739  -5.003   6.028
  360    H    GLY  48           H        GLY  48   2.298  -3.742   4.566
  361   1HA   GLY  48          HA3       GLY  48   4.494  -5.307   4.126
  362   2HA   GLY  48          HA2       GLY  48   3.822  -5.063   2.526
  363    H    TYR  49           H        TYR  49   6.294  -4.028   2.868
  364    HA   TYR  49           HA       TYR  49   5.888  -1.193   3.512
  365   1HB   TYR  49          HB2       TYR  49   8.187  -3.204   3.403
  366   2HB   TYR  49          HB3       TYR  49   8.565  -1.499   3.257
  367    HD1  TYR  49           HD1      TYR  49   8.366   0.006   5.160
  368    HD2  TYR  49           HD2      TYR  49   7.302  -4.124   5.514
  369    HE1  TYR  49           HE1      TYR  49   8.350   0.218   7.694
  370    HE2  TYR  49           HE2      TYR  49   7.290  -3.896   8.046
  371    HH   TYR  49           HH       TYR  49   8.621  -2.155   9.703
  372    H    ILE  50           H        ILE  50   4.961  -0.449   1.558
  373    HA   ILE  50           HA       ILE  50   6.863  -0.429  -0.658
  374    HB   ILE  50           HB       ILE  50   4.567  -0.553  -2.035
  375   1HG1  ILE  50          HG12      ILE  50   3.489  -2.713  -0.869
  376   2HG1  ILE  50          HG13      ILE  50   4.029  -1.887   0.579
  377   1HG2  ILE  50          HG21      ILE  50   5.122  -2.979  -2.404
  378   2HG2  ILE  50          HG22      ILE  50   6.479  -1.846  -2.608
  379   3HG2  ILE  50          HG23      ILE  50   6.349  -2.822  -1.125
  380   1HD1  ILE  50          HD11      ILE  50   2.708   0.049   0.121
  381   2HD1  ILE  50          HD12      ILE  50   2.469  -0.420  -1.580
  382   3HD1  ILE  50          HD13      ILE  50   1.653  -1.327  -0.283
  383    HA   PRO  51           HA       PRO  51   5.418   3.677  -0.849
  384   1HB   PRO  51          HB2       PRO  51   6.428   4.464  -3.263
  385   2HB   PRO  51          HB3       PRO  51   7.412   4.295  -1.823
  386   1HG   PRO  51          HG2       PRO  51   7.249   2.514  -4.176
  387   2HG   PRO  51          HG3       PRO  51   8.498   2.602  -2.951
  388   1HD   PRO  51          HD2       PRO  51   6.443   0.613  -3.168
  389   2HD   PRO  51          HD3       PRO  51   7.619   0.767  -1.879
  390    H    SER  52           H        SER  52   3.728   5.026  -1.279
  391    HA   SER  52           HA       SER  52   2.053   3.986  -3.431
  392   1HB   SER  52          HB2       SER  52   0.559   5.615  -1.559
  393   2HB   SER  52          HB3       SER  52   0.306   3.938  -1.999
  394    HG   SER  52           HG       SER  52   2.046   3.396  -0.435
  395    H    ASN  53           H        ASN  53   3.811   5.604  -4.489
  396    HA   ASN  53           HA       ASN  53   2.792   8.312  -4.251
  397   1HB   ASN  53          HB2       ASN  53   5.403   7.080  -5.161
  398   2HB   ASN  53          HB3       ASN  53   4.948   8.623  -5.856
  399   1HD2  ASN  53          HD21      ASN  53   4.792   7.040  -2.663
  400   2HD2  ASN  53          HD22      ASN  53   5.462   8.344  -1.740
  401    H    TYR  54           H        TYR  54   2.418   5.478  -6.059
  402    HA   TYR  54           HA       TYR  54   2.099   6.855  -8.618
  403   1HB   TYR  54          HB2       TYR  54   2.192   3.975  -7.560
  404   2HB   TYR  54          HB3       TYR  54   1.657   4.293  -9.197
  405    HD1  TYR  54           HD1      TYR  54   3.219   4.499 -10.944
  406    HD2  TYR  54           HD2      TYR  54   4.549   4.824  -6.890
  407    HE1  TYR  54           HE1      TYR  54   5.639   4.491 -11.728
  408    HE2  TYR  54           HE2      TYR  54   6.963   4.815  -7.688
  409    HH   TYR  54           HH       TYR  54   8.294   4.800  -9.385
  410    H    VAL  55           H        VAL  55   0.287   6.367  -5.872
  411    HA   VAL  55           HA       VAL  55  -2.160   5.806  -7.389
  412    HB   VAL  55           HB       VAL  55  -3.125   5.387  -5.129
  413   1HG1  VAL  55          HG11      VAL  55  -2.048   3.190  -4.824
  414   2HG1  VAL  55          HG12      VAL  55  -2.367   3.539  -6.541
  415   3HG1  VAL  55          HG13      VAL  55  -0.716   3.700  -5.891
  416   1HG2  VAL  55          HG21      VAL  55  -1.938   6.374  -3.463
  417   2HG2  VAL  55          HG22      VAL  55  -1.085   4.812  -3.457
  418   3HG2  VAL  55          HG23      VAL  55  -0.385   6.204  -4.316
  419    H    ALA  56           H        ALA  56  -4.096   6.996  -5.902
  420    HA   ALA  56           HA       ALA  56  -3.386   9.647  -5.141
  421   1HB   ALA  56          HB1       ALA  56  -5.183   9.545  -7.552
  422   2HB   ALA  56          HB2       ALA  56  -4.159  10.873  -6.955
  423   3HB   ALA  56          HB3       ALA  56  -3.420   9.484  -7.787
  424    HA   PRO  57           HA       PRO  57  -7.160   8.789  -3.157
  425   1HB   PRO  57          HB2       PRO  57  -7.264  10.984  -1.532
  426   2HB   PRO  57          HB3       PRO  57  -6.328   9.552  -1.150
  427   1HG   PRO  57          HG2       PRO  57  -5.383  12.184  -2.110
  428   2HG   PRO  57          HG3       PRO  57  -4.470  10.908  -1.331
  429   1HD   PRO  57          HD2       PRO  57  -4.472  11.556  -4.125
  430   2HD   PRO  57          HD3       PRO  57  -3.650  10.209  -3.363
  431    H    VAL  58           H        VAL  58  -9.349   9.782  -2.603
  432    HA   VAL  58           HA       VAL  58 -10.056  11.355  -4.972
  433    HB   VAL  58           HB       VAL  58 -12.398  10.578  -4.275
  434   1HG1  VAL  58          HG11      VAL  58 -11.938   8.245  -5.268
  435   2HG1  VAL  58          HG12      VAL  58 -11.502   9.667  -6.247
  436   3HG1  VAL  58          HG13      VAL  58 -10.239   8.769  -5.370
  437   1HG2  VAL  58          HG21      VAL  58 -11.522   9.822  -1.974
  438   2HG2  VAL  58          HG22      VAL  58 -12.648   8.740  -2.829
  439   3HG2  VAL  58          HG23      VAL  58 -10.903   8.387  -2.826
  440    H    ASP  59           H        ASP  59 -12.640  12.155  -3.763
  441    HA   ASP  59           HA       ASP  59 -11.630  13.986  -1.737
  442   1HB   ASP  59          HB2       ASP  59 -12.414  14.688  -4.347
  443   2HB   ASP  59          HB3       ASP  59 -13.835  15.049  -3.387
  444    HD2  ASP  59           HD2      ASP  59 -12.836  17.934  -3.383
  Start of MODEL    6
    1   1H    VAL   1           H        VAL   1 -13.349   9.477   5.992
    2    HA   VAL   1           HA       VAL   1 -13.144   7.636   4.535
    3    HB   VAL   1           HB       VAL   1 -13.492   9.499   2.202
    4   1HG1  VAL   1          HG11      VAL   1 -14.160   7.399   1.064
    5   2HG1  VAL   1          HG12      VAL   1 -12.512   7.325   1.731
    6   3HG1  VAL   1          HG13      VAL   1 -13.850   6.505   2.572
    7   1HG2  VAL   1          HG21      VAL   1 -15.491   9.337   3.991
    8   2HG2  VAL   1          HG22      VAL   1 -15.770   9.435   2.236
    9   3HG2  VAL   1          HG23      VAL   1 -15.828   7.858   3.059
   10    H    THR   2           H        THR   2 -11.038   7.514   5.268
   11    HA   THR   2           HA       THR   2  -9.130   9.349   3.977
   12    HB   THR   2           HB       THR   2  -8.703   7.767   6.551
   13    HG1  THR   2           HG1      THR   2 -10.545   9.079   6.928
   14   1HG2  THR   2          HG21      THR   2  -7.302   9.908   5.045
   15   2HG2  THR   2          HG22      THR   2  -7.589  10.320   6.752
   16   3HG2  THR   2          HG23      THR   2  -6.682   8.847   6.333
   17    H    LEU   3           H        LEU   3 -10.256   7.005   2.661
   18    HA   LEU   3           HA       LEU   3  -7.764   5.468   2.460
   19   1HB   LEU   3          HB2       LEU   3  -9.027   3.456   2.100
   20   2HB   LEU   3          HB3       LEU   3  -9.417   4.157   3.658
   21    HG   LEU   3           HG       LEU   3 -11.235   4.984   1.492
   22   1HD1  LEU   3          HD11      LEU   3 -10.847   2.076   2.153
   23   2HD1  LEU   3          HD12      LEU   3 -12.450   2.704   1.703
   24   3HD1  LEU   3          HD13      LEU   3 -11.085   2.861   0.572
   25   1HD2  LEU   3          HD21      LEU   3 -11.367   4.197   4.367
   26   2HD2  LEU   3          HD22      LEU   3 -12.046   5.612   3.527
   27   3HD2  LEU   3          HD23      LEU   3 -12.838   4.024   3.379
   28    H    PHE   4           H        PHE   4  -6.946   5.252   0.414
   29    HA   PHE   4           HA       PHE   4  -8.651   6.318  -1.728
   30   1HB   PHE   4          HB2       PHE   4  -5.716   6.201  -2.162
   31   2HB   PHE   4          HB3       PHE   4  -6.789   7.575  -2.347
   32    HD1  PHE   4           HD1      PHE   4  -7.366   8.958  -0.341
   33    HD2  PHE   4           HD2      PHE   4  -4.384   5.942  -0.214
   34    HE1  PHE   4           HE1      PHE   4  -6.424   9.976   1.752
   35    HE2  PHE   4           HE2      PHE   4  -3.442   6.960   1.878
   36    HZ   PHE   4           HZ       PHE   4  -4.474   8.965   2.836
   37    H    VAL   5           H        VAL   5  -6.737   5.572  -3.812
   38    HA   VAL   5           HA       VAL   5  -6.391   2.728  -3.602
   39    HB   VAL   5           HB       VAL   5  -8.708   2.723  -4.132
   40   1HG1  VAL   5          HG11      VAL   5  -7.975   4.933  -6.017
   41   2HG1  VAL   5          HG12      VAL   5  -9.344   3.875  -6.435
   42   3HG1  VAL   5          HG13      VAL   5  -9.358   4.787  -4.907
   43   1HG2  VAL   5          HG21      VAL   5  -7.105   1.212  -5.428
   44   2HG2  VAL   5          HG22      VAL   5  -8.731   1.437  -6.118
   45   3HG2  VAL   5          HG23      VAL   5  -7.345   2.317  -6.803
   46    H    ALA   6           H        ALA   6  -4.835   1.981  -5.073
   47    HA   ALA   6           HA       ALA   6  -3.501   4.128  -6.533
   48   1HB   ALA   6          HB1       ALA   6  -1.546   2.928  -6.226
   49   2HB   ALA   6          HB2       ALA   6  -2.460   2.408  -4.789
   50   3HB   ALA   6          HB3       ALA   6  -2.382   1.357  -6.223
   51    H    LEU   7           H        LEU   7  -2.502   3.439  -8.710
   52    HA   LEU   7           HA       LEU   7  -4.152   1.472 -10.085
   53   1HB   LEU   7          HB2       LEU   7  -4.890   4.071 -10.189
   54   2HB   LEU   7          HB3       LEU   7  -3.759   4.024 -11.527
   55    HG   LEU   7           HG       LEU   7  -5.465   1.744 -11.760
   56   1HD1  LEU   7          HD11      LEU   7  -7.457   3.691 -12.164
   57   2HD1  LEU   7          HD12      LEU   7  -7.437   2.376 -10.965
   58   3HD1  LEU   7          HD13      LEU   7  -6.802   3.983 -10.534
   59   1HD2  LEU   7          HD21      LEU   7  -5.057   4.282 -13.347
   60   2HD2  LEU   7          HD22      LEU   7  -4.431   2.648 -13.673
   61   3HD2  LEU   7          HD23      LEU   7  -6.167   2.990 -13.866
   62    H    TYR   8           H        TYR   8  -1.578   1.039  -9.191
   63    HA   TYR   8           HA       TYR   8  -0.178   0.900 -11.735
   64   1HB   TYR   8          HB2       TYR   8   0.381   2.695  -9.465
   65   2HB   TYR   8          HB3       TYR   8   1.705   1.561  -9.639
   66    HD1  TYR   8           HD1      TYR   8   2.214   1.207 -12.394
   67    HD2  TYR   8           HD2      TYR   8   0.836   4.747 -10.427
   68    HE1  TYR   8           HE1      TYR   8   3.180   2.631 -14.266
   69    HE2  TYR   8           HE2      TYR   8   1.807   6.160 -12.305
   70    HH   TYR   8           HH       TYR   8   2.424   5.209 -15.139
   71    H    ASP   9           H        ASP   9   0.734  -1.087 -11.992
   72    HA   ASP   9           HA       ASP   9   0.627  -2.828  -9.708
   73   1HB   ASP   9          HB2       ASP   9  -0.128  -3.375 -12.148
   74   2HB   ASP   9          HB3       ASP   9   1.578  -3.529 -12.514
   75    HD2  ASP   9           HD2      ASP   9  -0.652  -6.259 -11.142
   76    H    TYR  10           H        TYR  10   2.519  -3.813  -8.779
   77    HA   TYR  10           HA       TYR  10   5.070  -2.749  -9.792
   78   1HB   TYR  10          HB2       TYR  10   3.679  -2.766  -7.214
   79   2HB   TYR  10          HB3       TYR  10   5.129  -3.737  -7.051
   80    HD1  TYR  10           HD1      TYR  10   3.991  -0.663  -6.298
   81    HD2  TYR  10           HD2      TYR  10   7.173  -2.415  -8.560
   82    HE1  TYR  10           HE1      TYR  10   5.377   1.447  -5.999
   83    HE2  TYR  10           HE2      TYR  10   8.547  -0.299  -8.253
   84    HH   TYR  10           HH       TYR  10   8.183   1.780  -6.052
   85    H    GLU  11           H        GLU  11   6.803  -4.329  -8.265
   86    HA   GLU  11           HA       GLU  11   6.073  -7.045  -8.445
   87   1HB   GLU  11          HB2       GLU  11   6.639  -6.206 -10.896
   88   2HB   GLU  11          HB3       GLU  11   8.302  -6.318 -10.355
   89   1HG   GLU  11          HG2       GLU  11   8.264  -8.557 -10.689
   90   2HG   GLU  11          HG3       GLU  11   7.004  -8.719  -9.481
   91    HE2  GLU  11           HE2      GLU  11   4.441  -8.752 -11.078
   92    H    ALA  12           H        ALA  12   7.387  -8.253  -7.076
   93    HA   ALA  12           HA       ALA  12  10.024  -7.232  -6.437
   94   1HB   ALA  12          HB1       ALA  12   7.986  -6.322  -4.900
   95   2HB   ALA  12          HB2       ALA  12   8.326  -7.857  -4.067
   96   3HB   ALA  12          HB3       ALA  12   9.616  -6.648  -4.263
   97    H    ARG  13           H        ARG  13  11.228  -8.859  -5.042
   98    HA   ARG  13           HA       ARG  13  10.034 -11.484  -5.210
   99   1HB   ARG  13          HB2       ARG  13  12.004 -10.589  -7.042
  100   2HB   ARG  13          HB3       ARG  13  12.895 -11.571  -5.896
  101   1HG   ARG  13          HG2       ARG  13  12.076 -13.465  -6.828
  102   2HG   ARG  13          HG3       ARG  13  10.433 -12.951  -6.499
  103   1HD   ARG  13          HD2       ARG  13  11.975 -11.869  -8.892
  104   2HD   ARG  13          HD3       ARG  13  11.094 -13.380  -8.987
  105    HE   ARG  13           HE       ARG  13   9.834 -10.730  -8.352
  106   1HH1  ARG  13          HH22      ARG  13   9.607 -14.024  -9.637
  107   2HH1  ARG  13          HH21      ARG  13   7.977 -13.829 -10.191
  108   1HH2  ARG  13          HH11      ARG  13   6.867 -11.731  -9.855
  109    H    THR  14           H        THR  14  10.227  -9.975  -2.883
  110    HA   THR  14           HA       THR  14  12.705 -10.763  -1.555
  111    HB   THR  14           HB       THR  14  11.933  -9.186   0.169
  112    HG1  THR  14           HG1      THR  14   9.546  -9.844  -1.229
  113   1HG2  THR  14          HG21      THR  14  12.360  -8.394  -2.514
  114   2HG2  THR  14          HG22      THR  14  10.848  -7.580  -2.044
  115   3HG2  THR  14          HG23      THR  14  12.332  -7.320  -1.095
  116    H    GLU  15           H        GLU  15  12.309 -11.454   0.874
  117    HA   GLU  15           HA       GLU  15  10.527 -13.738   0.642
  118   1HB   GLU  15          HB2       GLU  15  13.206 -13.363   1.680
  119   2HB   GLU  15          HB3       GLU  15  12.176 -13.944   2.973
  120   1HG   GLU  15          HG2       GLU  15  11.419 -15.839   1.561
  121   2HG   GLU  15          HG3       GLU  15  12.360 -15.237   0.210
  122    HE2  GLU  15           HE2      GLU  15  14.049 -17.335   3.101
  123    H    ASP  16           H        ASP  16  10.103 -10.710   1.528
  124    HA   ASP  16           HA       ASP  16   8.655 -11.460   3.943
  125   1HB   ASP  16          HB2       ASP  16  10.782  -9.787   3.997
  126   2HB   ASP  16          HB3       ASP  16   9.564  -8.618   3.527
  127    HD2  ASP  16           HD2      ASP  16   8.861 -10.519   6.957
  128    H    ASP  17           H        ASP  17   8.975  -8.472   1.882
  129    HA   ASP  17           HA       ASP  17   6.156  -8.185   1.835
  130   1HB   ASP  17          HB2       ASP  17   6.829  -6.289   0.152
  131   2HB   ASP  17          HB3       ASP  17   7.285  -6.123   1.836
  132    HD2  ASP  17           HD2      ASP  17   8.466  -6.191  -1.274
  133    H    LEU  18           H        LEU  18   5.081  -7.723  -0.455
  134    HA   LEU  18           HA       LEU  18   6.264  -9.398  -2.531
  135   1HB   LEU  18          HB2       LEU  18   3.657  -9.840  -1.143
  136   2HB   LEU  18          HB3       LEU  18   3.760 -10.170  -2.861
  137    HG   LEU  18           HG       LEU  18   5.959 -11.508  -2.007
  138   1HD1  LEU  18          HD11      LEU  18   5.118 -10.800   0.389
  139   2HD1  LEU  18          HD12      LEU  18   4.043 -12.205   0.182
  140   3HD1  LEU  18          HD13      LEU  18   5.808 -12.413   0.090
  141   1HD2  LEU  18          HD21      LEU  18   3.547 -12.125  -3.165
  142   2HD2  LEU  18          HD22      LEU  18   4.870 -13.271  -2.848
  143   3HD2  LEU  18          HD23      LEU  18   3.528 -13.119  -1.689
  144    H    SER  19           H        SER  19   3.567  -9.107  -3.969
  145    HA   SER  19           HA       SER  19   4.032  -6.335  -4.732
  146   1HB   SER  19          HB2       SER  19   4.489  -7.990  -6.512
  147   2HB   SER  19          HB3       SER  19   2.879  -8.658  -6.338
  148    HG   SER  19           HG       SER  19   3.215  -5.861  -6.912
  149    H    PHE  20           H        PHE  20   1.837  -5.472  -5.939
  150    HA   PHE  20           HA       PHE  20  -0.485  -6.341  -4.413
  151   1HB   PHE  20          HB2       PHE  20   1.118  -4.065  -3.808
  152   2HB   PHE  20          HB3       PHE  20  -0.211  -3.397  -4.736
  153    HD1  PHE  20           HD1      PHE  20   0.739  -5.045  -1.619
  154    HD2  PHE  20           HD2      PHE  20  -2.489  -3.464  -3.873
  155    HE1  PHE  20           HE1      PHE  20  -0.705  -5.070   0.434
  156    HE2  PHE  20           HE2      PHE  20  -3.935  -3.489  -1.821
  157    HZ   PHE  20           HZ       PHE  20  -3.026  -4.293   0.308
  158    H    HIS  21           H        HIS  21  -2.510  -5.840  -5.431
  159    HA   HIS  21           HA       HIS  21  -2.159  -5.046  -8.226
  160   1HB   HIS  21          HB2       HIS  21  -3.058  -7.394  -7.467
  161   2HB   HIS  21          HB3       HIS  21  -4.558  -6.531  -7.190
  162    HD1  HIS  21           HD1      HIS  21  -3.419  -4.685  -9.905
  163    HD2  HIS  21           HD2      HIS  21  -4.743  -8.650  -9.558
  164    HE1  HIS  21           HE1      HIS  21  -4.144  -5.404 -12.243
  165    H    LYS  22           H        LYS  22  -3.606  -3.512  -9.160
  166    HA   LYS  22           HA       LYS  22  -4.553  -1.593  -7.264
  167   1HB   LYS  22          HB2       LYS  22  -5.320  -0.472  -9.478
  168   2HB   LYS  22          HB3       LYS  22  -3.609  -0.591  -9.117
  169   1HG   LYS  22          HG2       LYS  22  -3.250  -1.837 -10.977
  170   2HG   LYS  22          HG3       LYS  22  -4.430  -3.024 -10.459
  171   1HD   LYS  22          HD2       LYS  22  -5.820  -2.330 -12.108
  172   2HD   LYS  22          HD3       LYS  22  -5.944  -0.768 -11.323
  173   1HE   LYS  22          HE2       LYS  22  -5.069  -0.049 -13.340
  174   2HE   LYS  22          HE3       LYS  22  -3.556  -0.383 -12.524
  175   1HZ   LYS  22          HZ1       LYS  22  -4.280  -2.802 -13.585
  176   2HZ   LYS  22          HZ2       LYS  22  -4.710  -1.754 -14.756
  177    H    GLY  23           H        GLY  23  -6.795  -0.742  -7.249
  178   1HA   GLY  23          HA3       GLY  23  -9.083  -1.028  -7.772
  179   2HA   GLY  23          HA2       GLY  23  -8.800  -2.727  -8.094
  180    H    GLU  24           H        GLU  24  -6.910  -2.046  -5.415
  181    HA   GLU  24           HA       GLU  24  -8.992  -3.087  -3.691
  182   1HB   GLU  24          HB2       GLU  24  -5.961  -3.041  -3.536
  183   2HB   GLU  24          HB3       GLU  24  -6.926  -3.417  -2.123
  184   1HG   GLU  24          HG2       GLU  24  -8.123  -5.048  -3.997
  185   2HG   GLU  24          HG3       GLU  24  -6.476  -5.027  -4.597
  186    HE2  GLU  24           HE2      GLU  24  -4.871  -5.453  -2.945
  187    H    LYS  25           H        LYS  25  -7.759  -2.260  -1.183
  188    HA   LYS  25           HA       LYS  25  -8.371   0.609  -1.322
  189   1HB   LYS  25          HB2       LYS  25  -8.756  -1.333   0.976
  190   2HB   LYS  25          HB3       LYS  25  -9.104   0.384   1.024
  191   1HG   LYS  25          HG2       LYS  25 -11.121   0.065   0.036
  192   2HG   LYS  25          HG3       LYS  25 -10.380  -0.762  -1.319
  193   1HD   LYS  25          HD2       LYS  25 -10.215  -2.817   0.333
  194   2HD   LYS  25          HD3       LYS  25 -11.411  -1.950   1.276
  195   1HE   LYS  25          HE2       LYS  25 -13.032  -2.018  -0.493
  196   2HE   LYS  25          HE3       LYS  25 -11.827  -2.427  -1.699
  197   1HZ   LYS  25          HZ1       LYS  25 -12.482  -4.538  -1.293
  198   2HZ   LYS  25          HZ2       LYS  25 -11.608  -4.467   0.079
  199    H    PHE  26           H        PHE  26  -7.330   1.706   0.823
  200    HA   PHE  26           HA       PHE  26  -4.737   0.643   1.428
  201   1HB   PHE  26          HB2       PHE  26  -5.110   2.314  -0.845
  202   2HB   PHE  26          HB3       PHE  26  -4.575   3.430   0.397
  203    HD1  PHE  26           HD1      PHE  26  -2.318   3.846   0.428
  204    HD2  PHE  26           HD2      PHE  26  -3.644  -0.001  -0.776
  205    HE1  PHE  26           HE1      PHE  26   0.060   3.153   0.025
  206    HE2  PHE  26           HE2      PHE  26  -1.265  -0.694  -1.180
  207    HZ   PHE  26           HZ       PHE  26   0.558   0.891  -0.775
  208    H    GLN  27           H        GLN  27  -4.864   0.875   3.621
  209    HA   GLN  27           HA       GLN  27  -6.225   3.163   4.678
  210   1HB   GLN  27          HB2       GLN  27  -4.826   0.821   6.044
  211   2HB   GLN  27          HB3       GLN  27  -5.722   2.065   6.894
  212   1HG   GLN  27          HG2       GLN  27  -7.250   0.879   4.652
  213   2HG   GLN  27          HG3       GLN  27  -6.794  -0.302   5.864
  214   1HE2  GLN  27          HE21      GLN  27  -8.518   2.664   5.211
  215   2HE2  GLN  27          HE22      GLN  27  -9.509   2.695   6.631
  216    H    ILE  28           H        ILE  28  -5.238   4.699   6.194
  217    HA   ILE  28           HA       ILE  28  -2.383   5.038   5.618
  218    HB   ILE  28           HB       ILE  28  -3.840   6.808   4.803
  219   1HG1  ILE  28          HG12      ILE  28  -2.245   7.835   7.160
  220   2HG1  ILE  28          HG13      ILE  28  -1.495   7.220   5.701
  221   1HG2  ILE  28          HG21      ILE  28  -4.782   8.313   6.780
  222   2HG2  ILE  28          HG22      ILE  28  -5.731   6.990   6.060
  223   3HG2  ILE  28          HG23      ILE  28  -4.874   6.735   7.598
  224   1HD1  ILE  28          HD11      ILE  28  -3.609   9.413   5.644
  225   2HD1  ILE  28          HD12      ILE  28  -1.866   9.751   5.769
  226   3HD1  ILE  28          HD13      ILE  28  -2.511   8.925   4.331
  227    H    LEU  29           H        LEU  29  -0.889   5.099   7.267
  228    HA   LEU  29           HA       LEU  29  -1.820   5.360   9.983
  229   1HB   LEU  29          HB2       LEU  29  -1.634   2.806   8.872
  230   2HB   LEU  29          HB3       LEU  29  -0.154   2.993   9.792
  231    HG   LEU  29           HG       LEU  29  -2.201   3.945  11.478
  232   1HD1  LEU  29          HD11      LEU  29  -3.110   1.212  10.861
  233   2HD1  LEU  29          HD12      LEU  29  -4.035   2.667  11.303
  234   3HD1  LEU  29          HD13      LEU  29  -3.501   2.428   9.622
  235   1HD2  LEU  29          HD21      LEU  29  -1.662   1.793  12.735
  236   2HD2  LEU  29          HD22      LEU  29  -0.542   1.425  11.402
  237   3HD2  LEU  29          HD23      LEU  29  -0.305   2.890  12.385
  238    H    ASN  30           H        ASN  30   1.043   4.155   8.086
  239    HA   ASN  30           HA       ASN  30   2.722   5.750   9.772
  240   1HB   ASN  30          HB2       ASN  30   3.086   3.338   8.492
  241   2HB   ASN  30          HB3       ASN  30   3.845   4.411   7.332
  242   1HD2  ASN  30          HD21      ASN  30   3.662   3.861  10.846
  243   2HD2  ASN  30          HD22      ASN  30   5.339   4.117  11.197
  244    H    SER  31           H        SER  31   3.543   7.779   9.161
  245    HA   SER  31           HA       SER  31   3.825   8.424   6.415
  246   1HB   SER  31          HB2       SER  31   1.653   9.752   8.077
  247   2HB   SER  31          HB3       SER  31   2.357  10.545   6.683
  248    HG   SER  31           HG       SER  31   1.786   8.200   5.707
  249    H    SER  32           H        SER  32   6.037   8.680   7.151
  250    HA   SER  32           HA       SER  32   6.385  10.929   8.970
  251   1HB   SER  32          HB2       SER  32   7.885   8.386   8.507
  252   2HB   SER  32          HB3       SER  32   8.873   9.800   8.817
  253    HG   SER  32           HG       SER  32   7.444  10.164  10.748
  254    H    GLU  33           H        GLU  33   8.843   9.520   6.770
  255    HA   GLU  33           HA       GLU  33   9.168  12.138   5.622
  256   1HB   GLU  33          HB2       GLU  33  10.838   9.703   4.933
  257   2HB   GLU  33          HB3       GLU  33  11.306  11.391   4.892
  258   1HG   GLU  33          HG2       GLU  33  12.103  11.209   7.004
  259   2HG   GLU  33          HG3       GLU  33  10.480  10.878   7.577
  260    HE2  GLU  33           HE2      GLU  33  12.728   7.884   6.255
  261    H    GLY  34           H        GLY  34   9.656   8.970   3.968
  262   1HA   GLY  34          HA3       GLY  34   7.426   8.777   2.417
  263   2HA   GLY  34          HA2       GLY  34   8.402   9.970   1.583
  264    H    ASP  35           H        ASP  35   8.652   6.689   3.119
  265    HA   ASP  35           HA       ASP  35  10.400   5.993   0.897
  266   1HB   ASP  35          HB2       ASP  35  10.916   5.883   3.784
  267   2HB   ASP  35          HB3       ASP  35  11.058   4.289   3.068
  268    HD2  ASP  35           HD2      ASP  35  12.999   7.064   1.168
  269    H    TRP  36           H        TRP  36   9.020   4.284   3.805
  270    HA   TRP  36           HA       TRP  36   7.610   2.495   1.944
  271   1HB   TRP  36          HB2       TRP  36   7.791   1.010   4.168
  272   2HB   TRP  36          HB3       TRP  36   8.952   0.961   2.856
  273    HD1  TRP  36           HD1      TRP  36   8.588   3.004   6.183
  274    HE1  TRP  36           HE1      TRP  36  10.946   3.333   7.319
  275    HE3  TRP  36           HE3      TRP  36  11.253   0.656   2.544
  276    HZ2  TRP  36           HZ2      TRP  36  13.602   2.591   6.586
  277    HZ3  TRP  36           HZ3      TRP  36  13.724   0.503   2.831
  278    HH2  TRP  36           HH2      TRP  36  14.901   1.423   4.766
  279    H    TRP  37           H        TRP  37   5.396   2.367   2.201
  280    HA   TRP  37           HA       TRP  37   4.300   3.748   4.556
  281   1HB   TRP  37          HB2       TRP  37   3.471   3.758   1.673
  282   2HB   TRP  37          HB3       TRP  37   2.276   4.012   2.931
  283    HD1  TRP  37           HD1      TRP  37   5.064   5.633   4.477
  284    HE1  TRP  37           HE1      TRP  37   5.285   8.219   4.000
  285    HE3  TRP  37           HE3      TRP  37   1.959   5.689   0.451
  286    HZ2  TRP  37           HZ2      TRP  37   4.163   9.959   2.035
  287    HZ3  TRP  37           HZ3      TRP  37   1.575   7.873  -0.690
  288    HH2  TRP  37           HH2      TRP  37   2.618   9.958   0.042
  289    H    GLU  38           H        GLU  38   2.303   2.788   5.430
  290    HA   GLU  38           HA       GLU  38   2.430  -0.057   5.235
  291   1HB   GLU  38          HB2       GLU  38   1.488   1.910   7.145
  292   2HB   GLU  38          HB3       GLU  38   0.204   0.758   6.835
  293   1HG   GLU  38          HG2       GLU  38   1.384  -0.326   8.545
  294   2HG   GLU  38          HG3       GLU  38   2.096  -1.063   7.124
  295    HE2  GLU  38           HE2      GLU  38   3.550   1.779   9.344
  296    H    ALA  39           H        ALA  39   0.317  -1.359   5.030
  297    HA   ALA  39           HA       ALA  39  -1.722  -0.043   3.449
  298   1HB   ALA  39          HB1       ALA  39   0.223  -2.091   2.381
  299   2HB   ALA  39          HB2       ALA  39  -1.443  -2.026   1.754
  300   3HB   ALA  39          HB3       ALA  39  -0.383  -0.603   1.614
  301    H    ARG  40           H        ARG  40  -3.176  -0.499   5.141
  302    HA   ARG  40           HA       ARG  40  -3.281  -3.171   6.128
  303   1HB   ARG  40          HB2       ARG  40  -5.409  -1.083   6.682
  304   2HB   ARG  40          HB3       ARG  40  -4.796  -2.328   7.753
  305   1HG   ARG  40          HG2       ARG  40  -2.579  -0.632   7.005
  306   2HG   ARG  40          HG3       ARG  40  -3.905   0.404   7.496
  307   1HD   ARG  40          HD2       ARG  40  -2.267  -0.474   9.343
  308   2HD   ARG  40          HD3       ARG  40  -3.986  -0.497   9.682
  309    HE   ARG  40           HE       ARG  40  -2.484  -2.910   8.710
  310   1HH1  ARG  40          HH22      ARG  40  -4.967  -1.435  10.762
  311   2HH1  ARG  40          HH21      ARG  40  -5.451  -2.940  11.471
  312   1HH2  ARG  40          HH11      ARG  40  -4.353  -4.962  10.798
  313    H    SER  41           H        SER  41  -4.023  -4.584   4.499
  314    HA   SER  41           HA       SER  41  -6.157  -3.801   2.811
  315   1HB   SER  41          HB2       SER  41  -4.288  -5.356   2.140
  316   2HB   SER  41          HB3       SER  41  -4.932  -6.562   3.237
  317    HG   SER  41           HG       SER  41  -5.694  -6.016   0.681
  318    H    LEU  42           H        LEU  42  -8.339  -4.040   3.191
  319    HA   LEU  42           HA       LEU  42  -9.106  -5.391   5.637
  320   1HB   LEU  42          HB2       LEU  42 -10.279  -3.360   3.822
  321   2HB   LEU  42          HB3       LEU  42 -11.406  -4.422   4.642
  322    HG   LEU  42           HG       LEU  42  -9.279  -3.045   6.249
  323   1HD1  LEU  42          HD11      LEU  42 -10.901  -1.139   6.581
  324   2HD1  LEU  42          HD12      LEU  42 -10.084  -1.196   5.001
  325   3HD1  LEU  42          HD13      LEU  42 -11.774  -1.736   5.149
  326   1HD2  LEU  42          HD21      LEU  42 -12.131  -3.890   6.828
  327   2HD2  LEU  42          HD22      LEU  42 -10.644  -4.711   7.360
  328   3HD2  LEU  42          HD23      LEU  42 -11.036  -3.089   7.980
  329    H    THR  43           H        THR  43  -8.639  -6.158   2.355
  330    HA   THR  43           HA       THR  43 -10.845  -8.034   2.207
  331    HB   THR  43           HB       THR  43  -8.548  -7.814   0.235
  332    HG1  THR  43           HG1      THR  43 -10.682  -5.966   0.977
  333   1HG2  THR  43          HG21      THR  43 -11.122  -9.026   0.224
  334   2HG2  THR  43          HG22      THR  43 -11.296  -7.547  -0.751
  335   3HG2  THR  43          HG23      THR  43 -10.069  -8.763  -1.186
  336    H    THR  44           H        THR  44  -7.303  -8.479   1.599
  337    HA   THR  44           HA       THR  44  -7.474 -11.222   2.310
  338    HB   THR  44           HB       THR  44  -4.890 -10.910   2.138
  339    HG1  THR  44           HG1      THR  44  -4.528  -8.723   2.379
  340   1HG2  THR  44          HG21      THR  44  -4.964 -10.365  -0.321
  341   2HG2  THR  44          HG22      THR  44  -6.172 -11.594   0.122
  342   3HG2  THR  44          HG23      THR  44  -6.675  -9.907  -0.144
  343    H    GLY  45           H        GLY  45  -6.099  -8.319   3.981
  344   1HA   GLY  45          HA3       GLY  45  -6.304  -7.980   6.280
  345   2HA   GLY  45          HA2       GLY  45  -6.584  -9.693   6.525
  346    H    GLU  46           H        GLU  46  -3.978  -7.982   4.664
  347    HA   GLU  46           HA       GLU  46  -2.080  -8.773   6.669
  348   1HB   GLU  46          HB2       GLU  46  -2.510 -10.445   4.434
  349   2HB   GLU  46          HB3       GLU  46  -1.056  -9.550   4.036
  350   1HG   GLU  46          HG2       GLU  46  -1.373 -10.807   6.783
  351   2HG   GLU  46          HG3       GLU  46  -0.851 -11.781   5.423
  352    HE2  GLU  46           HE2      GLU  46   1.660 -10.953   7.316
  353    H    THR  47           H        THR  47  -0.292  -7.377   6.739
  354    HA   THR  47           HA       THR  47  -0.432  -5.148   4.837
  355    HB   THR  47           HB       THR  47   0.883  -3.984   6.646
  356    HG1  THR  47           HG1      THR  47   1.282  -6.600   7.256
  357   1HG2  THR  47          HG21      THR  47  -1.651  -5.467   7.498
  358   2HG2  THR  47          HG22      THR  47  -0.844  -4.272   8.543
  359   3HG2  THR  47          HG23      THR  47  -1.514  -3.772   6.972
  360    H    GLY  48           H        GLY  48   2.201  -4.168   5.210
  361   1HA   GLY  48          HA3       GLY  48   4.291  -5.891   4.879
  362   2HA   GLY  48          HA2       GLY  48   3.558  -5.815   3.290
  363    H    TYR  49           H        TYR  49   5.920  -4.867   3.015
  364    HA   TYR  49           HA       TYR  49   5.763  -1.962   3.463
  365   1HB   TYR  49          HB2       TYR  49   8.046  -4.013   3.207
  366   2HB   TYR  49          HB3       TYR  49   8.349  -2.287   3.188
  367    HD1  TYR  49           HD1      TYR  49   8.174  -0.952   5.222
  368    HD2  TYR  49           HD2      TYR  49   7.339  -5.147   5.273
  369    HE1  TYR  49           HE1      TYR  49   8.290  -0.953   7.762
  370    HE2  TYR  49           HE2      TYR  49   7.457  -5.133   7.812
  371    HH   TYR  49           HH       TYR  49   7.816  -3.966   9.589
  372    H    ILE  50           H        ILE  50   5.136  -0.958   1.611
  373    HA   ILE  50           HA       ILE  50   6.641  -1.565  -0.786
  374    HB   ILE  50           HB       ILE  50   4.325  -1.497  -2.012
  375   1HG1  ILE  50          HG12      ILE  50   3.298  -3.128   0.229
  376   2HG1  ILE  50          HG13      ILE  50   3.360  -1.405   0.543
  377   1HG2  ILE  50          HG21      ILE  50   5.199  -3.442  -2.627
  378   2HG2  ILE  50          HG22      ILE  50   6.096  -3.587  -1.097
  379   3HG2  ILE  50          HG23      ILE  50   4.423  -4.185  -1.209
  380   1HD1  ILE  50          HD11      ILE  50   1.459  -2.849  -1.056
  381   2HD1  ILE  50          HD12      ILE  50   1.509  -1.102  -0.720
  382   3HD1  ILE  50          HD13      ILE  50   2.363  -1.761  -2.136
  383    HA   PRO  51           HA       PRO  51   6.111   2.735  -1.006
  384   1HB   PRO  51          HB2       PRO  51   7.590   3.220  -3.252
  385   2HB   PRO  51          HB3       PRO  51   8.303   2.989  -1.668
  386   1HG   PRO  51          HG2       PRO  51   8.225   1.117  -3.955
  387   2HG   PRO  51          HG3       PRO  51   9.269   1.089  -2.548
  388   1HD   PRO  51          HD2       PRO  51   6.984  -0.579  -3.022
  389   2HD   PRO  51          HD3       PRO  51   7.960  -0.527  -1.568
  390    H    SER  52           H        SER  52   4.709   4.270  -1.721
  391    HA   SER  52           HA       SER  52   3.677   3.919  -4.352
  392   1HB   SER  52          HB2       SER  52   2.096   3.150  -1.921
  393   2HB   SER  52          HB3       SER  52   1.243   4.053  -3.158
  394    HG   SER  52           HG       SER  52   2.830   1.741  -3.829
  395    H    ASN  53           H        ASN  53   4.160   6.037  -4.923
  396    HA   ASN  53           HA       ASN  53   3.298   8.089  -3.055
  397   1HB   ASN  53          HB2       ASN  53   5.507   7.829  -5.042
  398   2HB   ASN  53          HB3       ASN  53   4.715   9.391  -5.072
  399   1HD2  ASN  53          HD21      ASN  53   4.497  10.573  -3.071
  400   2HD2  ASN  53          HD22      ASN  53   5.697  10.428  -1.831
  401    H    TYR  54           H        TYR  54   2.098   6.353  -5.593
  402    HA   TYR  54           HA       TYR  54   0.972   8.654  -7.015
  403   1HB   TYR  54          HB2       TYR  54   2.148   6.247  -7.807
  404   2HB   TYR  54          HB3       TYR  54   0.460   5.777  -7.771
  405    HD1  TYR  54           HD1      TYR  54  -1.068   6.492  -9.471
  406    HD2  TYR  54           HD2      TYR  54   2.891   8.106  -9.330
  407    HE1  TYR  54           HE1      TYR  54  -1.394   7.511 -11.778
  408    HE2  TYR  54           HE2      TYR  54   2.553   9.120 -11.636
  409    HH   TYR  54           HH       TYR  54  -0.138   9.741 -12.953
  410    H    VAL  55           H        VAL  55  -0.117   8.571  -4.542
  411    HA   VAL  55           HA       VAL  55  -2.528   6.935  -4.748
  412    HB   VAL  55           HB       VAL  55  -2.836   7.740  -2.375
  413   1HG1  VAL  55          HG11      VAL  55  -0.301   6.378  -2.101
  414   2HG1  VAL  55          HG12      VAL  55  -1.951   5.767  -1.827
  415   3HG1  VAL  55          HG13      VAL  55  -1.230   5.689  -3.453
  416   1HG2  VAL  55          HG21      VAL  55  -1.256   8.968  -1.253
  417   2HG2  VAL  55          HG22      VAL  55   0.075   8.434  -2.308
  418   3HG2  VAL  55          HG23      VAL  55  -1.076   9.665  -2.881
  419    H    ALA  56           H        ALA  56  -4.504   7.803  -5.215
  420    HA   ALA  56           HA       ALA  56  -4.587  10.736  -5.425
  421   1HB   ALA  56          HB1       ALA  56  -6.472   8.961  -6.940
  422   2HB   ALA  56          HB2       ALA  56  -5.770  10.532  -7.396
  423   3HB   ALA  56          HB3       ALA  56  -4.783   9.054  -7.494
  424    HA   PRO  57           HA       PRO  57  -7.598  10.133  -2.289
  425   1HB   PRO  57          HB2       PRO  57  -7.709  12.730  -1.441
  426   2HB   PRO  57          HB3       PRO  57  -6.542  11.572  -0.833
  427   1HG   PRO  57          HG2       PRO  57  -6.127  13.797  -2.735
  428   2HG   PRO  57          HG3       PRO  57  -4.935  12.914  -1.800
  429   1HD   PRO  57          HD2       PRO  57  -5.499  12.601  -4.596
  430   2HD   PRO  57          HD3       PRO  57  -4.391  11.640  -3.635
  431    H    VAL  58           H        VAL  58  -9.470   9.501  -3.217
  432    HA   VAL  58           HA       VAL  58 -10.908  11.689  -4.550
  433    HB   VAL  58           HB       VAL  58 -12.079   9.975  -5.780
  434   1HG1  VAL  58          HG11      VAL  58  -9.091  10.038  -5.799
  435   2HG1  VAL  58          HG12      VAL  58  -9.906   8.808  -6.793
  436   3HG1  VAL  58          HG13      VAL  58 -10.257  10.534  -7.049
  437   1HG2  VAL  58          HG21      VAL  58 -10.477   8.025  -4.098
  438   2HG2  VAL  58          HG22      VAL  58 -12.247   8.195  -4.186
  439   3HG2  VAL  58          HG23      VAL  58 -11.341   7.573  -5.587
  440    H    ASP  59           H        ASP  59 -13.470  10.361  -4.484
  441    HA   ASP  59           HA       ASP  59 -13.997  10.713  -1.647
  442   1HB   ASP  59          HB2       ASP  59 -15.519  11.251  -4.182
  443   2HB   ASP  59          HB3       ASP  59 -16.471  10.752  -2.797
  444    HD2  ASP  59           HD2      ASP  59 -17.080  13.066  -1.581
  Start of MODEL    7
    1   1H    VAL   1           H        VAL   1  -7.316  12.851   0.241
    2    HA   VAL   1           HA       VAL   1  -7.599  13.111   2.542
    3    HB   VAL   1           HB       VAL   1  -9.873  11.294   1.766
    4   1HG1  VAL   1          HG11      VAL   1 -10.899  12.163   3.546
    5   2HG1  VAL   1          HG12      VAL   1  -9.375  12.978   3.974
    6   3HG1  VAL   1          HG13      VAL   1 -10.586  13.820   2.976
    7   1HG2  VAL   1          HG21      VAL   1 -10.102  14.153   1.037
    8   2HG2  VAL   1          HG22      VAL   1  -8.965  13.205   0.049
    9   3HG2  VAL   1          HG23      VAL   1 -10.666  12.698   0.182
   10    H    THR   2           H        THR   2  -9.519  10.527   3.352
   11    HA   THR   2           HA       THR   2  -7.251   9.175   4.653
   12    HB   THR   2           HB       THR   2 -10.197   9.285   5.479
   13    HG1  THR   2           HG1      THR   2  -9.164  10.886   7.020
   14   1HG2  THR   2          HG21      THR   2  -8.740   7.443   6.487
   15   2HG2  THR   2          HG22      THR   2  -7.662   8.721   7.098
   16   3HG2  THR   2          HG23      THR   2  -9.343   8.623   7.676
   17    H    LEU   3           H        LEU   3  -8.278   8.752   1.850
   18    HA   LEU   3           HA       LEU   3  -8.581   5.882   2.154
   19   1HB   LEU   3          HB2       LEU   3 -10.854   7.242   1.942
   20   2HB   LEU   3          HB3       LEU   3 -10.440   7.206   0.239
   21    HG   LEU   3           HG       LEU   3 -10.163   4.573   1.460
   22   1HD1  LEU   3          HD11      LEU   3 -11.884   5.198   2.981
   23   2HD1  LEU   3          HD12      LEU   3 -12.835   5.973   1.691
   24   3HD1  LEU   3          HD13      LEU   3 -12.639   4.204   1.712
   25   1HD2  LEU   3          HD21      LEU   3 -10.193   4.827  -0.915
   26   2HD2  LEU   3          HD22      LEU   3 -11.680   3.971  -0.439
   27   3HD2  LEU   3          HD23      LEU   3 -11.745   5.699  -0.862
   28    H    PHE   4           H        PHE   4  -7.132   4.912   0.842
   29    HA   PHE   4           HA       PHE   4  -6.258   6.462  -1.495
   30   1HB   PHE   4          HB2       PHE   4  -4.833   4.441   0.337
   31   2HB   PHE   4          HB3       PHE   4  -4.096   5.116  -1.102
   32    HD1  PHE   4           HD1      PHE   4  -2.930   7.138  -0.993
   33    HD2  PHE   4           HD2      PHE   4  -5.542   6.086   2.181
   34    HE1  PHE   4           HE1      PHE   4  -2.077   9.078   0.353
   35    HE2  PHE   4           HE2      PHE   4  -4.689   8.026   3.526
   36    HZ   PHE   4           HZ       PHE   4  -2.967   9.498   2.596
   37    H    VAL   5           H        VAL   5  -6.230   5.445  -3.493
   38    HA   VAL   5           HA       VAL   5  -7.082   2.631  -3.468
   39    HB   VAL   5           HB       VAL   5  -8.888   3.944  -4.240
   40   1HG1  VAL   5          HG11      VAL   5  -7.597   6.029  -4.652
   41   2HG1  VAL   5          HG12      VAL   5  -7.003   5.328  -6.177
   42   3HG1  VAL   5          HG13      VAL   5  -8.741   5.647  -5.961
   43   1HG2  VAL   5          HG21      VAL   5  -7.870   1.941  -5.705
   44   2HG2  VAL   5          HG22      VAL   5  -9.340   2.826  -6.174
   45   3HG2  VAL   5          HG23      VAL   5  -7.777   3.243  -6.916
   46    H    ALA   6           H        ALA   6  -6.085   1.213  -4.975
   47    HA   ALA   6           HA       ALA   6  -3.400   1.898  -5.570
   48   1HB   ALA   6          HB1       ALA   6  -5.174  -0.464  -6.301
   49   2HB   ALA   6          HB2       ALA   6  -3.432  -0.379  -6.653
   50   3HB   ALA   6          HB3       ALA   6  -4.000  -0.368  -4.966
   51    H    LEU   7           H        LEU   7  -2.408   1.904  -7.737
   52    HA   LEU   7           HA       LEU   7  -4.290   2.996  -9.710
   53   1HB   LEU   7          HB2       LEU   7  -2.334   4.368  -8.629
   54   2HB   LEU   7          HB3       LEU   7  -1.338   3.486  -9.771
   55    HG   LEU   7           HG       LEU   7  -3.093   4.328 -11.538
   56   1HD1  LEU   7          HD11      LEU   7  -3.443   6.856 -10.309
   57   2HD1  LEU   7          HD12      LEU   7  -4.687   5.684 -10.807
   58   3HD1  LEU   7          HD13      LEU   7  -4.020   5.627  -9.157
   59   1HD2  LEU   7          HD21      LEU   7  -1.740   6.551 -11.626
   60   2HD2  LEU   7          HD22      LEU   7  -0.805   5.827 -10.296
   61   3HD2  LEU   7          HD23      LEU   7  -0.905   4.998 -11.868
   62    H    TYR   8           H        TYR   8  -0.969   1.533  -9.816
   63    HA   TYR   8           HA       TYR   8  -1.988  -0.207 -11.957
   64   1HB   TYR   8          HB2       TYR   8   0.372   1.507 -11.454
   65   2HB   TYR   8          HB3       TYR   8   0.886  -0.138 -11.776
   66    HD1  TYR   8           HD1      TYR   8   0.782  -1.067 -13.981
   67    HD2  TYR   8           HD2      TYR   8  -0.965   2.754 -13.179
   68    HE1  TYR   8           HE1      TYR   8   0.524  -0.654 -16.477
   69    HE2  TYR   8           HE2      TYR   8  -1.217   3.155 -15.677
   70    HH   TYR   8           HH       TYR   8   0.336   1.911 -17.865
   71    H    ASP   9           H        ASP   9   0.094  -2.059 -12.054
   72    HA   ASP   9           HA       ASP   9  -0.224  -3.323  -9.446
   73   1HB   ASP   9          HB2       ASP   9   0.333  -5.452 -10.902
   74   2HB   ASP   9          HB3       ASP   9  -1.288  -4.786 -10.928
   75    HD2  ASP   9           HD2      ASP   9   1.692  -4.538 -12.952
   76    H    TYR  10           H        TYR  10   1.706  -3.733  -8.333
   77    HA   TYR  10           HA       TYR  10   4.189  -3.532  -9.902
   78   1HB   TYR  10          HB2       TYR  10   3.212  -1.930  -7.839
   79   2HB   TYR  10          HB3       TYR  10   4.073  -3.140  -6.908
   80    HD1  TYR  10           HD1      TYR  10   4.433  -0.428  -9.386
   81    HD2  TYR  10           HD2      TYR  10   6.496  -3.251  -6.921
   82    HE1  TYR  10           HE1      TYR  10   6.619   0.804  -9.791
   83    HE2  TYR  10           HE2      TYR  10   8.675  -2.009  -7.334
   84    HH   TYR  10           HH       TYR  10   8.981   0.332  -9.767
   85    H    GLU  11           H        GLU  11   5.914  -4.975  -9.383
   86    HA   GLU  11           HA       GLU  11   5.043  -7.208  -7.716
   87   1HB   GLU  11          HB2       GLU  11   5.396  -7.376 -10.412
   88   2HB   GLU  11          HB3       GLU  11   7.036  -7.712  -9.894
   89   1HG   GLU  11          HG2       GLU  11   6.472  -9.732  -8.924
   90   2HG   GLU  11          HG3       GLU  11   4.917  -9.152  -8.361
   91    HE2  GLU  11           HE2      GLU  11   5.664 -11.451  -9.770
   92    H    ALA  12           H        ALA  12   6.681  -8.238  -6.408
   93    HA   ALA  12           HA       ALA  12   9.298  -6.959  -6.403
   94   1HB   ALA  12          HB1       ALA  12   8.747  -5.678  -4.633
   95   2HB   ALA  12          HB2       ALA  12   7.179  -6.497  -4.443
   96   3HB   ALA  12          HB3       ALA  12   8.638  -7.184  -3.690
   97    H    ARG  13           H        ARG  13  10.939  -8.393  -5.887
   98    HA   ARG  13           HA       ARG  13  10.036 -11.107  -5.526
   99   1HB   ARG  13          HB2       ARG  13  12.240  -9.815  -6.902
  100   2HB   ARG  13          HB3       ARG  13  12.906 -10.948  -5.742
  101   1HG   ARG  13          HG2       ARG  13  12.582 -12.315  -7.631
  102   2HG   ARG  13          HG3       ARG  13  11.137 -12.640  -6.693
  103   1HD   ARG  13          HD2       ARG  13   9.812 -11.103  -8.056
  104   2HD   ARG  13          HD3       ARG  13  11.242 -10.502  -8.872
  105    HE   ARG  13           HE       ARG  13  10.774 -13.411  -9.118
  106   1HH1  ARG  13          HH22      ARG  13  10.364 -10.212 -10.588
  107   2HH1  ARG  13          HH21      ARG  13  10.116 -10.840 -12.183
  108   1HH2  ARG  13          HH11      ARG  13  10.169 -13.211 -12.533
  109    H    THR  14           H        THR  14  10.601  -8.614  -3.504
  110    HA   THR  14           HA       THR  14  12.534  -9.728  -1.716
  111    HB   THR  14           HB       THR  14  10.651  -7.708  -0.658
  112    HG1  THR  14           HG1      THR  14  10.906  -6.295  -2.416
  113   1HG2  THR  14          HG21      THR  14  13.275  -8.253  -0.219
  114   2HG2  THR  14          HG22      THR  14  13.461  -7.075  -1.540
  115   3HG2  THR  14          HG23      THR  14  12.619  -6.608  -0.044
  116    H    GLU  15           H        GLU  15  12.272 -10.836   0.201
  117    HA   GLU  15           HA       GLU  15   9.875 -12.355   0.307
  118   1HB   GLU  15          HB2       GLU  15  12.311 -13.118   0.830
  119   2HB   GLU  15          HB3       GLU  15  12.080 -12.362   2.396
  120   1HG   GLU  15          HG2       GLU  15  11.236 -14.408   2.995
  121   2HG   GLU  15          HG3       GLU  15   9.766 -13.822   2.244
  122    HE2  GLU  15           HE2      GLU  15   9.049 -15.448   1.346
  123    H    ASP  16           H        ASP  16  10.821  -9.297   1.473
  124    HA   ASP  16           HA       ASP  16   9.540  -9.427   3.984
  125   1HB   ASP  16          HB2       ASP  16  10.206  -6.991   2.265
  126   2HB   ASP  16          HB3       ASP  16   9.839  -6.961   3.978
  127    HD2  ASP  16           HD2      ASP  16  12.405  -5.936   3.552
  128    H    ASP  17           H        ASP  17   8.829  -7.664   0.863
  129    HA   ASP  17           HA       ASP  17   6.055  -7.538   1.695
  130   1HB   ASP  17          HB2       ASP  17   5.812  -5.839  -0.078
  131   2HB   ASP  17          HB3       ASP  17   7.136  -5.420   0.992
  132    HD2  ASP  17           HD2      ASP  17   6.386  -5.564  -2.194
  133    H    LEU  18           H        LEU  18   4.545  -7.591  -0.503
  134    HA   LEU  18           HA       LEU  18   5.510  -9.785  -2.190
  135   1HB   LEU  18          HB2       LEU  18   2.869  -9.596  -0.745
  136   2HB   LEU  18          HB3       LEU  18   3.138 -10.661  -2.111
  137    HG   LEU  18           HG       LEU  18   5.141 -10.928   0.039
  138   1HD1  LEU  18          HD11      LEU  18   2.524 -10.598   0.909
  139   2HD1  LEU  18          HD12      LEU  18   2.736 -12.364   0.836
  140   3HD1  LEU  18          HD13      LEU  18   3.856 -11.372   1.801
  141   1HD2  LEU  18          HD21      LEU  18   3.719 -13.332  -0.636
  142   2HD2  LEU  18          HD22      LEU  18   4.129 -12.440  -2.121
  143   3HD2  LEU  18          HD23      LEU  18   5.410 -12.885  -0.968
  144    H    SER  19           H        SER  19   3.431 -10.004  -3.957
  145    HA   SER  19           HA       SER  19   3.667  -7.478  -5.289
  146   1HB   SER  19          HB2       SER  19   2.115  -9.850  -6.354
  147   2HB   SER  19          HB3       SER  19   2.993  -8.628  -7.250
  148    HG   SER  19           HG       SER  19   4.502 -10.232  -5.446
  149    H    PHE  20           H        PHE  20   1.808  -6.252  -6.105
  150    HA   PHE  20           HA       PHE  20  -0.791  -7.008  -5.093
  151   1HB   PHE  20          HB2       PHE  20   0.988  -4.759  -4.110
  152   2HB   PHE  20          HB3       PHE  20  -0.710  -4.370  -4.305
  153    HD1  PHE  20           HD1      PHE  20   1.723  -5.751  -2.140
  154    HD2  PHE  20           HD2      PHE  20  -2.398  -5.967  -3.134
  155    HE1  PHE  20           HE1      PHE  20   1.234  -6.759   0.106
  156    HE2  PHE  20           HE2      PHE  20  -2.886  -6.975  -0.888
  157    HZ   PHE  20           HZ       PHE  20  -1.065  -7.360   0.704
  158    H    HIS  21           H        HIS  21  -2.461  -6.208  -6.374
  159    HA   HIS  21           HA       HIS  21  -1.575  -4.461  -8.553
  160   1HB   HIS  21          HB2       HIS  21  -4.039  -6.002  -8.981
  161   2HB   HIS  21          HB3       HIS  21  -2.675  -5.731 -10.047
  162    HD1  HIS  21           HD1      HIS  21  -3.418  -7.821  -6.909
  163    HD2  HIS  21           HD2      HIS  21  -1.195  -7.984 -10.462
  164    HE1  HIS  21           HE1      HIS  21  -2.335 -10.130  -6.968
  165    H    LYS  22           H        LYS  22  -4.037  -3.666  -9.568
  166    HA   LYS  22           HA       LYS  22  -4.870  -1.866  -7.465
  167   1HB   LYS  22          HB2       LYS  22  -6.010  -0.669  -9.252
  168   2HB   LYS  22          HB3       LYS  22  -4.342  -0.983  -9.685
  169   1HG   LYS  22          HG2       LYS  22  -6.238  -3.124 -10.513
  170   2HG   LYS  22          HG3       LYS  22  -6.526  -1.575 -11.280
  171   1HD   LYS  22          HD2       LYS  22  -4.347  -1.508 -12.254
  172   2HD   LYS  22          HD3       LYS  22  -3.713  -2.710 -11.150
  173   1HE   LYS  22          HE2       LYS  22  -5.615  -4.246 -12.281
  174   2HE   LYS  22          HE3       LYS  22  -5.440  -3.098 -13.594
  175   1HZ   LYS  22          HZ1       LYS  22  -3.878  -5.177 -13.455
  176   2HZ   LYS  22          HZ2       LYS  22  -3.265  -3.757 -13.966
  177    H    GLY  23           H        GLY  23  -7.398  -1.369  -7.516
  178   1HA   GLY  23          HA3       GLY  23  -9.564  -2.319  -7.722
  179   2HA   GLY  23          HA2       GLY  23  -8.868  -3.924  -7.621
  180    H    GLU  24           H        GLU  24  -6.954  -3.047  -5.410
  181    HA   GLU  24           HA       GLU  24  -8.945  -3.206  -3.301
  182   1HB   GLU  24          HB2       GLU  24  -5.971  -3.727  -2.978
  183   2HB   GLU  24          HB3       GLU  24  -7.283  -4.280  -1.955
  184   1HG   GLU  24          HG2       GLU  24  -7.045  -5.121  -4.875
  185   2HG   GLU  24          HG3       GLU  24  -6.262  -6.011  -3.585
  186    HE2  GLU  24           HE2      GLU  24  -8.702  -7.846  -4.155
  187    H    LYS  25           H        LYS  25  -8.371  -2.040  -1.191
  188    HA   LYS  25           HA       LYS  25  -7.031   0.495  -1.831
  189   1HB   LYS  25          HB2       LYS  25  -8.628   1.639  -0.425
  190   2HB   LYS  25          HB3       LYS  25  -9.477   0.744  -1.669
  191   1HG   LYS  25          HG2       LYS  25 -10.594  -0.482  -0.119
  192   2HG   LYS  25          HG3       LYS  25  -9.098  -0.972   0.650
  193   1HD   LYS  25          HD2       LYS  25  -9.276   0.606   2.304
  194   2HD   LYS  25          HD3       LYS  25  -9.817   1.851   1.198
  195   1HE   LYS  25          HE2       LYS  25 -12.092   1.171   1.330
  196   2HE   LYS  25          HE3       LYS  25 -11.684  -0.433   1.905
  197   1HZ   LYS  25          HZ1       LYS  25 -11.383   0.339   4.039
  198   2HZ   LYS  25          HZ2       LYS  25 -10.898   1.828   3.594
  199    H    PHE  26           H        PHE  26  -6.142   1.616   0.172
  200    HA   PHE  26           HA       PHE  26  -5.433  -0.294   2.257
  201   1HB   PHE  26          HB2       PHE  26  -3.560   1.455   0.554
  202   2HB   PHE  26          HB3       PHE  26  -3.032   0.612   1.997
  203    HD1  PHE  26           HD1      PHE  26  -3.602  -2.002   1.972
  204    HD2  PHE  26           HD2      PHE  26  -3.182   0.435  -1.476
  205    HE1  PHE  26           HE1      PHE  26  -3.092  -4.038   0.595
  206    HE2  PHE  26           HE2      PHE  26  -2.671  -1.602  -2.853
  207    HZ   PHE  26           HZ       PHE  26  -2.632  -3.814  -1.801
  208    H    GLN  27           H        GLN  27  -5.463   0.618   4.281
  209    HA   GLN  27           HA       GLN  27  -6.117   3.413   4.367
  210   1HB   GLN  27          HB2       GLN  27  -7.019   1.244   5.784
  211   2HB   GLN  27          HB3       GLN  27  -5.831   1.876   6.907
  212   1HG   GLN  27          HG2       GLN  27  -7.066   4.211   6.190
  213   2HG   GLN  27          HG3       GLN  27  -8.401   3.098   5.970
  214   1HE2  GLN  27          HE21      GLN  27  -7.624   5.236   7.993
  215   2HE2  GLN  27          HE22      GLN  27  -7.879   4.508   9.543
  216    H    ILE  28           H        ILE  28  -5.060   4.799   6.158
  217    HA   ILE  28           HA       ILE  28  -2.198   4.505   5.859
  218    HB   ILE  28           HB       ILE  28  -3.239   6.643   5.402
  219   1HG1  ILE  28          HG12      ILE  28  -1.715   7.133   7.934
  220   2HG1  ILE  28          HG13      ILE  28  -0.915   6.281   6.629
  221   1HG2  ILE  28          HG21      ILE  28  -3.852   7.293   8.210
  222   2HG2  ILE  28          HG22      ILE  28  -4.720   7.705   6.712
  223   3HG2  ILE  28          HG23      ILE  28  -4.943   6.105   7.459
  224   1HD1  ILE  28          HD11      ILE  28  -1.991   9.103   6.673
  225   2HD1  ILE  28          HD12      ILE  28  -0.416   8.507   6.098
  226   3HD1  ILE  28          HD13      ILE  28  -1.879   8.241   5.120
  227    H    LEU  29           H        LEU  29  -0.716   4.233   7.564
  228    HA   LEU  29           HA       LEU  29  -1.962   3.522  10.128
  229   1HB   LEU  29          HB2       LEU  29  -1.093   1.629   8.569
  230   2HB   LEU  29          HB3       LEU  29   0.497   2.161   9.079
  231    HG   LEU  29           HG       LEU  29  -1.117   1.855  11.421
  232   1HD1  LEU  29          HD11      LEU  29  -2.506   0.187  10.954
  233   2HD1  LEU  29          HD12      LEU  29  -1.812  -0.017   9.327
  234   3HD1  LEU  29          HD13      LEU  29  -1.083  -0.856  10.717
  235   1HD2  LEU  29          HD21      LEU  29   0.611   0.018  11.852
  236   2HD2  LEU  29          HD22      LEU  29   1.317   0.483  10.285
  237   3HD2  LEU  29          HD23      LEU  29   1.213   1.675  11.603
  238    H    ASN  30           H        ASN  30   1.499   3.606   9.164
  239    HA   ASN  30           HA       ASN  30   1.970   5.374  11.352
  240   1HB   ASN  30          HB2       ASN  30   3.591   3.687   9.489
  241   2HB   ASN  30          HB3       ASN  30   4.393   5.153  10.016
  242   1HD2  ASN  30          HD21      ASN  30   2.740   2.233  11.085
  243   2HD2  ASN  30          HD22      ASN  30   3.478   2.099  12.646
  244    H    SER  31           H        SER  31   3.364   7.411  10.986
  245    HA   SER  31           HA       SER  31   3.125   8.472   8.310
  246   1HB   SER  31          HB2       SER  31   1.206   9.141  10.157
  247   2HB   SER  31          HB3       SER  31   2.388  10.395  10.470
  248    HG   SER  31           HG       SER  31   0.713  10.854   8.773
  249    H    SER  32           H        SER  32   5.491   8.025   8.461
  250    HA   SER  32           HA       SER  32   6.940   9.503  10.427
  251   1HB   SER  32          HB2       SER  32   7.636   7.233   9.559
  252   2HB   SER  32          HB3       SER  32   7.971   7.964   8.002
  253    HG   SER  32           HG       SER  32   9.924   7.886   9.155
  254    H    GLU  33           H        GLU  33   7.182   9.362   6.791
  255    HA   GLU  33           HA       GLU  33   7.127  12.239   6.743
  256   1HB   GLU  33          HB2       GLU  33   9.566  11.434   7.047
  257   2HB   GLU  33          HB3       GLU  33   9.450  10.784   5.425
  258   1HG   GLU  33          HG2       GLU  33   8.751  13.099   4.620
  259   2HG   GLU  33          HG3       GLU  33   9.069  13.703   6.234
  260    HE2  GLU  33           HE2      GLU  33  10.986  11.363   4.410
  261    H    GLY  34           H        GLY  34   8.329   9.739   4.403
  262   1HA   GLY  34          HA3       GLY  34   5.960   9.381   2.982
  263   2HA   GLY  34          HA2       GLY  34   6.781  10.755   2.268
  264    H    ASP  35           H        ASP  35   7.165   7.290   3.179
  265    HA   ASP  35           HA       ASP  35   8.815   6.985   0.842
  266   1HB   ASP  35          HB2       ASP  35  10.157   7.352   3.151
  267   2HB   ASP  35          HB3       ASP  35   9.784   5.654   3.372
  268    HD2  ASP  35           HD2      ASP  35  10.970   4.953   0.236
  269    H    TRP  36           H        TRP  36   8.990   4.608   3.446
  270    HA   TRP  36           HA       TRP  36   7.026   2.956   2.018
  271   1HB   TRP  36          HB2       TRP  36   9.489   2.269   3.610
  272   2HB   TRP  36          HB3       TRP  36   8.246   1.083   3.265
  273    HD1  TRP  36           HD1      TRP  36   7.725   2.145   0.165
  274    HE1  TRP  36           HE1      TRP  36   9.433   1.532  -1.750
  275    HE3  TRP  36           HE3      TRP  36  11.639   1.150   3.254
  276    HZ2  TRP  36           HZ2      TRP  36  12.168   0.717  -1.759
  277    HZ3  TRP  36           HZ3      TRP  36  13.793   0.452   2.210
  278    HH2  TRP  36           HH2      TRP  36  14.093   0.230  -0.205
  279    H    TRP  37           H        TRP  37   5.061   3.007   3.026
  280    HA   TRP  37           HA       TRP  37   5.085   3.207   5.959
  281   1HB   TRP  37          HB2       TRP  37   3.258   4.318   3.864
  282   2HB   TRP  37          HB3       TRP  37   2.617   3.936   5.449
  283    HD1  TRP  37           HD1      TRP  37   5.539   4.941   6.883
  284    HE1  TRP  37           HE1      TRP  37   5.916   7.520   7.296
  285    HE3  TRP  37           HE3      TRP  37   2.061   6.522   3.528
  286    HZ2  TRP  37           HZ2      TRP  37   4.744   9.878   6.199
  287    HZ3  TRP  37           HZ3      TRP  37   1.739   8.979   3.260
  288    HH2  TRP  37           HH2      TRP  37   3.012  10.635   4.529
  289    H    GLU  38           H        GLU  38   2.782   2.188   6.756
  290    HA   GLU  38           HA       GLU  38   2.859  -0.497   5.668
  291   1HB   GLU  38          HB2       GLU  38   3.103   0.176   8.214
  292   2HB   GLU  38          HB3       GLU  38   1.355   0.298   8.173
  293   1HG   GLU  38          HG2       GLU  38   1.223  -2.051   7.296
  294   2HG   GLU  38          HG3       GLU  38   2.970  -2.170   7.367
  295    HE2  GLU  38           HE2      GLU  38   3.040  -2.259  10.875
  296    H    ALA  39           H        ALA  39   0.826  -1.673   5.245
  297    HA   ALA  39           HA       ALA  39  -1.564  -0.048   5.057
  298   1HB   ALA  39          HB1       ALA  39  -1.460   0.307   2.841
  299   2HB   ALA  39          HB2       ALA  39   0.177  -0.393   2.830
  300   3HB   ALA  39          HB3       ALA  39  -1.239  -1.434   2.547
  301    H    ARG  40           H        ARG  40  -3.333  -1.269   5.569
  302    HA   ARG  40           HA       ARG  40  -2.852  -4.138   5.638
  303   1HB   ARG  40          HB2       ARG  40  -3.896  -2.290   7.601
  304   2HB   ARG  40          HB3       ARG  40  -5.188  -3.393   7.174
  305   1HG   ARG  40          HG2       ARG  40  -4.166  -4.672   8.813
  306   2HG   ARG  40          HG3       ARG  40  -3.248  -5.233   7.430
  307   1HD   ARG  40          HD2       ARG  40  -1.322  -4.079   8.052
  308   2HD   ARG  40          HD3       ARG  40  -2.213  -2.766   8.796
  309    HE   ARG  40           HE       ARG  40  -1.585  -5.392  10.052
  310   1HH1  ARG  40          HH22      ARG  40  -3.061  -2.184  10.340
  311   2HH1  ARG  40          HH21      ARG  40  -3.169  -2.252  12.066
  312   1HH2  ARG  40          HH11      ARG  40  -2.378  -4.200  13.216
  313    H    SER  41           H        SER  41  -4.212  -5.479   4.435
  314    HA   SER  41           HA       SER  41  -6.105  -4.139   2.758
  315   1HB   SER  41          HB2       SER  41  -4.522  -5.898   1.903
  316   2HB   SER  41          HB3       SER  41  -5.343  -7.090   2.893
  317    HG   SER  41           HG       SER  41  -6.322  -7.269   0.905
  318    H    LEU  42           H        LEU  42  -8.377  -4.441   2.787
  319    HA   LEU  42           HA       LEU  42  -9.369  -5.614   5.262
  320   1HB   LEU  42          HB2       LEU  42 -10.204  -3.469   3.428
  321   2HB   LEU  42          HB3       LEU  42 -11.514  -4.466   4.028
  322    HG   LEU  42           HG       LEU  42  -9.493  -3.051   5.788
  323   1HD1  LEU  42          HD11      LEU  42 -12.230  -2.227   4.827
  324   2HD1  LEU  42          HD12      LEU  42 -11.537  -1.605   6.343
  325   3HD1  LEU  42          HD13      LEU  42 -10.704  -1.311   4.798
  326   1HD2  LEU  42          HD21      LEU  42 -10.859  -5.221   6.507
  327   2HD2  LEU  42          HD22      LEU  42 -10.558  -3.868   7.624
  328   3HD2  LEU  42          HD23      LEU  42 -12.129  -4.008   6.798
  329    H    THR  43           H        THR  43  -8.444  -6.906   2.486
  330    HA   THR  43           HA       THR  43 -10.870  -8.554   2.201
  331    HB   THR  43           HB       THR  43  -8.671  -7.875   0.174
  332    HG1  THR  43           HG1      THR  43 -10.930  -6.959  -0.683
  333   1HG2  THR  43          HG21      THR  43  -9.649  -9.375  -1.257
  334   2HG2  THR  43          HG22      THR  43 -10.433 -10.077   0.179
  335   3HG2  THR  43          HG23      THR  43 -11.285  -8.849  -0.790
  336    H    THR  44           H        THR  44  -7.276  -8.762   1.712
  337    HA   THR  44           HA       THR  44  -7.458 -11.536   2.637
  338    HB   THR  44           HB       THR  44  -4.866 -11.068   1.734
  339    HG1  THR  44           HG1      THR  44  -5.143  -9.556   0.015
  340   1HG2  THR  44          HG21      THR  44  -7.403 -12.082   0.478
  341   2HG2  THR  44          HG22      THR  44  -6.082 -11.650  -0.635
  342   3HG2  THR  44          HG23      THR  44  -5.819 -12.881   0.624
  343    H    GLY  45           H        GLY  45  -5.288  -8.659   3.093
  344   1HA   GLY  45          HA3       GLY  45  -4.805  -7.804   5.232
  345   2HA   GLY  45          HA2       GLY  45  -5.165  -9.363   5.946
  346    H    GLU  46           H        GLU  46  -3.071  -8.407   3.130
  347    HA   GLU  46           HA       GLU  46  -0.952  -9.924   4.424
  348   1HB   GLU  46          HB2       GLU  46  -1.933 -10.193   1.892
  349   2HB   GLU  46          HB3       GLU  46  -0.658  -9.032   1.584
  350   1HG   GLU  46          HG2       GLU  46   0.849 -10.723   1.630
  351   2HG   GLU  46          HG3       GLU  46   0.494 -10.960   3.330
  352    HE2  GLU  46           HE2      GLU  46  -2.282 -13.086   2.224
  353    H    THR  47           H        THR  47  -0.168  -8.300   5.858
  354    HA   THR  47           HA       THR  47   0.397  -5.667   4.933
  355    HB   THR  47           HB       THR  47  -0.085  -5.892   7.255
  356    HG1  THR  47           HG1      THR  47   1.892  -5.072   8.036
  357   1HG2  THR  47          HG21      THR  47   0.166  -8.266   7.673
  358   2HG2  THR  47          HG22      THR  47   1.872  -8.238   7.167
  359   3HG2  THR  47          HG23      THR  47   1.384  -7.464   8.693
  360    H    GLY  48           H        GLY  48   2.255  -4.724   4.203
  361   1HA   GLY  48          HA3       GLY  48   4.752  -6.174   4.273
  362   2HA   GLY  48          HA2       GLY  48   4.032  -6.070   2.679
  363    H    TYR  49           H        TYR  49   6.138  -4.809   2.305
  364    HA   TYR  49           HA       TYR  49   5.833  -2.030   3.210
  365   1HB   TYR  49          HB2       TYR  49   8.034  -3.998   2.665
  366   2HB   TYR  49          HB3       TYR  49   8.348  -2.411   1.991
  367    HD1  TYR  49           HD1      TYR  49   8.780  -0.494   3.425
  368    HD2  TYR  49           HD2      TYR  49   7.865  -4.320   5.107
  369    HE1  TYR  49           HE1      TYR  49   9.578   0.308   5.701
  370    HE2  TYR  49           HE2      TYR  49   8.666  -3.505   7.377
  371    HH   TYR  49           HH       TYR  49  10.504  -0.767   7.763
  372    H    ILE  50           H        ILE  50   4.934  -0.690   1.728
  373    HA   ILE  50           HA       ILE  50   5.831  -0.962  -1.028
  374    HB   ILE  50           HB       ILE  50   3.296  -0.454  -1.572
  375   1HG1  ILE  50          HG12      ILE  50   2.848  -2.381   0.683
  376   2HG1  ILE  50          HG13      ILE  50   2.896  -0.664   1.035
  377   1HG2  ILE  50          HG21      ILE  50   3.165  -3.188  -1.459
  378   2HG2  ILE  50          HG22      ILE  50   3.937  -2.242  -2.754
  379   3HG2  ILE  50          HG23      ILE  50   4.921  -2.896  -1.423
  380   1HD1  ILE  50          HD11      ILE  50   1.091  -0.207  -0.537
  381   2HD1  ILE  50          HD12      ILE  50   1.141  -1.880  -1.146
  382   3HD1  ILE  50          HD13      ILE  50   0.581  -1.551   0.512
  383    HA   PRO  51           HA       PRO  51   5.862   3.342  -0.633
  384   1HB   PRO  51          HB2       PRO  51   6.099   4.097  -3.249
  385   2HB   PRO  51          HB3       PRO  51   7.450   3.528  -2.289
  386   1HG   PRO  51          HG2       PRO  51   5.954   2.110  -4.407
  387   2HG   PRO  51          HG3       PRO  51   7.535   1.743  -3.747
  388   1HD   PRO  51          HD2       PRO  51   5.076   0.382  -3.169
  389   2HD   PRO  51          HD3       PRO  51   6.635   0.092  -2.423
  390    H    SER  52           H        SER  52   4.846   5.461  -1.233
  391    HA   SER  52           HA       SER  52   2.103   4.883  -2.037
  392   1HB   SER  52          HB2       SER  52   2.572   5.408   0.494
  393   2HB   SER  52          HB3       SER  52   2.795   7.061  -0.043
  394    HG   SER  52           HG       SER  52   0.432   5.489  -0.621
  395    H    ASN  53           H        ASN  53   3.731   5.519  -4.057
  396    HA   ASN  53           HA       ASN  53   3.562   8.414  -4.315
  397   1HB   ASN  53          HB2       ASN  53   5.377   6.303  -5.536
  398   2HB   ASN  53          HB3       ASN  53   5.142   7.819  -6.384
  399   1HD2  ASN  53          HD21      ASN  53   6.557   9.322  -5.977
  400   2HD2  ASN  53          HD22      ASN  53   7.457   9.559  -4.516
  401    H    TYR  54           H        TYR  54   1.853   5.649  -4.979
  402    HA   TYR  54           HA       TYR  54   0.900   6.690  -7.560
  403   1HB   TYR  54          HB2       TYR  54   1.648   3.951  -6.480
  404   2HB   TYR  54          HB3       TYR  54   0.272   4.009  -7.563
  405    HD1  TYR  54           HD1      TYR  54   3.622   3.313  -7.501
  406    HD2  TYR  54           HD2      TYR  54   0.840   5.689  -9.719
  407    HE1  TYR  54           HE1      TYR  54   5.188   3.289  -9.504
  408    HE2  TYR  54           HE2      TYR  54   2.415   5.657 -11.714
  409    HH   TYR  54           HH       TYR  54   5.006   5.386 -11.956
  410    H    VAL  55           H        VAL  55  -0.143   7.614  -5.098
  411    HA   VAL  55           HA       VAL  55  -2.723   6.206  -5.057
  412    HB   VAL  55           HB       VAL  55  -2.892   7.012  -2.698
  413   1HG1  VAL  55          HG11      VAL  55  -0.635   5.099  -3.381
  414   2HG1  VAL  55          HG12      VAL  55  -1.377   5.263  -1.772
  415   3HG1  VAL  55          HG13      VAL  55  -2.353   4.696  -3.148
  416   1HG2  VAL  55          HG21      VAL  55  -0.502   8.405  -3.393
  417   2HG2  VAL  55          HG22      VAL  55  -1.392   8.427  -1.852
  418   3HG2  VAL  55          HG23      VAL  55  -0.098   7.234  -2.115
  419    H    ALA  56           H        ALA  56  -4.441   7.416  -5.689
  420    HA   ALA  56           HA       ALA  56  -3.985  10.313  -5.872
  421   1HB   ALA  56          HB1       ALA  56  -6.111   8.794  -7.386
  422   2HB   ALA  56          HB2       ALA  56  -5.296  10.319  -7.811
  423   3HB   ALA  56          HB3       ALA  56  -4.423   8.773  -7.952
  424    HA   PRO  57           HA       PRO  57  -7.409  10.647  -3.197
  425   1HB   PRO  57          HB2       PRO  57  -7.586  13.372  -3.091
  426   2HB   PRO  57          HB3       PRO  57  -6.405  12.453  -2.180
  427   1HG   PRO  57          HG2       PRO  57  -6.009  14.084  -4.614
  428   2HG   PRO  57          HG3       PRO  57  -4.813  13.519  -3.463
  429   1HD   PRO  57          HD2       PRO  57  -5.328  12.443  -6.071
  430   2HD   PRO  57          HD3       PRO  57  -4.214  11.807  -4.877
  431    H    VAL  58           H        VAL  58  -9.587  10.498  -3.179
  432    HA   VAL  58           HA       VAL  58 -10.840  11.690  -5.557
  433    HB   VAL  58           HB       VAL  58 -12.495   9.754  -5.233
  434   1HG1  VAL  58          HG11      VAL  58 -11.085   9.874  -7.176
  435   2HG1  VAL  58          HG12      VAL  58  -9.671   9.312  -6.251
  436   3HG1  VAL  58          HG13      VAL  58 -11.031   8.205  -6.559
  437   1HG2  VAL  58          HG21      VAL  58 -11.945   7.907  -3.978
  438   2HG2  VAL  58          HG22      VAL  58 -10.198   8.238  -4.047
  439   3HG2  VAL  58          HG23      VAL  58 -11.243   9.194  -2.969
  440    H    ASP  59           H        ASP  59 -13.459  11.566  -5.001
  441    HA   ASP  59           HA       ASP  59 -14.079  12.096  -2.327
  442   1HB   ASP  59          HB2       ASP  59 -12.981  14.301  -3.751
  443   2HB   ASP  59          HB3       ASP  59 -14.709  14.591  -3.727
  444    HD2  ASP  59           HD2      ASP  59 -15.051  13.480  -0.980
  Start of MODEL    8
    1   1H    VAL   1           H        VAL   1 -12.036   9.214   4.922
    2    HA   VAL   1           HA       VAL   1 -11.656   9.918   2.856
    3    HB   VAL   1           HB       VAL   1 -10.566  12.314   2.834
    4   1HG1  VAL   1          HG11      VAL   1 -12.756  13.278   3.323
    5   2HG1  VAL   1          HG12      VAL   1 -12.936  11.774   2.389
    6   3HG1  VAL   1          HG13      VAL   1 -13.255  11.778   4.140
    7   1HG2  VAL   1          HG21      VAL   1  -9.635  12.268   5.074
    8   2HG2  VAL   1          HG22      VAL   1 -10.924  13.493   4.993
    9   3HG2  VAL   1          HG23      VAL   1 -11.237  11.921   5.769
   10    H    THR   2           H        THR   2  -9.524   8.303   4.309
   11    HA   THR   2           HA       THR   2  -7.256   9.097   2.602
   12    HB   THR   2           HB       THR   2  -6.710   7.329   4.918
   13    HG1  THR   2           HG1      THR   2  -7.485   8.807   6.437
   14   1HG2  THR   2          HG21      THR   2  -4.726   8.373   4.381
   15   2HG2  THR   2          HG22      THR   2  -5.556   9.703   3.539
   16   3HG2  THR   2          HG23      THR   2  -5.386   9.740   5.311
   17    H    LEU   3           H        LEU   3  -9.430   7.654   1.520
   18    HA   LEU   3           HA       LEU   3  -8.821   4.867   1.659
   19   1HB   LEU   3          HB2       LEU   3 -11.044   6.213   1.110
   20   2HB   LEU   3          HB3       LEU   3 -10.453   6.056  -0.532
   21    HG   LEU   3           HG       LEU   3 -10.743   3.665   1.292
   22   1HD1  LEU   3          HD11      LEU   3 -12.900   5.021   1.002
   23   2HD1  LEU   3          HD12      LEU   3 -12.849   4.498  -0.698
   24   3HD1  LEU   3          HD13      LEU   3 -12.947   3.287   0.603
   25   1HD2  LEU   3          HD21      LEU   3  -9.332   3.349  -0.673
   26   2HD2  LEU   3          HD22      LEU   3 -10.842   2.417  -0.817
   27   3HD2  LEU   3          HD23      LEU   3 -10.643   3.935  -1.726
   28    H    PHE   4           H        PHE   4  -6.950   4.081   0.848
   29    HA   PHE   4           HA       PHE   4  -5.649   5.466  -1.304
   30   1HB   PHE   4          HB2       PHE   4  -5.183   2.927   0.358
   31   2HB   PHE   4          HB3       PHE   4  -4.085   3.379  -0.931
   32    HD1  PHE   4           HD1      PHE   4  -5.309   4.253   2.410
   33    HD2  PHE   4           HD2      PHE   4  -2.579   5.257  -0.680
   34    HE1  PHE   4           HE1      PHE   4  -4.048   5.727   4.002
   35    HE2  PHE   4           HE2      PHE   4  -1.318   6.731   0.913
   36    HZ   PHE   4           HZ       PHE   4  -2.067   6.948   3.235
   37    H    VAL   5           H        VAL   5  -6.402   5.212  -3.361
   38    HA   VAL   5           HA       VAL   5  -7.582   2.655  -4.084
   39    HB   VAL   5           HB       VAL   5  -7.328   5.142  -5.771
   40   1HG1  VAL   5          HG11      VAL   5  -9.278   4.263  -6.925
   41   2HG1  VAL   5          HG12      VAL   5  -7.994   3.030  -6.892
   42   3HG1  VAL   5          HG13      VAL   5  -9.380   2.902  -5.782
   43   1HG2  VAL   5          HG21      VAL   5  -9.086   4.613  -3.426
   44   2HG2  VAL   5          HG22      VAL   5  -8.476   6.150  -4.085
   45   3HG2  VAL   5          HG23      VAL   5  -9.853   5.334  -4.862
   46    H    ALA   6           H        ALA   6  -6.554   1.128  -5.294
   47    HA   ALA   6           HA       ALA   6  -3.788   1.439  -5.791
   48   1HB   ALA   6          HB1       ALA   6  -5.752  -0.664  -6.787
   49   2HB   ALA   6          HB2       ALA   6  -3.980  -0.817  -6.723
   50   3HB   ALA   6          HB3       ALA   6  -4.919  -0.704  -5.215
   51    H    LEU   7           H        LEU   7  -2.664   1.776  -7.731
   52    HA   LEU   7           HA       LEU   7  -4.261   3.063  -9.785
   53   1HB   LEU   7          HB2       LEU   7  -1.988   3.820  -8.638
   54   2HB   LEU   7          HB3       LEU   7  -1.290   2.838  -9.911
   55    HG   LEU   7           HG       LEU   7  -2.727   4.218 -11.541
   56   1HD1  LEU   7          HD11      LEU   7  -3.535   5.403  -9.043
   57   2HD1  LEU   7          HD12      LEU   7  -2.767   6.627 -10.083
   58   3HD1  LEU   7          HD13      LEU   7  -4.152   5.687 -10.688
   59   1HD2  LEU   7          HD21      LEU   7  -0.467   4.593 -11.745
   60   2HD2  LEU   7          HD22      LEU   7  -1.043   6.210 -11.276
   61   3HD2  LEU   7          HD23      LEU   7  -0.291   5.147 -10.062
   62    H    TYR   8           H        TYR   8  -1.376   0.870  -9.973
   63    HA   TYR   8           HA       TYR   8  -2.916  -0.799 -11.826
   64   1HB   TYR   8          HB2       TYR   8  -0.407   0.848 -12.161
   65   2HB   TYR   8          HB3       TYR   8  -0.309  -0.773 -12.818
   66    HD1  TYR   8           HD1      TYR   8  -1.868   2.529 -13.157
   67    HD2  TYR   8           HD2      TYR   8  -1.708  -1.448 -14.726
   68    HE1  TYR   8           HE1      TYR   8  -3.060   3.304 -15.265
   69    HE2  TYR   8           HE2      TYR   8  -2.901  -0.660 -16.828
   70    HH   TYR   8           HH       TYR   8  -3.006   2.180 -17.880
   71    H    ASP   9           H        ASP   9  -0.787  -2.544 -12.509
   72    HA   ASP   9           HA       ASP   9  -0.689  -4.021 -10.083
   73   1HB   ASP   9          HB2       ASP   9  -0.736  -4.664 -12.774
   74   2HB   ASP   9          HB3       ASP   9   0.959  -4.915 -12.403
   75    HD2  ASP   9           HD2      ASP   9  -0.720  -7.039 -13.080
   76    H    TYR  10           H        TYR  10   1.214  -4.441  -8.825
   77    HA   TYR  10           HA       TYR  10   3.431  -2.637  -9.350
   78   1HB   TYR  10          HB2       TYR  10   2.213  -4.285  -7.122
   79   2HB   TYR  10          HB3       TYR  10   3.949  -4.063  -7.023
   80    HD1  TYR  10           HD1      TYR  10   4.712  -1.493  -7.440
   81    HD2  TYR  10           HD2      TYR  10   0.886  -2.753  -6.000
   82    HE1  TYR  10           HE1      TYR  10   4.352   0.788  -6.377
   83    HE2  TYR  10           HE2      TYR  10   0.538  -0.468  -4.942
   84    HH   TYR  10           HH       TYR  10   2.981   1.658  -4.406
   85    H    GLU  11           H        GLU  11   5.656  -3.746  -8.458
   86    HA   GLU  11           HA       GLU  11   5.897  -6.443  -9.356
   87   1HB   GLU  11          HB2       GLU  11   6.242  -4.470 -11.296
   88   2HB   GLU  11          HB3       GLU  11   7.885  -4.767 -10.764
   89   1HG   GLU  11          HG2       GLU  11   7.943  -6.712 -11.924
   90   2HG   GLU  11          HG3       GLU  11   6.578  -7.325 -11.012
   91    HE2  GLU  11           HE2      GLU  11   7.195  -4.988 -13.398
   92    H    ALA  12           H        ALA  12   6.709  -6.979  -7.310
   93    HA   ALA  12           HA       ALA  12   9.440  -6.250  -6.854
   94   1HB   ALA  12          HB1       ALA  12   7.855  -4.382  -5.875
   95   2HB   ALA  12          HB2       ALA  12   7.562  -5.581  -4.592
   96   3HB   ALA  12          HB3       ALA  12   9.214  -4.995  -4.902
   97    H    ARG  13           H        ARG  13  10.373  -8.144  -6.282
   98    HA   ARG  13           HA       ARG  13   8.625 -10.104  -5.053
   99   1HB   ARG  13          HB2       ARG  13  10.701 -10.221  -7.077
  100   2HB   ARG  13          HB3       ARG  13  11.191 -11.230  -5.732
  101   1HG   ARG  13          HG2       ARG  13   9.683 -12.825  -6.305
  102   2HG   ARG  13          HG3       ARG  13   8.368 -11.669  -6.234
  103   1HD   ARG  13          HD2       ARG  13  10.234 -11.838  -8.640
  104   2HD   ARG  13          HD3       ARG  13   8.792 -12.825  -8.516
  105    HE   ARG  13           HE       ARG  13   7.953 -10.190  -7.982
  106   1HH1  ARG  13          HH22      ARG  13   9.446 -11.915 -10.693
  107   2HH1  ARG  13          HH21      ARG  13   8.755 -10.876 -11.895
  108   1HH2  ARG  13          HH11      ARG  13   7.345  -9.063 -11.210
  109    H    THR  14           H        THR  14   9.448  -8.066  -3.324
  110    HA   THR  14           HA       THR  14  11.818  -9.041  -1.931
  111    HB   THR  14           HB       THR  14  10.028  -6.631  -1.338
  112    HG1  THR  14           HG1      THR  14  10.917  -6.700  -3.560
  113   1HG2  THR  14          HG21      THR  14  12.606  -5.892  -0.821
  114   2HG2  THR  14          HG22      THR  14  11.547  -6.593   0.426
  115   3HG2  THR  14          HG23      THR  14  12.716  -7.625  -0.433
  116    H    GLU  15           H        GLU  15  11.787  -9.422   0.404
  117    HA   GLU  15           HA       GLU  15   9.488 -11.008   1.019
  118   1HB   GLU  15          HB2       GLU  15  11.989 -11.581   1.470
  119   2HB   GLU  15          HB3       GLU  15  11.861 -10.506   2.847
  120   1HG   GLU  15          HG2       GLU  15  10.127 -11.852   3.865
  121   2HG   GLU  15          HG3       GLU  15   9.884 -12.779   2.397
  122    HE2  GLU  15           HE2      GLU  15  12.477 -14.676   2.469
  123    H    ASP  16           H        ASP  16  11.028  -7.947   2.066
  124    HA   ASP  16           HA       ASP  16   9.304  -7.662   4.292
  125   1HB   ASP  16          HB2       ASP  16  11.170  -5.759   2.813
  126   2HB   ASP  16          HB3       ASP  16  10.229  -5.245   4.199
  127    HD2  ASP  16           HD2      ASP  16  12.016  -8.174   3.649
  128    H    ASP  17           H        ASP  17   9.343  -6.823   0.839
  129    HA   ASP  17           HA       ASP  17   6.992  -5.159   1.235
  130   1HB   ASP  17          HB2       ASP  17   8.740  -5.493  -1.248
  131   2HB   ASP  17          HB3       ASP  17   7.431  -4.342  -1.069
  132    HD2  ASP  17           HD2      ASP  17   9.446  -4.007   1.867
  133    H    LEU  18           H        LEU  18   5.496  -5.379  -0.954
  134    HA   LEU  18           HA       LEU  18   5.468  -8.035  -2.037
  135   1HB   LEU  18          HB2       LEU  18   4.297  -7.948   0.334
  136   2HB   LEU  18          HB3       LEU  18   2.966  -7.286  -0.592
  137    HG   LEU  18           HG       LEU  18   3.284  -9.371  -2.120
  138   1HD1  LEU  18          HD11      LEU  18   5.473  -9.904  -0.781
  139   2HD1  LEU  18          HD12      LEU  18   4.347 -10.678   0.359
  140   3HD1  LEU  18          HD13      LEU  18   4.409 -11.218  -1.335
  141   1HD2  LEU  18          HD21      LEU  18   1.670  -8.795   0.109
  142   2HD2  LEU  18          HD22      LEU  18   1.361  -9.971  -1.191
  143   3HD2  LEU  18          HD23      LEU  18   2.184 -10.488   0.300
  144    H    SER  19           H        SER  19   3.922  -8.218  -3.828
  145    HA   SER  19           HA       SER  19   3.267  -5.557  -4.814
  146   1HB   SER  19          HB2       SER  19   3.358  -6.579  -7.083
  147   2HB   SER  19          HB3       SER  19   4.878  -6.744  -6.225
  148    HG   SER  19           HG       SER  19   4.278  -8.739  -7.249
  149    H    PHE  20           H        PHE  20   1.164  -5.177  -5.741
  150    HA   PHE  20           HA       PHE  20  -0.753  -7.347  -5.256
  151   1HB   PHE  20          HB2       PHE  20  -1.046  -4.305  -4.879
  152   2HB   PHE  20          HB3       PHE  20  -2.317  -5.472  -4.571
  153    HD1  PHE  20           HD1      PHE  20  -0.001  -3.476  -3.010
  154    HD2  PHE  20           HD2      PHE  20  -1.433  -7.470  -2.919
  155    HE1  PHE  20           HE1      PHE  20   0.782  -3.703  -0.637
  156    HE2  PHE  20           HE2      PHE  20  -0.649  -7.697  -0.546
  157    HZ   PHE  20           HZ       PHE  20   0.450  -5.811   0.566
  158    H    HIS  21           H        HIS  21  -3.038  -6.308  -6.315
  159    HA   HIS  21           HA       HIS  21  -2.241  -5.606  -9.047
  160   1HB   HIS  21          HB2       HIS  21  -4.738  -7.168  -8.472
  161   2HB   HIS  21          HB3       HIS  21  -3.796  -7.077  -9.948
  162    HD1  HIS  21           HD1      HIS  21  -1.797  -8.696 -10.213
  163    HD2  HIS  21           HD2      HIS  21  -3.726  -8.978  -6.499
  164    HE1  HIS  21           HE1      HIS  21  -0.896 -10.808  -9.097
  165    H    LYS  22           H        LYS  22  -4.369  -4.729 -10.264
  166    HA   LYS  22           HA       LYS  22  -5.066  -2.378  -8.820
  167   1HB   LYS  22          HB2       LYS  22  -6.508  -2.032 -10.941
  168   2HB   LYS  22          HB3       LYS  22  -4.762  -2.002 -11.084
  169   1HG   LYS  22          HG2       LYS  22  -4.737  -4.350 -11.849
  170   2HG   LYS  22          HG3       LYS  22  -6.464  -4.489 -11.584
  171   1HD   LYS  22          HD2       LYS  22  -6.908  -2.778 -13.316
  172   2HD   LYS  22          HD3       LYS  22  -5.190  -2.511 -13.532
  173   1HE   LYS  22          HE2       LYS  22  -4.917  -4.405 -14.805
  174   2HE   LYS  22          HE3       LYS  22  -5.991  -5.359 -13.801
  175   1HZ   LYS  22          HZ1       LYS  22  -6.797  -4.790 -16.139
  176   2HZ   LYS  22          HZ2       LYS  22  -7.868  -4.527 -14.941
  177    H    GLY  23           H        GLY  23  -7.238  -1.677  -8.255
  178   1HA   GLY  23          HA3       GLY  23  -9.465  -2.031  -7.773
  179   2HA   GLY  23          HA2       GLY  23  -9.299  -3.735  -8.152
  180    H    GLU  24           H        GLU  24  -6.960  -2.042  -6.055
  181    HA   GLU  24           HA       GLU  24  -8.033  -3.616  -3.847
  182   1HB   GLU  24          HB2       GLU  24  -5.236  -2.907  -4.696
  183   2HB   GLU  24          HB3       GLU  24  -5.542  -3.071  -2.979
  184   1HG   GLU  24          HG2       GLU  24  -6.675  -5.235  -4.713
  185   2HG   GLU  24          HG3       GLU  24  -4.926  -5.177  -4.613
  186    HE2  GLU  24           HE2      GLU  24  -4.343  -6.176  -1.865
  187    H    LYS  25           H        LYS  25  -8.077  -2.627  -1.700
  188    HA   LYS  25           HA       LYS  25  -7.764   0.282  -1.734
  189   1HB   LYS  25          HB2       LYS  25 -10.226  -1.275  -0.931
  190   2HB   LYS  25          HB3       LYS  25  -9.907   0.335  -0.315
  191   1HG   LYS  25          HG2       LYS  25 -10.128   1.345  -2.428
  192   2HG   LYS  25          HG3       LYS  25  -9.697  -0.115  -3.293
  193   1HD   LYS  25          HD2       LYS  25 -11.904  -0.537  -3.586
  194   2HD   LYS  25          HD3       LYS  25 -12.047  -0.798  -1.860
  195   1HE   LYS  25          HE2       LYS  25 -12.234   1.817  -1.689
  196   2HE   LYS  25          HE3       LYS  25 -12.539   1.769  -3.415
  197   1HZ   LYS  25          HZ1       LYS  25 -14.608   0.981  -3.047
  198   2HZ   LYS  25          HZ2       LYS  25 -14.120  -0.155  -1.986
  199    H    PHE  26           H        PHE  26  -6.580   1.010  -0.038
  200    HA   PHE  26           HA       PHE  26  -6.366  -0.794   2.266
  201   1HB   PHE  26          HB2       PHE  26  -4.222   1.002   0.981
  202   2HB   PHE  26          HB3       PHE  26  -3.954  -0.082   2.332
  203    HD1  PHE  26           HD1      PHE  26  -4.065   0.227  -1.243
  204    HD2  PHE  26           HD2      PHE  26  -4.148  -2.572   1.946
  205    HE1  PHE  26           HE1      PHE  26  -3.441  -1.609  -2.838
  206    HE2  PHE  26           HE2      PHE  26  -3.525  -4.408   0.351
  207    HZ   PHE  26           HZ       PHE  26  -3.178  -3.904  -2.022
  208    H    GLN  27           H        GLN  27  -5.580   0.372   4.286
  209    HA   GLN  27           HA       GLN  27  -6.745   3.043   4.273
  210   1HB   GLN  27          HB2       GLN  27  -6.442   1.066   6.576
  211   2HB   GLN  27          HB3       GLN  27  -7.135   2.669   6.718
  212   1HG   GLN  27          HG2       GLN  27  -8.580   1.621   4.587
  213   2HG   GLN  27          HG3       GLN  27  -8.318   0.195   5.572
  214   1HE2  GLN  27          HE21      GLN  27  -8.901   0.268   7.826
  215   2HE2  GLN  27          HE22      GLN  27 -10.226   1.248   8.361
  216    H    ILE  28           H        ILE  28  -5.763   4.133   6.601
  217    HA   ILE  28           HA       ILE  28  -2.882   4.179   6.051
  218    HB   ILE  28           HB       ILE  28  -3.978   6.262   5.584
  219   1HG1  ILE  28          HG12      ILE  28  -2.833   7.598   7.638
  220   2HG1  ILE  28          HG13      ILE  28  -2.069   6.036   7.852
  221   1HG2  ILE  28          HG21      ILE  28  -4.817   6.700   8.413
  222   2HG2  ILE  28          HG22      ILE  28  -5.490   7.347   6.899
  223   3HG2  ILE  28          HG23      ILE  28  -5.839   5.670   7.383
  224   1HD1  ILE  28          HD11      ILE  28  -2.166   7.522   5.186
  225   2HD1  ILE  28          HD12      ILE  28  -0.794   7.584   6.319
  226   3HD1  ILE  28          HD13      ILE  28  -1.245   6.043   5.549
  227    H    LEU  29           H        LEU  29  -1.408   4.350   7.894
  228    HA   LEU  29           HA       LEU  29  -2.536   3.717  10.480
  229   1HB   LEU  29          HB2       LEU  29  -1.532   1.679   8.735
  230   2HB   LEU  29          HB3       LEU  29  -0.443   1.843  10.098
  231    HG   LEU  29           HG       LEU  29  -3.418   1.570  10.507
  232   1HD1  LEU  29          HD11      LEU  29  -3.431  -0.531   9.804
  233   2HD1  LEU  29          HD12      LEU  29  -1.723  -0.395   9.320
  234   3HD1  LEU  29          HD13      LEU  29  -2.143  -0.931  10.965
  235   1HD2  LEU  29          HD21      LEU  29  -2.600   2.115  12.553
  236   2HD2  LEU  29          HD22      LEU  29  -2.313   0.360  12.614
  237   3HD2  LEU  29          HD23      LEU  29  -0.979   1.467  12.209
  238    H    ASN  30           H        ASN  30   0.790   2.984   9.413
  239    HA   ASN  30           HA       ASN  30   1.667   5.083  11.180
  240   1HB   ASN  30          HB2       ASN  30   2.634   2.485  10.452
  241   2HB   ASN  30          HB3       ASN  30   3.825   3.622   9.852
  242   1HD2  ASN  30          HD21      ASN  30   5.437   3.497  11.242
  243   2HD2  ASN  30          HD22      ASN  30   5.345   3.738  12.956
  244    H    SER  31           H        SER  31   2.749   6.957  10.415
  245    HA   SER  31           HA       SER  31   3.704   6.970   7.712
  246   1HB   SER  31          HB2       SER  31   1.191   7.647   7.733
  247   2HB   SER  31          HB3       SER  31   1.715   9.118   8.531
  248    HG   SER  31           HG       SER  31   1.771   8.528   5.881
  249    H    SER  32           H        SER  32   5.761   7.244   8.808
  250    HA   SER  32           HA       SER  32   6.008   9.561  10.491
  251   1HB   SER  32          HB2       SER  32   8.375   7.901   9.650
  252   2HB   SER  32          HB3       SER  32   8.048   8.658  11.196
  253    HG   SER  32           HG       SER  32   7.766   6.153  10.794
  254    H    GLU  33           H        GLU  33   8.638   8.518   8.329
  255    HA   GLU  33           HA       GLU  33   8.111  10.487   6.374
  256   1HB   GLU  33          HB2       GLU  33   9.616  11.292   8.717
  257   2HB   GLU  33          HB3       GLU  33  10.681  11.316   7.325
  258   1HG   GLU  33          HG2       GLU  33   7.915  12.532   7.098
  259   2HG   GLU  33          HG3       GLU  33   9.186  13.435   7.898
  260    HE2  GLU  33           HE2      GLU  33   8.266  13.219   4.432
  261    H    GLY  34           H        GLY  34   8.288   8.189   5.446
  262   1HA   GLY  34          HA3       GLY  34  11.029   7.814   4.498
  263   2HA   GLY  34          HA2       GLY  34  10.276   6.474   5.341
  264    H    ASP  35           H        ASP  35  10.926   5.803   2.864
  265    HA   ASP  35           HA       ASP  35   8.810   6.509   1.065
  266   1HB   ASP  35          HB2       ASP  35  11.047   4.466   0.698
  267   2HB   ASP  35          HB3       ASP  35  10.062   5.167  -0.571
  268    HD2  ASP  35           HD2      ASP  35  13.373   6.948   0.483
  269    H    TRP  36           H        TRP  36   9.955   3.821   3.132
  270    HA   TRP  36           HA       TRP  36   7.960   2.006   2.058
  271   1HB   TRP  36          HB2       TRP  36   9.818   1.462   4.360
  272   2HB   TRP  36          HB3       TRP  36   9.025   0.319   3.294
  273    HD1  TRP  36           HD1      TRP  36  12.337   1.791   3.781
  274    HE1  TRP  36           HE1      TRP  36  13.941   1.564   1.697
  275    HE3  TRP  36           HE3      TRP  36   8.696   0.564   0.451
  276    HZ2  TRP  36           HZ2      TRP  36  13.516   0.912  -1.048
  277    HZ3  TRP  36           HZ3      TRP  36   9.375   0.147  -1.912
  278    HH2  TRP  36           HH2      TRP  36  11.690   0.304  -2.679
  279    H    TRP  37           H        TRP  37   5.904   2.576   2.723
  280    HA   TRP  37           HA       TRP  37   5.593   3.299   5.551
  281   1HB   TRP  37          HB2       TRP  37   4.238   4.117   3.044
  282   2HB   TRP  37          HB3       TRP  37   3.210   3.903   4.448
  283    HD1  TRP  37           HD1      TRP  37   5.634   5.047   6.507
  284    HE1  TRP  37           HE1      TRP  37   6.001   7.651   6.727
  285    HE3  TRP  37           HE3      TRP  37   3.335   6.270   2.140
  286    HZ2  TRP  37           HZ2      TRP  37   5.303   9.880   5.088
  287    HZ3  TRP  37           HZ3      TRP  37   3.221   8.683   1.524
  288    HH2  TRP  37           HH2      TRP  37   4.157  10.459   2.918
  289    H    GLU  38           H        GLU  38   3.362   2.473   6.444
  290    HA   GLU  38           HA       GLU  38   3.294  -0.345   5.812
  291   1HB   GLU  38          HB2       GLU  38   3.401   0.850   8.212
  292   2HB   GLU  38          HB3       GLU  38   1.659   0.874   8.029
  293   1HG   GLU  38          HG2       GLU  38   1.539  -1.529   7.829
  294   2HG   GLU  38          HG3       GLU  38   3.268  -1.672   7.581
  295    HE2  GLU  38           HE2      GLU  38   4.052   0.042   9.775
  296    H    ALA  39           H        ALA  39   1.370  -1.464   5.195
  297    HA   ALA  39           HA       ALA  39  -0.926   0.251   4.585
  298   1HB   ALA  39          HB1       ALA  39   0.899  -0.927   2.700
  299   2HB   ALA  39          HB2       ALA  39  -0.677  -1.739   2.551
  300   3HB   ALA  39          HB3       ALA  39  -0.567   0.029   2.380
  301    H    ARG  40           H        ARG  40  -2.861  -0.641   5.192
  302    HA   ARG  40           HA       ARG  40  -2.698  -3.420   6.048
  303   1HB   ARG  40          HB2       ARG  40  -3.115  -1.648   7.845
  304   2HB   ARG  40          HB3       ARG  40  -4.633  -1.272   7.052
  305   1HG   ARG  40          HG2       ARG  40  -5.065  -3.890   7.262
  306   2HG   ARG  40          HG3       ARG  40  -3.833  -3.806   8.505
  307   1HD   ARG  40          HD2       ARG  40  -6.044  -1.758   8.607
  308   2HD   ARG  40          HD3       ARG  40  -6.449  -3.404   9.055
  309    HE   ARG  40           HE       ARG  40  -4.107  -2.915  10.464
  310   1HH1  ARG  40          HH22      ARG  40  -7.234  -1.261  10.246
  311   2HH1  ARG  40          HH21      ARG  40  -7.151  -0.630  11.857
  312   1HH2  ARG  40          HH11      ARG  40  -5.242  -1.126  13.217
  313    H    SER  41           H        SER  41  -4.197  -4.881   5.183
  314    HA   SER  41           HA       SER  41  -5.938  -3.764   3.164
  315   1HB   SER  41          HB2       SER  41  -5.069  -6.625   3.762
  316   2HB   SER  41          HB3       SER  41  -6.194  -6.202   2.487
  317    HG   SER  41           HG       SER  41  -3.966  -6.405   1.737
  318    H    LEU  42           H        LEU  42  -8.185  -3.804   3.326
  319    HA   LEU  42           HA       LEU  42  -9.242  -4.625   5.890
  320   1HB   LEU  42          HB2       LEU  42 -11.337  -3.682   4.366
  321   2HB   LEU  42          HB3       LEU  42 -10.406  -2.787   5.551
  322    HG   LEU  42           HG       LEU  42  -8.805  -2.276   3.547
  323   1HD1  LEU  42          HD11      LEU  42 -10.124  -2.071   1.397
  324   2HD1  LEU  42          HD12      LEU  42  -9.652  -3.719   1.875
  325   3HD1  LEU  42          HD13      LEU  42 -11.324  -3.162   2.131
  326   1HD2  LEU  42          HD21      LEU  42 -11.532  -0.993   3.849
  327   2HD2  LEU  42          HD22      LEU  42 -10.044  -0.572   4.727
  328   3HD2  LEU  42          HD23      LEU  42 -10.155  -0.282   2.974
  329    H    THR  43           H        THR  43  -8.605  -6.073   2.895
  330    HA   THR  43           HA       THR  43 -10.975  -7.771   2.962
  331    HB   THR  43           HB       THR  43  -8.834  -8.343   0.997
  332    HG1  THR  43           HG1      THR  43  -8.424  -6.097   1.130
  333   1HG2  THR  43          HG21      THR  43 -10.653  -8.055  -0.602
  334   2HG2  THR  43          HG22      THR  43 -11.325  -8.941   0.789
  335   3HG2  THR  43          HG23      THR  43 -11.645  -7.199   0.603
  336    H    THR  44           H        THR  44  -7.532  -8.655   2.358
  337    HA   THR  44           HA       THR  44  -7.961 -11.062   3.903
  338    HB   THR  44           HB       THR  44  -5.658 -11.575   3.007
  339    HG1  THR  44           HG1      THR  44  -4.937  -9.788   1.470
  340   1HG2  THR  44          HG21      THR  44  -6.803 -10.386   0.557
  341   2HG2  THR  44          HG22      THR  44  -6.499 -12.098   0.938
  342   3HG2  THR  44          HG23      THR  44  -8.008 -11.322   1.476
  343    H    GLY  45           H        GLY  45  -5.978  -8.058   4.109
  344   1HA   GLY  45          HA3       GLY  45  -5.573  -7.034   6.187
  345   2HA   GLY  45          HA2       GLY  45  -5.717  -8.585   6.990
  346    H    GLU  46           H        GLU  46  -3.950  -8.621   3.969
  347    HA   GLU  46           HA       GLU  46  -1.610  -9.398   5.348
  348   1HB   GLU  46          HB2       GLU  46  -2.271  -8.938   2.416
  349   2HB   GLU  46          HB3       GLU  46  -0.661  -9.391   2.935
  350   1HG   GLU  46          HG2       GLU  46  -1.972 -11.307   4.269
  351   2HG   GLU  46          HG3       GLU  46  -3.220 -10.992   3.080
  352    HE2  GLU  46           HE2      GLU  46  -0.832 -13.544   2.480
  353    H    THR  47           H        THR  47   0.176  -8.191   5.912
  354    HA   THR  47           HA       THR  47   0.039  -5.338   5.307
  355    HB   THR  47           HB       THR  47   1.842  -6.913   7.218
  356    HG1  THR  47           HG1      THR  47  -0.044  -6.985   8.369
  357   1HG2  THR  47          HG21      THR  47   2.740  -4.857   7.653
  358   2HG2  THR  47          HG22      THR  47   1.635  -4.092   6.486
  359   3HG2  THR  47          HG23      THR  47   1.125  -4.321   8.175
  360    H    GLY  48           H        GLY  48   1.944  -4.148   4.608
  361   1HA   GLY  48          HA3       GLY  48   4.227  -5.480   3.592
  362   2HA   GLY  48          HA2       GLY  48   3.078  -5.195   2.299
  363    H    TYR  49           H        TYR  49   5.735  -3.968   2.623
  364    HA   TYR  49           HA       TYR  49   5.012  -1.192   3.232
  365   1HB   TYR  49          HB2       TYR  49   7.555  -2.888   2.981
  366   2HB   TYR  49          HB3       TYR  49   7.673  -1.140   2.946
  367    HD1  TYR  49           HD1      TYR  49   6.232  -3.894   5.045
  368    HD2  TYR  49           HD2      TYR  49   7.962   0.017   4.948
  369    HE1  TYR  49           HE1      TYR  49   6.266  -3.839   7.587
  370    HE2  TYR  49           HE2      TYR  49   7.991   0.059   7.490
  371    HH   TYR  49           HH       TYR  49   8.000  -1.454   9.314
  372    H    ILE  50           H        ILE  50   4.200  -0.180   1.442
  373    HA   ILE  50           HA       ILE  50   5.698  -0.594  -1.053
  374    HB   ILE  50           HB       ILE  50   3.279   0.377  -1.844
  375   1HG1  ILE  50          HG12      ILE  50   1.871  -1.549  -0.484
  376   2HG1  ILE  50          HG13      ILE  50   2.900  -0.909   0.782
  377   1HG2  ILE  50          HG21      ILE  50   3.622  -1.368  -3.167
  378   2HG2  ILE  50          HG22      ILE  50   4.785  -2.060  -2.011
  379   3HG2  ILE  50          HG23      ILE  50   3.053  -2.442  -1.866
  380   1HD1  ILE  50          HD11      ILE  50   1.938   1.202   0.704
  381   2HD1  ILE  50          HD12      ILE  50   1.570   1.086  -1.033
  382   3HD1  ILE  50          HD13      ILE  50   0.549   0.235   0.151
  383    HA   PRO  51           HA       PRO  51   6.268   3.699  -1.044
  384   1HB   PRO  51          HB2       PRO  51   6.584   4.264  -3.700
  385   2HB   PRO  51          HB3       PRO  51   7.842   3.539  -2.718
  386   1HG   PRO  51          HG2       PRO  51   6.107   2.265  -4.744
  387   2HG   PRO  51          HG3       PRO  51   7.619   1.686  -4.074
  388   1HD   PRO  51          HD2       PRO  51   4.985   0.770  -3.406
  389   2HD   PRO  51          HD3       PRO  51   6.489   0.275  -2.655
  390    H    SER  52           H        SER  52   5.596   5.918  -1.769
  391    HA   SER  52           HA       SER  52   2.728   5.725  -2.248
  392   1HB   SER  52          HB2       SER  52   3.633   6.736  -0.042
  393   2HB   SER  52          HB3       SER  52   4.177   8.094  -1.008
  394    HG   SER  52           HG       SER  52   2.170   8.766  -0.466
  395    H    ASN  53           H        ASN  53   4.402   5.523  -4.478
  396    HA   ASN  53           HA       ASN  53   4.337   8.223  -5.570
  397   1HB   ASN  53          HB2       ASN  53   6.333   6.144  -5.647
  398   2HB   ASN  53          HB3       ASN  53   5.728   6.324  -7.282
  399   1HD2  ASN  53          HD21      ASN  53   7.775   7.522  -4.906
  400   2HD2  ASN  53          HD22      ASN  53   8.239   9.026  -5.628
  401    H    TYR  54           H        TYR  54   2.476   5.513  -5.334
  402    HA   TYR  54           HA       TYR  54   1.367   5.886  -8.018
  403   1HB   TYR  54          HB2       TYR  54   2.431   3.427  -6.580
  404   2HB   TYR  54          HB3       TYR  54   0.984   3.203  -7.543
  405    HD1  TYR  54           HD1      TYR  54   4.170   2.395  -7.740
  406    HD2  TYR  54           HD2      TYR  54   1.465   4.926  -9.879
  407    HE1  TYR  54           HE1      TYR  54   5.593   2.158  -9.834
  408    HE2  TYR  54           HE2      TYR  54   2.898   4.681 -11.966
  409    HH   TYR  54           HH       TYR  54   6.024   3.190 -11.840
  410    H    VAL  55           H        VAL  55   0.356   7.192  -5.801
  411    HA   VAL  55           HA       VAL  55  -2.034   5.584  -5.224
  412    HB   VAL  55           HB       VAL  55  -1.904   7.310  -3.137
  413   1HG1  VAL  55          HG11      VAL  55  -2.126   4.691  -3.370
  414   2HG1  VAL  55          HG12      VAL  55  -0.411   4.717  -2.895
  415   3HG1  VAL  55          HG13      VAL  55  -1.642   5.430  -1.824
  416   1HG2  VAL  55          HG21      VAL  55   0.737   6.573  -2.576
  417   2HG2  VAL  55          HG22      VAL  55   0.782   7.189  -4.245
  418   3HG2  VAL  55          HG23      VAL  55   0.133   8.208  -2.938
  419    H    ALA  56           H        ALA  56  -4.039   6.755  -5.163
  420    HA   ALA  56           HA       ALA  56  -3.833   9.442  -6.336
  421   1HB   ALA  56          HB1       ALA  56  -5.290   8.885  -7.998
  422   2HB   ALA  56          HB2       ALA  56  -4.707   7.234  -7.678
  423   3HB   ALA  56          HB3       ALA  56  -6.231   7.796  -6.949
  424    HA   PRO  57           HA       PRO  57  -6.691  10.300  -3.142
  425   1HB   PRO  57          HB2       PRO  57  -6.671  13.024  -3.365
  426   2HB   PRO  57          HB3       PRO  57  -5.411  12.120  -2.548
  427   1HG   PRO  57          HG2       PRO  57  -5.340  13.413  -5.206
  428   2HG   PRO  57          HG3       PRO  57  -4.001  12.887  -4.205
  429   1HD   PRO  57          HD2       PRO  57  -5.031  11.559  -6.529
  430   2HD   PRO  57          HD3       PRO  57  -3.771  10.976  -5.462
  431    H    VAL  58           H        VAL  58  -8.709   9.526  -3.373
  432    HA   VAL  58           HA       VAL  58 -10.303  10.737  -5.465
  433    HB   VAL  58           HB       VAL  58 -11.949   9.025  -4.790
  434   1HG1  VAL  58          HG11      VAL  58  -9.787   8.701  -6.327
  435   2HG1  VAL  58          HG12      VAL  58  -9.395   7.501  -5.071
  436   3HG1  VAL  58          HG13      VAL  58 -10.917   7.370  -5.984
  437   1HG2  VAL  58          HG21      VAL  58 -11.096   9.006  -2.354
  438   2HG2  VAL  58          HG22      VAL  58 -11.587   7.458  -3.081
  439   3HG2  VAL  58          HG23      VAL  58  -9.861   7.867  -2.941
  440    H    ASP  59           H        ASP  59 -12.745  11.140  -4.721
  441    HA   ASP  59           HA       ASP  59 -12.667  12.528  -2.171
  442   1HB   ASP  59          HB2       ASP  59 -14.355  13.916  -4.107
  443   2HB   ASP  59          HB3       ASP  59 -13.078  14.564  -3.098
  444    HD2  ASP  59           HD2      ASP  59 -11.902  15.683  -4.455
  Start of MODEL    9
    1   1H    VAL   1           H        VAL   1  -4.562  10.460   2.986
    2    HA   VAL   1           HA       VAL   1  -4.860  12.194   4.628
    3    HB   VAL   1           HB       VAL   1  -7.229  13.409   4.005
    4   1HG1  VAL   1          HG11      VAL   1  -5.039  14.976   2.953
    5   2HG1  VAL   1          HG12      VAL   1  -5.958  15.184   4.462
    6   3HG1  VAL   1          HG13      VAL   1  -4.533  14.119   4.428
    7   1HG2  VAL   1          HG21      VAL   1  -7.534  13.782   1.793
    8   2HG2  VAL   1          HG22      VAL   1  -5.789  13.831   1.449
    9   3HG2  VAL   1          HG23      VAL   1  -6.619  12.266   1.615
   10    H    THR   2           H        THR   2  -7.440  10.505   2.741
   11    HA   THR   2           HA       THR   2  -8.376   9.390   5.304
   12    HB   THR   2           HB       THR   2 -10.615   9.252   3.968
   13    HG1  THR   2           HG1      THR   2 -10.377  11.188   2.324
   14   1HG2  THR   2          HG21      THR   2 -10.731  11.973   4.019
   15   2HG2  THR   2          HG22      THR   2 -10.834  10.994   5.502
   16   3HG2  THR   2          HG23      THR   2  -9.285  11.734   5.030
   17    H    LEU   3           H        LEU   3  -9.197   8.529   1.913
   18    HA   LEU   3           HA       LEU   3  -7.975   5.914   2.468
   19   1HB   LEU   3          HB2       LEU   3  -9.850   5.381   0.585
   20   2HB   LEU   3          HB3       LEU   3 -10.045   5.144   2.310
   21    HG   LEU   3           HG       LEU   3 -10.734   7.864   1.628
   22   1HD1  LEU   3          HD11      LEU   3 -12.923   6.795   0.393
   23   2HD1  LEU   3          HD12      LEU   3 -11.559   7.581  -0.436
   24   3HD1  LEU   3          HD13      LEU   3 -11.607   5.808  -0.288
   25   1HD2  LEU   3          HD21      LEU   3 -11.424   6.608   3.650
   26   2HD2  LEU   3          HD22      LEU   3 -12.794   7.324   2.767
   27   3HD2  LEU   3          HD23      LEU   3 -12.459   5.581   2.629
   28    H    PHE   4           H        PHE   4  -7.379   4.720   0.370
   29    HA   PHE   4           HA       PHE   4  -6.768   6.494  -1.826
   30   1HB   PHE   4          HB2       PHE   4  -4.852   5.413   0.229
   31   2HB   PHE   4          HB3       PHE   4  -4.331   5.187  -1.429
   32    HD1  PHE   4           HD1      PHE   4  -5.382   7.684  -2.669
   33    HD2  PHE   4           HD2      PHE   4  -3.401   7.053   1.030
   34    HE1  PHE   4           HE1      PHE   4  -4.531  10.044  -2.722
   35    HE2  PHE   4           HE2      PHE   4  -2.550   9.414   0.977
   36    HZ   PHE   4           HZ       PHE   4  -3.124  10.881  -0.900
   37    H    VAL   5           H        VAL   5  -6.543   5.389  -3.796
   38    HA   VAL   5           HA       VAL   5  -6.724   2.463  -3.587
   39    HB   VAL   5           HB       VAL   5  -8.084   2.698  -5.741
   40   1HG1  VAL   5          HG11      VAL   5 -10.000   3.742  -3.930
   41   2HG1  VAL   5          HG12      VAL   5  -9.671   2.037  -4.323
   42   3HG1  VAL   5          HG13      VAL   5  -8.826   2.817  -2.964
   43   1HG2  VAL   5          HG21      VAL   5  -7.692   5.512  -5.046
   44   2HG2  VAL   5          HG22      VAL   5  -8.254   4.773  -6.566
   45   3HG2  VAL   5          HG23      VAL   5  -9.410   5.089  -5.249
   46    H    ALA   6           H        ALA   6  -5.209   1.344  -4.732
   47    HA   ALA   6           HA       ALA   6  -3.369   2.946  -6.323
   48   1HB   ALA   6          HB1       ALA   6  -2.339   0.401  -6.215
   49   2HB   ALA   6          HB2       ALA   6  -2.000   1.682  -5.026
   50   3HB   ALA   6          HB3       ALA   6  -3.266   0.474  -4.697
   51    H    LEU   7           H        LEU   7  -2.970   2.571  -8.522
   52    HA   LEU   7           HA       LEU   7  -4.769   0.616  -9.775
   53   1HB   LEU   7          HB2       LEU   7  -4.051   3.354 -10.831
   54   2HB   LEU   7          HB3       LEU   7  -5.054   2.164 -11.635
   55    HG   LEU   7           HG       LEU   7  -6.333   2.457  -9.205
   56   1HD1  LEU   7          HD11      LEU   7  -6.536   5.144  -9.394
   57   2HD1  LEU   7          HD12      LEU   7  -5.454   4.304  -8.259
   58   3HD1  LEU   7          HD13      LEU   7  -4.817   4.929  -9.798
   59   1HD2  LEU   7          HD21      LEU   7  -7.658   4.231 -10.841
   60   2HD2  LEU   7          HD22      LEU   7  -6.769   3.216 -12.000
   61   3HD2  LEU   7          HD23      LEU   7  -7.873   2.465 -10.822
   62    H    TYR   8           H        TYR   8  -2.022   0.246  -8.808
   63    HA   TYR   8           HA       TYR   8  -0.893  -0.615 -11.328
   64   1HB   TYR   8          HB2       TYR   8  -0.001   1.680  -9.616
   65   2HB   TYR   8          HB3       TYR   8   1.286   0.538  -9.947
   66    HD1  TYR   8           HD1      TYR   8   1.016  -0.291 -12.655
   67    HD2  TYR   8           HD2      TYR   8   0.146   3.547 -10.975
   68    HE1  TYR   8           HE1      TYR   8   1.387   0.795 -14.924
   69    HE2  TYR   8           HE2      TYR   8   0.521   4.619 -13.249
   70    HH   TYR   8           HH       TYR   8   0.514   4.068 -15.520
   71    H    ASP   9           H        ASP   9  -0.350  -2.708 -10.996
   72    HA   ASP   9           HA       ASP   9   0.220  -3.491  -8.273
   73   1HB   ASP   9          HB2       ASP   9   0.193  -5.528 -10.456
   74   2HB   ASP   9          HB3       ASP   9  -0.526  -5.603  -8.859
   75    HD2  ASP   9           HD2      ASP   9  -2.319  -5.783 -11.785
   76    H    TYR  10           H        TYR  10   2.028  -5.318  -8.129
   77    HA   TYR  10           HA       TYR  10   4.041  -5.277 -10.152
   78   1HB   TYR  10          HB2       TYR  10   3.966  -3.305  -7.992
   79   2HB   TYR  10          HB3       TYR  10   5.304  -4.390  -7.675
   80    HD1  TYR  10           HD1      TYR  10   4.059  -1.693  -9.771
   81    HD2  TYR  10           HD2      TYR  10   7.156  -4.616  -9.351
   82    HE1  TYR  10           HE1      TYR  10   5.499  -0.419 -11.434
   83    HE2  TYR  10           HE2      TYR  10   8.585  -3.332 -11.016
   84    HH   TYR  10           HH       TYR  10   7.383  -1.068 -13.050
   85    H    GLU  11           H        GLU  11   4.391  -7.453 -10.156
   86    HA   GLU  11           HA       GLU  11   4.205  -8.909  -7.725
   87   1HB   GLU  11          HB2       GLU  11   4.043  -9.485 -10.501
   88   2HB   GLU  11          HB3       GLU  11   5.423 -10.395  -9.920
   89   1HG   GLU  11          HG2       GLU  11   4.111 -11.569  -8.288
   90   2HG   GLU  11          HG3       GLU  11   2.786 -10.427  -8.405
   91    HE2  GLU  11           HE2      GLU  11   3.435 -11.228 -11.772
   92    H    ALA  12           H        ALA  12   5.824  -9.021  -6.236
   93    HA   ALA  12           HA       ALA  12   8.570  -8.721  -7.239
   94   1HB   ALA  12          HB1       ALA  12   8.803  -7.188  -5.617
   95   2HB   ALA  12          HB2       ALA  12   7.101  -7.421  -5.152
   96   3HB   ALA  12          HB3       ALA  12   8.373  -8.408  -4.393
   97    H    ARG  13           H        ARG  13  10.128 -10.264  -6.685
   98    HA   ARG  13           HA       ARG  13   9.063 -12.531  -5.200
   99   1HB   ARG  13          HB2       ARG  13   9.526 -12.700  -7.839
  100   2HB   ARG  13          HB3       ARG  13  11.187 -12.911  -7.325
  101   1HG   ARG  13          HG2       ARG  13  10.664 -14.891  -6.061
  102   2HG   ARG  13          HG3       ARG  13   8.942 -14.566  -6.106
  103   1HD   ARG  13          HD2       ARG  13   8.905 -14.955  -8.562
  104   2HD   ARG  13          HD3       ARG  13  10.640 -15.205  -8.567
  105    HE   ARG  13           HE       ARG  13   8.596 -17.075  -7.532
  106   1HH1  ARG  13          HH22      ARG  13  12.043 -16.288  -7.769
  107   2HH1  ARG  13          HH21      ARG  13  12.563 -17.898  -7.398
  108   1HH2  ARG  13          HH11      ARG  13  10.922 -19.593  -6.974
  109    H    THR  14           H        THR  14  10.399 -10.439  -3.895
  110    HA   THR  14           HA       THR  14  13.100 -11.542  -3.479
  111    HB   THR  14           HB       THR  14  12.230  -8.728  -2.737
  112    HG1  THR  14           HG1      THR  14  13.192  -8.408  -5.057
  113   1HG2  THR  14          HG21      THR  14  14.749  -8.806  -4.031
  114   2HG2  THR  14          HG22      THR  14  14.471  -8.624  -2.282
  115   3HG2  THR  14          HG23      THR  14  14.738 -10.241  -2.977
  116    H    GLU  15           H        GLU  15  13.597 -10.154  -1.041
  117    HA   GLU  15           HA       GLU  15  11.612 -11.445   0.662
  118   1HB   GLU  15          HB2       GLU  15  14.296 -12.211   0.367
  119   2HB   GLU  15          HB3       GLU  15  14.301 -11.266   1.843
  120   1HG   GLU  15          HG2       GLU  15  12.016 -12.791   2.194
  121   2HG   GLU  15          HG3       GLU  15  13.025 -13.899   1.285
  122    HE2  GLU  15           HE2      GLU  15  15.421 -12.411   2.727
  123    H    ASP  16           H        ASP  16  11.781  -8.641  -0.316
  124    HA   ASP  16           HA       ASP  16  12.303  -7.366   2.256
  125   1HB   ASP  16          HB2       ASP  16  13.278  -6.744  -0.369
  126   2HB   ASP  16          HB3       ASP  16  12.141  -5.479   0.048
  127    HD2  ASP  16           HD2      ASP  16  15.740  -5.510   1.572
  128    H    ASP  17           H        ASP  17  10.553  -6.747  -0.894
  129    HA   ASP  17           HA       ASP  17   8.320  -5.776   0.685
  130   1HB   ASP  17          HB2       ASP  17   7.647  -5.213  -1.911
  131   2HB   ASP  17          HB3       ASP  17   8.536  -4.115  -0.874
  132    HD2  ASP  17           HD2      ASP  17   9.115  -6.727  -3.052
  133    H    LEU  18           H        LEU  18   6.261  -6.113  -1.283
  134    HA   LEU  18           HA       LEU  18   6.303  -8.949  -1.952
  135   1HB   LEU  18          HB2       LEU  18   5.212  -8.290   0.378
  136   2HB   LEU  18          HB3       LEU  18   3.849  -7.878  -0.644
  137    HG   LEU  18           HG       LEU  18   4.238 -10.295  -1.632
  138   1HD1  LEU  18          HD11      LEU  18   5.782 -10.319   0.937
  139   2HD1  LEU  18          HD12      LEU  18   4.875 -11.769   0.442
  140   3HD1  LEU  18          HD13      LEU  18   6.138 -11.104  -0.621
  141   1HD2  LEU  18          HD21      LEU  18   2.159  -9.858  -0.705
  142   2HD2  LEU  18          HD22      LEU  18   2.776 -11.172   0.324
  143   3HD2  LEU  18          HD23      LEU  18   2.832  -9.489   0.900
  144    H    SER  19           H        SER  19   3.243  -8.500  -2.396
  145    HA   SER  19           HA       SER  19   3.474  -6.710  -4.670
  146   1HB   SER  19          HB2       SER  19   2.102  -8.422  -6.007
  147   2HB   SER  19          HB3       SER  19   3.790  -8.810  -5.743
  148    HG   SER  19           HG       SER  19   2.311 -10.615  -5.328
  149    H    PHE  20           H        PHE  20   1.430  -5.731  -5.296
  150    HA   PHE  20           HA       PHE  20  -0.761  -6.290  -3.429
  151   1HB   PHE  20          HB2       PHE  20   0.729  -4.144  -3.072
  152   2HB   PHE  20          HB3       PHE  20   0.048  -3.561  -4.578
  153    HD1  PHE  20           HD1      PHE  20  -1.216  -5.078  -1.400
  154    HD2  PHE  20           HD2      PHE  20  -1.704  -2.093  -4.375
  155    HE1  PHE  20           HE1      PHE  20  -3.190  -4.158  -0.153
  156    HE2  PHE  20           HE2      PHE  20  -3.679  -1.172  -3.128
  157    HZ   PHE  20           HZ       PHE  20  -4.398  -2.216  -1.032
  158    H    HIS  21           H        HIS  21  -2.856  -6.218  -4.303
  159    HA   HIS  21           HA       HIS  21  -2.891  -5.962  -7.217
  160   1HB   HIS  21          HB2       HIS  21  -4.234  -7.757  -5.276
  161   2HB   HIS  21          HB3       HIS  21  -5.236  -7.193  -6.599
  162    HD1  HIS  21           HD1      HIS  21  -5.150  -9.859  -7.224
  163    HD2  HIS  21           HD2      HIS  21  -1.622  -7.660  -7.790
  164    HE1  HIS  21           HE1      HIS  21  -3.679 -11.255  -8.773
  165    H    LYS  22           H        LYS  22  -4.362  -4.576  -8.235
  166    HA   LYS  22           HA       LYS  22  -5.305  -2.437  -6.599
  167   1HB   LYS  22          HB2       LYS  22  -6.092  -1.517  -8.776
  168   2HB   LYS  22          HB3       LYS  22  -4.387  -1.917  -8.745
  169   1HG   LYS  22          HG2       LYS  22  -4.612  -3.613 -10.286
  170   2HG   LYS  22          HG3       LYS  22  -6.143  -4.154  -9.625
  171   1HD   LYS  22          HD2       LYS  22  -6.671  -1.575 -10.702
  172   2HD   LYS  22          HD3       LYS  22  -5.640  -2.361 -11.882
  173   1HE   LYS  22          HE2       LYS  22  -8.141  -3.656 -10.698
  174   2HE   LYS  22          HE3       LYS  22  -8.130  -2.773 -12.212
  175   1HZ   LYS  22          HZ1       LYS  22  -6.133  -4.888 -11.925
  176   2HZ   LYS  22          HZ2       LYS  22  -7.677  -5.372 -12.116
  177    H    GLY  23           H        GLY  23  -7.732  -1.655  -7.485
  178   1HA   GLY  23          HA3       GLY  23  -9.956  -2.091  -7.502
  179   2HA   GLY  23          HA2       GLY  23  -9.621  -3.807  -7.622
  180    H    GLU  24           H        GLU  24  -7.733  -2.641  -5.077
  181    HA   GLU  24           HA       GLU  24  -9.790  -3.481  -3.196
  182   1HB   GLU  24          HB2       GLU  24  -6.878  -3.938  -3.415
  183   2HB   GLU  24          HB3       GLU  24  -7.374  -3.460  -1.804
  184   1HG   GLU  24          HG2       GLU  24  -8.466  -5.434  -1.419
  185   2HG   GLU  24          HG3       GLU  24  -9.201  -5.450  -3.009
  186    HE2  GLU  24           HE2      GLU  24  -6.906  -6.657  -1.109
  187    H    LYS  25           H        LYS  25  -8.187  -2.422  -0.892
  188    HA   LYS  25           HA       LYS  25  -8.446   0.454  -1.374
  189   1HB   LYS  25          HB2       LYS  25  -9.596   0.704   0.794
  190   2HB   LYS  25          HB3       LYS  25 -10.539  -0.205  -0.370
  191   1HG   LYS  25          HG2       LYS  25 -10.307  -2.214   0.783
  192   2HG   LYS  25          HG3       LYS  25  -8.726  -1.800   1.417
  193   1HD   LYS  25          HD2       LYS  25 -10.127  -1.690   3.325
  194   2HD   LYS  25          HD3       LYS  25  -9.952  -0.011   2.855
  195   1HE   LYS  25          HE2       LYS  25 -12.132  -0.393   1.441
  196   2HE   LYS  25          HE3       LYS  25 -12.336  -1.844   2.404
  197   1HZ   LYS  25          HZ1       LYS  25 -12.500  -0.563   4.371
  198   2HZ   LYS  25          HZ2       LYS  25 -11.892   0.786   3.690
  199    H    PHE  26           H        PHE  26  -7.422   1.695   0.571
  200    HA   PHE  26           HA       PHE  26  -5.211   0.150   1.688
  201   1HB   PHE  26          HB2       PHE  26  -5.012   1.832  -0.553
  202   2HB   PHE  26          HB3       PHE  26  -4.644   2.944   0.751
  203    HD1  PHE  26           HD1      PHE  26  -2.639   2.646   2.114
  204    HD2  PHE  26           HD2      PHE  26  -3.503   0.019  -1.106
  205    HE1  PHE  26           HE1      PHE  26  -0.274   1.803   2.166
  206    HE2  PHE  26           HE2      PHE  26  -1.140  -0.823  -1.053
  207    HZ   PHE  26           HZ       PHE  26   0.447   0.079   0.582
  208    H    GLN  27           H        GLN  27  -5.415   0.376   3.864
  209    HA   GLN  27           HA       GLN  27  -6.530   2.876   4.819
  210   1HB   GLN  27          HB2       GLN  27  -6.199   0.126   6.070
  211   2HB   GLN  27          HB3       GLN  27  -6.613   1.526   7.039
  212   1HG   GLN  27          HG2       GLN  27  -8.476   1.877   5.136
  213   2HG   GLN  27          HG3       GLN  27  -8.235   0.159   4.891
  214   1HE2  GLN  27          HE21      GLN  27  -8.142   2.214   7.795
  215   2HE2  GLN  27          HE22      GLN  27  -9.353   1.371   8.702
  216    H    ILE  28           H        ILE  28  -5.399   4.271   6.211
  217    HA   ILE  28           HA       ILE  28  -2.546   3.927   6.185
  218    HB   ILE  28           HB       ILE  28  -4.228   6.110   7.419
  219   1HG1  ILE  28          HG12      ILE  28  -2.939   6.196   4.688
  220   2HG1  ILE  28          HG13      ILE  28  -4.580   5.624   4.915
  221   1HG2  ILE  28          HG21      ILE  28  -2.313   6.964   8.136
  222   2HG2  ILE  28          HG22      ILE  28  -1.424   5.575   7.467
  223   3HG2  ILE  28          HG23      ILE  28  -1.708   7.016   6.462
  224   1HD1  ILE  28          HD11      ILE  28  -3.986   8.234   4.482
  225   2HD1  ILE  28          HD12      ILE  28  -5.397   7.719   5.437
  226   3HD1  ILE  28          HD13      ILE  28  -3.898   8.213   6.260
  227    H    LEU  29           H        LEU  29  -1.246   3.247   7.837
  228    HA   LEU  29           HA       LEU  29  -2.620   2.687  10.374
  229   1HB   LEU  29          HB2       LEU  29  -1.638   0.829   8.679
  230   2HB   LEU  29          HB3       LEU  29  -0.205   1.142   9.637
  231    HG   LEU  29           HG       LEU  29  -2.840   0.529  10.965
  232   1HD1  LEU  29          HD11      LEU  29  -1.224  -1.817  10.879
  233   2HD1  LEU  29          HD12      LEU  29  -2.868  -1.565  10.245
  234   3HD1  LEU  29          HD13      LEU  29  -1.455  -1.236   9.212
  235   1HD2  LEU  29          HD21      LEU  29  -1.303   1.303  12.539
  236   2HD2  LEU  29          HD22      LEU  29  -1.182  -0.470  12.662
  237   3HD2  LEU  29          HD23      LEU  29   0.060   0.448  11.775
  238    H    ASN  30           H        ASN  30   0.803   2.896   9.172
  239    HA   ASN  30           HA       ASN  30   1.411   4.366  11.570
  240   1HB   ASN  30          HB2       ASN  30   2.843   2.604   9.754
  241   2HB   ASN  30          HB3       ASN  30   3.698   4.132   9.822
  242   1HD2  ASN  30          HD21      ASN  30   1.753   2.378  12.231
  243   2HD2  ASN  30          HD22      ASN  30   2.976   2.240  13.448
  244    H    SER  31           H        SER  31   2.657   6.457  11.404
  245    HA   SER  31           HA       SER  31   2.795   7.702   8.855
  246   1HB   SER  31          HB2       SER  31   0.564   8.357   9.054
  247   2HB   SER  31          HB3       SER  31   0.615   8.400  10.805
  248    HG   SER  31           HG       SER  31   2.266  10.265   9.429
  249    H    SER  32           H        SER  32   4.852   8.520   9.034
  250    HA   SER  32           HA       SER  32   5.491   9.808  11.574
  251   1HB   SER  32          HB2       SER  32   7.286   8.283   9.639
  252   2HB   SER  32          HB3       SER  32   7.916   9.275  10.939
  253    HG   SER  32           HG       SER  32   7.279   6.752  11.148
  254    H    GLU  33           H        GLU  33   6.914   9.724   8.222
  255    HA   GLU  33           HA       GLU  33   6.549  12.615   8.172
  256   1HB   GLU  33          HB2       GLU  33   9.021  11.303   8.382
  257   2HB   GLU  33          HB3       GLU  33   8.903  11.678   6.674
  258   1HG   GLU  33          HG2       GLU  33   8.034  13.919   8.402
  259   2HG   GLU  33          HG3       GLU  33   9.700  13.452   8.682
  260    HE2  GLU  33           HE2      GLU  33  10.170  15.804   6.902
  261    H    GLY  34           H        GLY  34   7.993  10.254   5.833
  262   1HA   GLY  34          HA3       GLY  34   5.789   9.827   4.218
  263   2HA   GLY  34          HA2       GLY  34   6.510  11.321   3.655
  264    H    ASP  35           H        ASP  35   6.927   7.819   4.018
  265    HA   ASP  35           HA       ASP  35   8.776   7.841   1.878
  266   1HB   ASP  35          HB2       ASP  35   9.874   8.010   4.475
  267   2HB   ASP  35          HB3       ASP  35   9.992   6.308   4.077
  268    HD2  ASP  35           HD2      ASP  35  13.049   7.356   2.870
  269    H    TRP  36           H        TRP  36   8.556   5.586   4.712
  270    HA   TRP  36           HA       TRP  36   7.533   3.533   2.911
  271   1HB   TRP  36          HB2       TRP  36   8.770   3.429   5.663
  272   2HB   TRP  36          HB3       TRP  36   8.050   2.038   4.877
  273    HD1  TRP  36           HD1      TRP  36  11.357   3.297   5.400
  274    HE1  TRP  36           HE1      TRP  36  13.137   2.605   3.578
  275    HE3  TRP  36           HE3      TRP  36   7.977   1.881   1.876
  276    HZ2  TRP  36           HZ2      TRP  36  12.936   1.568   0.927
  277    HZ3  TRP  36           HZ3      TRP  36   8.851   1.041  -0.301
  278    HH2  TRP  36           HH2      TRP  36  11.238   0.872  -0.802
  279    H    TRP  37           H        TRP  37   5.379   3.037   2.914
  280    HA   TRP  37           HA       TRP  37   3.826   3.952   5.240
  281   1HB   TRP  37          HB2       TRP  37   3.562   4.847   2.692
  282   2HB   TRP  37          HB3       TRP  37   2.443   3.499   2.667
  283    HD1  TRP  37           HD1      TRP  37   0.047   4.082   3.537
  284    HE1  TRP  37           HE1      TRP  37  -1.133   5.967   4.959
  285    HE3  TRP  37           HE3      TRP  37   4.317   6.540   4.794
  286    HZ2  TRP  37           HZ2      TRP  37  -0.170   8.223   6.416
  287    HZ3  TRP  37           HZ3      TRP  37   4.110   8.575   6.219
  288    HH2  TRP  37           HH2      TRP  37   1.964   9.423   7.025
  289    H    GLU  38           H        GLU  38   2.176   2.484   6.010
  290    HA   GLU  38           HA       GLU  38   2.916  -0.233   5.577
  291   1HB   GLU  38          HB2       GLU  38   2.218   0.902   7.811
  292   2HB   GLU  38          HB3       GLU  38   0.568   0.746   7.238
  293   1HG   GLU  38          HG2       GLU  38   0.574  -1.368   8.060
  294   2HG   GLU  38          HG3       GLU  38   1.672  -1.800   6.763
  295    HE2  GLU  38           HE2      GLU  38   3.890  -0.270   9.492
  296    H    ALA  39           H        ALA  39   1.002  -1.911   5.353
  297    HA   ALA  39           HA       ALA  39  -1.004  -0.871   3.492
  298   1HB   ALA  39          HB1       ALA  39   1.278  -2.337   2.726
  299   2HB   ALA  39          HB2       ALA  39  -0.056  -3.515   2.728
  300   3HB   ALA  39          HB3       ALA  39  -0.180  -2.032   1.751
  301    H    ARG  40           H        ARG  40  -2.924  -1.270   4.466
  302    HA   ARG  40           HA       ARG  40  -3.209  -3.906   5.651
  303   1HB   ARG  40          HB2       ARG  40  -2.918  -1.902   7.338
  304   2HB   ARG  40          HB3       ARG  40  -4.547  -1.456   6.868
  305   1HG   ARG  40          HG2       ARG  40  -5.228  -3.889   7.428
  306   2HG   ARG  40          HG3       ARG  40  -3.646  -4.067   8.160
  307   1HD   ARG  40          HD2       ARG  40  -4.113  -2.518   9.886
  308   2HD   ARG  40          HD3       ARG  40  -5.358  -1.702   8.960
  309    HE   ARG  40           HE       ARG  40  -6.927  -3.344   9.615
  310   1HH1  ARG  40          HH22      ARG  40  -3.664  -4.334  10.578
  311   2HH1  ARG  40          HH21      ARG  40  -4.221  -5.629  11.585
  312   1HH2  ARG  40          HH11      ARG  40  -6.574  -6.034  11.784
  313    H    SER  41           H        SER  41  -4.480  -4.736   3.944
  314    HA   SER  41           HA       SER  41  -6.632  -3.119   2.955
  315   1HB   SER  41          HB2       SER  41  -6.535  -4.459   1.116
  316   2HB   SER  41          HB3       SER  41  -5.007  -4.997   1.786
  317    HG   SER  41           HG       SER  41  -6.932  -6.590   1.194
  318    H    LEU  42           H        LEU  42  -8.903  -4.037   2.838
  319    HA   LEU  42           HA       LEU  42  -9.455  -5.538   5.297
  320   1HB   LEU  42          HB2       LEU  42 -10.350  -3.077   4.561
  321   2HB   LEU  42          HB3       LEU  42 -11.640  -4.092   3.945
  322    HG   LEU  42           HG       LEU  42 -11.409  -5.137   6.428
  323   1HD1  LEU  42          HD11      LEU  42  -9.604  -3.277   6.799
  324   2HD1  LEU  42          HD12      LEU  42 -11.021  -2.226   7.036
  325   3HD1  LEU  42          HD13      LEU  42 -10.788  -3.653   8.074
  326   1HD2  LEU  42          HD21      LEU  42 -13.469  -4.228   6.834
  327   2HD2  LEU  42          HD22      LEU  42 -13.024  -2.633   6.182
  328   3HD2  LEU  42          HD23      LEU  42 -13.359  -3.986   5.074
  329    H    THR  43           H        THR  43  -9.210  -5.805   1.921
  330    HA   THR  43           HA       THR  43 -11.450  -7.545   1.509
  331    HB   THR  43           HB       THR  43  -8.959  -6.785  -0.098
  332    HG1  THR  43           HG1      THR  43 -11.526  -5.838   0.464
  333   1HG2  THR  43          HG21      THR  43 -11.309  -8.615  -0.744
  334   2HG2  THR  43          HG22      THR  43 -10.506  -7.674  -2.024
  335   3HG2  THR  43          HG23      THR  43  -9.582  -8.874  -1.090
  336    H    THR  44           H        THR  44  -7.864  -8.128   1.470
  337    HA   THR  44           HA       THR  44  -8.489 -10.891   2.273
  338    HB   THR  44           HB       THR  44  -5.784 -10.487   1.288
  339    HG1  THR  44           HG1      THR  44  -6.554  -9.679  -0.848
  340   1HG2  THR  44          HG21      THR  44  -6.760 -11.876  -0.672
  341   2HG2  THR  44          HG22      THR  44  -6.849 -12.632   0.937
  342   3HG2  THR  44          HG23      THR  44  -8.294 -11.872   0.230
  343    H    GLY  45           H        GLY  45  -5.681  -8.616   2.589
  344   1HA   GLY  45          HA3       GLY  45  -5.378  -7.811   4.948
  345   2HA   GLY  45          HA2       GLY  45  -5.496  -9.498   5.406
  346    H    GLU  46           H        GLU  46  -3.710  -7.432   2.997
  347    HA   GLU  46           HA       GLU  46  -1.386  -9.095   3.580
  348   1HB   GLU  46          HB2       GLU  46  -1.489  -7.370   1.120
  349   2HB   GLU  46          HB3       GLU  46  -0.700  -8.916   1.360
  350   1HG   GLU  46          HG2       GLU  46  -3.711  -8.832   1.525
  351   2HG   GLU  46          HG3       GLU  46  -2.975  -8.697  -0.059
  352    HE2  GLU  46           HE2      GLU  46  -3.762 -11.566   2.031
  353    H    THR  47           H        THR  47   0.736  -7.986   3.676
  354    HA   THR  47           HA       THR  47   0.664  -5.097   3.919
  355    HB   THR  47           HB       THR  47  -0.057  -5.895   6.170
  356    HG1  THR  47           HG1      THR  47   1.313  -4.115   6.355
  357   1HG2  THR  47          HG21      THR  47   2.107  -7.847   5.706
  358   2HG2  THR  47          HG22      THR  47   2.326  -6.959   7.232
  359   3HG2  THR  47          HG23      THR  47   0.824  -7.867   6.939
  360    H    GLY  48           H        GLY  48   2.732  -4.115   3.796
  361   1HA   GLY  48          HA3       GLY  48   5.135  -5.596   3.760
  362   2HA   GLY  48          HA2       GLY  48   4.541  -5.418   2.121
  363    H    TYR  49           H        TYR  49   6.812  -4.192   2.253
  364    HA   TYR  49           HA       TYR  49   6.322  -1.421   3.085
  365   1HB   TYR  49          HB2       TYR  49   8.669  -3.321   2.703
  366   2HB   TYR  49          HB3       TYR  49   8.985  -1.615   2.460
  367    HD1  TYR  49           HD1      TYR  49   7.465  -3.948   4.972
  368    HD2  TYR  49           HD2      TYR  49   9.580  -0.292   4.288
  369    HE1  TYR  49           HE1      TYR  49   7.753  -3.638   7.478
  370    HE2  TYR  49           HE2      TYR  49   9.861   0.006   6.797
  371    HH   TYR  49           HH       TYR  49   8.086  -1.437   8.992
  372    H    ILE  50           H        ILE  50   5.611  -0.118   1.470
  373    HA   ILE  50           HA       ILE  50   7.093  -0.115  -1.002
  374    HB   ILE  50           HB       ILE  50   4.672  -0.109  -2.135
  375   1HG1  ILE  50          HG12      ILE  50   4.181  -2.441  -0.393
  376   2HG1  ILE  50          HG13      ILE  50   3.961  -0.890   0.391
  377   1HG2  ILE  50          HG21      ILE  50   6.092  -1.482  -3.221
  378   2HG2  ILE  50          HG22      ILE  50   6.772  -2.153  -1.719
  379   3HG2  ILE  50          HG23      ILE  50   5.210  -2.748  -2.333
  380   1HD1  ILE  50          HD11      ILE  50   2.765  -1.401  -2.351
  381   2HD1  ILE  50          HD12      ILE  50   1.929  -1.935  -0.874
  382   3HD1  ILE  50          HD13      ILE  50   2.273  -0.207  -1.127
  383    HA   PRO  51           HA       PRO  51   5.999   4.055  -0.685
  384   1HB   PRO  51          HB2       PRO  51   6.327   4.946  -3.248
  385   2HB   PRO  51          HB3       PRO  51   7.666   4.667  -2.152
  386   1HG   PRO  51          HG2       PRO  51   6.773   3.026  -4.442
  387   2HG   PRO  51          HG3       PRO  51   8.319   3.008  -3.615
  388   1HD   PRO  51          HD2       PRO  51   6.200   1.095  -3.334
  389   2HD   PRO  51          HD3       PRO  51   7.696   1.144  -2.422
  390    H    SER  52           H        SER  52   4.274   5.377  -0.459
  391    HA   SER  52           HA       SER  52   1.953   4.384  -1.870
  392   1HB   SER  52          HB2       SER  52   2.176   4.942   0.721
  393   2HB   SER  52          HB3       SER  52   1.866   6.586   0.199
  394    HG   SER  52           HG       SER  52   0.065   4.997  -1.056
  395    H    ASN  53           H        ASN  53   3.793   5.693  -3.548
  396    HA   ASN  53           HA       ASN  53   2.765   8.389  -3.786
  397   1HB   ASN  53          HB2       ASN  53   5.322   7.219  -4.190
  398   2HB   ASN  53          HB3       ASN  53   4.746   7.571  -5.807
  399   1HD2  ASN  53          HD21      ASN  53   6.531   8.750  -3.405
  400   2HD2  ASN  53          HD22      ASN  53   6.332  10.460  -3.599
  401    H    TYR  54           H        TYR  54   2.279   5.189  -4.925
  402    HA   TYR  54           HA       TYR  54   1.505   5.968  -7.614
  403   1HB   TYR  54          HB2       TYR  54   1.246   3.322  -6.060
  404   2HB   TYR  54          HB3       TYR  54   1.227   3.494  -7.804
  405    HD1  TYR  54           HD1      TYR  54   3.114   2.029  -5.534
  406    HD2  TYR  54           HD2      TYR  54   3.535   5.235  -8.336
  407    HE1  TYR  54           HE1      TYR  54   5.626   1.645  -5.607
  408    HE2  TYR  54           HE2      TYR  54   6.045   4.839  -8.399
  409    HH   TYR  54           HH       TYR  54   7.739   3.717  -6.499
  410    H    VAL  55           H        VAL  55   0.051   7.040  -5.193
  411    HA   VAL  55           HA       VAL  55  -2.569   5.842  -5.785
  412    HB   VAL  55           HB       VAL  55  -3.235   6.491  -3.538
  413   1HG1  VAL  55          HG11      VAL  55  -0.752   4.772  -3.761
  414   2HG1  VAL  55          HG12      VAL  55  -1.689   4.927  -2.255
  415   3HG1  VAL  55          HG13      VAL  55  -2.456   4.256  -3.715
  416   1HG2  VAL  55          HG21      VAL  55  -1.662   8.445  -3.358
  417   2HG2  VAL  55          HG22      VAL  55  -1.724   7.405  -1.914
  418   3HG2  VAL  55          HG23      VAL  55  -0.350   7.285  -3.039
  419    H    ALA  56           H        ALA  56  -4.398   7.359  -5.824
  420    HA   ALA  56           HA       ALA  56  -3.606  10.151  -6.160
  421   1HB   ALA  56          HB1       ALA  56  -3.930  10.124  -8.382
  422   2HB   ALA  56          HB2       ALA  56  -4.148   8.359  -8.306
  423   3HB   ALA  56          HB3       ALA  56  -5.557   9.437  -8.161
  424    HA   PRO  57           HA       PRO  57  -7.342  10.785  -4.076
  425   1HB   PRO  57          HB2       PRO  57  -8.013  13.323  -4.835
  426   2HB   PRO  57          HB3       PRO  57  -6.806  12.976  -3.613
  427   1HG   PRO  57          HG2       PRO  57  -6.412  13.866  -6.404
  428   2HG   PRO  57          HG3       PRO  57  -5.284  13.922  -5.063
  429   1HD   PRO  57          HD2       PRO  57  -5.280  12.046  -7.233
  430   2HD   PRO  57          HD3       PRO  57  -4.225  12.033  -5.833
  431    H    VAL  58           H        VAL  58  -9.695  11.116  -4.138
  432    HA   VAL  58           HA       VAL  58 -10.601  10.270  -6.796
  433    HB   VAL  58           HB       VAL  58 -11.905   9.938  -4.088
  434   1HG1  VAL  58          HG11      VAL  58 -13.309  10.024  -6.293
  435   2HG1  VAL  58          HG12      VAL  58 -12.636   8.399  -6.570
  436   3HG1  VAL  58          HG13      VAL  58 -13.602   8.726  -5.110
  437   1HG2  VAL  58          HG21      VAL  58 -11.071   7.487  -5.411
  438   2HG2  VAL  58          HG22      VAL  58  -9.689   8.568  -5.113
  439   3HG2  VAL  58          HG23      VAL  58 -10.731   8.064  -3.761
  440    H    ASP  59           H        ASP  59 -12.543  11.649  -4.114
  441    HA   ASP  59           HA       ASP  59 -13.182  13.828  -5.940
  442   1HB   ASP  59          HB2       ASP  59 -14.817  12.008  -4.370
  443   2HB   ASP  59          HB3       ASP  59 -15.102  13.645  -3.813
  444    HD2  ASP  59           HD2      ASP  59 -15.880  15.149  -5.589
  Start of MODEL   10
    1   1H    VAL   1           H        VAL   1 -10.435  13.040   2.896
    2    HA   VAL   1           HA       VAL   1  -9.665  11.968   0.875
    3    HB   VAL   1           HB       VAL   1  -7.078  12.469   0.540
    4   1HG1  VAL   1          HG11      VAL   1  -7.858  14.333  -1.108
    5   2HG1  VAL   1          HG12      VAL   1  -8.456  12.671  -1.324
    6   3HG1  VAL   1          HG13      VAL   1  -9.492  13.898  -0.554
    7   1HG2  VAL   1          HG21      VAL   1  -6.756  14.985   0.733
    8   2HG2  VAL   1          HG22      VAL   1  -8.178  14.992   1.803
    9   3HG2  VAL   1          HG23      VAL   1  -6.726  14.069   2.259
   10    H    THR   2           H        THR   2 -10.067  10.246   2.338
   11    HA   THR   2           HA       THR   2  -7.633   9.345   3.713
   12    HB   THR   2           HB       THR   2  -9.199   8.589   5.590
   13    HG1  THR   2           HG1      THR   2 -11.324   8.897   5.060
   14   1HG2  THR   2          HG21      THR   2  -8.598  10.541   6.609
   15   2HG2  THR   2          HG22      THR   2  -8.287  11.283   5.021
   16   3HG2  THR   2          HG23      THR   2  -9.911  11.374   5.744
   17    H    LEU   3           H        LEU   3  -8.550   8.678   1.067
   18    HA   LEU   3           HA       LEU   3  -8.874   5.830   1.524
   19   1HB   LEU   3          HB2       LEU   3 -11.156   6.872   1.263
   20   2HB   LEU   3          HB3       LEU   3 -10.697   7.311  -0.370
   21    HG   LEU   3           HG       LEU   3 -10.195   4.772  -0.672
   22   1HD1  LEU   3          HD11      LEU   3 -12.326   4.009   1.116
   23   2HD1  LEU   3          HD12      LEU   3 -10.677   3.356   0.966
   24   3HD1  LEU   3          HD13      LEU   3 -10.989   4.752   2.025
   25   1HD2  LEU   3          HD21      LEU   3 -12.098   6.236  -1.622
   26   2HD2  LEU   3          HD22      LEU   3 -12.293   4.467  -1.630
   27   3HD2  LEU   3          HD23      LEU   3 -13.115   5.447  -0.393
   28    H    PHE   4           H        PHE   4  -7.144   4.962   0.528
   29    HA   PHE   4           HA       PHE   4  -6.101   6.371  -1.807
   30   1HB   PHE   4          HB2       PHE   4  -5.126   4.506   0.367
   31   2HB   PHE   4          HB3       PHE   4  -4.334   4.337  -1.186
   32    HD1  PHE   4           HD1      PHE   4  -4.979   6.653   1.603
   33    HD2  PHE   4           HD2      PHE   4  -2.799   5.991  -1.977
   34    HE1  PHE   4           HE1      PHE   4  -3.484   8.592   2.156
   35    HE2  PHE   4           HE2      PHE   4  -1.303   7.930  -1.425
   36    HZ   PHE   4           HZ       PHE   4  -1.664   9.207   0.635
   37    H    VAL   5           H        VAL   5  -6.718   5.648  -3.783
   38    HA   VAL   5           HA       VAL   5  -7.633   2.886  -3.986
   39    HB   VAL   5           HB       VAL   5  -8.402   3.698  -6.251
   40   1HG1  VAL   5          HG11      VAL   5 -10.108   3.496  -4.686
   41   2HG1  VAL   5          HG12      VAL   5  -9.436   4.763  -3.632
   42   3HG1  VAL   5          HG13      VAL   5 -10.234   5.208  -5.160
   43   1HG2  VAL   5          HG21      VAL   5  -6.957   6.070  -5.359
   44   2HG2  VAL   5          HG22      VAL   5  -7.558   5.638  -6.978
   45   3HG2  VAL   5          HG23      VAL   5  -8.638   6.441  -5.812
   46    H    ALA   6           H        ALA   6  -6.597   1.336  -5.224
   47    HA   ALA   6           HA       ALA   6  -3.920   2.080  -6.097
   48   1HB   ALA   6          HB1       ALA   6  -3.351  -0.103  -5.672
   49   2HB   ALA   6          HB2       ALA   6  -4.764   0.011  -4.596
   50   3HB   ALA   6          HB3       ALA   6  -4.928  -0.733  -6.204
   51    H    LEU   7           H        LEU   7  -3.174   1.770  -8.236
   52    HA   LEU   7           HA       LEU   7  -5.318   1.222 -10.171
   53   1HB   LEU   7          HB2       LEU   7  -4.311   3.648  -9.826
   54   2HB   LEU   7          HB3       LEU   7  -3.033   3.017 -10.848
   55    HG   LEU   7           HG       LEU   7  -4.906   2.344 -12.485
   56   1HD1  LEU   7          HD11      LEU   7  -6.513   3.340 -10.382
   57   2HD1  LEU   7          HD12      LEU   7  -6.661   4.487 -11.734
   58   3HD1  LEU   7          HD13      LEU   7  -7.024   2.763 -11.985
   59   1HD2  LEU   7          HD21      LEU   7  -4.694   4.360 -13.642
   60   2HD2  LEU   7          HD22      LEU   7  -4.612   5.324 -12.148
   61   3HD2  LEU   7          HD23      LEU   7  -3.237   4.298 -12.621
   62    H    TYR   8           H        TYR   8  -1.723   1.667 -10.339
   63    HA   TYR   8           HA       TYR   8  -1.620  -0.888 -11.765
   64   1HB   TYR   8          HB2       TYR   8   0.225   1.549 -11.391
   65   2HB   TYR   8          HB3       TYR   8   0.737   0.124 -12.274
   66    HD1  TYR   8           HD1      TYR   8  -0.466  -0.512 -14.405
   67    HD2  TYR   8           HD2      TYR   8  -1.151   3.212 -12.413
   68    HE1  TYR   8           HE1      TYR   8  -1.492   0.443 -16.526
   69    HE2  TYR   8           HE2      TYR   8  -2.175   4.154 -14.540
   70    HH   TYR   8           HH       TYR   8  -2.048   3.751 -16.927
   71    H    ASP   9           H        ASP   9  -0.324  -2.603 -11.084
   72    HA   ASP   9           HA       ASP   9   0.721  -2.255  -8.391
   73   1HB   ASP   9          HB2       ASP   9   0.688  -4.864  -8.482
   74   2HB   ASP   9          HB3       ASP   9  -0.838  -4.020  -8.310
   75    HD2  ASP   9           HD2      ASP   9  -2.002  -3.737 -10.110
   76    H    TYR  10           H        TYR  10   2.508  -4.371  -8.200
   77    HA   TYR  10           HA       TYR  10   4.172  -4.512 -10.542
   78   1HB   TYR  10          HB2       TYR  10   4.519  -2.593  -8.308
   79   2HB   TYR  10          HB3       TYR  10   5.899  -3.668  -8.408
   80    HD1  TYR  10           HD1      TYR  10   6.313  -4.085 -11.253
   81    HD2  TYR  10           HD2      TYR  10   5.116  -0.530  -9.192
   82    HE1  TYR  10           HE1      TYR  10   7.275  -2.664 -13.129
   83    HE2  TYR  10           HE2      TYR  10   6.083   0.878 -11.076
   84    HH   TYR  10           HH       TYR  10   7.241  -0.610 -14.027
   85    H    GLU  11           H        GLU  11   5.608  -6.272 -10.464
   86    HA   GLU  11           HA       GLU  11   5.259  -7.905  -8.076
   87   1HB   GLU  11          HB2       GLU  11   5.509  -8.525 -11.000
   88   2HB   GLU  11          HB3       GLU  11   6.229  -9.673  -9.890
   89   1HG   GLU  11          HG2       GLU  11   4.078  -9.905  -8.681
   90   2HG   GLU  11          HG3       GLU  11   3.345  -8.680  -9.697
   91    HE2  GLU  11           HE2      GLU  11   4.016  -9.533 -12.267
   92    H    ALA  12           H        ALA  12   7.047  -8.567  -6.888
   93    HA   ALA  12           HA       ALA  12   9.681  -8.143  -8.064
   94   1HB   ALA  12          HB1       ALA  12   9.031  -7.097  -5.297
   95   2HB   ALA  12          HB2       ALA  12  10.443  -6.742  -6.319
   96   3HB   ALA  12          HB3       ALA  12   8.847  -6.078  -6.744
   97    H    ARG  13           H        ARG  13  11.390  -9.017  -6.344
   98    HA   ARG  13           HA       ARG  13  10.185 -11.402  -5.188
   99   1HB   ARG  13          HB2       ARG  13  12.840 -11.053  -6.652
  100   2HB   ARG  13          HB3       ARG  13  12.529 -12.445  -5.633
  101   1HG   ARG  13          HG2       ARG  13  10.703 -13.188  -7.017
  102   2HG   ARG  13          HG3       ARG  13  10.602 -11.651  -7.852
  103   1HD   ARG  13          HD2       ARG  13  12.753 -12.034  -8.964
  104   2HD   ARG  13          HD3       ARG  13  13.056 -13.463  -7.997
  105    HE   ARG  13           HE       ARG  13  10.823 -13.259  -9.996
  106   1HH1  ARG  13          HH22      ARG  13  13.289 -15.157  -8.300
  107   2HH1  ARG  13          HH21      ARG  13  12.934 -16.617  -9.162
  108   1HH2  ARG  13          HH11      ARG  13  11.208 -16.611 -10.822
  109    H    THR  14           H        THR  14  10.178  -9.361  -3.482
  110    HA   THR  14           HA       THR  14  12.538  -9.827  -1.793
  111    HB   THR  14           HB       THR  14  11.775  -7.187  -1.286
  112    HG1  THR  14           HG1      THR  14  11.415  -6.347  -3.433
  113   1HG2  THR  14          HG21      THR  14  13.705  -7.741  -3.552
  114   2HG2  THR  14          HG22      THR  14  13.857  -6.583  -2.209
  115   3HG2  THR  14          HG23      THR  14  14.119  -8.321  -1.921
  116    H    GLU  15           H        GLU  15  12.073  -9.022   0.532
  117    HA   GLU  15           HA       GLU  15   9.511 -10.181   1.190
  118   1HB   GLU  15          HB2       GLU  15  11.930 -10.679   2.249
  119   2HB   GLU  15          HB3       GLU  15  11.498  -9.334   3.286
  120   1HG   GLU  15          HG2       GLU  15  10.433 -10.919   4.544
  121   2HG   GLU  15          HG3       GLU  15   9.155 -10.774   3.354
  122    HE2  GLU  15           HE2      GLU  15   8.960 -13.588   2.554
  123    H    ASP  16           H        ASP  16  10.912  -7.113   0.677
  124    HA   ASP  16           HA       ASP  16   9.046  -5.888   2.545
  125   1HB   ASP  16          HB2       ASP  16  11.766  -5.340   1.888
  126   2HB   ASP  16          HB3       ASP  16  10.844  -4.026   1.187
  127    HD2  ASP  16           HD2      ASP  16  10.977  -2.478   4.242
  128    H    ASP  17           H        ASP  17   8.499  -7.120  -0.199
  129    HA   ASP  17           HA       ASP  17   6.893  -5.043  -1.169
  130   1HB   ASP  17          HB2       ASP  17   9.448  -4.786  -2.104
  131   2HB   ASP  17          HB3       ASP  17   8.827  -5.912  -3.294
  132    HD2  ASP  17           HD2      ASP  17   8.209  -2.671  -4.685
  133    H    LEU  18           H        LEU  18   5.148  -6.489  -1.367
  134    HA   LEU  18           HA       LEU  18   5.673  -9.061  -2.647
  135   1HB   LEU  18          HB2       LEU  18   3.747  -8.039  -0.650
  136   2HB   LEU  18          HB3       LEU  18   3.106  -9.191  -1.804
  137    HG   LEU  18           HG       LEU  18   5.659 -10.073  -0.691
  138   1HD1  LEU  18          HD11      LEU  18   3.566 -10.267   1.386
  139   2HD1  LEU  18          HD12      LEU  18   5.327 -10.048   1.533
  140   3HD1  LEU  18          HD13      LEU  18   4.285  -8.654   1.164
  141   1HD2  LEU  18          HD21      LEU  18   2.920 -11.172  -1.180
  142   2HD2  LEU  18          HD22      LEU  18   4.506 -11.750  -1.742
  143   3HD2  LEU  18          HD23      LEU  18   4.005 -12.027  -0.057
  144    H    SER  19           H        SER  19   3.410  -9.761  -3.875
  145    HA   SER  19           HA       SER  19   3.333  -7.856  -6.021
  146   1HB   SER  19          HB2       SER  19   1.606 -10.253  -6.227
  147   2HB   SER  19          HB3       SER  19   2.803  -9.640  -7.349
  148    HG   SER  19           HG       SER  19   4.394 -10.456  -5.568
  149    H    PHE  20           H        PHE  20   1.788  -6.269  -6.097
  150    HA   PHE  20           HA       PHE  20  -0.562  -6.588  -4.424
  151   1HB   PHE  20          HB2       PHE  20   1.165  -4.516  -4.913
  152   2HB   PHE  20          HB3       PHE  20   0.031  -4.209  -6.214
  153    HD1  PHE  20           HD1      PHE  20  -2.105  -3.257  -5.779
  154    HD2  PHE  20           HD2      PHE  20   0.363  -4.467  -2.546
  155    HE1  PHE  20           HE1      PHE  20  -3.615  -2.054  -4.177
  156    HE2  PHE  20           HE2      PHE  20  -1.148  -3.263  -0.943
  157    HZ   PHE  20           HZ       PHE  20  -3.119  -2.070  -1.778
  158    H    HIS  21           H        HIS  21  -2.689  -5.655  -5.397
  159    HA   HIS  21           HA       HIS  21  -2.889  -6.312  -8.227
  160   1HB   HIS  21          HB2       HIS  21  -4.386  -7.622  -5.971
  161   2HB   HIS  21          HB3       HIS  21  -5.143  -7.450  -7.542
  162    HD1  HIS  21           HD1      HIS  21  -2.743  -9.529  -5.666
  163    HD2  HIS  21           HD2      HIS  21  -3.705  -8.834  -9.691
  164    HE1  HIS  21           HE1      HIS  21  -1.711 -11.450  -6.991
  165    H    LYS  22           H        LYS  22  -4.388  -5.045  -9.356
  166    HA   LYS  22           HA       LYS  22  -5.082  -2.608  -8.130
  167   1HB   LYS  22          HB2       LYS  22  -6.245  -2.180 -10.294
  168   2HB   LYS  22          HB3       LYS  22  -4.567  -2.652 -10.461
  169   1HG   LYS  22          HG2       LYS  22  -5.287  -5.016 -10.911
  170   2HG   LYS  22          HG3       LYS  22  -6.963  -4.521 -10.775
  171   1HD   LYS  22          HD2       LYS  22  -5.690  -2.715 -12.620
  172   2HD   LYS  22          HD3       LYS  22  -5.216  -4.340 -13.074
  173   1HE   LYS  22          HE2       LYS  22  -7.314  -3.713 -14.220
  174   2HE   LYS  22          HE3       LYS  22  -7.603  -5.047 -13.120
  175   1HZ   LYS  22          HZ1       LYS  22  -9.056  -2.805 -13.108
  176   2HZ   LYS  22          HZ2       LYS  22  -8.885  -3.740 -11.786
  177    H    GLY  23           H        GLY  23  -7.067  -1.805  -7.393
  178   1HA   GLY  23          HA3       GLY  23  -9.384  -1.947  -7.076
  179   2HA   GLY  23          HA2       GLY  23  -9.331  -3.676  -7.354
  180    H    GLU  24           H        GLU  24  -6.744  -2.419  -5.369
  181    HA   GLU  24           HA       GLU  24  -8.179  -3.412  -3.030
  182   1HB   GLU  24          HB2       GLU  24  -5.992  -4.585  -4.030
  183   2HB   GLU  24          HB3       GLU  24  -5.167  -3.328  -3.130
  184   1HG   GLU  24          HG2       GLU  24  -6.066  -4.067  -1.037
  185   2HG   GLU  24          HG3       GLU  24  -7.324  -5.013  -1.808
  186    HE2  GLU  24           HE2      GLU  24  -4.324  -6.941  -0.680
  187    H    LYS  25           H        LYS  25  -8.247  -2.121  -1.175
  188    HA   LYS  25           HA       LYS  25  -6.986   0.512  -1.484
  189   1HB   LYS  25          HB2       LYS  25  -9.543  -0.338  -0.104
  190   2HB   LYS  25          HB3       LYS  25  -8.801   1.229   0.147
  191   1HG   LYS  25          HG2       LYS  25 -10.077   1.858  -1.650
  192   2HG   LYS  25          HG3       LYS  25  -8.780   1.148  -2.591
  193   1HD   LYS  25          HD2       LYS  25 -10.166  -1.111  -2.211
  194   2HD   LYS  25          HD3       LYS  25 -11.496  -0.004  -1.929
  195   1HE   LYS  25          HE2       LYS  25 -10.250   1.021  -4.244
  196   2HE   LYS  25          HE3       LYS  25 -10.167  -0.716  -4.461
  197   1HZ   LYS  25          HZ1       LYS  25 -12.266  -0.140  -5.286
  198   2HZ   LYS  25          HZ2       LYS  25 -12.643  -0.655  -3.786
  199    H    PHE  26           H        PHE  26  -6.248   1.552   0.576
  200    HA   PHE  26           HA       PHE  26  -5.515  -0.445   2.586
  201   1HB   PHE  26          HB2       PHE  26  -3.819   0.684   0.621
  202   2HB   PHE  26          HB3       PHE  26  -3.546   1.726   2.003
  203    HD1  PHE  26           HD1      PHE  26  -2.056   1.077   3.672
  204    HD2  PHE  26           HD2      PHE  26  -3.582  -1.863   1.020
  205    HE1  PHE  26           HE1      PHE  26  -0.470  -0.613   4.633
  206    HE2  PHE  26           HE2      PHE  26  -1.995  -3.554   1.982
  207    HZ   PHE  26           HZ       PHE  26  -0.458  -2.909   3.776
  208    H    GLN  27           H        GLN  27  -5.358   0.352   4.727
  209    HA   GLN  27           HA       GLN  27  -6.469   3.028   4.992
  210   1HB   GLN  27          HB2       GLN  27  -6.343   0.835   7.105
  211   2HB   GLN  27          HB3       GLN  27  -7.262   2.324   7.192
  212   1HG   GLN  27          HG2       GLN  27  -7.712   0.290   4.970
  213   2HG   GLN  27          HG3       GLN  27  -8.546   0.175   6.507
  214   1HE2  GLN  27          HE21      GLN  27  -8.245   1.828   3.502
  215   2HE2  GLN  27          HE22      GLN  27  -9.596   2.903   3.648
  216    H    ILE  28           H        ILE  28  -5.412   4.629   6.204
  217    HA   ILE  28           HA       ILE  28  -2.634   4.389   6.444
  218    HB   ILE  28           HB       ILE  28  -2.914   6.562   7.740
  219   1HG1  ILE  28          HG12      ILE  28  -5.652   6.905   6.746
  220   2HG1  ILE  28          HG13      ILE  28  -5.535   5.703   8.016
  221   1HG2  ILE  28          HG21      ILE  28  -3.500   5.960   4.915
  222   2HG2  ILE  28          HG22      ILE  28  -4.053   7.557   5.474
  223   3HG2  ILE  28          HG23      ILE  28  -2.340   7.100   5.639
  224   1HD1  ILE  28          HD11      ILE  28  -5.067   8.644   8.139
  225   2HD1  ILE  28          HD12      ILE  28  -5.664   7.532   9.395
  226   3HD1  ILE  28          HD13      ILE  28  -3.919   7.649   9.067
  227    H    LEU  29           H        LEU  29  -1.268   4.001   8.194
  228    HA   LEU  29           HA       LEU  29  -2.515   3.492  10.767
  229   1HB   LEU  29          HB2       LEU  29  -1.807   1.410   8.951
  230   2HB   LEU  29          HB3       LEU  29  -0.679   1.369  10.292
  231    HG   LEU  29           HG       LEU  29  -3.034   1.617  11.640
  232   1HD1  LEU  29          HD11      LEU  29  -3.930   1.171   9.080
  233   2HD1  LEU  29          HD12      LEU  29  -3.934  -0.465   9.783
  234   3HD1  LEU  29          HD13      LEU  29  -4.841   0.846  10.575
  235   1HD2  LEU  29          HD21      LEU  29  -2.738  -1.138  11.347
  236   2HD2  LEU  29          HD22      LEU  29  -1.111  -0.478  11.052
  237   3HD2  LEU  29          HD23      LEU  29  -1.966  -0.098  12.567
  238    H    ASN  30           H        ASN  30   0.706   2.564   9.431
  239    HA   ASN  30           HA       ASN  30   1.884   4.157  11.505
  240   1HB   ASN  30          HB2       ASN  30   2.567   1.731  10.416
  241   2HB   ASN  30          HB3       ASN  30   3.589   2.775   9.449
  242   1HD2  ASN  30          HD21      ASN  30   4.850   1.045  10.962
  243   2HD2  ASN  30          HD22      ASN  30   5.588   1.762  12.356
  244    H    SER  31           H        SER  31   3.373   5.934  11.059
  245    HA   SER  31           HA       SER  31   3.999   6.614   8.394
  246   1HB   SER  31          HB2       SER  31   1.507   7.579   9.356
  247   2HB   SER  31          HB3       SER  31   2.597   8.948   9.445
  248    HG   SER  31           HG       SER  31   1.739   7.457   7.161
  249    H    SER  32           H        SER  32   6.156   6.903   8.958
  250    HA   SER  32           HA       SER  32   6.779   8.265  11.387
  251   1HB   SER  32          HB2       SER  32   8.049   6.332   9.861
  252   2HB   SER  32          HB3       SER  32   8.967   7.765   9.442
  253    HG   SER  32           HG       SER  32   9.111   6.278  11.708
  254    H    GLU  33           H        GLU  33   7.387   8.772   7.833
  255    HA   GLU  33           HA       GLU  33   7.290  11.618   8.371
  256   1HB   GLU  33          HB2       GLU  33   9.725  10.435   8.095
  257   2HB   GLU  33          HB3       GLU  33   9.364  10.722   6.405
  258   1HG   GLU  33          HG2       GLU  33   8.754  13.033   8.175
  259   2HG   GLU  33          HG3       GLU  33  10.451  12.595   8.139
  260    HE2  GLU  33           HE2      GLU  33  11.389  13.705   6.790
  261    H    GLY  34           H        GLY  34   8.200   9.636   5.471
  262   1HA   GLY  34          HA3       GLY  34   5.730   9.564   4.220
  263   2HA   GLY  34          HA2       GLY  34   6.460  11.091   3.764
  264    H    ASP  35           H        ASP  35   6.578   7.582   3.446
  265    HA   ASP  35           HA       ASP  35   8.002   7.802   1.055
  266   1HB   ASP  35          HB2       ASP  35   9.526   7.203   3.540
  267   2HB   ASP  35          HB3       ASP  35   9.790   6.045   2.251
  268    HD2  ASP  35           HD2      ASP  35  10.119   7.430   0.066
  269    H    TRP  36           H        TRP  36   7.722   5.527   3.901
  270    HA   TRP  36           HA       TRP  36   6.446   3.598   2.083
  271   1HB   TRP  36          HB2       TRP  36   7.756   2.659   4.574
  272   2HB   TRP  36          HB3       TRP  36   7.579   1.869   3.020
  273    HD1  TRP  36           HD1      TRP  36   9.871   4.419   4.804
  274    HE1  TRP  36           HE1      TRP  36  12.185   4.651   3.556
  275    HE3  TRP  36           HE3      TRP  36   8.591   1.570   0.791
  276    HZ2  TRP  36           HZ2      TRP  36  13.198   3.641   1.086
  277    HZ3  TRP  36           HZ3      TRP  36  10.300   1.243  -0.994
  278    HH2  TRP  36           HH2      TRP  36  12.536   2.224  -0.893
  279    H    TRP  37           H        TRP  37   4.629   2.412   2.988
  280    HA   TRP  37           HA       TRP  37   3.535   3.673   5.410
  281   1HB   TRP  37          HB2       TRP  37   2.518   3.925   2.855
  282   2HB   TRP  37          HB3       TRP  37   1.570   2.610   3.523
  283    HD1  TRP  37           HD1      TRP  37   0.507   3.318   6.165
  284    HE1  TRP  37           HE1      TRP  37  -0.724   5.529   6.909
  285    HE3  TRP  37           HE3      TRP  37   2.326   6.219   2.405
  286    HZ2  TRP  37           HZ2      TRP  37  -0.798   8.185   5.864
  287    HZ3  TRP  37           HZ3      TRP  37   1.625   8.610   2.339
  288    HH2  TRP  37           HH2      TRP  37   0.118   9.601   3.989
  289    H    GLU  38           H        GLU  38   2.754   2.229   6.962
  290    HA   GLU  38           HA       GLU  38   2.864  -0.578   6.176
  291   1HB   GLU  38          HB2       GLU  38   4.727   0.406   7.770
  292   2HB   GLU  38          HB3       GLU  38   3.478   0.332   8.998
  293   1HG   GLU  38          HG2       GLU  38   3.524  -2.157   7.468
  294   2HG   GLU  38          HG3       GLU  38   5.126  -1.801   8.082
  295    HE2  GLU  38           HE2      GLU  38   4.659  -3.619   9.323
  296    H    ALA  39           H        ALA  39   0.941  -1.634   6.418
  297    HA   ALA  39           HA       ALA  39  -0.723  -1.202   8.664
  298   1HB   ALA  39          HB1       ALA  39  -1.086   0.821   6.983
  299   2HB   ALA  39          HB2       ALA  39  -2.070  -0.374   6.105
  300   3HB   ALA  39          HB3       ALA  39  -2.471   0.045   7.788
  301    H    ARG  40           H        ARG  40  -3.180  -2.049   7.275
  302    HA   ARG  40           HA       ARG  40  -2.251  -4.633   6.312
  303   1HB   ARG  40          HB2       ARG  40  -4.430  -3.954   8.315
  304   2HB   ARG  40          HB3       ARG  40  -4.564  -5.421   7.364
  305   1HG   ARG  40          HG2       ARG  40  -1.913  -4.907   8.686
  306   2HG   ARG  40          HG3       ARG  40  -3.250  -5.324   9.740
  307   1HD   ARG  40          HD2       ARG  40  -2.394  -6.963   7.303
  308   2HD   ARG  40          HD3       ARG  40  -1.947  -7.335   8.955
  309    HE   ARG  40           HE       ARG  40  -4.532  -7.826   7.710
  310   1HH1  ARG  40          HH22      ARG  40  -2.956  -7.178  10.816
  311   2HH1  ARG  40          HH21      ARG  40  -4.208  -7.927  11.750
  312   1HH2  ARG  40          HH11      ARG  40  -6.096  -8.883  10.625
  313    H    SER  41           H        SER  41  -4.735  -5.738   5.567
  314    HA   SER  41           HA       SER  41  -5.773  -3.729   3.726
  315   1HB   SER  41          HB2       SER  41  -4.696  -6.466   3.193
  316   2HB   SER  41          HB3       SER  41  -6.166  -6.052   2.334
  317    HG   SER  41           HG       SER  41  -3.678  -5.349   1.684
  318    H    LEU  42           H        LEU  42  -8.057  -3.840   3.308
  319    HA   LEU  42           HA       LEU  42  -9.493  -5.344   5.338
  320   1HB   LEU  42          HB2       LEU  42  -9.758  -2.794   4.099
  321   2HB   LEU  42          HB3       LEU  42 -11.191  -3.728   3.713
  322    HG   LEU  42           HG       LEU  42 -11.834  -3.933   5.952
  323   1HD1  LEU  42          HD11      LEU  42 -10.499  -3.807   7.846
  324   2HD1  LEU  42          HD12      LEU  42  -9.418  -4.562   6.649
  325   3HD1  LEU  42          HD13      LEU  42  -9.252  -2.831   7.032
  326   1HD2  LEU  42          HD21      LEU  42 -11.655  -1.501   4.865
  327   2HD2  LEU  42          HD22      LEU  42 -12.292  -1.778   6.504
  328   3HD2  LEU  42          HD23      LEU  42 -10.610  -1.239   6.283
  329    H    THR  43           H        THR  43  -8.434  -5.725   2.133
  330    HA   THR  43           HA       THR  43 -10.788  -7.232   1.308
  331    HB   THR  43           HB       THR  43  -8.534  -7.320  -0.527
  332    HG1  THR  43           HG1      THR  43  -7.693  -5.385   0.186
  333   1HG2  THR  43          HG21      THR  43 -10.968  -5.475  -0.630
  334   2HG2  THR  43          HG22      THR  43 -10.028  -6.113  -2.001
  335   3HG2  THR  43          HG23      THR  43 -11.067  -7.202  -1.052
  336    H    THR  44           H        THR  44  -7.358  -7.716   2.250
  337    HA   THR  44           HA       THR  44  -8.001 -10.575   2.498
  338    HB   THR  44           HB       THR  44  -5.525 -10.882   1.750
  339    HG1  THR  44           HG1      THR  44  -4.572  -8.970   1.127
  340   1HG2  THR  44          HG21      THR  44  -6.485  -9.753  -0.695
  341   2HG2  THR  44          HG22      THR  44  -6.532 -11.467  -0.216
  342   3HG2  THR  44          HG23      THR  44  -7.914 -10.404   0.142
  343    H    GLY  45           H        GLY  45  -5.148  -8.468   3.229
  344   1HA   GLY  45          HA3       GLY  45  -5.009  -7.717   5.593
  345   2HA   GLY  45          HA2       GLY  45  -5.416  -9.362   6.039
  346    H    GLU  46           H        GLU  46  -3.157  -7.891   3.588
  347    HA   GLU  46           HA       GLU  46  -1.092  -9.579   4.773
  348   1HB   GLU  46          HB2       GLU  46  -0.020  -9.344   2.412
  349   2HB   GLU  46          HB3       GLU  46  -1.381 -10.432   2.595
  350   1HG   GLU  46          HG2       GLU  46  -2.917  -8.562   1.837
  351   2HG   GLU  46          HG3       GLU  46  -1.506  -7.563   1.551
  352    HE2  GLU  46           HE2      GLU  46  -0.515 -10.381  -0.718
  353    H    THR  47           H        THR  47   0.206  -8.319   6.045
  354    HA   THR  47           HA       THR  47   0.556  -5.520   5.362
  355    HB   THR  47           HB       THR  47   0.086  -6.168   7.700
  356    HG1  THR  47           HG1      THR  47   2.801  -5.668   8.039
  357   1HG2  THR  47          HG21      THR  47   1.832  -7.436   8.982
  358   2HG2  THR  47          HG22      THR  47   1.081  -8.455   7.730
  359   3HG2  THR  47          HG23      THR  47   2.696  -7.757   7.459
  360    H    GLY  48           H        GLY  48   2.433  -4.522   4.705
  361   1HA   GLY  48          HA3       GLY  48   4.938  -5.862   4.628
  362   2HA   GLY  48          HA2       GLY  48   4.161  -5.919   3.058
  363    H    TYR  49           H        TYR  49   5.820  -4.528   2.156
  364    HA   TYR  49           HA       TYR  49   5.465  -1.720   2.963
  365   1HB   TYR  49          HB2       TYR  49   7.821  -3.543   2.535
  366   2HB   TYR  49          HB3       TYR  49   7.984  -1.987   1.745
  367    HD1  TYR  49           HD1      TYR  49   6.908  -3.320   5.094
  368    HD2  TYR  49           HD2      TYR  49   9.071  -0.325   2.934
  369    HE1  TYR  49           HE1      TYR  49   7.669  -2.278   7.285
  370    HE2  TYR  49           HE2      TYR  49   9.824   0.706   5.132
  371    HH   TYR  49           HH       TYR  49   8.650  -0.576   8.220
  372    H    ILE  50           H        ILE  50   4.444  -0.609   1.378
  373    HA   ILE  50           HA       ILE  50   5.157  -1.309  -1.381
  374    HB   ILE  50           HB       ILE  50   2.830  -0.814  -2.017
  375   1HG1  ILE  50          HG12      ILE  50   1.925  -1.116   0.815
  376   2HG1  ILE  50          HG13      ILE  50   2.520   0.453   0.310
  377   1HG2  ILE  50          HG21      ILE  50   3.392  -3.093  -0.120
  378   2HG2  ILE  50          HG22      ILE  50   1.854  -2.937  -1.003
  379   3HG2  ILE  50          HG23      ILE  50   3.382  -3.098  -1.900
  380   1HD1  ILE  50          HD11      ILE  50   0.092   0.325  -0.056
  381   2HD1  ILE  50          HD12      ILE  50   0.926   0.425  -1.625
  382   3HD1  ILE  50          HD13      ILE  50   0.296  -1.137  -1.049
  383    HA   PRO  51           HA       PRO  51   5.831   2.956  -1.684
  384   1HB   PRO  51          HB2       PRO  51   6.037   3.230  -4.394
  385   2HB   PRO  51          HB3       PRO  51   7.339   2.624  -3.391
  386   1HG   PRO  51          HG2       PRO  51   5.541   1.126  -5.197
  387   2HG   PRO  51          HG3       PRO  51   7.085   0.633  -4.528
  388   1HD   PRO  51          HD2       PRO  51   4.488  -0.223  -3.661
  389   2HD   PRO  51          HD3       PRO  51   6.025  -0.622  -2.920
  390    H    SER  52           H        SER  52   4.824   4.914  -1.684
  391    HA   SER  52           HA       SER  52   2.117   4.709  -2.731
  392   1HB   SER  52          HB2       SER  52   1.550   6.525  -1.165
  393   2HB   SER  52          HB3       SER  52   2.288   5.185  -0.312
  394    HG   SER  52           HG       SER  52   4.346   6.372  -0.410
  395    H    ASN  53           H        ASN  53   3.613   5.066  -4.843
  396    HA   ASN  53           HA       ASN  53   3.768   7.955  -5.213
  397   1HB   ASN  53          HB2       ASN  53   5.585   5.714  -5.997
  398   2HB   ASN  53          HB3       ASN  53   5.290   6.878  -7.273
  399   1HD2  ASN  53          HD21      ASN  53   5.863   9.041  -7.010
  400   2HD2  ASN  53          HD22      ASN  53   7.016   9.567  -5.828
  401    H    TYR  54           H        TYR  54   2.349   4.903  -6.089
  402    HA   TYR  54           HA       TYR  54   1.347   6.015  -8.620
  403   1HB   TYR  54          HB2       TYR  54   1.756   3.213  -7.421
  404   2HB   TYR  54          HB3       TYR  54   0.792   3.442  -8.866
  405    HD1  TYR  54           HD1      TYR  54   3.978   2.620  -7.707
  406    HD2  TYR  54           HD2      TYR  54   2.049   4.915 -10.760
  407    HE1  TYR  54           HE1      TYR  54   6.079   2.502  -9.135
  408    HE2  TYR  54           HE2      TYR  54   4.156   4.788 -12.177
  409    HH   TYR  54           HH       TYR  54   6.099   3.779 -12.422
  410    H    VAL  55           H        VAL  55   0.182   7.027  -6.279
  411    HA   VAL  55           HA       VAL  55  -2.365   5.560  -6.227
  412    HB   VAL  55           HB       VAL  55  -2.484   6.975  -3.973
  413   1HG1  VAL  55          HG11      VAL  55  -1.510   4.911  -2.814
  414   2HG1  VAL  55          HG12      VAL  55  -2.862   4.643  -3.941
  415   3HG1  VAL  55          HG13      VAL  55  -1.195   4.278  -4.449
  416   1HG2  VAL  55          HG21      VAL  55   0.099   6.361  -3.149
  417   2HG2  VAL  55          HG22      VAL  55   0.331   7.092  -4.756
  418   3HG2  VAL  55          HG23      VAL  55  -0.545   7.986  -3.489
  419    H    ALA  56           H        ALA  56  -4.264   7.102  -5.675
  420    HA   ALA  56           HA       ALA  56  -3.827   9.807  -6.616
  421   1HB   ALA  56          HB1       ALA  56  -4.534   9.403  -8.710
  422   2HB   ALA  56          HB2       ALA  56  -4.814   7.689  -8.321
  423   3HB   ALA  56          HB3       ALA  56  -6.102   8.887  -8.044
  424    HA   PRO  57           HA       PRO  57  -6.754   9.617  -3.254
  425   1HB   PRO  57          HB2       PRO  57  -6.010  11.969  -2.078
  426   2HB   PRO  57          HB3       PRO  57  -5.307  10.421  -1.653
  427   1HG   PRO  57          HG2       PRO  57  -4.139  12.606  -3.265
  428   2HG   PRO  57          HG3       PRO  57  -3.327  11.266  -2.482
  429   1HD   PRO  57          HD2       PRO  57  -3.911  11.521  -5.278
  430   2HD   PRO  57          HD3       PRO  57  -3.203  10.133  -4.478
  431    H    VAL  58           H        VAL  58  -8.850  10.167  -3.311
  432    HA   VAL  58           HA       VAL  58  -9.385  12.507  -5.005
  433    HB   VAL  58           HB       VAL  58 -11.547  11.432  -5.468
  434   1HG1  VAL  58          HG11      VAL  58  -9.036   9.860  -6.105
  435   2HG1  VAL  58          HG12      VAL  58 -10.619   9.510  -6.841
  436   3HG1  VAL  58          HG13      VAL  58  -9.847  11.093  -7.101
  437   1HG2  VAL  58          HG21      VAL  58 -10.583   9.545  -3.415
  438   2HG2  VAL  58          HG22      VAL  58 -12.242   9.946  -3.923
  439   3HG2  VAL  58          HG23      VAL  58 -11.282   8.775  -4.859
  440    H    ASP  59           H        ASP  59 -10.696  14.149  -4.214
  441    HA   ASP  59           HA       ASP  59 -11.015  14.123  -1.385
  442   1HB   ASP  59          HB2       ASP  59 -10.562  16.085  -3.277
  443   2HB   ASP  59          HB3       ASP  59 -12.280  16.294  -2.998
  444    HD2  ASP  59           HD2      ASP  59 -10.345  15.296  -0.329
  Start of MODEL   11
    1   1H    VAL   1           H        VAL   1 -13.840   8.250   5.708
    2    HA   VAL   1           HA       VAL   1 -13.811   7.153   3.760
    3    HB   VAL   1           HB       VAL   1 -14.482   8.493   1.634
    4   1HG1  VAL   1          HG11      VAL   1 -16.391   7.734   3.863
    5   2HG1  VAL   1          HG12      VAL   1 -16.920   8.162   2.219
    6   3HG1  VAL   1          HG13      VAL   1 -15.874   6.744   2.476
    7   1HG2  VAL   1          HG21      VAL   1 -15.428  10.549   1.822
    8   2HG2  VAL   1          HG22      VAL   1 -16.101  10.216   3.435
    9   3HG2  VAL   1          HG23      VAL   1 -14.384  10.648   3.260
   10    H    THR   2           H        THR   2 -11.563   8.212   4.998
   11    HA   THR   2           HA       THR   2 -10.024   9.569   2.932
   12    HB   THR   2           HB       THR   2  -8.337   9.124   5.070
   13    HG1  THR   2           HG1      THR   2 -10.006   8.027   6.263
   14   1HG2  THR   2          HG21      THR   2  -8.514  11.398   5.148
   15   2HG2  THR   2          HG22      THR   2  -9.955  11.314   4.106
   16   3HG2  THR   2          HG23      THR   2 -10.131  11.244   5.876
   17    H    LEU   3           H        LEU   3 -10.752   7.285   1.786
   18    HA   LEU   3           HA       LEU   3  -8.461   5.498   2.208
   19   1HB   LEU   3          HB2       LEU   3 -11.159   4.898   0.986
   20   2HB   LEU   3          HB3       LEU   3  -9.838   3.761   1.176
   21    HG   LEU   3           HG       LEU   3 -10.150   4.611   3.754
   22   1HD1  LEU   3          HD11      LEU   3 -12.041   5.956   3.540
   23   2HD1  LEU   3          HD12      LEU   3 -12.819   4.853   2.379
   24   3HD1  LEU   3          HD13      LEU   3 -12.697   4.397   4.095
   25   1HD2  LEU   3          HD21      LEU   3  -9.908   2.315   3.178
   26   2HD2  LEU   3          HD22      LEU   3 -11.436   2.474   4.076
   27   3HD2  LEU   3          HD23      LEU   3 -11.459   2.300   2.306
   28    H    PHE   4           H        PHE   4  -6.948   5.352   0.627
   29    HA   PHE   4           HA       PHE   4  -7.325   7.005  -1.696
   30   1HB   PHE   4          HB2       PHE   4  -5.133   5.240  -0.482
   31   2HB   PHE   4          HB3       PHE   4  -4.912   5.955  -2.066
   32    HD1  PHE   4           HD1      PHE   4  -4.760   8.414  -2.304
   33    HD2  PHE   4           HD2      PHE   4  -4.964   6.562   1.509
   34    HE1  PHE   4           HE1      PHE   4  -3.928  10.526  -1.233
   35    HE2  PHE   4           HE2      PHE   4  -4.132   8.674   2.579
   36    HZ   PHE   4           HZ       PHE   4  -3.624  10.631   1.195
   37    H    VAL   5           H        VAL   5  -6.042   5.808  -3.756
   38    HA   VAL   5           HA       VAL   5  -7.498   3.284  -4.141
   39    HB   VAL   5           HB       VAL   5  -7.520   4.105  -6.601
   40   1HG1  VAL   5          HG11      VAL   5  -9.544   3.724  -5.337
   41   2HG1  VAL   5          HG12      VAL   5  -9.341   5.262  -4.466
   42   3HG1  VAL   5          HG13      VAL   5  -9.695   5.267  -6.210
   43   1HG2  VAL   5          HG21      VAL   5  -7.955   6.848  -5.887
   44   2HG2  VAL   5          HG22      VAL   5  -6.330   6.364  -5.345
   45   3HG2  VAL   5          HG23      VAL   5  -6.796   6.164  -7.052
   46    H    ALA   6           H        ALA   6  -6.411   1.666  -5.362
   47    HA   ALA   6           HA       ALA   6  -3.528   2.183  -5.585
   48   1HB   ALA   6          HB1       ALA   6  -4.367   0.418  -3.970
   49   2HB   ALA   6          HB2       ALA   6  -4.970  -0.487  -5.379
   50   3HB   ALA   6          HB3       ALA   6  -3.227  -0.176  -5.201
   51    H    LEU   7           H        LEU   7  -3.597   3.156  -7.677
   52    HA   LEU   7           HA       LEU   7  -4.605   1.391  -9.789
   53   1HB   LEU   7          HB2       LEU   7  -3.830   4.146 -10.466
   54   2HB   LEU   7          HB3       LEU   7  -5.212   3.196 -10.975
   55    HG   LEU   7           HG       LEU   7  -5.653   3.730  -8.246
   56   1HD1  LEU   7          HD11      LEU   7  -5.615   6.423  -8.818
   57   2HD1  LEU   7          HD12      LEU   7  -4.454   5.557  -7.782
   58   3HD1  LEU   7          HD13      LEU   7  -4.070   5.855  -9.495
   59   1HD2  LEU   7          HD21      LEU   7  -7.628   3.852  -9.263
   60   2HD2  LEU   7          HD22      LEU   7  -7.216   5.537  -9.659
   61   3HD2  LEU   7          HD23      LEU   7  -6.887   4.241 -10.833
   62    H    TYR   8           H        TYR   8  -2.039   1.117  -8.210
   63    HA   TYR   8           HA       TYR   8  -0.302   1.025 -10.553
   64   1HB   TYR   8          HB2       TYR   8  -0.193   3.006  -8.540
   65   2HB   TYR   8          HB3       TYR   8   0.939   1.811  -7.938
   66    HD1  TYR   8           HD1      TYR   8   0.148   3.349 -11.281
   67    HD2  TYR   8           HD2      TYR   8   3.151   2.251  -8.438
   68    HE1  TYR   8           HE1      TYR   8   1.950   4.271 -12.819
   69    HE2  TYR   8           HE2      TYR   8   4.943   3.177  -9.986
   70    HH   TYR   8           HH       TYR   8   4.052   4.767 -13.029
   71    H    ASP   9           H        ASP   9   0.148  -1.116 -10.739
   72    HA   ASP   9           HA       ASP   9   0.363  -2.626  -8.279
   73   1HB   ASP   9          HB2       ASP   9   0.258  -4.616  -9.768
   74   2HB   ASP   9          HB3       ASP   9  -1.108  -3.547 -10.022
   75    HD2  ASP   9           HD2      ASP   9  -1.305  -3.165 -12.577
   76    H    TYR  10           H        TYR  10   2.295  -3.972  -7.896
   77    HA   TYR  10           HA       TYR  10   4.521  -3.612  -9.731
   78   1HB   TYR  10          HB2       TYR  10   4.076  -2.011  -7.421
   79   2HB   TYR  10          HB3       TYR  10   5.164  -3.255  -6.837
   80    HD1  TYR  10           HD1      TYR  10   7.266  -3.709  -8.451
   81    HD2  TYR  10           HD2      TYR  10   5.008  -0.078  -8.304
   82    HE1  TYR  10           HE1      TYR  10   9.237  -2.435  -9.430
   83    HE2  TYR  10           HE2      TYR  10   6.987   1.184  -9.283
   84    HH   TYR  10           HH       TYR  10   9.902   0.306  -9.196
   85    H    GLU  11           H        GLU  11   6.542  -4.846  -8.626
   86    HA   GLU  11           HA       GLU  11   5.449  -7.253  -7.402
   87   1HB   GLU  11          HB2       GLU  11   7.379  -7.041  -9.742
   88   2HB   GLU  11          HB3       GLU  11   7.260  -8.498  -8.775
   89   1HG   GLU  11          HG2       GLU  11   4.856  -8.707  -9.303
   90   2HG   GLU  11          HG3       GLU  11   4.879  -7.179 -10.161
   91    HE2  GLU  11           HE2      GLU  11   5.016 -10.443 -11.214
   92    H    ALA  12           H        ALA  12   7.083  -8.518  -6.137
   93    HA   ALA  12           HA       ALA  12   9.542  -7.123  -5.525
   94   1HB   ALA  12          HB1       ALA  12   8.460  -7.669  -2.984
   95   2HB   ALA  12          HB2       ALA  12   8.712  -6.068  -3.720
   96   3HB   ALA  12          HB3       ALA  12   7.141  -6.889  -3.892
   97    H    ARG  13           H        ARG  13  11.102  -8.517  -4.549
   98    HA   ARG  13           HA       ARG  13  10.195 -11.282  -4.433
   99   1HB   ARG  13          HB2       ARG  13  12.515 -10.018  -5.830
  100   2HB   ARG  13          HB3       ARG  13  12.902 -11.493  -4.968
  101   1HG   ARG  13          HG2       ARG  13  12.126 -12.597  -6.801
  102   2HG   ARG  13          HG3       ARG  13  10.521 -12.178  -6.237
  103   1HD   ARG  13          HD2       ARG  13  10.193 -10.806  -8.019
  104   2HD   ARG  13          HD3       ARG  13  11.640  -9.892  -7.638
  105    HE   ARG  13           HE       ARG  13  12.854 -11.158  -9.213
  106   1HH1  ARG  13          HH22      ARG  13   9.694 -12.663  -8.661
  107   2HH1  ARG  13          HH21      ARG  13   9.848 -13.765  -9.987
  108   1HH2  ARG  13          HH11      ARG  13  11.834 -13.717 -11.328
  109    H    THR  14           H        THR  14  10.305  -9.300  -2.245
  110    HA   THR  14           HA       THR  14  12.491 -10.463  -0.645
  111    HB   THR  14           HB       THR  14  11.149  -7.716  -0.431
  112    HG1  THR  14           HG1      THR  14  13.790  -7.642  -0.989
  113   1HG2  THR  14          HG21      THR  14  13.410  -7.348   0.873
  114   2HG2  THR  14          HG22      THR  14  12.070  -8.148   1.729
  115   3HG2  THR  14          HG23      THR  14  13.405  -9.119   1.058
  116    H    GLU  15           H        GLU  15  12.060 -11.116   1.489
  117    HA   GLU  15           HA       GLU  15   9.385 -12.024   1.787
  118   1HB   GLU  15          HB2       GLU  15  11.782 -12.234   3.663
  119   2HB   GLU  15          HB3       GLU  15  10.269 -13.094   3.869
  120   1HG   GLU  15          HG2       GLU  15  10.766 -13.876   1.344
  121   2HG   GLU  15          HG3       GLU  15  12.418 -13.502   1.791
  122    HE2  GLU  15           HE2      GLU  15  10.536 -16.402   3.860
  123    H    ASP  16           H        ASP  16  11.193  -9.204   2.692
  124    HA   ASP  16           HA       ASP  16   9.732  -8.671   5.057
  125   1HB   ASP  16          HB2       ASP  16  11.483  -6.928   3.264
  126   2HB   ASP  16          HB3       ASP  16  10.788  -6.356   4.767
  127    HD2  ASP  16           HD2      ASP  16  14.013  -6.867   5.061
  128    H    ASP  17           H        ASP  17   9.402  -8.142   1.576
  129    HA   ASP  17           HA       ASP  17   7.232  -6.269   2.075
  130   1HB   ASP  17          HB2       ASP  17   8.871  -6.903  -0.419
  131   2HB   ASP  17          HB3       ASP  17   7.430  -5.907  -0.472
  132    HD2  ASP  17           HD2      ASP  17   8.023  -3.771  -0.459
  133    H    LEU  18           H        LEU  18   5.912  -6.688  -0.485
  134    HA   LEU  18           HA       LEU  18   5.429  -9.454  -0.897
  135   1HB   LEU  18          HB2       LEU  18   4.267  -9.073   1.272
  136   2HB   LEU  18          HB3       LEU  18   3.239  -7.895   0.480
  137    HG   LEU  18           HG       LEU  18   2.760  -9.944  -1.160
  138   1HD1  LEU  18          HD11      LEU  18   2.532 -11.999   0.416
  139   2HD1  LEU  18          HD12      LEU  18   4.101 -11.645  -0.345
  140   3HD1  LEU  18          HD13      LEU  18   3.817 -11.202   1.355
  141   1HD2  LEU  18          HD21      LEU  18   0.696  -9.832  -0.307
  142   2HD2  LEU  18          HD22      LEU  18   1.238 -10.293   1.324
  143   3HD2  LEU  18          HD23      LEU  18   1.368  -8.600   0.788
  144    H    SER  19           H        SER  19   3.879  -9.791  -2.682
  145    HA   SER  19           HA       SER  19   4.149  -7.684  -4.542
  146   1HB   SER  19          HB2       SER  19   4.047 -10.334  -4.843
  147   2HB   SER  19          HB3       SER  19   2.326 -10.047  -4.998
  148    HG   SER  19           HG       SER  19   4.441  -8.919  -6.619
  149    H    PHE  20           H        PHE  20   2.366  -6.564  -5.661
  150    HA   PHE  20           HA       PHE  20  -0.170  -6.641  -4.207
  151   1HB   PHE  20          HB2       PHE  20   1.827  -4.414  -4.651
  152   2HB   PHE  20          HB3       PHE  20   0.146  -3.971  -4.874
  153    HD1  PHE  20           HD1      PHE  20  -1.363  -3.835  -3.003
  154    HD2  PHE  20           HD2      PHE  20   2.637  -5.136  -2.442
  155    HE1  PHE  20           HE1      PHE  20  -1.617  -3.549  -0.523
  156    HE2  PHE  20           HE2      PHE  20   2.383  -4.851   0.038
  157    HZ   PHE  20           HZ       PHE  20   0.258  -4.061   0.968
  158    H    HIS  21           H        HIS  21  -2.014  -5.869  -5.461
  159    HA   HIS  21           HA       HIS  21  -1.443  -5.506  -8.296
  160   1HB   HIS  21          HB2       HIS  21  -2.707  -7.826  -7.073
  161   2HB   HIS  21          HB3       HIS  21  -3.785  -7.041  -8.210
  162    HD1  HIS  21           HD1      HIS  21  -1.019  -9.401  -8.054
  163    HD2  HIS  21           HD2      HIS  21  -2.500  -6.688 -10.889
  164    HE1  HIS  21           HE1      HIS  21  -0.030 -10.103 -10.299
  165    H    LYS  22           H        LYS  22  -3.540  -4.747  -9.466
  166    HA   LYS  22           HA       LYS  22  -4.508  -2.517  -7.989
  167   1HB   LYS  22          HB2       LYS  22  -5.901  -2.235 -10.141
  168   2HB   LYS  22          HB3       LYS  22  -4.160  -2.066 -10.239
  169   1HG   LYS  22          HG2       LYS  22  -4.284  -4.714 -10.720
  170   2HG   LYS  22          HG3       LYS  22  -5.911  -4.313 -11.232
  171   1HD   LYS  22          HD2       LYS  22  -4.937  -2.520 -12.743
  172   2HD   LYS  22          HD3       LYS  22  -3.333  -3.065 -12.295
  173   1HE   LYS  22          HE2       LYS  22  -3.925  -4.140 -14.398
  174   2HE   LYS  22          HE3       LYS  22  -3.913  -5.371 -13.151
  175   1HZ   LYS  22          HZ1       LYS  22  -6.356  -5.105 -12.985
  176   2HZ   LYS  22          HZ2       LYS  22  -6.343  -4.014 -14.194
  177    H    GLY  23           H        GLY  23  -6.825  -2.027  -7.630
  178   1HA   GLY  23          HA3       GLY  23  -9.019  -2.657  -7.274
  179   2HA   GLY  23          HA2       GLY  23  -8.602  -4.339  -7.529
  180    H    GLU  24           H        GLU  24  -7.797  -1.614  -5.254
  181    HA   GLU  24           HA       GLU  24  -8.674  -3.091  -3.049
  182   1HB   GLU  24          HB2       GLU  24  -5.956  -3.604  -3.865
  183   2HB   GLU  24          HB3       GLU  24  -5.909  -2.719  -2.352
  184   1HG   GLU  24          HG2       GLU  24  -7.382  -4.357  -1.272
  185   2HG   GLU  24          HG3       GLU  24  -7.662  -5.179  -2.795
  186    HE2  GLU  24           HE2      GLU  24  -4.591  -4.426  -0.887
  187    H    LYS  25           H        LYS  25  -8.132  -1.859  -0.931
  188    HA   LYS  25           HA       LYS  25  -8.204   0.980  -1.583
  189   1HB   LYS  25          HB2       LYS  25  -9.487  -0.742   0.367
  190   2HB   LYS  25          HB3       LYS  25  -8.678   0.592   1.165
  191   1HG   LYS  25          HG2       LYS  25  -9.989   2.218   0.106
  192   2HG   LYS  25          HG3       LYS  25 -10.275   1.226  -1.309
  193   1HD   LYS  25          HD2       LYS  25 -11.796  -0.246   0.007
  194   2HD   LYS  25          HD3       LYS  25 -11.484   0.703   1.448
  195   1HE   LYS  25          HE2       LYS  25 -12.630   2.616   0.593
  196   2HE   LYS  25          HE3       LYS  25 -12.530   2.053  -1.064
  197   1HZ   LYS  25          HZ1       LYS  25 -14.554   1.162  -0.735
  198   2HZ   LYS  25          HZ2       LYS  25 -13.912   0.084   0.304
  199    H    PHE  26           H        PHE  26  -7.257   2.191   0.677
  200    HA   PHE  26           HA       PHE  26  -4.652   1.056   1.243
  201   1HB   PHE  26          HB2       PHE  26  -5.063   2.907  -0.840
  202   2HB   PHE  26          HB3       PHE  26  -4.671   3.959   0.506
  203    HD1  PHE  26           HD1      PHE  26  -3.392   1.542  -1.869
  204    HD2  PHE  26           HD2      PHE  26  -2.468   3.756   1.631
  205    HE1  PHE  26           HE1      PHE  26  -0.949   1.095  -2.231
  206    HE2  PHE  26           HE2      PHE  26  -0.025   3.309   1.269
  207    HZ   PHE  26           HZ       PHE  26   0.706   1.983  -0.657
  208    H    GLN  27           H        GLN  27  -4.482   1.151   3.428
  209    HA   GLN  27           HA       GLN  27  -5.855   3.359   4.733
  210   1HB   GLN  27          HB2       GLN  27  -5.562   0.525   5.323
  211   2HB   GLN  27          HB3       GLN  27  -4.955   1.470   6.668
  212   1HG   GLN  27          HG2       GLN  27  -7.304   2.826   5.979
  213   2HG   GLN  27          HG3       GLN  27  -7.733   1.149   5.699
  214   1HE2  GLN  27          HE21      GLN  27  -6.374  -0.244   7.531
  215   2HE2  GLN  27          HE22      GLN  27  -6.831   0.179   9.147
  216    H    ILE  28           H        ILE  28  -4.683   4.970   5.703
  217    HA   ILE  28           HA       ILE  28  -1.821   4.800   5.555
  218    HB   ILE  28           HB       ILE  28  -3.112   7.069   6.932
  219   1HG1  ILE  28          HG12      ILE  28  -3.478   7.044   3.972
  220   2HG1  ILE  28          HG13      ILE  28  -4.622   6.122   4.928
  221   1HG2  ILE  28          HG21      ILE  28  -1.149   6.879   4.631
  222   2HG2  ILE  28          HG22      ILE  28  -1.596   8.352   5.523
  223   3HG2  ILE  28          HG23      ILE  28  -0.727   7.038   6.353
  224   1HD1  ILE  28          HD11      ILE  28  -4.097   9.094   4.933
  225   2HD1  ILE  28          HD12      ILE  28  -5.648   8.221   4.918
  226   3HD1  ILE  28          HD13      ILE  28  -4.701   8.326   6.422
  227    H    LEU  29           H        LEU  29  -0.349   4.714   7.277
  228    HA   LEU  29           HA       LEU  29  -1.322   4.714   9.968
  229   1HB   LEU  29          HB2       LEU  29  -1.862   2.413   9.018
  230   2HB   LEU  29          HB3       LEU  29  -0.132   2.138   8.959
  231    HG   LEU  29           HG       LEU  29  -0.208   2.803  11.499
  232   1HD1  LEU  29          HD11      LEU  29  -2.226   2.380  12.659
  233   2HD1  LEU  29          HD12      LEU  29  -2.639   3.484  11.326
  234   3HD1  LEU  29          HD13      LEU  29  -3.026   1.751  11.198
  235   1HD2  LEU  29          HD21      LEU  29   0.564   0.683  11.103
  236   2HD2  LEU  29          HD22      LEU  29  -0.956   0.318  11.953
  237   3HD2  LEU  29          HD23      LEU  29  -0.880   0.205  10.178
  238    H    ASN  30           H        ASN  30   1.385   3.607   7.812
  239    HA   ASN  30           HA       ASN  30   3.228   4.684   9.746
  240   1HB   ASN  30          HB2       ASN  30   3.575   2.436   8.554
  241   2HB   ASN  30          HB3       ASN  30   3.814   3.327   7.063
  242   1HD2  ASN  30          HD21      ASN  30   5.832   1.873   7.572
  243   2HD2  ASN  30          HD22      ASN  30   7.180   2.704   8.274
  244    H    SER  31           H        SER  31   3.528   6.919   9.540
  245    HA   SER  31           HA       SER  31   4.008   7.879   6.834
  246   1HB   SER  31          HB2       SER  31   2.926  10.099   7.768
  247   2HB   SER  31          HB3       SER  31   1.900   8.819   7.152
  248    HG   SER  31           HG       SER  31   2.583   9.215   9.942
  249    H    SER  32           H        SER  32   6.113   7.057   8.369
  250    HA   SER  32           HA       SER  32   7.272   9.602   9.130
  251   1HB   SER  32          HB2       SER  32   8.188   8.760  11.185
  252   2HB   SER  32          HB3       SER  32   6.482   8.357  11.201
  253    HG   SER  32           HG       SER  32   8.740   6.632  10.777
  254    H    GLU  33           H        GLU  33   7.580   8.296   6.657
  255    HA   GLU  33           HA       GLU  33  10.357   7.491   6.891
  256   1HB   GLU  33          HB2       GLU  33   8.468   5.574   6.512
  257   2HB   GLU  33          HB3       GLU  33   8.716   6.046   4.843
  258   1HG   GLU  33          HG2       GLU  33  11.323   5.867   5.983
  259   2HG   GLU  33          HG3       GLU  33  10.452   4.467   6.577
  260    HE2  GLU  33           HE2      GLU  33  11.406   3.126   5.415
  261    H    GLY  34           H        GLY  34   7.942   7.643   4.181
  262   1HA   GLY  34          HA3       GLY  34   8.366  10.093   3.146
  263   2HA   GLY  34          HA2       GLY  34   9.788   9.221   2.608
  264    H    ASP  35           H        ASP  35   9.526   7.269   1.263
  265    HA   ASP  35           HA       ASP  35   7.129   7.523  -0.329
  266   1HB   ASP  35          HB2       ASP  35   9.539   5.743  -0.873
  267   2HB   ASP  35          HB3       ASP  35   8.341   6.289  -2.030
  268    HD2  ASP  35           HD2      ASP  35   8.523   8.708  -2.533
  269    H    TRP  36           H        TRP  36   9.251   4.986   1.208
  270    HA   TRP  36           HA       TRP  36   7.299   2.936   0.851
  271   1HB   TRP  36          HB2       TRP  36   9.961   3.140   2.224
  272   2HB   TRP  36          HB3       TRP  36   8.931   1.745   2.481
  273    HD1  TRP  36           HD1      TRP  36   8.752  -0.018   0.455
  274    HE1  TRP  36           HE1      TRP  36  10.010  -0.405  -1.832
  275    HE3  TRP  36           HE3      TRP  36  11.039   4.522   0.344
  276    HZ2  TRP  36           HZ2      TRP  36  11.782   1.196  -3.395
  277    HZ3  TRP  36           HZ3      TRP  36  12.518   5.030  -1.598
  278    HH2  TRP  36           HH2      TRP  36  12.904   3.454  -3.425
  279    H    TRP  37           H        TRP  37   5.520   2.626   2.120
  280    HA   TRP  37           HA       TRP  37   5.703   3.331   4.937
  281   1HB   TRP  37          HB2       TRP  37   3.330   4.372   4.614
  282   2HB   TRP  37          HB3       TRP  37   4.780   5.334   4.403
  283    HD1  TRP  37           HD1      TRP  37   3.394   2.955   1.659
  284    HE1  TRP  37           HE1      TRP  37   2.735   4.309  -0.508
  285    HE3  TRP  37           HE3      TRP  37   4.215   7.563   3.650
  286    HZ2  TRP  37           HZ2      TRP  37   2.634   7.092  -1.133
  287    HZ3  TRP  37           HZ3      TRP  37   3.812   9.545   2.193
  288    HH2  TRP  37           HH2      TRP  37   3.050   9.364  -0.122
  289    H    GLU  38           H        GLU  38   3.346   2.620   5.901
  290    HA   GLU  38           HA       GLU  38   3.114  -0.104   5.028
  291   1HB   GLU  38          HB2       GLU  38   2.448   1.458   7.470
  292   2HB   GLU  38          HB3       GLU  38   1.314   0.175   7.099
  293   1HG   GLU  38          HG2       GLU  38   3.058  -1.507   7.124
  294   2HG   GLU  38          HG3       GLU  38   4.324  -0.295   7.127
  295    HE2  GLU  38           HE2      GLU  38   4.519   0.473  10.079
  296    H    ALA  39           H        ALA  39   0.972  -1.127   4.616
  297    HA   ALA  39           HA       ALA  39  -1.182   0.699   3.975
  298   1HB   ALA  39          HB1       ALA  39  -1.250   0.287   1.679
  299   2HB   ALA  39          HB2       ALA  39   0.502   0.403   1.974
  300   3HB   ALA  39          HB3       ALA  39  -0.269  -1.193   1.810
  301    H    ARG  40           H        ARG  40  -2.894  -0.215   4.983
  302    HA   ARG  40           HA       ARG  40  -2.821  -3.065   5.374
  303   1HB   ARG  40          HB2       ARG  40  -3.728  -0.874   6.918
  304   2HB   ARG  40          HB3       ARG  40  -5.203  -1.670   6.408
  305   1HG   ARG  40          HG2       ARG  40  -3.726  -3.861   7.129
  306   2HG   ARG  40          HG3       ARG  40  -3.027  -2.669   8.207
  307   1HD   ARG  40          HD2       ARG  40  -5.008  -2.373   9.403
  308   2HD   ARG  40          HD3       ARG  40  -6.027  -2.704   8.017
  309    HE   ARG  40           HE       ARG  40  -4.472  -4.905   9.332
  310   1HH1  ARG  40          HH22      ARG  40  -7.550  -3.572   8.189
  311   2HH1  ARG  40          HH21      ARG  40  -8.436  -5.027   8.493
  312   1HH2  ARG  40          HH11      ARG  40  -7.295  -6.928   9.402
  313    H    SER  41           H        SER  41  -3.958  -4.451   4.049
  314    HA   SER  41           HA       SER  41  -5.755  -3.261   2.152
  315   1HB   SER  41          HB2       SER  41  -4.512  -4.814   0.995
  316   2HB   SER  41          HB3       SER  41  -4.241  -5.814   2.408
  317    HG   SER  41           HG       SER  41  -5.676  -7.092   1.427
  318    H    LEU  42           H        LEU  42  -7.920  -3.087   2.589
  319    HA   LEU  42           HA       LEU  42  -9.013  -4.685   4.742
  320   1HB   LEU  42          HB2       LEU  42  -9.347  -2.091   3.957
  321   2HB   LEU  42          HB3       LEU  42 -10.762  -2.846   3.252
  322    HG   LEU  42           HG       LEU  42 -11.105  -3.869   5.634
  323   1HD1  LEU  42          HD11      LEU  42  -9.821  -3.198   7.320
  324   2HD1  LEU  42          HD12      LEU  42  -8.737  -2.470   6.111
  325   3HD1  LEU  42          HD13      LEU  42 -10.009  -1.485   6.873
  326   1HD2  LEU  42          HD21      LEU  42 -12.153  -1.697   4.286
  327   2HD2  LEU  42          HD22      LEU  42 -12.800  -2.428   5.774
  328   3HD2  LEU  42          HD23      LEU  42 -11.713  -1.021   5.872
  329    H    THR  43           H        THR  43  -8.131  -6.046   2.286
  330    HA   THR  43           HA       THR  43 -10.717  -7.243   1.608
  331    HB   THR  43           HB       THR  43  -8.597  -6.176  -0.319
  332    HG1  THR  43           HG1      THR  43 -11.507  -5.954   0.016
  333   1HG2  THR  43          HG21      THR  43 -11.063  -7.363  -1.446
  334   2HG2  THR  43          HG22      THR  43  -9.378  -7.544  -1.990
  335   3HG2  THR  43          HG23      THR  43 -10.007  -8.576  -0.684
  336    H    THR  44           H        THR  44  -7.172  -7.575   0.888
  337    HA   THR  44           HA       THR  44  -7.364 -10.413   0.914
  338    HB   THR  44           HB       THR  44  -4.922  -8.573   1.098
  339    HG1  THR  44           HG1      THR  44  -6.669  -9.599  -1.015
  340   1HG2  THR  44          HG21      THR  44  -4.219 -10.885   1.336
  341   2HG2  THR  44          HG22      THR  44  -5.392 -11.430   0.114
  342   3HG2  THR  44          HG23      THR  44  -3.976 -10.469  -0.377
  343    H    GLY  45           H        GLY  45  -6.116  -7.962   3.261
  344   1HA   GLY  45          HA3       GLY  45  -6.427  -8.214   5.570
  345   2HA   GLY  45          HA2       GLY  45  -6.554  -9.951   5.378
  346    H    GLU  46           H        GLU  46  -4.044  -8.567   3.429
  347    HA   GLU  46           HA       GLU  46  -2.112  -9.353   5.469
  348   1HB   GLU  46          HB2       GLU  46  -2.489 -10.393   2.854
  349   2HB   GLU  46          HB3       GLU  46  -1.040  -9.412   2.756
  350   1HG   GLU  46          HG2       GLU  46   0.173 -10.863   4.038
  351   2HG   GLU  46          HG3       GLU  46  -1.112 -11.041   5.216
  352    HE2  GLU  46           HE2      GLU  46  -2.676 -13.155   2.596
  353    H    THR  47           H        THR  47  -0.141  -8.088   5.627
  354    HA   THR  47           HA       THR  47  -0.435  -5.420   4.415
  355    HB   THR  47           HB       THR  47   0.700  -4.607   6.453
  356    HG1  THR  47           HG1      THR  47   0.559  -7.192   7.640
  357   1HG2  THR  47          HG21      THR  47  -0.884  -6.262   8.120
  358   2HG2  THR  47          HG22      THR  47  -1.356  -4.679   7.457
  359   3HG2  THR  47          HG23      THR  47  -1.785  -6.171   6.588
  360    H    GLY  48           H        GLY  48   1.854  -4.259   4.403
  361   1HA   GLY  48          HA3       GLY  48   4.230  -5.533   4.116
  362   2HA   GLY  48          HA2       GLY  48   3.438  -5.831   2.580
  363    H    TYR  49           H        TYR  49   5.407  -4.485   1.856
  364    HA   TYR  49           HA       TYR  49   4.852  -1.619   2.186
  365   1HB   TYR  49          HB2       TYR  49   7.249  -3.426   1.620
  366   2HB   TYR  49          HB3       TYR  49   7.321  -1.765   1.065
  367    HD1  TYR  49           HD1      TYR  49   8.348  -3.824   3.614
  368    HD2  TYR  49           HD2      TYR  49   6.423  -0.045   3.052
  369    HE1  TYR  49           HE1      TYR  49   9.119  -3.080   5.920
  370    HE2  TYR  49           HE2      TYR  49   7.201   0.687   5.359
  371    HH   TYR  49           HH       TYR  49   7.815  -0.507   7.512
  372    H    ILE  50           H        ILE  50   4.338  -0.358   0.430
  373    HA   ILE  50           HA       ILE  50   4.727  -1.520  -2.215
  374    HB   ILE  50           HB       ILE  50   2.518  -2.214  -1.693
  375   1HG1  ILE  50          HG12      ILE  50   1.184  -0.693  -3.322
  376   2HG1  ILE  50          HG13      ILE  50   2.702   0.151  -3.551
  377   1HG2  ILE  50          HG21      ILE  50   1.483   0.538  -1.197
  378   2HG2  ILE  50          HG22      ILE  50   0.911  -1.035  -0.591
  379   3HG2  ILE  50          HG23      ILE  50   2.356  -0.279   0.121
  380   1HD1  ILE  50          HD11      ILE  50   3.658  -1.591  -4.708
  381   2HD1  ILE  50          HD12      ILE  50   2.884  -2.825  -3.687
  382   3HD1  ILE  50          HD13      ILE  50   1.962  -2.048  -4.996
  383    HA   PRO  51           HA       PRO  51   6.139   2.665  -2.301
  384   1HB   PRO  51          HB2       PRO  51   7.883   2.345  -4.380
  385   2HB   PRO  51          HB3       PRO  51   8.332   2.091  -2.706
  386   1HG   PRO  51          HG2       PRO  51   7.813   0.082  -4.811
  387   2HG   PRO  51          HG3       PRO  51   8.657  -0.117  -3.289
  388   1HD   PRO  51          HD2       PRO  51   5.989  -0.975  -3.896
  389   2HD   PRO  51          HD3       PRO  51   6.792  -1.069  -2.341
  390    H    SER  52           H        SER  52   4.105   3.525  -2.810
  391    HA   SER  52           HA       SER  52   3.998   4.089  -5.640
  392   1HB   SER  52          HB2       SER  52   2.509   2.040  -4.981
  393   2HB   SER  52          HB3       SER  52   1.470   3.219  -4.203
  394    HG   SER  52           HG       SER  52   1.044   4.211  -6.181
  395    H    ASN  53           H        ASN  53   4.323   6.304  -5.415
  396    HA   ASN  53           HA       ASN  53   2.890   7.649  -3.308
  397   1HB   ASN  53          HB2       ASN  53   4.784   8.855  -5.387
  398   2HB   ASN  53          HB3       ASN  53   4.298   9.583  -3.869
  399   1HD2  ASN  53          HD21      ASN  53   6.539   7.646  -5.468
  400   2HD2  ASN  53          HD22      ASN  53   7.454   7.064  -4.117
  401    H    TYR  54           H        TYR  54   1.900   6.465  -6.113
  402    HA   TYR  54           HA       TYR  54   0.857   8.911  -7.307
  403   1HB   TYR  54          HB2       TYR  54   1.481   6.078  -7.994
  404   2HB   TYR  54          HB3       TYR  54  -0.096   6.549  -8.595
  405    HD1  TYR  54           HD1      TYR  54   3.489   7.615  -8.608
  406    HD2  TYR  54           HD2      TYR  54  -0.289   7.737 -10.612
  407    HE1  TYR  54           HE1      TYR  54   4.579   8.739 -10.610
  408    HE2  TYR  54           HE2      TYR  54   0.815   8.861 -12.608
  409    HH   TYR  54           HH       TYR  54   2.853  10.298 -12.962
  410    H    VAL  55           H        VAL  55  -0.063   7.992  -4.610
  411    HA   VAL  55           HA       VAL  55  -2.707   6.941  -5.138
  412    HB   VAL  55           HB       VAL  55  -2.779   7.365  -2.549
  413   1HG1  VAL  55          HG11      VAL  55  -1.453   5.218  -4.146
  414   2HG1  VAL  55          HG12      VAL  55  -1.253   5.178  -2.378
  415   3HG1  VAL  55          HG13      VAL  55  -2.884   5.146  -3.091
  416   1HG2  VAL  55          HG21      VAL  55  -0.443   8.621  -2.923
  417   2HG2  VAL  55          HG22      VAL  55  -0.829   7.742  -1.424
  418   3HG2  VAL  55          HG23      VAL  55   0.175   6.971  -2.675
  419    H    ALA  56           H        ALA  56  -4.612   8.106  -5.096
  420    HA   ALA  56           HA       ALA  56  -4.293  10.995  -4.642
  421   1HB   ALA  56          HB1       ALA  56  -6.498  10.743  -6.265
  422   2HB   ALA  56          HB2       ALA  56  -4.850  11.089  -6.842
  423   3HB   ALA  56          HB3       ALA  56  -5.466   9.418  -6.857
  424    HA   PRO  57           HA       PRO  57  -7.527  10.504  -1.795
  425   1HB   PRO  57          HB2       PRO  57  -8.391  13.084  -1.532
  426   2HB   PRO  57          HB3       PRO  57  -6.949  12.472  -0.748
  427   1HG   PRO  57          HG2       PRO  57  -7.167  14.235  -3.112
  428   2HG   PRO  57          HG3       PRO  57  -5.784  13.960  -2.070
  429   1HD   PRO  57          HD2       PRO  57  -6.199  12.879  -4.695
  430   2HD   PRO  57          HD3       PRO  57  -4.873  12.514  -3.608
  431    H    VAL  58           H        VAL  58  -9.298   9.332  -2.140
  432    HA   VAL  58           HA       VAL  58 -11.134  10.484  -4.119
  433    HB   VAL  58           HB       VAL  58 -11.186   7.647  -3.137
  434   1HG1  VAL  58          HG11      VAL  58 -12.939   7.661  -4.533
  435   2HG1  VAL  58          HG12      VAL  58 -12.477   9.232  -5.231
  436   3HG1  VAL  58          HG13      VAL  58 -11.749   7.733  -5.854
  437   1HG2  VAL  58          HG21      VAL  58  -9.767   7.168  -5.249
  438   2HG2  VAL  58          HG22      VAL  58  -9.256   8.868  -5.111
  439   3HG2  VAL  58          HG23      VAL  58  -8.937   7.731  -3.779
  440    H    ASP  59           H        ASP  59 -11.534  11.955  -2.068
  441    HA   ASP  59           HA       ASP  59 -13.073  10.670  -0.049
  442   1HB   ASP  59          HB2       ASP  59 -11.561  12.837   0.066
  443   2HB   ASP  59          HB3       ASP  59 -12.979  13.663  -0.548
  444    HD2  ASP  59           HD2      ASP  59 -11.700  12.013   2.148
  Start of MODEL   12
    1   1H    VAL   1           H        VAL   1 -13.007   8.971   1.984
    2    HA   VAL   1           HA       VAL   1 -11.541  11.075   2.203
    3    HB   VAL   1           HB       VAL   1 -11.680  10.743   4.799
    4   1HG1  VAL   1          HG11      VAL   1 -13.257  12.220   4.130
    5   2HG1  VAL   1          HG12      VAL   1 -13.748  11.228   2.737
    6   3HG1  VAL   1          HG13      VAL   1 -14.363  10.845   4.363
    7   1HG2  VAL   1          HG21      VAL   1 -13.339   9.054   5.466
    8   2HG2  VAL   1          HG22      VAL   1 -13.385   8.437   3.797
    9   3HG2  VAL   1          HG23      VAL   1 -11.890   8.302   4.755
   10    H    THR   2           H        THR   2 -10.486   8.119   4.047
   11    HA   THR   2           HA       THR   2  -7.718   9.024   3.596
   12    HB   THR   2           HB       THR   2  -7.875   7.498   6.005
   13    HG1  THR   2           HG1      THR   2 -10.112   7.932   6.179
   14   1HG2  THR   2          HG21      THR   2  -7.182   9.541   7.088
   15   2HG2  THR   2          HG22      THR   2  -6.471   9.616   5.458
   16   3HG2  THR   2          HG23      THR   2  -7.942  10.546   5.833
   17    H    LEU   3           H        LEU   3  -8.907   7.451   1.689
   18    HA   LEU   3           HA       LEU   3  -7.889   4.778   2.355
   19   1HB   LEU   3          HB2       LEU   3  -9.871   5.515   0.201
   20   2HB   LEU   3          HB3       LEU   3  -9.386   3.904   0.693
   21    HG   LEU   3           HG       LEU   3 -10.442   5.413   2.946
   22   1HD1  LEU   3          HD11      LEU   3 -11.829   5.732   0.409
   23   2HD1  LEU   3          HD12      LEU   3 -12.847   4.937   1.633
   24   3HD1  LEU   3          HD13      LEU   3 -12.112   6.521   1.979
   25   1HD2  LEU   3          HD21      LEU   3 -11.622   2.936   1.701
   26   2HD2  LEU   3          HD22      LEU   3 -10.097   2.888   2.615
   27   3HD2  LEU   3          HD23      LEU   3 -11.593   3.434   3.409
   28    H    PHE   4           H        PHE   4  -6.611   3.667   0.729
   29    HA   PHE   4           HA       PHE   4  -5.194   5.597  -0.957
   30   1HB   PHE   4          HB2       PHE   4  -4.572   3.124   0.651
   31   2HB   PHE   4          HB3       PHE   4  -3.714   3.237  -0.874
   32    HD1  PHE   4           HD1      PHE   4  -4.547   5.469   2.012
   33    HD2  PHE   4           HD2      PHE   4  -1.632   4.206  -0.801
   34    HE1  PHE   4           HE1      PHE   4  -2.861   6.993   3.077
   35    HE2  PHE   4           HE2      PHE   4   0.055   5.731   0.263
   36    HZ   PHE   4           HZ       PHE   4  -0.580   7.105   2.188
   37    H    VAL   5           H        VAL   5  -4.925   5.236  -3.171
   38    HA   VAL   5           HA       VAL   5  -6.417   2.927  -4.213
   39    HB   VAL   5           HB       VAL   5  -6.553   4.476  -6.281
   40   1HG1  VAL   5          HG11      VAL   5  -8.673   5.290  -5.577
   41   2HG1  VAL   5          HG12      VAL   5  -8.419   3.754  -4.716
   42   3HG1  VAL   5          HG13      VAL   5  -8.186   5.300  -3.866
   43   1HG2  VAL   5          HG21      VAL   5  -6.775   6.887  -4.770
   44   2HG2  VAL   5          HG22      VAL   5  -5.165   6.192  -4.461
   45   3HG2  VAL   5          HG23      VAL   5  -5.686   6.523  -6.131
   46    H    ALA   6           H        ALA   6  -5.594   2.252  -6.476
   47    HA   ALA   6           HA       ALA   6  -2.786   2.792  -6.894
   48   1HB   ALA   6          HB1       ALA   6  -3.233  -0.095  -6.882
   49   2HB   ALA   6          HB2       ALA   6  -1.962   0.860  -6.081
   50   3HB   ALA   6          HB3       ALA   6  -3.534   0.623  -5.281
   51    H    LEU   7           H        LEU   7  -2.387   2.854  -9.064
   52    HA   LEU   7           HA       LEU   7  -4.583   2.096 -10.795
   53   1HB   LEU   7          HB2       LEU   7  -2.760   4.186 -10.740
   54   2HB   LEU   7          HB3       LEU   7  -2.183   3.175 -12.050
   55    HG   LEU   7           HG       LEU   7  -4.847   4.562 -11.785
   56   1HD1  LEU   7          HD11      LEU   7  -2.589   5.493 -12.852
   57   2HD1  LEU   7          HD12      LEU   7  -3.194   4.592 -14.263
   58   3HD1  LEU   7          HD13      LEU   7  -4.193   5.868 -13.527
   59   1HD2  LEU   7          HD21      LEU   7  -4.494   2.920 -14.195
   60   2HD2  LEU   7          HD22      LEU   7  -4.688   1.984 -12.693
   61   3HD2  LEU   7          HD23      LEU   7  -5.926   3.172 -13.168
   62    H    TYR   8           H        TYR   8  -1.233   1.149  -9.976
   63    HA   TYR   8           HA       TYR   8  -1.655  -1.247 -11.621
   64   1HB   TYR   8          HB2       TYR   8   0.120   0.931 -12.081
   65   2HB   TYR   8          HB3       TYR   8   1.135  -0.242 -11.266
   66    HD1  TYR   8           HD1      TYR   8  -0.871   0.422 -14.290
   67    HD2  TYR   8           HD2      TYR   8   1.771  -2.323 -12.344
   68    HE1  TYR   8           HE1      TYR   8  -0.540  -0.824 -16.482
   69    HE2  TYR   8           HE2      TYR   8   2.093  -3.560 -14.542
   70    HH   TYR   8           HH       TYR   8   1.416  -3.777 -16.598
   71    H    ASP   9           H        ASP   9  -0.339  -3.122 -10.919
   72    HA   ASP   9           HA       ASP   9  -0.095  -3.044  -8.046
   73   1HB   ASP   9          HB2       ASP   9   0.218  -5.574  -8.376
   74   2HB   ASP   9          HB3       ASP   9  -1.347  -4.922  -8.818
   75    HD2  ASP   9           HD2      ASP   9   0.931  -7.065 -10.210
   76    H    TYR  10           H        TYR  10   1.851  -4.611  -7.236
   77    HA   TYR  10           HA       TYR  10   4.214  -4.134  -8.911
   78   1HB   TYR  10          HB2       TYR  10   3.394  -3.009  -6.315
   79   2HB   TYR  10          HB3       TYR  10   4.829  -3.988  -6.082
   80    HD1  TYR  10           HD1      TYR  10   3.492  -0.895  -7.466
   81    HD2  TYR  10           HD2      TYR  10   6.947  -3.410  -7.271
   82    HE1  TYR  10           HE1      TYR  10   4.943   1.022  -8.293
   83    HE2  TYR  10           HE2      TYR  10   8.387  -1.484  -8.097
   84    HH   TYR  10           HH       TYR  10   8.304   0.953  -8.093
   85    H    GLU  11           H        GLU  11   5.067  -6.094  -9.387
   86    HA   GLU  11           HA       GLU  11   4.467  -8.300  -7.678
   87   1HB   GLU  11          HB2       GLU  11   6.045  -8.040 -10.270
   88   2HB   GLU  11          HB3       GLU  11   5.860  -9.563  -9.424
   89   1HG   GLU  11          HG2       GLU  11   3.238  -8.462  -9.574
   90   2HG   GLU  11          HG3       GLU  11   3.953  -8.176 -11.149
   91    HE2  GLU  11           HE2      GLU  11   2.623  -9.644 -11.955
   92    H    ALA  12           H        ALA  12   5.563  -7.867  -5.698
   93    HA   ALA  12           HA       ALA  12   8.485  -7.696  -5.919
   94   1HB   ALA  12          HB1       ALA  12   7.467  -7.264  -3.253
   95   2HB   ALA  12          HB2       ALA  12   8.327  -6.128  -4.320
   96   3HB   ALA  12          HB3       ALA  12   6.554  -6.257  -4.402
   97    H    ARG  13           H        ARG  13   9.803  -9.177  -4.774
   98    HA   ARG  13           HA       ARG  13   8.355 -11.316  -3.463
   99   1HB   ARG  13          HB2       ARG  13   9.960 -11.498  -5.942
  100   2HB   ARG  13          HB3       ARG  13  10.513 -12.617  -4.712
  101   1HG   ARG  13          HG2       ARG  13   7.621 -12.365  -5.667
  102   2HG   ARG  13          HG3       ARG  13   8.743 -13.607  -6.188
  103   1HD   ARG  13          HD2       ARG  13   8.963 -14.407  -3.828
  104   2HD   ARG  13          HD3       ARG  13   7.859 -13.155  -3.295
  105    HE   ARG  13           HE       ARG  13   6.072 -14.451  -4.059
  106   1HH1  ARG  13          HH22      ARG  13   9.031 -15.569  -5.655
  107   2HH1  ARG  13          HH21      ARG  13   8.258 -16.916  -6.420
  108   1HH2  ARG  13          HH11      ARG  13   5.917 -17.285  -6.060
  109    H    THR  14           H        THR  14   9.762  -9.076  -2.304
  110    HA   THR  14           HA       THR  14  12.398 -10.024  -1.575
  111    HB   THR  14           HB       THR  14  10.857  -7.629  -0.473
  112    HG1  THR  14           HG1      THR  14  10.822  -7.154  -2.651
  113   1HG2  THR  14          HG21      THR  14  13.158  -8.159   0.466
  114   2HG2  THR  14          HG22      THR  14  13.807  -8.048  -1.187
  115   3HG2  THR  14          HG23      THR  14  13.101  -6.610  -0.411
  116    H    GLU  15           H        GLU  15  12.363  -9.031   1.149
  117    HA   GLU  15           HA       GLU  15  10.768 -11.177   2.318
  118   1HB   GLU  15          HB2       GLU  15  13.604 -10.310   2.765
  119   2HB   GLU  15          HB3       GLU  15  12.710 -10.828   4.181
  120   1HG   GLU  15          HG2       GLU  15  12.352 -13.017   3.321
  121   2HG   GLU  15          HG3       GLU  15  12.642 -12.520   1.665
  122    HE2  GLU  15           HE2      GLU  15  15.522 -14.003   1.913
  123    H    ASP  16           H        ASP  16  10.058  -8.296   1.781
  124    HA   ASP  16           HA       ASP  16   9.237  -7.734   4.478
  125   1HB   ASP  16          HB2       ASP  16  11.179  -6.100   2.915
  126   2HB   ASP  16          HB3       ASP  16   9.858  -5.178   3.605
  127    HD2  ASP  16           HD2      ASP  16  12.549  -4.897   4.527
  128    H    ASP  17           H        ASP  17   9.404  -6.560   1.034
  129    HA   ASP  17           HA       ASP  17   6.834  -5.365   1.237
  130   1HB   ASP  17          HB2       ASP  17   8.154  -5.973  -1.408
  131   2HB   ASP  17          HB3       ASP  17   7.240  -4.554  -0.938
  132    HD2  ASP  17           HD2      ASP  17   8.328  -3.515   0.933
  133    H    LEU  18           H        LEU  18   5.137  -5.989  -0.586
  134    HA   LEU  18           HA       LEU  18   5.248  -8.835  -1.214
  135   1HB   LEU  18          HB2       LEU  18   3.453  -7.553   0.716
  136   2HB   LEU  18          HB3       LEU  18   2.612  -8.474  -0.517
  137    HG   LEU  18           HG       LEU  18   4.826  -9.570   1.241
  138   1HD1  LEU  18          HD11      LEU  18   3.091 -10.733   2.480
  139   2HD1  LEU  18          HD12      LEU  18   2.823  -8.975   2.543
  140   3HD1  LEU  18          HD13      LEU  18   1.833  -9.987   1.466
  141   1HD2  LEU  18          HD21      LEU  18   2.900 -11.065  -0.554
  142   2HD2  LEU  18          HD22      LEU  18   4.571 -10.643  -0.999
  143   3HD2  LEU  18          HD23      LEU  18   4.264 -11.732   0.376
  144    H    SER  19           H        SER  19   2.961  -9.230  -2.555
  145    HA   SER  19           HA       SER  19   3.016  -7.077  -4.523
  146   1HB   SER  19          HB2       SER  19   2.438 -10.045  -4.941
  147   2HB   SER  19          HB3       SER  19   2.406  -8.826  -6.200
  148    HG   SER  19           HG       SER  19   4.770  -9.100  -4.603
  149    H    PHE  20           H        PHE  20   1.068  -6.086  -5.036
  150    HA   PHE  20           HA       PHE  20  -1.315  -7.279  -3.805
  151   1HB   PHE  20          HB2       PHE  20  -0.315  -4.439  -4.364
  152   2HB   PHE  20          HB3       PHE  20  -2.027  -4.722  -4.106
  153    HD1  PHE  20           HD1      PHE  20  -2.853  -5.430  -1.909
  154    HD2  PHE  20           HD2      PHE  20   1.259  -4.587  -2.539
  155    HE1  PHE  20           HE1      PHE  20  -2.500  -5.296   0.573
  156    HE2  PHE  20           HE2      PHE  20   1.611  -4.454  -0.057
  157    HZ   PHE  20           HZ       PHE  20  -0.272  -4.810   1.469
  158    H    HIS  21           H        HIS  21  -3.137  -5.432  -5.141
  159    HA   HIS  21           HA       HIS  21  -2.745  -6.099  -7.947
  160   1HB   HIS  21          HB2       HIS  21  -4.452  -7.563  -6.259
  161   2HB   HIS  21          HB3       HIS  21  -5.512  -6.499  -7.162
  162    HD1  HIS  21           HD1      HIS  21  -5.999  -7.101  -9.580
  163    HD2  HIS  21           HD2      HIS  21  -2.829  -9.314  -7.953
  164    HE1  HIS  21           HE1      HIS  21  -5.429  -8.901 -11.296
  165    H    LYS  22           H        LYS  22  -3.630  -4.575  -9.380
  166    HA   LYS  22           HA       LYS  22  -4.084  -2.017  -8.260
  167   1HB   LYS  22          HB2       LYS  22  -4.409  -1.333 -10.605
  168   2HB   LYS  22          HB3       LYS  22  -2.943  -2.266 -10.374
  169   1HG   LYS  22          HG2       LYS  22  -4.771  -4.271 -10.933
  170   2HG   LYS  22          HG3       LYS  22  -5.405  -2.955 -11.900
  171   1HD   LYS  22          HD2       LYS  22  -3.232  -2.659 -13.023
  172   2HD   LYS  22          HD3       LYS  22  -2.484  -3.844 -11.969
  173   1HE   LYS  22          HE2       LYS  22  -3.235  -5.586 -13.230
  174   2HE   LYS  22          HE3       LYS  22  -4.872  -4.961 -13.258
  175   1HZ   LYS  22          HZ1       LYS  22  -4.450  -4.474 -15.404
  176   2HZ   LYS  22          HZ2       LYS  22  -3.483  -3.263 -14.903
  177    H    GLY  23           H        GLY  23  -5.965  -0.907  -7.842
  178   1HA   GLY  23          HA3       GLY  23  -8.220  -0.461  -7.969
  179   2HA   GLY  23          HA2       GLY  23  -8.498  -1.983  -8.792
  180    H    GLU  24           H        GLU  24  -7.298  -0.761  -5.580
  181    HA   GLU  24           HA       GLU  24  -9.158  -2.587  -4.339
  182   1HB   GLU  24          HB2       GLU  24  -6.428  -3.246  -4.558
  183   2HB   GLU  24          HB3       GLU  24  -6.585  -2.626  -2.926
  184   1HG   GLU  24          HG2       GLU  24  -7.991  -4.344  -2.247
  185   2HG   GLU  24          HG3       GLU  24  -8.736  -4.510  -3.824
  186    HE2  GLU  24           HE2      GLU  24  -7.149  -7.383  -4.003
  187    H    LYS  25           H        LYS  25  -8.673  -2.209  -1.690
  188    HA   LYS  25           HA       LYS  25  -8.456   0.700  -1.372
  189   1HB   LYS  25          HB2       LYS  25 -10.811  -0.911  -1.058
  190   2HB   LYS  25          HB3       LYS  25 -10.333  -0.313   0.517
  191   1HG   LYS  25          HG2       LYS  25 -10.898   1.835  -0.007
  192   2HG   LYS  25          HG3       LYS  25 -10.072   1.766  -1.551
  193   1HD   LYS  25          HD2       LYS  25 -12.786   0.458  -1.066
  194   2HD   LYS  25          HD3       LYS  25 -12.614   2.098  -1.660
  195   1HE   LYS  25          HE2       LYS  25 -11.304   1.259  -3.618
  196   2HE   LYS  25          HE3       LYS  25 -11.455  -0.382  -3.021
  197   1HZ   LYS  25          HZ1       LYS  25 -13.497  -0.503  -3.921
  198   2HZ   LYS  25          HZ2       LYS  25 -14.015   0.842  -3.165
  199    H    PHE  26           H        PHE  26  -6.721   1.110  -0.122
  200    HA   PHE  26           HA       PHE  26  -6.014  -0.925   1.864
  201   1HB   PHE  26          HB2       PHE  26  -4.410   1.454   0.764
  202   2HB   PHE  26          HB3       PHE  26  -3.758   0.094   1.655
  203    HD1  PHE  26           HD1      PHE  26  -3.471  -2.081   0.572
  204    HD2  PHE  26           HD2      PHE  26  -4.935   1.263  -1.590
  205    HE1  PHE  26           HE1      PHE  26  -3.003  -3.274  -1.587
  206    HE2  PHE  26           HE2      PHE  26  -4.467   0.071  -3.749
  207    HZ   PHE  26           HZ       PHE  26  -3.508  -2.183  -3.722
  208    H    GLN  27           H        GLN  27  -5.191  -0.157   3.983
  209    HA   GLN  27           HA       GLN  27  -6.614   2.272   4.727
  210   1HB   GLN  27          HB2       GLN  27  -6.822  -0.242   5.808
  211   2HB   GLN  27          HB3       GLN  27  -5.603   0.448   6.860
  212   1HG   GLN  27          HG2       GLN  27  -7.669   1.007   7.908
  213   2HG   GLN  27          HG3       GLN  27  -7.170   2.489   7.117
  214   1HE2  GLN  27          HE21      GLN  27  -9.665   2.507   7.668
  215   2HE2  GLN  27          HE22      GLN  27 -10.708   2.171   6.326
  216    H    ILE  28           H        ILE  28  -5.531   3.456   6.701
  217    HA   ILE  28           HA       ILE  28  -2.688   3.699   6.038
  218    HB   ILE  28           HB       ILE  28  -3.953   5.692   5.639
  219   1HG1  ILE  28          HG12      ILE  28  -2.836   7.189   7.491
  220   2HG1  ILE  28          HG13      ILE  28  -2.054   5.694   7.966
  221   1HG2  ILE  28          HG21      ILE  28  -5.838   5.973   6.799
  222   2HG2  ILE  28          HG22      ILE  28  -5.264   4.970   8.153
  223   3HG2  ILE  28          HG23      ILE  28  -4.809   6.688   8.065
  224   1HD1  ILE  28          HD11      ILE  28  -0.611   5.830   6.227
  225   2HD1  ILE  28          HD12      ILE  28  -1.956   5.959   5.068
  226   3HD1  ILE  28          HD13      ILE  28  -1.305   7.424   5.843
  227    H    LEU  29           H        LEU  29  -1.095   3.528   7.624
  228    HA   LEU  29           HA       LEU  29  -2.037   2.956  10.330
  229   1HB   LEU  29          HB2       LEU  29  -1.536   0.893   8.748
  230   2HB   LEU  29          HB3       LEU  29   0.125   1.253   9.178
  231    HG   LEU  29           HG       LEU  29  -1.943   0.951  11.340
  232   1HD1  LEU  29          HD11      LEU  29  -2.119  -1.281  11.195
  233   2HD1  LEU  29          HD12      LEU  29  -1.670  -1.031   9.491
  234   3HD1  LEU  29          HD13      LEU  29  -0.427  -1.489  10.679
  235   1HD2  LEU  29          HD21      LEU  29   1.010   1.012  11.129
  236   2HD2  LEU  29          HD22      LEU  29  -0.068   1.562  12.434
  237   3HD2  LEU  29          HD23      LEU  29   0.328  -0.166  12.276
  238    H    ASN  30           H        ASN  30   1.131   2.854   8.560
  239    HA   ASN  30           HA       ASN  30   2.245   4.451  10.650
  240   1HB   ASN  30          HB2       ASN  30   3.397   2.475   9.405
  241   2HB   ASN  30          HB3       ASN  30   3.603   3.575   8.055
  242   1HD2  ASN  30          HD21      ASN  30   5.873   2.887   8.639
  243   2HD2  ASN  30          HD22      ASN  30   6.763   3.906   9.722
  244    H    SER  31           H        SER  31   3.250   6.580  10.264
  245    HA   SER  31           HA       SER  31   2.884   7.742   7.673
  246   1HB   SER  31          HB2       SER  31   0.692   8.197   8.657
  247   2HB   SER  31          HB3       SER  31   1.425   8.801  10.130
  248    HG   SER  31           HG       SER  31   1.637   9.989   7.495
  249    H    SER  32           H        SER  32   5.308   7.196   8.592
  250    HA   SER  32           HA       SER  32   6.263   9.220  10.353
  251   1HB   SER  32          HB2       SER  32   7.632   7.031   8.737
  252   2HB   SER  32          HB3       SER  32   8.528   8.161   9.733
  253    HG   SER  32           HG       SER  32   8.039   6.977  11.439
  254    H    GLU  33           H        GLU  33   8.410   8.474   7.704
  255    HA   GLU  33           HA       GLU  33   7.610  10.455   5.925
  256   1HB   GLU  33          HB2       GLU  33   9.716  11.966   6.433
  257   2HB   GLU  33          HB3       GLU  33   8.226  12.217   7.320
  258   1HG   GLU  33          HG2       GLU  33   9.096  11.405   9.301
  259   2HG   GLU  33          HG3       GLU  33  10.070  10.185   8.502
  260    HE2  GLU  33           HE2      GLU  33  11.675  13.297   9.911
  261    H    GLY  34           H        GLY  34   8.091   8.243   4.917
  262   1HA   GLY  34          HA3       GLY  34  10.964   8.094   4.220
  263   2HA   GLY  34          HA2       GLY  34   9.973   6.678   4.503
  264    H    ASP  35           H        ASP  35  10.018   5.751   2.443
  265    HA   ASP  35           HA       ASP  35   8.966   7.463   0.329
  266   1HB   ASP  35          HB2       ASP  35  11.329   5.957   0.394
  267   2HB   ASP  35          HB3       ASP  35  10.231   4.913  -0.486
  268    HD2  ASP  35           HD2      ASP  35  10.592   5.298  -2.690
  269    H    TRP  36           H        TRP  36   9.088   4.125   1.748
  270    HA   TRP  36           HA       TRP  36   6.534   3.547   0.415
  271   1HB   TRP  36          HB2       TRP  36   8.270   1.435   1.632
  272   2HB   TRP  36          HB3       TRP  36   7.092   1.310   0.339
  273    HD1  TRP  36           HD1      TRP  36   8.010   2.932  -1.986
  274    HE1  TRP  36           HE1      TRP  36  10.358   2.833  -3.188
  275    HE3  TRP  36           HE3      TRP  36  10.518   0.885   1.934
  276    HZ2  TRP  36           HZ2      TRP  36  12.942   1.931  -2.381
  277    HZ3  TRP  36           HZ3      TRP  36  12.951   0.426   1.645
  278    HH2  TRP  36           HH2      TRP  36  14.161   0.915  -0.421
  279    H    TRP  37           H        TRP  37   4.739   3.337   1.712
  280    HA   TRP  37           HA       TRP  37   5.239   3.326   4.607
  281   1HB   TRP  37          HB2       TRP  37   2.969   4.461   2.974
  282   2HB   TRP  37          HB3       TRP  37   2.893   4.260   4.712
  283    HD1  TRP  37           HD1      TRP  37   6.089   5.246   5.095
  284    HE1  TRP  37           HE1      TRP  37   6.657   7.823   5.046
  285    HE3  TRP  37           HE3      TRP  37   1.856   6.669   2.663
  286    HZ2  TRP  37           HZ2      TRP  37   5.303  10.115   4.018
  287    HZ3  TRP  37           HZ3      TRP  37   1.557   9.094   2.175
  288    HH2  TRP  37           HH2      TRP  37   3.195  10.793   2.811
  289    H    GLU  38           H        GLU  38   3.205   2.260   5.782
  290    HA   GLU  38           HA       GLU  38   2.974  -0.341   4.563
  291   1HB   GLU  38          HB2       GLU  38   2.690   0.786   7.325
  292   2HB   GLU  38          HB3       GLU  38   1.716  -0.624   6.956
  293   1HG   GLU  38          HG2       GLU  38   3.630  -1.972   6.465
  294   2HG   GLU  38          HG3       GLU  38   4.676  -0.580   6.272
  295    HE2  GLU  38           HE2      GLU  38   5.499   0.283   7.975
  296    H    ALA  39           H        ALA  39   0.847  -1.475   4.475
  297    HA   ALA  39           HA       ALA  39  -1.486   0.234   4.610
  298   1HB   ALA  39          HB1       ALA  39  -1.841   0.462   2.389
  299   2HB   ALA  39          HB2       ALA  39  -0.121   0.045   2.201
  300   3HB   ALA  39          HB3       ALA  39  -1.365  -1.220   2.054
  301    H    ARG  40           H        ARG  40  -3.136  -0.930   5.480
  302    HA   ARG  40           HA       ARG  40  -2.713  -3.787   5.604
  303   1HB   ARG  40          HB2       ARG  40  -3.601  -1.864   7.481
  304   2HB   ARG  40          HB3       ARG  40  -5.055  -2.751   7.065
  305   1HG   ARG  40          HG2       ARG  40  -3.445  -4.878   7.375
  306   2HG   ARG  40          HG3       ARG  40  -2.519  -3.760   8.357
  307   1HD   ARG  40          HD2       ARG  40  -5.212  -4.952   8.868
  308   2HD   ARG  40          HD3       ARG  40  -3.952  -4.519  10.007
  309    HE   ARG  40           HE       ARG  40  -4.678  -2.058   9.374
  310   1HH1  ARG  40          HH22      ARG  40  -6.845  -4.847   9.666
  311   2HH1  ARG  40          HH21      ARG  40  -8.219  -3.890  10.110
  312   1HH2  ARG  40          HH11      ARG  40  -7.987  -1.510  10.277
  313    H    SER  41           H        SER  41  -3.629  -4.853   3.859
  314    HA   SER  41           HA       SER  41  -5.853  -3.751   2.515
  315   1HB   SER  41          HB2       SER  41  -3.871  -5.755   2.028
  316   2HB   SER  41          HB3       SER  41  -5.425  -6.552   1.882
  317    HG   SER  41           HG       SER  41  -4.403  -5.351  -0.070
  318    H    LEU  42           H        LEU  42  -8.045  -4.372   2.607
  319    HA   LEU  42           HA       LEU  42  -8.711  -6.064   4.890
  320   1HB   LEU  42          HB2       LEU  42 -10.852  -5.026   4.849
  321   2HB   LEU  42          HB3       LEU  42  -9.614  -3.787   4.807
  322    HG   LEU  42           HG       LEU  42 -10.308  -4.388   2.105
  323   1HD1  LEU  42          HD11      LEU  42 -12.815  -3.367   3.178
  324   2HD1  LEU  42          HD12      LEU  42 -12.515  -4.653   1.985
  325   3HD1  LEU  42          HD13      LEU  42 -12.471  -5.024   3.725
  326   1HD2  LEU  42          HD21      LEU  42  -9.664  -2.245   2.257
  327   2HD2  LEU  42          HD22      LEU  42 -11.382  -1.931   2.600
  328   3HD2  LEU  42          HD23      LEU  42 -10.220  -2.086   3.940
  329    H    THR  43           H        THR  43  -7.775  -6.798   1.971
  330    HA   THR  43           HA       THR  43 -10.102  -8.453   1.280
  331    HB   THR  43           HB       THR  43  -7.628  -7.592  -0.313
  332    HG1  THR  43           HG1      THR  43 -10.203  -6.618   0.308
  333   1HG2  THR  43          HG21      THR  43  -9.187  -9.822  -0.831
  334   2HG2  THR  43          HG22      THR  43 -10.112  -8.550  -1.663
  335   3HG2  THR  43          HG23      THR  43  -8.409  -8.838  -2.094
  336    H    THR  44           H        THR  44  -6.488  -8.635   1.549
  337    HA   THR  44           HA       THR  44  -6.784 -11.526   1.904
  338    HB   THR  44           HB       THR  44  -4.385  -9.700   1.356
  339    HG1  THR  44           HG1      THR  44  -5.608 -11.818  -0.231
  340   1HG2  THR  44          HG21      THR  44  -3.049 -11.650   1.122
  341   2HG2  THR  44          HG22      THR  44  -3.999 -12.021   2.581
  342   3HG2  THR  44          HG23      THR  44  -4.469 -12.718   1.012
  343    H    GLY  45           H        GLY  45  -5.606  -8.562   3.550
  344   1HA   GLY  45          HA3       GLY  45  -5.760  -8.283   5.857
  345   2HA   GLY  45          HA2       GLY  45  -5.800 -10.020   6.083
  346    H    GLU  46           H        GLU  46  -3.531  -7.840   4.257
  347    HA   GLU  46           HA       GLU  46  -1.456  -8.609   6.113
  348   1HB   GLU  46          HB2       GLU  46  -1.712  -9.708   3.437
  349   2HB   GLU  46          HB3       GLU  46  -0.253  -8.742   3.526
  350   1HG   GLU  46          HG2       GLU  46   0.784 -10.390   4.683
  351   2HG   GLU  46          HG3       GLU  46  -0.402 -10.252   5.966
  352    HE2  GLU  46           HE2      GLU  46  -2.461 -11.529   5.468
  353    H    THR  47           H        THR  47   0.702  -7.348   5.391
  354    HA   THR  47           HA       THR  47  -0.071  -4.731   4.305
  355    HB   THR  47           HB       THR  47   1.464  -5.307   6.894
  356    HG1  THR  47           HG1      THR  47  -0.988  -5.425   6.719
  357   1HG2  THR  47          HG21      THR  47   2.317  -3.254   5.695
  358   2HG2  THR  47          HG22      THR  47   0.645  -2.649   5.609
  359   3HG2  THR  47          HG23      THR  47   1.439  -2.847   7.189
  360    H    GLY  48           H        GLY  48   1.587  -3.565   3.248
  361   1HA   GLY  48          HA3       GLY  48   4.193  -4.828   2.993
  362   2HA   GLY  48          HA2       GLY  48   3.198  -4.845   1.550
  363    H    TYR  49           H        TYR  49   5.765  -3.388   2.116
  364    HA   TYR  49           HA       TYR  49   5.097  -0.633   2.420
  365   1HB   TYR  49          HB2       TYR  49   7.443  -2.442   1.766
  366   2HB   TYR  49          HB3       TYR  49   7.611  -0.766   1.283
  367    HD1  TYR  49           HD1      TYR  49   8.855   0.509   2.757
  368    HD2  TYR  49           HD2      TYR  49   6.327  -2.565   4.328
  369    HE1  TYR  49           HE1      TYR  49   9.579   1.110   5.119
  370    HE2  TYR  49           HE2      TYR  49   7.061  -1.954   6.684
  371    HH   TYR  49           HH       TYR  49   8.355  -0.729   7.903
  372    H    ILE  50           H        ILE  50   4.219   0.678   0.905
  373    HA   ILE  50           HA       ILE  50   4.891   0.099  -1.890
  374    HB   ILE  50           HB       ILE  50   2.596   0.695  -2.517
  375   1HG1  ILE  50          HG12      ILE  50   1.397   0.245   0.108
  376   2HG1  ILE  50          HG13      ILE  50   2.394   1.686   0.080
  377   1HG2  ILE  50          HG21      ILE  50   3.547  -1.715  -1.679
  378   2HG2  ILE  50          HG22      ILE  50   2.098  -1.540  -0.661
  379   3HG2  ILE  50          HG23      ILE  50   1.955  -1.455  -2.433
  380   1HD1  ILE  50          HD11      ILE  50   1.099   2.731  -1.579
  381   2HD1  ILE  50          HD12      ILE  50   0.485   1.185  -2.212
  382   3HD1  ILE  50          HD13      ILE  50  -0.137   1.826  -0.673
  383    HA   PRO  51           HA       PRO  51   5.916   4.298  -1.863
  384   1HB   PRO  51          HB2       PRO  51   6.173   4.738  -4.548
  385   2HB   PRO  51          HB3       PRO  51   7.430   4.002  -3.573
  386   1HG   PRO  51          HG2       PRO  51   5.583   2.719  -5.492
  387   2HG   PRO  51          HG3       PRO  51   7.089   2.105  -4.841
  388   1HD   PRO  51          HD2       PRO  51   4.441   1.331  -4.059
  389   2HD   PRO  51          HD3       PRO  51   5.945   0.804  -3.331
  390    H    SER  52           H        SER  52   5.081   6.366  -1.894
  391    HA   SER  52           HA       SER  52   2.292   6.311  -2.649
  392   1HB   SER  52          HB2       SER  52   3.239   7.171  -0.373
  393   2HB   SER  52          HB3       SER  52   3.733   8.597  -1.262
  394    HG   SER  52           HG       SER  52   1.063   7.595  -0.837
  395    H    ASN  53           H        ASN  53   3.842   6.215  -4.912
  396    HA   ASN  53           HA       ASN  53   3.999   8.987  -5.786
  397   1HB   ASN  53          HB2       ASN  53   5.776   6.772  -6.102
  398   2HB   ASN  53          HB3       ASN  53   5.070   7.024  -7.687
  399   1HD2  ASN  53          HD21      ASN  53   4.781   9.514  -8.156
  400   2HD2  ASN  53          HD22      ASN  53   6.216  10.465  -7.962
  401    H    TYR  54           H        TYR  54   2.012   6.255  -5.779
  402    HA   TYR  54           HA       TYR  54   0.783   7.041  -8.331
  403   1HB   TYR  54          HB2       TYR  54   1.823   4.468  -7.233
  404   2HB   TYR  54          HB3       TYR  54   0.152   4.329  -7.742
  405    HD1  TYR  54           HD1      TYR  54  -0.409   4.103 -10.030
  406    HD2  TYR  54           HD2      TYR  54   3.547   5.310  -8.932
  407    HE1  TYR  54           HE1      TYR  54   0.355   3.816 -12.438
  408    HE2  TYR  54           HE2      TYR  54   4.297   5.017 -11.343
  409    HH   TYR  54           HH       TYR  54   2.859   3.281 -13.480
  410    H    VAL  55           H        VAL  55   0.314   7.845  -5.433
  411    HA   VAL  55           HA       VAL  55  -2.295   6.602  -4.996
  412    HB   VAL  55           HB       VAL  55  -0.979   8.562  -3.151
  413   1HG1  VAL  55          HG11      VAL  55  -2.567   6.058  -2.529
  414   2HG1  VAL  55          HG12      VAL  55  -2.192   7.423  -1.450
  415   3HG1  VAL  55          HG13      VAL  55  -3.321   7.646  -2.807
  416   1HG2  VAL  55          HG21      VAL  55   0.212   6.079  -4.010
  417   2HG2  VAL  55          HG22      VAL  55   0.825   7.284  -2.853
  418   3HG2  VAL  55          HG23      VAL  55  -0.240   5.972  -2.293
  419    H    ALA  56           H        ALA  56  -4.132   8.074  -4.395
  420    HA   ALA  56           HA       ALA  56  -3.912  10.809  -5.233
  421   1HB   ALA  56          HB1       ALA  56  -5.942  10.247  -6.889
  422   2HB   ALA  56          HB2       ALA  56  -4.246  10.188  -7.427
  423   3HB   ALA  56          HB3       ALA  56  -5.094   8.686  -6.988
  424    HA   PRO  57           HA       PRO  57  -6.799  10.107  -1.885
  425   1HB   PRO  57          HB2       PRO  57  -6.500  12.581  -0.765
  426   2HB   PRO  57          HB3       PRO  57  -5.529  11.197  -0.305
  427   1HG   PRO  57          HG2       PRO  57  -4.772  13.521  -1.967
  428   2HG   PRO  57          HG3       PRO  57  -3.732  12.369  -1.154
  429   1HD   PRO  57          HD2       PRO  57  -4.342  12.451  -3.955
  430   2HD   PRO  57          HD3       PRO  57  -3.397  11.231  -3.123
  431    H    VAL  58           H        VAL  58  -8.955  10.234  -2.001
  432    HA   VAL  58           HA       VAL  58  -9.938  12.589  -3.451
  433    HB   VAL  58           HB       VAL  58 -11.683  11.029  -4.401
  434   1HG1  VAL  58          HG11      VAL  58  -8.844  11.286  -5.186
  435   2HG1  VAL  58          HG12      VAL  58  -9.725   9.947  -5.962
  436   3HG1  VAL  58          HG13      VAL  58 -10.328  11.614  -6.112
  437   1HG2  VAL  58          HG21      VAL  58 -11.008   9.173  -2.721
  438   2HG2  VAL  58          HG22      VAL  58 -11.414   8.708  -4.390
  439   3HG2  VAL  58          HG23      VAL  58  -9.711   8.808  -3.884
  440    H    ASP  59           H        ASP  59 -12.408  12.842  -3.041
  441    HA   ASP  59           HA       ASP  59 -12.824  12.218  -0.225
  442   1HB   ASP  59          HB2       ASP  59 -14.450  14.347  -1.565
  443   2HB   ASP  59          HB3       ASP  59 -13.811  14.302   0.066
  444    HD2  ASP  59           HD2      ASP  59 -12.995  16.420  -0.205
  Start of MODEL   13
    1   1H    VAL   1           H        VAL   1 -13.657   8.213   5.664
    2    HA   VAL   1           HA       VAL   1 -13.640   9.147   3.567
    3    HB   VAL   1           HB       VAL   1 -12.542  11.541   4.947
    4   1HG1  VAL   1          HG11      VAL   1 -15.230  11.854   4.087
    5   2HG1  VAL   1          HG12      VAL   1 -13.751  12.510   3.345
    6   3HG1  VAL   1          HG13      VAL   1 -14.382  10.928   2.826
    7   1HG2  VAL   1          HG21      VAL   1 -15.222  10.482   5.829
    8   2HG2  VAL   1          HG22      VAL   1 -13.731   9.998   6.672
    9   3HG2  VAL   1          HG23      VAL   1 -14.189  11.716   6.588
   10    H    THR   2           H        THR   2 -10.661   8.479   4.991
   11    HA   THR   2           HA       THR   2  -9.152   9.806   2.854
   12    HB   THR   2           HB       THR   2  -7.874   8.279   5.121
   13    HG1  THR   2           HG1      THR   2  -8.679  10.987   5.548
   14   1HG2  THR   2          HG21      THR   2  -7.414  10.910   3.642
   15   2HG2  THR   2          HG22      THR   2  -6.585  10.540   5.173
   16   3HG2  THR   2          HG23      THR   2  -6.322   9.509   3.747
   17    H    LEU   3           H        LEU   3 -10.728   7.920   1.757
   18    HA   LEU   3           HA       LEU   3  -9.254   5.429   1.712
   19   1HB   LEU   3          HB2       LEU   3 -11.516   5.919  -0.134
   20   2HB   LEU   3          HB3       LEU   3 -11.101   4.494   0.796
   21    HG   LEU   3           HG       LEU   3 -11.799   6.359   2.745
   22   1HD1  LEU   3          HD11      LEU   3 -12.718   7.939   1.238
   23   2HD1  LEU   3          HD12      LEU   3 -13.572   6.678   0.317
   24   3HD1  LEU   3          HD13      LEU   3 -14.094   7.081   1.971
   25   1HD2  LEU   3          HD21      LEU   3 -12.301   3.865   2.492
   26   2HD2  LEU   3          HD22      LEU   3 -13.547   4.879   3.257
   27   3HD2  LEU   3          HD23      LEU   3 -13.733   4.368   1.562
   28    H    PHE   4           H        PHE   4  -7.744   4.877   0.217
   29    HA   PHE   4           HA       PHE   4  -7.402   6.768  -1.999
   30   1HB   PHE   4          HB2       PHE   4  -5.562   4.877  -0.425
   31   2HB   PHE   4          HB3       PHE   4  -5.031   5.635  -1.913
   32    HD1  PHE   4           HD1      PHE   4  -5.123   8.219  -2.001
   33    HD2  PHE   4           HD2      PHE   4  -5.301   5.991   1.606
   34    HE1  PHE   4           HE1      PHE   4  -4.404  10.249  -0.713
   35    HE2  PHE   4           HE2      PHE   4  -4.581   8.021   2.895
   36    HZ   PHE   4           HZ       PHE   4  -4.141  10.125   1.721
   37    H    VAL   5           H        VAL   5  -7.112   5.988  -4.127
   38    HA   VAL   5           HA       VAL   5  -8.025   3.236  -4.471
   39    HB   VAL   5           HB       VAL   5  -9.341   4.920  -5.560
   40   1HG1  VAL   5          HG11      VAL   5  -7.048   6.386  -5.783
   41   2HG1  VAL   5          HG12      VAL   5  -7.265   5.826  -7.458
   42   3HG1  VAL   5          HG13      VAL   5  -8.562   6.738  -6.649
   43   1HG2  VAL   5          HG21      VAL   5  -8.191   2.725  -6.845
   44   2HG2  VAL   5          HG22      VAL   5  -9.642   3.622  -7.356
   45   3HG2  VAL   5          HG23      VAL   5  -8.049   4.051  -8.023
   46    H    ALA   6           H        ALA   6  -6.847   1.708  -5.687
   47    HA   ALA   6           HA       ALA   6  -4.010   2.270  -5.772
   48   1HB   ALA   6          HB1       ALA   6  -5.564  -0.271  -6.407
   49   2HB   ALA   6          HB2       ALA   6  -3.811  -0.135  -6.128
   50   3HB   ALA   6          HB3       ALA   6  -4.951   0.168  -4.794
   51    H    LEU   7           H        LEU   7  -2.811   2.610  -7.611
   52    HA   LEU   7           HA       LEU   7  -4.338   2.917 -10.058
   53   1HB   LEU   7          HB2       LEU   7  -2.432   4.441  -8.876
   54   2HB   LEU   7          HB3       LEU   7  -1.447   3.519  -9.996
   55    HG   LEU   7           HG       LEU   7  -3.893   4.664 -11.189
   56   1HD1  LEU   7          HD11      LEU   7  -3.717   6.740 -10.430
   57   2HD1  LEU   7          HD12      LEU   7  -2.253   6.331  -9.504
   58   3HD1  LEU   7          HD13      LEU   7  -2.117   6.846 -11.203
   59   1HD2  LEU   7          HD21      LEU   7  -1.742   3.505 -12.222
   60   2HD2  LEU   7          HD22      LEU   7  -2.624   4.791 -13.081
   61   3HD2  LEU   7          HD23      LEU   7  -1.129   5.176 -12.195
   62    H    TYR   8           H        TYR   8  -1.100   1.494  -9.203
   63    HA   TYR   8           HA       TYR   8  -1.786  -0.741 -10.982
   64   1HB   TYR   8          HB2       TYR   8  -0.169   1.204 -11.817
   65   2HB   TYR   8          HB3       TYR   8   0.970   0.568 -10.648
   66    HD1  TYR   8           HD1      TYR   8   2.627  -0.750 -11.574
   67    HD2  TYR   8           HD2      TYR   8  -1.299  -0.899 -13.267
   68    HE1  TYR   8           HE1      TYR   8   3.422  -2.455 -13.285
   69    HE2  TYR   8           HE2      TYR   8  -0.491  -2.603 -14.973
   70    HH   TYR   8           HH       TYR   8   1.222  -4.201 -15.244
   71    H    ASP   9           H        ASP   9  -0.645  -2.751 -10.502
   72    HA   ASP   9           HA       ASP   9  -0.347  -3.060  -7.707
   73   1HB   ASP   9          HB2       ASP   9   0.187  -5.447  -8.331
   74   2HB   ASP   9          HB3       ASP   9  -1.330  -4.868  -8.990
   75    HD2  ASP   9           HD2      ASP   9   1.863  -6.056 -10.355
   76    H    TYR  10           H        TYR  10   1.664  -3.897  -6.648
   77    HA   TYR  10           HA       TYR  10   4.059  -2.932  -8.034
   78   1HB   TYR  10          HB2       TYR  10   3.707  -3.785  -5.111
   79   2HB   TYR  10          HB3       TYR  10   4.880  -2.650  -5.747
   80    HD1  TYR  10           HD1      TYR  10   1.872  -2.934  -3.972
   81    HD2  TYR  10           HD2      TYR  10   3.784  -0.494  -6.920
   82    HE1  TYR  10           HE1      TYR  10   0.328  -1.001  -3.384
   83    HE2  TYR  10           HE2      TYR  10   2.236   1.431  -6.322
   84    HH   TYR  10           HH       TYR  10   0.616   2.114  -5.077
   85    H    GLU  11           H        GLU  11   5.482  -4.382  -8.852
   86    HA   GLU  11           HA       GLU  11   5.103  -7.139  -8.113
   87   1HB   GLU  11          HB2       GLU  11   6.792  -5.783 -10.256
   88   2HB   GLU  11          HB3       GLU  11   6.801  -7.515  -9.987
   89   1HG   GLU  11          HG2       GLU  11   4.087  -7.030 -10.118
   90   2HG   GLU  11          HG3       GLU  11   4.689  -5.796 -11.205
   91    HE2  GLU  11           HE2      GLU  11   3.990  -8.670 -13.073
   92    H    ALA  12           H        ALA  12   6.373  -8.194  -6.642
   93    HA   ALA  12           HA       ALA  12   9.112  -7.322  -6.283
   94   1HB   ALA  12          HB1       ALA  12   7.355  -6.079  -4.704
   95   2HB   ALA  12          HB2       ALA  12   7.470  -7.600  -3.785
   96   3HB   ALA  12          HB3       ALA  12   8.932  -6.628  -4.087
   97    H    ARG  13           H        ARG  13  10.438  -9.056  -5.841
   98    HA   ARG  13           HA       ARG  13   9.032 -11.524  -5.195
   99   1HB   ARG  13          HB2       ARG  13  10.952 -10.879  -7.362
  100   2HB   ARG  13          HB3       ARG  13  11.409 -12.309  -6.458
  101   1HG   ARG  13          HG2       ARG  13   8.532 -12.012  -7.344
  102   2HG   ARG  13          HG3       ARG  13   9.733 -12.477  -8.533
  103   1HD   ARG  13          HD2       ARG  13   8.665 -14.468  -7.462
  104   2HD   ARG  13          HD3       ARG  13  10.396 -14.429  -7.183
  105    HE   ARG  13           HE       ARG  13   8.887 -13.091  -5.066
  106   1HH1  ARG  13          HH22      ARG  13  10.074 -16.230  -6.201
  107   2HH1  ARG  13          HH21      ARG  13  10.048 -16.950  -4.626
  108   1HH2  ARG  13          HH11      ARG  13   9.325 -15.643  -2.751
  109    H    THR  14           H        THR  14   9.752 -10.174  -3.015
  110    HA   THR  14           HA       THR  14  12.226 -11.496  -2.149
  111    HB   THR  14           HB       THR  14  12.108  -9.021  -0.789
  112    HG1  THR  14           HG1      THR  14  11.536  -7.573  -2.446
  113   1HG2  THR  14          HG21      THR  14  13.683  -9.980  -3.222
  114   2HG2  THR  14          HG22      THR  14  13.942  -8.366  -2.517
  115   3HG2  THR  14          HG23      THR  14  14.253  -9.824  -1.543
  116    H    GLU  15           H        GLU  15  12.388 -11.381   0.354
  117    HA   GLU  15           HA       GLU  15   9.839 -12.351   1.262
  118   1HB   GLU  15          HB2       GLU  15  12.688 -12.650   2.074
  119   2HB   GLU  15          HB3       GLU  15  11.546 -12.639   3.404
  120   1HG   GLU  15          HG2       GLU  15  10.592 -14.296   1.161
  121   2HG   GLU  15          HG3       GLU  15  12.157 -14.830   1.742
  122    HE2  GLU  15           HE2      GLU  15   8.805 -15.104   3.795
  123    H    ASP  16           H        ASP  16  11.007  -9.346   0.913
  124    HA   ASP  16           HA       ASP  16  10.402  -8.454   3.593
  125   1HB   ASP  16          HB2       ASP  16  11.618  -7.189   1.121
  126   2HB   ASP  16          HB3       ASP  16  10.978  -6.156   2.384
  127    HD2  ASP  16           HD2      ASP  16  13.202  -5.608   2.173
  128    H    ASP  17           H        ASP  17   9.647  -7.424   0.168
  129    HA   ASP  17           HA       ASP  17   7.036  -6.592   1.142
  130   1HB   ASP  17          HB2       ASP  17   7.793  -5.862  -1.630
  131   2HB   ASP  17          HB3       ASP  17   7.122  -4.857  -0.360
  132    HD2  ASP  17           HD2      ASP  17   9.676  -3.607  -1.656
  133    H    LEU  18           H        LEU  18   5.154  -7.055  -0.374
  134    HA   LEU  18           HA       LEU  18   5.695  -9.370  -2.098
  135   1HB   LEU  18          HB2       LEU  18   3.421  -8.978  -0.150
  136   2HB   LEU  18          HB3       LEU  18   3.450 -10.216  -1.390
  137    HG   LEU  18           HG       LEU  18   5.828 -10.709  -0.158
  138   1HD1  LEU  18          HD11      LEU  18   4.012  -9.434   1.874
  139   2HD1  LEU  18          HD12      LEU  18   5.155 -10.715   2.343
  140   3HD1  LEU  18          HD13      LEU  18   5.758  -9.209   1.612
  141   1HD2  LEU  18          HD21      LEU  18   4.618 -12.594  -0.453
  142   2HD2  LEU  18          HD22      LEU  18   4.237 -12.349   1.269
  143   3HD2  LEU  18          HD23      LEU  18   3.085 -11.822   0.019
  144    H    SER  19           H        SER  19   3.862  -9.693  -3.742
  145    HA   SER  19           HA       SER  19   3.484  -7.170  -4.992
  146   1HB   SER  19          HB2       SER  19   2.089  -8.877  -6.577
  147   2HB   SER  19          HB3       SER  19   3.831  -8.699  -6.662
  148    HG   SER  19           HG       SER  19   2.944 -10.957  -6.458
  149    H    PHE  20           H        PHE  20   1.458  -6.126  -5.446
  150    HA   PHE  20           HA       PHE  20  -0.746  -7.120  -3.780
  151   1HB   PHE  20          HB2       PHE  20   0.660  -4.558  -4.097
  152   2HB   PHE  20          HB3       PHE  20  -1.022  -4.343  -4.536
  153    HD1  PHE  20           HD1      PHE  20   1.255  -4.313  -1.879
  154    HD2  PHE  20           HD2      PHE  20  -2.746  -5.382  -2.808
  155    HE1  PHE  20           HE1      PHE  20   0.644  -4.138   0.549
  156    HE2  PHE  20           HE2      PHE  20  -3.356  -5.206  -0.379
  157    HZ   PHE  20           HZ       PHE  20  -1.653  -4.586   1.270
  158    H    HIS  21           H        HIS  21  -2.867  -5.684  -4.680
  159    HA   HIS  21           HA       HIS  21  -2.891  -6.054  -7.575
  160   1HB   HIS  21          HB2       HIS  21  -4.292  -7.663  -5.614
  161   2HB   HIS  21          HB3       HIS  21  -5.435  -6.835  -6.651
  162    HD1  HIS  21           HD1      HIS  21  -2.735  -7.177  -8.864
  163    HD2  HIS  21           HD2      HIS  21  -5.429  -9.932  -7.206
  164    HE1  HIS  21           HE1      HIS  21  -2.710  -9.214 -10.400
  165    H    LYS  22           H        LYS  22  -3.860  -4.380  -8.658
  166    HA   LYS  22           HA       LYS  22  -4.735  -2.160  -7.070
  167   1HB   LYS  22          HB2       LYS  22  -5.052  -1.135  -9.390
  168   2HB   LYS  22          HB3       LYS  22  -3.421  -1.559  -8.907
  169   1HG   LYS  22          HG2       LYS  22  -3.225  -2.936 -10.695
  170   2HG   LYS  22          HG3       LYS  22  -4.577  -3.896 -10.126
  171   1HD   LYS  22          HD2       LYS  22  -6.147  -2.203 -11.200
  172   2HD   LYS  22          HD3       LYS  22  -4.745  -1.397 -11.876
  173   1HE   LYS  22          HE2       LYS  22  -5.197  -2.807 -13.654
  174   2HE   LYS  22          HE3       LYS  22  -4.177  -3.895 -12.733
  175   1HZ   LYS  22          HZ1       LYS  22  -6.247  -4.988 -13.336
  176   2HZ   LYS  22          HZ2       LYS  22  -6.215  -4.819 -11.717
  177    H    GLY  23           H        GLY  23  -6.837  -1.109  -7.271
  178   1HA   GLY  23          HA3       GLY  23  -9.065  -1.313  -8.303
  179   2HA   GLY  23          HA2       GLY  23  -8.967  -3.035  -7.991
  180    H    GLU  24           H        GLU  24  -7.743  -2.993  -5.382
  181    HA   GLU  24           HA       GLU  24 -10.077  -2.352  -3.885
  182   1HB   GLU  24          HB2       GLU  24  -7.400  -3.615  -3.198
  183   2HB   GLU  24          HB3       GLU  24  -8.580  -3.248  -1.957
  184   1HG   GLU  24          HG2       GLU  24  -9.232  -5.419  -2.469
  185   2HG   GLU  24          HG3       GLU  24 -10.251  -4.542  -3.594
  186    HE2  GLU  24           HE2      GLU  24  -9.044  -6.499  -6.037
  187    H    LYS  25           H        LYS  25  -9.381  -1.418  -1.456
  188    HA   LYS  25           HA       LYS  25  -8.248   1.199  -2.098
  189   1HB   LYS  25          HB2       LYS  25  -9.338   1.637   0.275
  190   2HB   LYS  25          HB3       LYS  25 -10.286   1.671  -1.198
  191   1HG   LYS  25          HG2       LYS  25  -9.964  -0.997   0.157
  192   2HG   LYS  25          HG3       LYS  25 -10.991   0.179   0.952
  193   1HD   LYS  25          HD2       LYS  25 -11.354  -0.312  -2.012
  194   2HD   LYS  25          HD3       LYS  25 -11.994  -1.482  -0.875
  195   1HE   LYS  25          HE2       LYS  25 -13.835  -0.116  -0.848
  196   2HE   LYS  25          HE3       LYS  25 -12.895   0.845   0.278
  197   1HZ   LYS  25          HZ1       LYS  25 -13.299   1.323  -2.604
  198   2HZ   LYS  25          HZ2       LYS  25 -13.488   2.368  -1.369
  199    H    PHE  26           H        PHE  26  -7.355   2.127   0.293
  200    HA   PHE  26           HA       PHE  26  -5.570   0.094   1.366
  201   1HB   PHE  26          HB2       PHE  26  -4.882   2.070  -0.600
  202   2HB   PHE  26          HB3       PHE  26  -4.271   2.712   0.912
  203    HD1  PHE  26           HD1      PHE  26  -2.165   2.072   1.621
  204    HD2  PHE  26           HD2      PHE  26  -4.263  -0.451  -1.070
  205    HE1  PHE  26           HE1      PHE  26  -0.145   0.593   1.432
  206    HE2  PHE  26           HE2      PHE  26  -2.243  -1.929  -1.260
  207    HZ   PHE  26           HZ       PHE  26  -0.209  -1.389  -0.006
  208    H    GLN  27           H        GLN  27  -5.073   0.402   3.541
  209    HA   GLN  27           HA       GLN  27  -6.654   2.381   4.841
  210   1HB   GLN  27          HB2       GLN  27  -5.162  -0.062   5.591
  211   2HB   GLN  27          HB3       GLN  27  -5.082   1.196   6.808
  212   1HG   GLN  27          HG2       GLN  27  -7.758   0.538   5.554
  213   2HG   GLN  27          HG3       GLN  27  -7.109  -0.533   6.779
  214   1HE2  GLN  27          HE21      GLN  27  -9.409   1.386   6.680
  215   2HE2  GLN  27          HE22      GLN  27  -9.253   2.392   8.082
  216    H    ILE  28           H        ILE  28  -5.618   3.733   6.689
  217    HA   ILE  28           HA       ILE  28  -3.031   4.748   5.732
  218    HB   ILE  28           HB       ILE  28  -4.592   6.394   5.204
  219   1HG1  ILE  28          HG12      ILE  28  -3.301   7.024   7.867
  220   2HG1  ILE  28          HG13      ILE  28  -2.676   7.361   6.265
  221   1HG2  ILE  28          HG21      ILE  28  -5.979   5.474   7.652
  222   2HG2  ILE  28          HG22      ILE  28  -6.086   7.216   7.299
  223   3HG2  ILE  28          HG23      ILE  28  -6.631   6.027   6.090
  224   1HD1  ILE  28          HD11      ILE  28  -3.572   9.443   6.785
  225   2HD1  ILE  28          HD12      ILE  28  -4.987   8.696   6.005
  226   3HD1  ILE  28          HD13      ILE  28  -4.875   8.749   7.781
  227    H    LEU  29           H        LEU  29  -1.485   3.984   7.080
  228    HA   LEU  29           HA       LEU  29  -2.057   4.211   9.949
  229   1HB   LEU  29          HB2       LEU  29  -1.552   1.845   8.438
  230   2HB   LEU  29          HB3       LEU  29  -0.169   2.133   9.477
  231    HG   LEU  29           HG       LEU  29  -1.749   2.307  11.426
  232   1HD1  LEU  29          HD11      LEU  29  -4.016   1.376  11.167
  233   2HD1  LEU  29          HD12      LEU  29  -3.788   2.884  10.246
  234   3HD1  LEU  29          HD13      LEU  29  -3.777   1.315   9.403
  235   1HD2  LEU  29          HD21      LEU  29  -0.861   0.267  11.634
  236   2HD2  LEU  29          HD22      LEU  29  -2.411  -0.328  10.993
  237   3HD2  LEU  29          HD23      LEU  29  -1.028  -0.087   9.898
  238    H    ASN  30           H        ASN  30   0.920   3.126   8.258
  239    HA   ASN  30           HA       ASN  30   2.561   4.710   9.739
  240   1HB   ASN  30          HB2       ASN  30   2.892   2.802   7.762
  241   2HB   ASN  30          HB3       ASN  30   3.411   4.239   6.904
  242   1HD2  ASN  30          HD21      ASN  30   4.926   1.922   7.808
  243   2HD2  ASN  30          HD22      ASN  30   6.204   2.499   8.825
  244    H    SER  31           H        SER  31   3.252   6.885   9.560
  245    HA   SER  31           HA       SER  31   2.862   8.271   7.099
  246   1HB   SER  31          HB2       SER  31   0.810   8.400   9.090
  247   2HB   SER  31          HB3       SER  31   1.643   9.941   9.137
  248    HG   SER  31           HG       SER  31  -0.096   8.955   7.237
  249    H    SER  32           H        SER  32   5.100   8.713   7.117
  250    HA   SER  32           HA       SER  32   5.953  10.370   9.362
  251   1HB   SER  32          HB2       SER  32   7.019   7.880   8.575
  252   2HB   SER  32          HB3       SER  32   8.152   9.053   7.933
  253    HG   SER  32           HG       SER  32   8.780   8.536  10.066
  254    H    GLU  33           H        GLU  33   7.839   9.538   6.429
  255    HA   GLU  33           HA       GLU  33   7.450  12.297   5.561
  256   1HB   GLU  33          HB2       GLU  33   9.892  10.771   6.111
  257   2HB   GLU  33          HB3       GLU  33   9.894  11.399   4.475
  258   1HG   GLU  33          HG2       GLU  33   8.902  13.420   6.351
  259   2HG   GLU  33          HG3       GLU  33  10.474  12.830   6.856
  260    HE2  GLU  33           HE2      GLU  33  12.250  13.735   5.538
  261    H    GLY  34           H        GLY  34   8.681   9.101   4.313
  262   1HA   GLY  34          HA3       GLY  34   6.832   8.377   2.553
  263   2HA   GLY  34          HA2       GLY  34   7.572   9.710   1.688
  264    H    ASP  35           H        ASP  35   8.008   6.424   2.937
  265    HA   ASP  35           HA       ASP  35  10.046   5.995   1.021
  266   1HB   ASP  35          HB2       ASP  35  11.133   6.983   3.233
  267   2HB   ASP  35          HB3       ASP  35  10.846   5.380   3.881
  268    HD2  ASP  35           HD2      ASP  35  11.897   4.673   0.678
  269    H    TRP  36           H        TRP  36   9.275   4.606   4.306
  270    HA   TRP  36           HA       TRP  36   8.296   2.196   2.932
  271   1HB   TRP  36          HB2       TRP  36  10.056   2.503   5.346
  272   2HB   TRP  36          HB3       TRP  36   9.045   1.085   5.154
  273    HD1  TRP  36           HD1      TRP  36   9.883   1.674   1.721
  274    HE1  TRP  36           HE1      TRP  36  12.022   0.402   0.842
  275    HE3  TRP  36           HE3      TRP  36  11.762   0.575   6.316
  276    HZ2  TRP  36           HZ2      TRP  36  14.210  -0.891   2.138
  277    HZ3  TRP  36           HZ3      TRP  36  13.904  -0.696   6.420
  278    HH2  TRP  36           HH2      TRP  36  15.120  -1.423   4.428
  279    H    TRP  37           H        TRP  37   6.082   2.355   3.055
  280    HA   TRP  37           HA       TRP  37   4.962   3.382   5.565
  281   1HB   TRP  37          HB2       TRP  37   4.152   3.511   2.722
  282   2HB   TRP  37          HB3       TRP  37   2.857   3.244   3.873
  283    HD1  TRP  37           HD1      TRP  37   5.889   5.535   4.660
  284    HE1  TRP  37           HE1      TRP  37   5.112   8.029   5.032
  285    HE3  TRP  37           HE3      TRP  37   1.034   4.771   3.355
  286    HZ2  TRP  37           HZ2      TRP  37   2.611   9.373   4.745
  287    HZ3  TRP  37           HZ3      TRP  37  -0.510   6.727   3.428
  288    HH2  TRP  37           HH2      TRP  37   0.209   8.966   4.093
  289    H    GLU  38           H        GLU  38   2.806   2.217   6.165
  290    HA   GLU  38           HA       GLU  38   3.405  -0.603   6.090
  291   1HB   GLU  38          HB2       GLU  38   2.453   1.127   8.078
  292   2HB   GLU  38          HB3       GLU  38   1.026   0.215   7.624
  293   1HG   GLU  38          HG2       GLU  38   2.393  -1.920   7.885
  294   2HG   GLU  38          HG3       GLU  38   3.711  -0.944   8.504
  295    HE2  GLU  38           HE2      GLU  38   3.642  -1.125  10.716
  296    H    ALA  39           H        ALA  39   2.276  -2.075   4.869
  297    HA   ALA  39           HA       ALA  39   0.056  -1.016   3.303
  298   1HB   ALA  39          HB1       ALA  39   0.560  -2.699   1.750
  299   2HB   ALA  39          HB2       ALA  39   2.164  -2.276   2.397
  300   3HB   ALA  39          HB3       ALA  39   1.328  -3.738   2.975
  301    H    ARG  40           H        ARG  40  -1.974  -1.304   4.065
  302    HA   ARG  40           HA       ARG  40  -2.502  -3.842   5.356
  303   1HB   ARG  40          HB2       ARG  40  -2.260  -1.545   6.852
  304   2HB   ARG  40          HB3       ARG  40  -3.966  -1.470   6.459
  305   1HG   ARG  40          HG2       ARG  40  -4.100  -2.776   8.370
  306   2HG   ARG  40          HG3       ARG  40  -3.907  -4.053   7.186
  307   1HD   ARG  40          HD2       ARG  40  -1.302  -3.654   7.613
  308   2HD   ARG  40          HD3       ARG  40  -1.857  -2.931   9.110
  309    HE   ARG  40           HE       ARG  40  -3.199  -5.430   8.802
  310   1HH1  ARG  40          HH22      ARG  40   0.073  -4.205   9.393
  311   2HH1  ARG  40          HH21      ARG  40   0.581  -5.618  10.257
  312   1HH2  ARG  40          HH11      ARG  40  -0.966  -7.421  10.568
  313    H    SER  41           H        SER  41  -3.926  -4.771   3.900
  314    HA   SER  41           HA       SER  41  -5.772  -3.026   2.537
  315   1HB   SER  41          HB2       SER  41  -6.357  -5.412   1.473
  316   2HB   SER  41          HB3       SER  41  -4.957  -4.494   0.952
  317    HG   SER  41           HG       SER  41  -4.366  -6.684   1.403
  318    H    LEU  42           H        LEU  42  -8.114  -3.460   2.520
  319    HA   LEU  42           HA       LEU  42  -8.956  -4.763   5.008
  320   1HB   LEU  42          HB2       LEU  42  -9.356  -2.251   4.456
  321   2HB   LEU  42          HB3       LEU  42 -10.628  -2.852   3.413
  322    HG   LEU  42           HG       LEU  42 -10.956  -4.139   5.926
  323   1HD1  LEU  42          HD11      LEU  42  -9.725  -2.584   7.147
  324   2HD1  LEU  42          HD12      LEU  42 -10.264  -1.217   6.143
  325   3HD1  LEU  42          HD13      LEU  42 -11.396  -1.986   7.279
  326   1HD2  LEU  42          HD21      LEU  42 -12.796  -3.751   4.483
  327   2HD2  LEU  42          HD22      LEU  42 -13.078  -2.770   5.941
  328   3HD2  LEU  42          HD23      LEU  42 -12.494  -1.998   4.446
  329    H    THR  43           H        THR  43  -8.239  -6.138   2.451
  330    HA   THR  43           HA       THR  43 -10.878  -7.349   1.964
  331    HB   THR  43           HB       THR  43  -8.645  -6.933  -0.089
  332    HG1  THR  43           HG1      THR  43  -9.588  -4.938  -0.252
  333   1HG2  THR  43          HG21      THR  43 -11.501  -7.157  -0.891
  334   2HG2  THR  43          HG22      THR  43 -10.064  -7.917  -1.615
  335   3HG2  THR  43          HG23      THR  43 -10.834  -8.650  -0.187
  336    H    THR  44           H        THR  44  -7.291  -7.823   1.770
  337    HA   THR  44           HA       THR  44  -7.796 -10.668   2.326
  338    HB   THR  44           HB       THR  44  -5.122  -9.614   1.420
  339    HG1  THR  44           HG1      THR  44  -6.261  -9.774  -0.809
  340   1HG2  THR  44          HG21      THR  44  -6.739 -12.099   1.259
  341   2HG2  THR  44          HG22      THR  44  -6.012 -11.627  -0.296
  342   3HG2  THR  44          HG23      THR  44  -4.976 -11.892   1.127
  343    H    GLY  45           H        GLY  45  -5.057  -8.390   2.981
  344   1HA   GLY  45          HA3       GLY  45  -4.819  -7.693   5.341
  345   2HA   GLY  45          HA2       GLY  45  -5.134  -9.362   5.776
  346    H    GLU  46           H        GLU  46  -2.979  -7.511   3.496
  347    HA   GLU  46           HA       GLU  46  -0.856  -9.325   4.343
  348   1HB   GLU  46          HB2       GLU  46  -1.752  -9.226   1.833
  349   2HB   GLU  46          HB3       GLU  46  -0.725  -7.810   1.735
  350   1HG   GLU  46          HG2       GLU  46   1.253  -9.076   2.297
  351   2HG   GLU  46          HG3       GLU  46   0.313 -10.456   2.830
  352    HE2  GLU  46           HE2      GLU  46   1.431  -8.709   0.273
  353    H    THR  47           H        THR  47   1.411  -8.298   4.182
  354    HA   THR  47           HA       THR  47   1.406  -5.406   4.457
  355    HB   THR  47           HB       THR  47   0.878  -6.496   6.743
  356    HG1  THR  47           HG1      THR  47   2.119  -4.789   7.526
  357   1HG2  THR  47          HG21      THR  47   3.817  -6.992   7.026
  358   2HG2  THR  47          HG22      THR  47   2.451  -7.821   7.811
  359   3HG2  THR  47          HG23      THR  47   2.916  -8.250   6.147
  360    H    GLY  48           H        GLY  48   3.540  -4.463   4.321
  361   1HA   GLY  48          HA3       GLY  48   5.819  -6.117   3.855
  362   2HA   GLY  48          HA2       GLY  48   5.125  -5.545   2.352
  363    H    TYR  49           H        TYR  49   7.217  -4.358   2.107
  364    HA   TYR  49           HA       TYR  49   7.027  -1.768   3.468
  365   1HB   TYR  49          HB2       TYR  49   9.349  -3.737   3.104
  366   2HB   TYR  49          HB3       TYR  49   9.688  -2.029   3.300
  367    HD1  TYR  49           HD1      TYR  49   8.558  -5.087   4.969
  368    HD2  TYR  49           HD2      TYR  49   9.239  -0.890   5.441
  369    HE1  TYR  49           HE1      TYR  49   8.449  -5.347   7.496
  370    HE2  TYR  49           HE2      TYR  49   9.129  -1.165   7.967
  371    HH   TYR  49           HH       TYR  49   9.478  -3.987   9.489
  372    H    ILE  50           H        ILE  50   6.223  -0.682   1.654
  373    HA   ILE  50           HA       ILE  50   8.174  -0.153  -0.374
  374    HB   ILE  50           HB       ILE  50   6.220  -0.696  -2.108
  375   1HG1  ILE  50          HG12      ILE  50   5.955  -2.981  -0.144
  376   2HG1  ILE  50          HG13      ILE  50   4.825  -1.641  -0.191
  377   1HG2  ILE  50          HG21      ILE  50   7.542  -3.136  -1.965
  378   2HG2  ILE  50          HG22      ILE  50   8.050  -1.697  -2.880
  379   3HG2  ILE  50          HG23      ILE  50   8.684  -1.979  -1.241
  380   1HD1  ILE  50          HD11      ILE  50   5.357  -2.731  -2.877
  381   2HD1  ILE  50          HD12      ILE  50   4.688  -3.946  -1.761
  382   3HD1  ILE  50          HD13      ILE  50   3.803  -2.432  -2.063
  383    HA   PRO  51           HA       PRO  51   6.230   3.679  -0.185
  384   1HB   PRO  51          HB2       PRO  51   6.573   4.661  -2.712
  385   2HB   PRO  51          HB3       PRO  51   7.824   4.714  -1.486
  386   1HG   PRO  51          HG2       PRO  51   7.607   2.934  -3.836
  387   2HG   PRO  51          HG3       PRO  51   9.016   3.296  -2.859
  388   1HD   PRO  51          HD2       PRO  51   7.433   0.906  -2.769
  389   2HD   PRO  51          HD3       PRO  51   8.770   1.317  -1.714
  390    H    SER  52           H        SER  52   4.287   4.784  -0.419
  391    HA   SER  52           HA       SER  52   2.507   3.431  -2.286
  392   1HB   SER  52          HB2       SER  52   1.862   2.553  -0.152
  393   2HB   SER  52          HB3       SER  52   2.021   4.111   0.634
  394    HG   SER  52           HG       SER  52  -0.126   3.050  -0.825
  395    H    ASN  53           H        ASN  53   3.965   5.779  -2.881
  396    HA   ASN  53           HA       ASN  53   2.073   7.920  -2.396
  397   1HB   ASN  53          HB2       ASN  53   4.742   8.019  -2.154
  398   2HB   ASN  53          HB3       ASN  53   4.694   8.269  -3.887
  399   1HD2  ASN  53          HD21      ASN  53   5.465  10.346  -3.742
  400   2HD2  ASN  53          HD22      ASN  53   4.527  11.683  -3.168
  401    H    TYR  54           H        TYR  54   1.583   5.618  -4.271
  402    HA   TYR  54           HA       TYR  54   1.631   7.063  -6.834
  403   1HB   TYR  54          HB2       TYR  54   1.896   4.186  -5.874
  404   2HB   TYR  54          HB3       TYR  54   1.155   4.433  -7.442
  405    HD1  TYR  54           HD1      TYR  54   4.159   3.706  -5.891
  406    HD2  TYR  54           HD2      TYR  54   2.573   6.238  -8.954
  407    HE1  TYR  54           HE1      TYR  54   6.460   3.867  -6.960
  408    HE2  TYR  54           HE2      TYR  54   4.879   6.391 -10.012
  409    HH   TYR  54           HH       TYR  54   7.664   4.774  -8.507
  410    H    VAL  55           H        VAL  55  -0.367   7.159  -4.492
  411    HA   VAL  55           HA       VAL  55  -2.673   5.855  -5.662
  412    HB   VAL  55           HB       VAL  55  -3.816   6.677  -3.661
  413   1HG1  VAL  55          HG11      VAL  55  -3.049   4.667  -2.998
  414   2HG1  VAL  55          HG12      VAL  55  -1.408   4.977  -3.615
  415   3HG1  VAL  55          HG13      VAL  55  -1.894   5.605  -2.021
  416   1HG2  VAL  55          HG21      VAL  55  -2.991   8.200  -2.189
  417   2HG2  VAL  55          HG22      VAL  55  -1.306   7.670  -2.410
  418   3HG2  VAL  55          HG23      VAL  55  -2.072   8.731  -3.617
  419    H    ALA  56           H        ALA  56  -4.707   7.693  -5.089
  420    HA   ALA  56           HA       ALA  56  -3.996  10.161  -6.435
  421   1HB   ALA  56          HB1       ALA  56  -4.504   8.527  -8.254
  422   2HB   ALA  56          HB2       ALA  56  -6.114   8.271  -7.538
  423   3HB   ALA  56          HB3       ALA  56  -5.671   9.869  -8.186
  424    HA   PRO  57           HA       PRO  57  -7.130  11.556  -3.794
  425   1HB   PRO  57          HB2       PRO  57  -7.820  13.935  -4.947
  426   2HB   PRO  57          HB3       PRO  57  -6.390  13.731  -3.956
  427   1HG   PRO  57          HG2       PRO  57  -6.588  13.978  -6.895
  428   2HG   PRO  57          HG3       PRO  57  -5.186  14.198  -5.867
  429   1HD   PRO  57          HD2       PRO  57  -5.766  11.921  -7.512
  430   2HD   PRO  57          HD3       PRO  57  -4.426  12.094  -6.396
  431    H    VAL  58           H        VAL  58  -9.050  10.677  -3.397
  432    HA   VAL  58           HA       VAL  58 -10.769  10.388  -5.736
  433    HB   VAL  58           HB       VAL  58 -11.227   9.245  -2.990
  434   1HG1  VAL  58          HG11      VAL  58 -11.865   7.590  -5.303
  435   2HG1  VAL  58          HG12      VAL  58 -12.900   8.115  -3.953
  436   3HG1  VAL  58          HG13      VAL  58 -12.684   9.169  -5.371
  437   1HG2  VAL  58          HG21      VAL  58 -10.070   7.176  -4.339
  438   2HG2  VAL  58          HG22      VAL  58  -9.102   8.549  -4.926
  439   3HG2  VAL  58          HG23      VAL  58  -9.220   8.225  -3.180
  440    H    ASP  59           H        ASP  59 -11.544  10.899  -2.237
  441    HA   ASP  59           HA       ASP  59 -13.274  13.062  -3.145
  442   1HB   ASP  59          HB2       ASP  59 -14.296  10.938  -2.073
  443   2HB   ASP  59          HB3       ASP  59 -13.553  11.453  -0.571
  444    HD2  ASP  59           HD2      ASP  59 -15.718  12.275  -2.966
  Start of MODEL   14
    1   1H    VAL   1           H        VAL   1 -11.193  12.066   2.303
    2    HA   VAL   1           HA       VAL   1 -11.869  10.642   4.036
    3    HB   VAL   1           HB       VAL   1 -12.160   8.124   3.127
    4   1HG1  VAL   1          HG11      VAL   1 -14.574   8.458   3.337
    5   2HG1  VAL   1          HG12      VAL   1 -13.701   9.360   4.601
    6   3HG1  VAL   1          HG13      VAL   1 -14.358  10.220   3.187
    7   1HG2  VAL   1          HG21      VAL   1 -13.087   7.923   1.028
    8   2HG2  VAL   1          HG22      VAL   1 -13.637   9.614   0.984
    9   3HG2  VAL   1          HG23      VAL   1 -11.916   9.232   0.740
   10    H    THR   2           H        THR   2 -10.793   7.922   4.101
   11    HA   THR   2           HA       THR   2  -7.957   8.549   3.592
   12    HB   THR   2           HB       THR   2  -7.512   7.236   5.661
   13    HG1  THR   2           HG1      THR   2 -10.283   6.763   5.130
   14   1HG2  THR   2          HG21      THR   2  -7.828   9.304   6.631
   15   2HG2  THR   2          HG22      THR   2  -9.295   9.623   5.675
   16   3HG2  THR   2          HG23      THR   2  -9.392   8.632   7.151
   17    H    LEU   3           H        LEU   3  -9.865   7.348   1.697
   18    HA   LEU   3           HA       LEU   3  -8.735   4.638   1.614
   19   1HB   LEU   3          HB2       LEU   3 -11.360   5.775   0.703
   20   2HB   LEU   3          HB3       LEU   3 -10.714   4.319  -0.028
   21    HG   LEU   3           HG       LEU   3 -11.109   4.589   2.957
   22   1HD1  LEU   3          HD11      LEU   3 -13.200   4.843   1.303
   23   2HD1  LEU   3          HD12      LEU   3 -13.093   3.066   1.352
   24   3HD1  LEU   3          HD13      LEU   3 -13.292   3.988   2.862
   25   1HD2  LEU   3          HD21      LEU   3 -10.243   2.552   3.084
   26   2HD2  LEU   3          HD22      LEU   3 -11.401   1.936   1.881
   27   3HD2  LEU   3          HD23      LEU   3  -9.857   2.643   1.348
   28    H    PHE   4           H        PHE   4  -7.697   3.929  -0.273
   29    HA   PHE   4           HA       PHE   4  -7.295   6.033  -2.281
   30   1HB   PHE   4          HB2       PHE   4  -5.376   3.902  -1.163
   31   2HB   PHE   4          HB3       PHE   4  -4.958   5.022  -2.443
   32    HD1  PHE   4           HD1      PHE   4  -4.687   7.429  -1.945
   33    HD2  PHE   4           HD2      PHE   4  -5.380   4.592   1.134
   34    HE1  PHE   4           HE1      PHE   4  -3.899   9.090  -0.236
   35    HE2  PHE   4           HE2      PHE   4  -4.593   6.253   2.843
   36    HZ   PHE   4           HZ       PHE   4  -3.862   8.482   2.137
   37    H    VAL   5           H        VAL   5  -6.281   4.976  -4.382
   38    HA   VAL   5           HA       VAL   5  -7.254   2.285  -4.820
   39    HB   VAL   5           HB       VAL   5  -9.243   3.451  -5.303
   40   1HG1  VAL   5          HG11      VAL   5  -8.069   5.721  -5.432
   41   2HG1  VAL   5          HG12      VAL   5  -7.791   5.356  -7.152
   42   3HG1  VAL   5          HG13      VAL   5  -9.452   5.465  -6.522
   43   1HG2  VAL   5          HG21      VAL   5  -9.441   2.148  -7.103
   44   2HG2  VAL   5          HG22      VAL   5  -8.798   3.488  -8.083
   45   3HG2  VAL   5          HG23      VAL   5  -7.695   2.251  -7.434
   46    H    ALA   6           H        ALA   6  -5.617   1.242  -5.819
   47    HA   ALA   6           HA       ALA   6  -3.531   2.793  -7.050
   48   1HB   ALA   6          HB1       ALA   6  -3.300  -0.067  -7.423
   49   2HB   ALA   6          HB2       ALA   6  -2.313   1.017  -6.414
   50   3HB   ALA   6          HB3       ALA   6  -3.793   0.285  -5.749
   51    H    LEU   7           H        LEU   7  -3.263   3.186  -9.206
   52    HA   LEU   7           HA       LEU   7  -5.288   2.041 -10.968
   53   1HB   LEU   7          HB2       LEU   7  -3.444   4.415 -11.228
   54   2HB   LEU   7          HB3       LEU   7  -4.459   3.829 -12.530
   55    HG   LEU   7           HG       LEU   7  -5.557   4.697  -9.848
   56   1HD1  LEU   7          HD11      LEU   7  -4.619   6.684 -10.582
   57   2HD1  LEU   7          HD12      LEU   7  -4.909   6.311 -12.299
   58   3HD1  LEU   7          HD13      LEU   7  -6.270   6.767 -11.246
   59   1HD2  LEU   7          HD21      LEU   7  -7.008   3.206 -11.139
   60   2HD2  LEU   7          HD22      LEU   7  -7.685   4.849 -11.035
   61   3HD2  LEU   7          HD23      LEU   7  -6.900   4.304 -12.537
   62    H    TYR   8           H        TYR   8  -2.069   1.545  -9.941
   63    HA   TYR   8           HA       TYR   8  -1.641  -0.210 -12.225
   64   1HB   TYR   8          HB2       TYR   8  -0.533   2.332 -12.108
   65   2HB   TYR   8          HB3       TYR   8   0.661   1.452 -11.175
   66    HD1  TYR   8           HD1      TYR   8   2.545   0.915 -12.401
   67    HD2  TYR   8           HD2      TYR   8  -1.272   0.765 -14.329
   68    HE1  TYR   8           HE1      TYR   8   3.655   0.147 -14.557
   69    HE2  TYR   8           HE2      TYR   8  -0.149  -0.002 -16.477
   70    HH   TYR   8           HH       TYR   8   1.724  -0.828 -17.331
   71    H    ASP   9           H        ASP   9  -0.657  -2.128 -11.654
   72    HA   ASP   9           HA       ASP   9  -0.156  -2.420  -8.837
   73   1HB   ASP   9          HB2       ASP   9   0.051  -4.869  -9.451
   74   2HB   ASP   9          HB3       ASP   9  -1.498  -4.157  -9.850
   75    HD2  ASP   9           HD2      ASP   9  -0.032  -6.157 -12.635
   76    H    TYR  10           H        TYR  10   1.898  -3.507  -8.091
   77    HA   TYR  10           HA       TYR  10   4.080  -3.434 -10.033
   78   1HB   TYR  10          HB2       TYR  10   3.665  -1.262  -8.527
   79   2HB   TYR  10          HB3       TYR  10   4.235  -2.260  -7.203
   80    HD1  TYR  10           HD1      TYR  10   5.228  -0.909 -10.536
   81    HD2  TYR  10           HD2      TYR  10   6.548  -2.546  -6.810
   82    HE1  TYR  10           HE1      TYR  10   7.633  -0.332 -11.125
   83    HE2  TYR  10           HE2      TYR  10   8.947  -1.963  -7.412
   84    HH   TYR  10           HH       TYR  10   9.991  -0.076  -9.022
   85    H    GLU  11           H        GLU  11   5.354  -5.217  -9.855
   86    HA   GLU  11           HA       GLU  11   4.846  -6.914  -7.581
   87   1HB   GLU  11          HB2       GLU  11   6.485  -7.444 -10.099
   88   2HB   GLU  11          HB3       GLU  11   6.045  -8.640  -8.896
   89   1HG   GLU  11          HG2       GLU  11   4.320  -8.997 -10.404
   90   2HG   GLU  11          HG3       GLU  11   3.561  -7.768  -9.410
   91    HE2  GLU  11           HE2      GLU  11   2.551  -7.809 -11.530
   92    H    ALA  12           H        ALA  12   6.724  -8.007  -6.464
   93    HA   ALA  12           HA       ALA  12   9.110  -6.297  -6.482
   94   1HB   ALA  12          HB1       ALA  12   8.001  -7.518  -3.950
   95   2HB   ALA  12          HB2       ALA  12   9.109  -6.138  -4.142
   96   3HB   ALA  12          HB3       ALA  12   7.385  -5.958  -4.545
   97    H    ARG  13           H        ARG  13  10.475  -7.837  -4.463
   98    HA   ARG  13           HA       ARG  13  10.362 -10.553  -5.216
   99   1HB   ARG  13          HB2       ARG  13  11.811  -9.043  -6.997
  100   2HB   ARG  13          HB3       ARG  13  13.069  -9.421  -5.837
  101   1HG   ARG  13          HG2       ARG  13  11.625 -11.853  -6.253
  102   2HG   ARG  13          HG3       ARG  13  11.856 -11.150  -7.842
  103   1HD   ARG  13          HD2       ARG  13  14.205 -11.222  -5.933
  104   2HD   ARG  13          HD3       ARG  13  13.740 -12.700  -6.750
  105    HE   ARG  13           HE       ARG  13  14.887 -10.290  -7.999
  106   1HH1  ARG  13          HH22      ARG  13  13.200 -13.359  -8.543
  107   2HH1  ARG  13          HH21      ARG  13  13.677 -13.469 -10.204
  108   1HH2  ARG  13          HH11      ARG  13  15.039 -11.740 -11.152
  109    H    THR  14           H        THR  14  10.036  -9.448  -2.733
  110    HA   THR  14           HA       THR  14  12.577 -10.100  -1.400
  111    HB   THR  14           HB       THR  14  10.930  -8.144   0.041
  112    HG1  THR  14           HG1      THR  14  11.825  -6.585  -1.857
  113   1HG2  THR  14          HG21      THR  14  13.652  -8.736  -0.243
  114   2HG2  THR  14          HG22      THR  14  13.472  -7.235  -1.181
  115   3HG2  THR  14          HG23      THR  14  12.999  -7.274   0.534
  116    H    GLU  15           H        GLU  15  12.163 -10.570   1.024
  117    HA   GLU  15           HA       GLU  15  10.093 -12.553   1.014
  118   1HB   GLU  15          HB2       GLU  15  12.428 -11.885   2.812
  119   2HB   GLU  15          HB3       GLU  15  11.152 -12.923   3.418
  120   1HG   GLU  15          HG2       GLU  15  12.413 -13.485   0.714
  121   2HG   GLU  15          HG3       GLU  15  13.219 -14.001   2.182
  122    HE2  GLU  15           HE2      GLU  15  11.481 -15.447   0.010
  123    H    ASP  16           H        ASP  16  10.913  -9.457   2.632
  124    HA   ASP  16           HA       ASP  16   8.859  -9.632   4.524
  125   1HB   ASP  16          HB2       ASP  16  10.964  -8.100   4.471
  126   2HB   ASP  16          HB3       ASP  16  10.046  -7.064   3.397
  127    HD2  ASP  16           HD2      ASP  16  11.049  -6.365   5.684
  128    H    ASP  17           H        ASP  17   9.266  -7.338   1.711
  129    HA   ASP  17           HA       ASP  17   6.444  -6.930   1.652
  130   1HB   ASP  17          HB2       ASP  17   7.110  -5.486  -0.397
  131   2HB   ASP  17          HB3       ASP  17   7.701  -4.977   1.173
  132    HD2  ASP  17           HD2      ASP  17   9.443  -4.310  -1.304
  133    H    LEU  18           H        LEU  18   5.045  -7.573  -0.124
  134    HA   LEU  18           HA       LEU  18   6.259  -9.561  -1.915
  135   1HB   LEU  18          HB2       LEU  18   3.951 -10.546  -1.980
  136   2HB   LEU  18          HB3       LEU  18   4.843 -10.735  -0.483
  137    HG   LEU  18           HG       LEU  18   3.217  -8.337  -0.386
  138   1HD1  LEU  18          HD11      LEU  18   1.646  -9.218  -1.861
  139   2HD1  LEU  18          HD12      LEU  18   1.870 -10.881  -1.270
  140   3HD1  LEU  18          HD13      LEU  18   1.020  -9.686  -0.262
  141   1HD2  LEU  18          HD21      LEU  18   3.043  -8.938   1.756
  142   2HD2  LEU  18          HD22      LEU  18   2.470 -10.573   1.348
  143   3HD2  LEU  18          HD23      LEU  18   4.214 -10.219   1.360
  144    H    SER  19           H        SER  19   3.875  -9.756  -3.577
  145    HA   SER  19           HA       SER  19   4.314  -7.306  -5.041
  146   1HB   SER  19          HB2       SER  19   3.954  -8.540  -6.929
  147   2HB   SER  19          HB3       SER  19   4.255  -9.904  -5.871
  148    HG   SER  19           HG       SER  19   1.924 -10.043  -5.504
  149    H    PHE  20           H        PHE  20   2.420  -6.155  -6.033
  150    HA   PHE  20           HA       PHE  20  -0.066  -6.616  -4.560
  151   1HB   PHE  20          HB2       PHE  20   1.842  -4.431  -4.348
  152   2HB   PHE  20          HB3       PHE  20   0.417  -3.793  -5.144
  153    HD1  PHE  20           HD1      PHE  20   1.878  -4.697  -2.024
  154    HD2  PHE  20           HD2      PHE  20  -1.845  -4.155  -3.985
  155    HE1  PHE  20           HE1      PHE  20   0.741  -4.461   0.201
  156    HE2  PHE  20           HE2      PHE  20  -2.983  -3.919  -1.761
  157    HZ   PHE  20           HZ       PHE  20  -1.676  -4.075   0.306
  158    H    HIS  21           H        HIS  21  -1.938  -6.359  -5.775
  159    HA   HIS  21           HA       HIS  21  -1.465  -5.658  -8.575
  160   1HB   HIS  21          HB2       HIS  21  -3.061  -7.723  -7.217
  161   2HB   HIS  21          HB3       HIS  21  -3.941  -6.868  -8.469
  162    HD1  HIS  21           HD1      HIS  21  -0.724  -8.876  -8.017
  163    HD2  HIS  21           HD2      HIS  21  -3.349  -7.649 -11.049
  164    HE1  HIS  21           HE1      HIS  21   0.020 -10.083 -10.137
  165    H    LYS  22           H        LYS  22  -3.518  -4.668  -9.662
  166    HA   LYS  22           HA       LYS  22  -4.215  -2.377  -8.054
  167   1HB   LYS  22          HB2       LYS  22  -5.045  -1.441 -10.108
  168   2HB   LYS  22          HB3       LYS  22  -3.473  -2.153 -10.406
  169   1HG   LYS  22          HG2       LYS  22  -4.342  -3.540 -11.975
  170   2HG   LYS  22          HG3       LYS  22  -5.489  -4.192 -10.821
  171   1HD   LYS  22          HD2       LYS  22  -7.210  -2.938 -11.648
  172   2HD   LYS  22          HD3       LYS  22  -6.239  -1.481 -11.706
  173   1HE   LYS  22          HE2       LYS  22  -5.659  -3.640 -13.735
  174   2HE   LYS  22          HE3       LYS  22  -7.113  -2.685 -13.949
  175   1HZ   LYS  22          HZ1       LYS  22  -4.566  -1.299 -13.428
  176   2HZ   LYS  22          HZ2       LYS  22  -4.878  -1.834 -14.934
  177    H    GLY  23           H        GLY  23  -6.367  -1.727  -7.524
  178   1HA   GLY  23          HA3       GLY  23  -8.657  -2.038  -7.371
  179   2HA   GLY  23          HA2       GLY  23  -8.499  -3.670  -7.989
  180    H    GLU  24           H        GLU  24  -6.879  -1.923  -5.241
  181    HA   GLU  24           HA       GLU  24  -8.055  -3.927  -3.489
  182   1HB   GLU  24          HB2       GLU  24  -5.315  -3.790  -4.195
  183   2HB   GLU  24          HB3       GLU  24  -5.399  -3.106  -2.584
  184   1HG   GLU  24          HG2       GLU  24  -5.105  -5.468  -2.271
  185   2HG   GLU  24          HG3       GLU  24  -6.785  -5.145  -1.889
  186    HE2  GLU  24           HE2      GLU  24  -4.668  -6.255  -4.217
  187    H    LYS  25           H        LYS  25  -7.478  -3.153  -1.030
  188    HA   LYS  25           HA       LYS  25  -8.277  -0.333  -0.975
  189   1HB   LYS  25          HB2       LYS  25  -8.795  -2.604   0.962
  190   2HB   LYS  25          HB3       LYS  25  -9.161  -0.927   1.312
  191   1HG   LYS  25          HG2       LYS  25 -10.995  -0.906  -0.061
  192   2HG   LYS  25          HG3       LYS  25 -10.180  -1.799  -1.329
  193   1HD   LYS  25          HD2       LYS  25 -10.506  -3.627   0.848
  194   2HD   LYS  25          HD3       LYS  25 -12.033  -2.780   0.689
  195   1HE   LYS  25          HE2       LYS  25 -11.765  -3.260  -1.892
  196   2HE   LYS  25          HE3       LYS  25 -10.585  -4.454  -1.391
  197   1HZ   LYS  25          HZ1       LYS  25 -12.205  -5.722  -0.367
  198   2HZ   LYS  25          HZ2       LYS  25 -13.198  -4.469  -0.052
  199    H    PHE  26           H        PHE  26  -7.431   0.966   0.890
  200    HA   PHE  26           HA       PHE  26  -4.945  -0.042   1.990
  201   1HB   PHE  26          HB2       PHE  26  -5.338   2.406   0.178
  202   2HB   PHE  26          HB3       PHE  26  -3.939   2.262   1.224
  203    HD1  PHE  26           HD1      PHE  26  -2.501   0.114   0.930
  204    HD2  PHE  26           HD2      PHE  26  -5.267   1.513  -1.967
  205    HE1  PHE  26           HE1      PHE  26  -1.310  -1.204  -0.843
  206    HE2  PHE  26           HE2      PHE  26  -4.076   0.195  -3.741
  207    HZ   PHE  26           HZ       PHE  26  -2.113  -1.149  -3.157
  208    H    GLN  27           H        GLN  27  -4.361   0.964   3.958
  209    HA   GLN  27           HA       GLN  27  -6.074   3.156   4.783
  210   1HB   GLN  27          HB2       GLN  27  -6.025   0.420   5.923
  211   2HB   GLN  27          HB3       GLN  27  -5.835   1.681   7.124
  212   1HG   GLN  27          HG2       GLN  27  -7.918   2.430   5.220
  213   2HG   GLN  27          HG3       GLN  27  -8.251   0.838   5.872
  214   1HE2  GLN  27          HE21      GLN  27  -6.543   3.565   7.359
  215   2HE2  GLN  27          HE22      GLN  27  -7.623   3.811   8.691
  216    H    ILE  28           H        ILE  28  -5.024   4.696   6.074
  217    HA   ILE  28           HA       ILE  28  -2.171   4.450   6.170
  218    HB   ILE  28           HB       ILE  28  -3.029   6.540   5.529
  219   1HG1  ILE  28          HG12      ILE  28  -2.352   7.979   7.663
  220   2HG1  ILE  28          HG13      ILE  28  -1.784   6.427   8.248
  221   1HG2  ILE  28          HG21      ILE  28  -5.045   6.010   7.567
  222   2HG2  ILE  28          HG22      ILE  28  -4.414   7.673   7.645
  223   3HG2  ILE  28          HG23      ILE  28  -5.111   7.055   6.127
  224   1HD1  ILE  28          HD11      ILE  28   0.119   7.004   7.096
  225   2HD1  ILE  28          HD12      ILE  28  -0.779   6.347   5.706
  226   3HD1  ILE  28          HD13      ILE  28  -0.756   8.103   6.001
  227    H    LEU  29           H        LEU  29  -0.863   4.103   7.950
  228    HA   LEU  29           HA       LEU  29  -2.201   3.868  10.533
  229   1HB   LEU  29          HB2       LEU  29  -0.768   1.692   9.055
  230   2HB   LEU  29          HB3       LEU  29  -0.697   1.746  10.805
  231    HG   LEU  29           HG       LEU  29  -3.329   1.785   9.328
  232   1HD1  LEU  29          HD11      LEU  29  -3.103  -0.788  10.222
  233   2HD1  LEU  29          HD12      LEU  29  -2.827  -0.254   8.547
  234   3HD1  LEU  29          HD13      LEU  29  -1.449  -0.453   9.656
  235   1HD2  LEU  29          HD21      LEU  29  -3.603   2.442  11.576
  236   2HD2  LEU  29          HD22      LEU  29  -4.081   0.728  11.513
  237   3HD2  LEU  29          HD23      LEU  29  -2.489   1.186  12.167
  238    H    ASN  30           H        ASN  30   1.034   3.330   8.953
  239    HA   ASN  30           HA       ASN  30   2.253   4.637  11.186
  240   1HB   ASN  30          HB2       ASN  30   3.092   2.606   9.579
  241   2HB   ASN  30          HB3       ASN  30   3.806   3.938   8.693
  242   1HD2  ASN  30          HD21      ASN  30   3.220   3.531  12.172
  243   2HD2  ASN  30          HD22      ASN  30   4.867   3.650  12.693
  244    H    SER  31           H        SER  31   3.912   6.454  10.726
  245    HA   SER  31           HA       SER  31   3.563   7.861   8.276
  246   1HB   SER  31          HB2       SER  31   1.749   8.492  10.290
  247   2HB   SER  31          HB3       SER  31   3.010   9.683  10.546
  248    HG   SER  31           HG       SER  31   1.458   9.219   8.155
  249    H    SER  32           H        SER  32   5.891   7.246   8.346
  250    HA   SER  32           HA       SER  32   7.462   8.381  10.431
  251   1HB   SER  32          HB2       SER  32   8.699   7.383   7.879
  252   2HB   SER  32          HB3       SER  32   9.235   7.161   9.532
  253    HG   SER  32           HG       SER  32   6.945   5.900   9.531
  254    H    GLU  33           H        GLU  33   8.451   8.595   7.001
  255    HA   GLU  33           HA       GLU  33   8.395  11.498   7.298
  256   1HB   GLU  33          HB2       GLU  33  10.601   9.700   6.693
  257   2HB   GLU  33          HB3       GLU  33  10.356  10.802   5.353
  258   1HG   GLU  33          HG2       GLU  33  11.010  12.642   6.566
  259   2HG   GLU  33          HG3       GLU  33  10.192  12.105   8.020
  260    HE2  GLU  33           HE2      GLU  33  13.633  11.776   8.897
  261    H    GLY  34           H        GLY  34   8.764   8.945   4.722
  262   1HA   GLY  34          HA3       GLY  34   6.470   9.139   3.374
  263   2HA   GLY  34          HA2       GLY  34   7.277  10.604   2.854
  264    H    ASP  35           H        ASP  35   7.301   7.057   2.777
  265    HA   ASP  35           HA       ASP  35   8.694   7.110   0.338
  266   1HB   ASP  35          HB2       ASP  35  10.436   7.197   2.419
  267   2HB   ASP  35          HB3       ASP  35  10.159   5.467   2.391
  268    HD2  ASP  35           HD2      ASP  35  10.798   4.375   0.682
  269    H    TRP  36           H        TRP  36   8.771   4.737   3.097
  270    HA   TRP  36           HA       TRP  36   7.134   2.935   1.451
  271   1HB   TRP  36          HB2       TRP  36   9.396   2.503   3.352
  272   2HB   TRP  36          HB3       TRP  36   8.156   1.269   3.238
  273    HD1  TRP  36           HD1      TRP  36   7.892   2.009  -0.119
  274    HE1  TRP  36           HE1      TRP  36   9.593   0.850  -1.770
  275    HE3  TRP  36           HE3      TRP  36  11.328   0.803   3.431
  276    HZ2  TRP  36           HZ2      TRP  36  12.128  -0.413  -1.414
  277    HZ3  TRP  36           HZ3      TRP  36  13.388  -0.392   2.695
  278    HH2  TRP  36           HH2      TRP  36  13.816  -0.998   0.367
  279    H    TRP  37           H        TRP  37   5.014   3.223   2.061
  280    HA   TRP  37           HA       TRP  37   4.474   3.695   4.895
  281   1HB   TRP  37          HB2       TRP  37   3.229   4.480   2.370
  282   2HB   TRP  37          HB3       TRP  37   2.077   3.847   3.529
  283    HD1  TRP  37           HD1      TRP  37   3.241   5.074   6.234
  284    HE1  TRP  37           HE1      TRP  37   3.179   7.657   6.771
  285    HE3  TRP  37           HE3      TRP  37   2.822   6.603   1.402
  286    HZ2  TRP  37           HZ2      TRP  37   2.966   9.997   5.151
  287    HZ3  TRP  37           HZ3      TRP  37   2.692   9.054   0.967
  288    HH2  TRP  37           HH2      TRP  37   2.758  10.728   2.747
  289    H    GLU  38           H        GLU  38   2.491   2.465   5.770
  290    HA   GLU  38           HA       GLU  38   2.951  -0.289   5.256
  291   1HB   GLU  38          HB2       GLU  38   2.335   0.988   7.503
  292   2HB   GLU  38          HB3       GLU  38   0.684   0.733   6.974
  293   1HG   GLU  38          HG2       GLU  38   0.805  -1.581   7.214
  294   2HG   GLU  38          HG3       GLU  38   2.515  -1.645   6.838
  295    HE2  GLU  38           HE2      GLU  38   3.914  -0.821   8.544
  296    H    ALA  39           H        ALA  39   0.841  -1.777   5.138
  297    HA   ALA  39           HA       ALA  39  -1.125  -0.557   3.354
  298   1HB   ALA  39          HB1       ALA  39   0.735  -2.860   2.741
  299   2HB   ALA  39          HB2       ALA  39  -0.874  -2.768   1.984
  300   3HB   ALA  39          HB3       ALA  39   0.306  -1.460   1.727
  301    H    ARG  40           H        ARG  40  -3.085  -0.939   4.244
  302    HA   ARG  40           HA       ARG  40  -3.384  -3.500   5.593
  303   1HB   ARG  40          HB2       ARG  40  -3.258  -1.473   7.164
  304   2HB   ARG  40          HB3       ARG  40  -4.744  -0.895   6.436
  305   1HG   ARG  40          HG2       ARG  40  -5.954  -2.239   7.800
  306   2HG   ARG  40          HG3       ARG  40  -5.170  -3.652   7.123
  307   1HD   ARG  40          HD2       ARG  40  -3.529  -2.106   9.091
  308   2HD   ARG  40          HD3       ARG  40  -4.947  -2.895   9.754
  309    HE   ARG  40           HE       ARG  40  -4.080  -5.048   8.961
  310   1HH1  ARG  40          HH22      ARG  40  -1.812  -2.337   8.703
  311   2HH1  ARG  40          HH21      ARG  40  -0.414  -3.354   8.609
  312   1HH2  ARG  40          HH11      ARG  40  -0.686  -5.735   8.688
  313    H    SER  41           H        SER  41  -4.693  -4.674   4.204
  314    HA   SER  41           HA       SER  41  -6.622  -3.284   2.621
  315   1HB   SER  41          HB2       SER  41  -5.304  -5.168   1.689
  316   2HB   SER  41          HB3       SER  41  -5.987  -6.257   2.880
  317    HG   SER  41           HG       SER  41  -7.005  -5.558   0.464
  318    H    LEU  42           H        LEU  42  -8.955  -3.764   2.653
  319    HA   LEU  42           HA       LEU  42  -9.864  -4.241   5.355
  320   1HB   LEU  42          HB2       LEU  42 -11.085  -3.172   2.833
  321   2HB   LEU  42          HB3       LEU  42 -12.110  -3.702   4.152
  322    HG   LEU  42           HG       LEU  42 -10.176  -2.022   5.334
  323   1HD1  LEU  42          HD11      LEU  42 -10.248  -1.371   2.635
  324   2HD1  LEU  42          HD12      LEU  42 -11.342  -0.191   3.395
  325   3HD1  LEU  42          HD13      LEU  42  -9.663  -0.344   3.966
  326   1HD2  LEU  42          HD21      LEU  42 -12.264  -0.462   5.447
  327   2HD2  LEU  42          HD22      LEU  42 -13.111  -1.853   4.727
  328   3HD2  LEU  42          HD23      LEU  42 -12.277  -2.031   6.289
  329    H    THR  43           H        THR  43  -8.846  -6.258   3.020
  330    HA   THR  43           HA       THR  43 -11.010  -8.190   3.545
  331    HB   THR  43           HB       THR  43  -9.168  -8.316   1.137
  332    HG1  THR  43           HG1      THR  43 -11.634  -7.070   0.735
  333   1HG2  THR  43          HG21      THR  43 -10.857 -10.149   1.570
  334   2HG2  THR  43          HG22      THR  43 -12.144  -8.920   1.542
  335   3HG2  THR  43          HG23      THR  43 -11.197  -9.249   0.072
  336    H    THR  44           H        THR  44  -7.650  -8.472   2.248
  337    HA   THR  44           HA       THR  44  -7.217 -10.761   3.913
  338    HB   THR  44           HB       THR  44  -5.493  -9.137   1.974
  339    HG1  THR  44           HG1      THR  44  -6.969 -10.377   0.818
  340   1HG2  THR  44          HG21      THR  44  -4.272 -10.605   3.832
  341   2HG2  THR  44          HG22      THR  44  -4.908 -11.973   2.887
  342   3HG2  THR  44          HG23      THR  44  -3.811 -10.799   2.124
  343    H    GLY  45           H        GLY  45  -5.357  -7.656   3.644
  344   1HA   GLY  45          HA3       GLY  45  -4.946  -6.281   5.518
  345   2HA   GLY  45          HA2       GLY  45  -5.158  -7.658   6.581
  346    H    GLU  46           H        GLU  46  -3.395  -8.395   3.674
  347    HA   GLU  46           HA       GLU  46  -1.101  -8.992   5.180
  348   1HB   GLU  46          HB2       GLU  46  -2.131  -9.877   2.808
  349   2HB   GLU  46          HB3       GLU  46  -0.883  -8.806   2.204
  350   1HG   GLU  46          HG2       GLU  46   0.834  -9.976   3.532
  351   2HG   GLU  46          HG3       GLU  46  -0.386 -10.974   4.297
  352    HE2  GLU  46           HE2      GLU  46   1.146 -12.629   1.321
  353    H    THR  47           H        THR  47   0.147  -7.368   6.033
  354    HA   THR  47           HA       THR  47   0.416  -4.868   4.619
  355    HB   THR  47           HB       THR  47   0.143  -4.966   7.090
  356    HG1  THR  47           HG1      THR  47   2.059  -3.763   5.590
  357   1HG2  THR  47          HG21      THR  47   1.752  -5.971   8.533
  358   2HG2  THR  47          HG22      THR  47   1.549  -7.197   7.259
  359   3HG2  THR  47          HG23      THR  47   2.959  -6.111   7.233
  360    H    GLY  48           H        GLY  48   2.463  -3.899   4.015
  361   1HA   GLY  48          HA3       GLY  48   4.779  -5.589   3.781
  362   2HA   GLY  48          HA2       GLY  48   3.945  -5.349   2.259
  363    H    TYR  49           H        TYR  49   6.431  -4.374   2.231
  364    HA   TYR  49           HA       TYR  49   6.188  -1.521   2.890
  365   1HB   TYR  49          HB2       TYR  49   8.459  -3.545   2.471
  366   2HB   TYR  49          HB3       TYR  49   8.794  -1.826   2.457
  367    HD1  TYR  49           HD1      TYR  49   7.267  -4.494   4.593
  368    HD2  TYR  49           HD2      TYR  49   9.243  -0.701   4.465
  369    HE1  TYR  49           HE1      TYR  49   7.471  -4.506   7.127
  370    HE2  TYR  49           HE2      TYR  49   9.439  -0.726   6.999
  371    HH   TYR  49           HH       TYR  49   7.660  -2.627   8.925
  372    H    ILE  50           H        ILE  50   5.012  -0.887   1.002
  373    HA   ILE  50           HA       ILE  50   6.703  -0.866  -1.378
  374    HB   ILE  50           HB       ILE  50   4.316  -1.121  -2.553
  375   1HG1  ILE  50          HG12      ILE  50   3.449  -3.290  -1.180
  376   2HG1  ILE  50          HG13      ILE  50   3.998  -2.297   0.156
  377   1HG2  ILE  50          HG21      ILE  50   6.400  -3.135  -1.778
  378   2HG2  ILE  50          HG22      ILE  50   4.942  -3.658  -2.654
  379   3HG2  ILE  50          HG23      ILE  50   6.020  -2.436  -3.370
  380   1HD1  ILE  50          HD11      ILE  50   2.127  -1.038  -0.011
  381   2HD1  ILE  50          HD12      ILE  50   2.591  -0.572  -1.665
  382   3HD1  ILE  50          HD13      ILE  50   1.590  -2.020  -1.395
  383    HA   PRO  51           HA       PRO  51   5.375   3.252  -1.397
  384   1HB   PRO  51          HB2       PRO  51   6.191   4.029  -3.887
  385   2HB   PRO  51          HB3       PRO  51   7.279   3.895  -2.520
  386   1HG   PRO  51          HG2       PRO  51   6.981   2.083  -4.836
  387   2HG   PRO  51          HG3       PRO  51   8.314   2.210  -3.706
  388   1HD   PRO  51          HD2       PRO  51   6.287   0.180  -3.751
  389   2HD   PRO  51          HD3       PRO  51   7.552   0.372  -2.552
  390    H    SER  52           H        SER  52   3.244   3.599  -1.156
  391    HA   SER  52           HA       SER  52   1.695   3.059  -3.552
  392   1HB   SER  52          HB2       SER  52   1.036   2.035  -1.314
  393   2HB   SER  52          HB3       SER  52   0.687   3.653  -0.737
  394    HG   SER  52           HG       SER  52  -0.540   2.461  -3.075
  395    H    ASN  53           H        ASN  53   3.418   5.360  -3.529
  396    HA   ASN  53           HA       ASN  53   1.711   7.572  -2.855
  397   1HB   ASN  53          HB2       ASN  53   4.349   7.385  -2.603
  398   2HB   ASN  53          HB3       ASN  53   4.377   7.784  -4.309
  399   1HD2  ASN  53          HD21      ASN  53   5.390   9.733  -3.950
  400   2HD2  ASN  53          HD22      ASN  53   4.591  11.120  -3.287
  401    H    TYR  54           H        TYR  54   1.594   5.407  -5.255
  402    HA   TYR  54           HA       TYR  54   1.547   7.289  -7.490
  403   1HB   TYR  54          HB2       TYR  54   1.838   4.349  -6.933
  404   2HB   TYR  54          HB3       TYR  54   0.858   4.696  -8.344
  405    HD1  TYR  54           HD1      TYR  54   3.823   3.472  -7.825
  406    HD2  TYR  54           HD2      TYR  54   2.248   7.118  -9.415
  407    HE1  TYR  54           HE1      TYR  54   5.929   3.784  -9.215
  408    HE2  TYR  54           HE2      TYR  54   4.359   7.418 -10.799
  409    HH   TYR  54           HH       TYR  54   7.146   5.474 -10.280
  410    H    VAL  55           H        VAL  55  -0.513   6.891  -5.118
  411    HA   VAL  55           HA       VAL  55  -2.836   6.473  -6.868
  412    HB   VAL  55           HB       VAL  55  -4.045   5.805  -4.880
  413   1HG1  VAL  55          HG11      VAL  55  -1.909   4.365  -6.082
  414   2HG1  VAL  55          HG12      VAL  55  -1.888   3.987  -4.342
  415   3HG1  VAL  55          HG13      VAL  55  -3.370   3.722  -5.293
  416   1HG2  VAL  55          HG21      VAL  55  -1.711   6.934  -3.514
  417   2HG2  VAL  55          HG22      VAL  55  -3.364   6.652  -2.919
  418   3HG2  VAL  55          HG23      VAL  55  -2.173   5.331  -2.894
  419    H    ALA  56           H        ALA  56  -4.830   7.769  -6.032
  420    HA   ALA  56           HA       ALA  56  -4.001  10.327  -4.895
  421   1HB   ALA  56          HB1       ALA  56  -5.563  10.027  -7.492
  422   2HB   ALA  56          HB2       ALA  56  -5.142  11.555  -6.683
  423   3HB   ALA  56          HB3       ALA  56  -3.860  10.530  -7.371
  424    HA   PRO  57           HA       PRO  57  -7.638   9.073  -2.742
  425   1HB   PRO  57          HB2       PRO  57  -7.482  10.961  -0.773
  426   2HB   PRO  57          HB3       PRO  57  -6.680   9.405  -0.675
  427   1HG   PRO  57          HG2       PRO  57  -5.509  12.062  -1.225
  428   2HG   PRO  57          HG3       PRO  57  -4.704  10.594  -0.709
  429   1HD   PRO  57          HD2       PRO  57  -4.719  11.704  -3.353
  430   2HD   PRO  57          HD3       PRO  57  -4.013  10.177  -2.862
  431    H    VAL  58           H        VAL  58  -9.796   9.814  -2.382
  432    HA   VAL  58           HA       VAL  58 -10.447  11.784  -4.353
  433    HB   VAL  58           HB       VAL  58 -12.165  10.324  -2.336
  434   1HG1  VAL  58          HG11      VAL  58 -13.061  11.553  -4.952
  435   2HG1  VAL  58          HG12      VAL  58 -14.057  10.975  -3.595
  436   3HG1  VAL  58          HG13      VAL  58 -13.084  12.454  -3.418
  437   1HG2  VAL  58          HG21      VAL  58 -12.708   8.811  -4.230
  438   2HG2  VAL  58          HG22      VAL  58 -11.472   9.635  -5.212
  439   3HG2  VAL  58          HG23      VAL  58 -10.995   8.734  -3.753
  440    H    ASP  59           H        ASP  59 -10.676  13.944  -4.055
  441    HA   ASP  59           HA       ASP  59 -10.035  15.043  -1.576
  442   1HB   ASP  59          HB2       ASP  59 -11.316  16.232  -4.078
  443   2HB   ASP  59          HB3       ASP  59 -10.839  17.208  -2.704
  444    HD2  ASP  59           HD2      ASP  59  -8.244  14.998  -3.044
  Start of MODEL   15
    1   1H    VAL   1           H        VAL   1 -14.368   9.055   1.935
    2    HA   VAL   1           HA       VAL   1 -13.736   8.744   4.521
    3    HB   VAL   1           HB       VAL   1 -12.745   6.198   3.960
    4   1HG1  VAL   1          HG11      VAL   1 -13.756   5.631   5.943
    5   2HG1  VAL   1          HG12      VAL   1 -13.805   7.406   6.071
    6   3HG1  VAL   1          HG13      VAL   1 -15.256   6.510   5.562
    7   1HG2  VAL   1          HG21      VAL   1 -15.657   5.805   3.617
    8   2HG2  VAL   1          HG22      VAL   1 -14.810   6.467   2.199
    9   3HG2  VAL   1          HG23      VAL   1 -14.285   4.922   2.908
   10    H    THR   2           H        THR   2 -11.567   9.245   4.789
   11    HA   THR   2           HA       THR   2 -10.123   9.797   2.367
   12    HB   THR   2           HB       THR   2  -8.434  10.624   4.167
   13    HG1  THR   2           HG1      THR   2  -9.837  10.772   6.267
   14   1HG2  THR   2          HG21      THR   2  -9.600  12.556   3.756
   15   2HG2  THR   2          HG22      THR   2 -11.121  11.661   3.525
   16   3HG2  THR   2          HG23      THR   2 -10.602  12.126   5.163
   17    H    LEU   3           H        LEU   3 -10.267   7.389   1.753
   18    HA   LEU   3           HA       LEU   3  -8.102   5.919   3.064
   19   1HB   LEU   3          HB2       LEU   3 -10.658   5.203   1.834
   20   2HB   LEU   3          HB3       LEU   3  -9.325   4.208   1.283
   21    HG   LEU   3           HG       LEU   3  -8.768   3.821   3.748
   22   1HD1  LEU   3          HD11      LEU   3 -11.618   4.578   4.312
   23   2HD1  LEU   3          HD12      LEU   3 -10.253   4.358   5.433
   24   3HD1  LEU   3          HD13      LEU   3 -10.329   5.804   4.398
   25   1HD2  LEU   3          HD21      LEU   3  -9.979   2.256   2.113
   26   2HD2  LEU   3          HD22      LEU   3 -10.141   1.933   3.856
   27   3HD2  LEU   3          HD23      LEU   3 -11.466   2.725   2.972
   28    H    PHE   4           H        PHE   4  -6.541   4.756   1.673
   29    HA   PHE   4           HA       PHE   4  -6.037   6.330  -0.750
   30   1HB   PHE   4          HB2       PHE   4  -4.332   4.763   1.264
   31   2HB   PHE   4          HB3       PHE   4  -3.666   5.259  -0.279
   32    HD1  PHE   4           HD1      PHE   4  -3.604   6.084   2.993
   33    HD2  PHE   4           HD2      PHE   4  -4.427   7.922  -0.742
   34    HE1  PHE   4           HE1      PHE   4  -3.020   8.323   3.966
   35    HE2  PHE   4           HE2      PHE   4  -3.843  10.161   0.231
   36    HZ   PHE   4           HZ       PHE   4  -3.146  10.335   2.573
   37    H    VAL   5           H        VAL   5  -5.173   5.205  -2.646
   38    HA   VAL   5           HA       VAL   5  -5.671   2.319  -2.616
   39    HB   VAL   5           HB       VAL   5  -6.600   2.754  -4.997
   40   1HG1  VAL   5          HG11      VAL   5  -8.319   1.888  -3.854
   41   2HG1  VAL   5          HG12      VAL   5  -7.849   2.729  -2.359
   42   3HG1  VAL   5          HG13      VAL   5  -8.851   3.563  -3.570
   43   1HG2  VAL   5          HG21      VAL   5  -5.980   5.263  -4.759
   44   2HG2  VAL   5          HG22      VAL   5  -7.541   4.831  -5.497
   45   3HG2  VAL   5          HG23      VAL   5  -7.478   5.380  -3.805
   46    H    ALA   6           H        ALA   6  -4.454   1.139  -4.252
   47    HA   ALA   6           HA       ALA   6  -1.894   2.348  -4.681
   48   1HB   ALA   6          HB1       ALA   6  -1.215   0.195  -4.818
   49   2HB   ALA   6          HB2       ALA   6  -2.862  -0.220  -4.288
   50   3HB   ALA   6          HB3       ALA   6  -2.461  -0.211  -6.021
   51    H    LEU   7           H        LEU   7  -0.903   1.805  -7.038
   52    HA   LEU   7           HA       LEU   7  -2.709   3.183  -8.877
   53   1HB   LEU   7          HB2       LEU   7  -0.259   3.887  -8.176
   54   2HB   LEU   7          HB3       LEU   7   0.192   2.740  -9.422
   55    HG   LEU   7           HG       LEU   7  -1.408   4.051 -10.964
   56   1HD1  LEU   7          HD11      LEU   7  -1.378   5.782  -8.535
   57   2HD1  LEU   7          HD12      LEU   7  -1.333   6.571 -10.130
   58   3HD1  LEU   7          HD13      LEU   7  -2.673   5.476  -9.716
   59   1HD2  LEU   7          HD21      LEU   7   0.674   5.982 -10.568
   60   2HD2  LEU   7          HD22      LEU   7   1.330   4.348 -10.307
   61   3HD2  LEU   7          HD23      LEU   7   0.508   4.744 -11.836
   62    H    TYR   8           H        TYR   8  -0.304   0.457  -8.816
   63    HA   TYR   8           HA       TYR   8  -2.123  -1.110 -10.423
   64   1HB   TYR   8          HB2       TYR   8   0.398   0.271 -11.329
   65   2HB   TYR   8          HB3       TYR   8   0.312  -1.422 -11.771
   66    HD1  TYR   8           HD1      TYR   8  -1.804  -2.213 -13.048
   67    HD2  TYR   8           HD2      TYR   8  -0.696   1.898 -12.628
   68    HE1  TYR   8           HE1      TYR   8  -3.255  -1.610 -15.047
   69    HE2  TYR   8           HE2      TYR   8  -2.151   2.488 -14.628
   70    HH   TYR   8           HH       TYR   8  -3.331   1.710 -16.283
   71    H    ASP   9           H        ASP   9  -1.036  -3.355 -10.884
   72    HA   ASP   9           HA       ASP   9   0.095  -4.143  -8.360
   73   1HB   ASP   9          HB2       ASP   9  -0.126  -6.483  -9.623
   74   2HB   ASP   9          HB3       ASP   9  -1.532  -5.698  -8.933
   75    HD2  ASP   9           HD2      ASP   9  -2.903  -4.705 -10.305
   76    H    TYR  10           H        TYR  10   2.115  -5.433  -8.263
   77    HA   TYR  10           HA       TYR  10   3.749  -5.252 -10.700
   78   1HB   TYR  10          HB2       TYR  10   3.956  -3.798  -8.253
   79   2HB   TYR  10          HB3       TYR  10   5.119  -5.094  -8.058
   80    HD1  TYR  10           HD1      TYR  10   6.763  -5.448 -10.119
   81    HD2  TYR  10           HD2      TYR  10   4.631  -1.830  -9.298
   82    HE1  TYR  10           HE1      TYR  10   8.448  -4.134 -11.498
   83    HE2  TYR  10           HE2      TYR  10   6.323  -0.528 -10.679
   84    HH   TYR  10           HH       TYR  10   8.598  -2.102 -12.694
   85    H    GLU  11           H        GLU  11   5.708  -6.743 -10.582
   86    HA   GLU  11           HA       GLU  11   4.856  -9.184  -9.239
   87   1HB   GLU  11          HB2       GLU  11   6.504  -8.733 -11.758
   88   2HB   GLU  11          HB3       GLU  11   6.390 -10.298 -10.978
   89   1HG   GLU  11          HG2       GLU  11   3.716  -9.520 -11.123
   90   2HG   GLU  11          HG3       GLU  11   4.375  -8.851 -12.603
   91    HE2  GLU  11           HE2      GLU  11   5.237 -10.830 -14.206
   92    H    ALA  12           H        ALA  12   6.111  -9.984  -7.598
   93    HA   ALA  12           HA       ALA  12   8.948  -9.463  -7.603
   94   1HB   ALA  12          HB1       ALA  12   7.248  -8.509  -5.269
   95   2HB   ALA  12          HB2       ALA  12   9.001  -8.303  -5.495
   96   3HB   ALA  12          HB3       ALA  12   7.859  -7.430  -6.546
   97    H    ARG  13           H        ARG  13  10.061 -10.791  -5.945
   98    HA   ARG  13           HA       ARG  13   8.332 -12.816  -4.811
   99   1HB   ARG  13          HB2       ARG  13   9.888 -13.283  -7.109
  100   2HB   ARG  13          HB3       ARG  13  10.886 -13.923  -5.817
  101   1HG   ARG  13          HG2       ARG  13   9.202 -15.473  -5.117
  102   2HG   ARG  13          HG3       ARG  13   7.931 -14.618  -5.968
  103   1HD   ARG  13          HD2       ARG  13   8.755 -15.339  -8.129
  104   2HD   ARG  13          HD3       ARG  13  10.268 -15.903  -7.446
  105    HE   ARG  13           HE       ARG  13   7.605 -17.217  -7.076
  106   1HH1  ARG  13          HH22      ARG  13  11.135 -17.328  -6.795
  107   2HH1  ARG  13          HH21      ARG  13  11.178 -19.024  -6.445
  108   1HH2  ARG  13          HH11      ARG  13   9.124 -20.254  -6.344
  109    H    THR  14           H        THR  14   9.254 -10.809  -3.251
  110    HA   THR  14           HA       THR  14  11.463 -12.068  -1.781
  111    HB   THR  14           HB       THR  14  12.302  -9.686  -1.377
  112    HG1  THR  14           HG1      THR  14  11.345  -8.161  -2.981
  113   1HG2  THR  14          HG21      THR  14  13.650  -9.780  -3.242
  114   2HG2  THR  14          HG22      THR  14  12.811 -11.313  -3.582
  115   3HG2  THR  14          HG23      THR  14  12.255  -9.805  -4.348
  116    H    GLU  15           H        GLU  15  11.623 -10.658   0.453
  117    HA   GLU  15           HA       GLU  15   8.960 -11.023   1.526
  118   1HB   GLU  15          HB2       GLU  15  11.497 -11.775   2.430
  119   2HB   GLU  15          HB3       GLU  15  11.117 -10.393   3.439
  120   1HG   GLU  15          HG2       GLU  15   9.777 -11.719   4.696
  121   2HG   GLU  15          HG3       GLU  15   8.713 -11.911   3.317
  122    HE2  GLU  15           HE2      GLU  15   9.126 -14.887   2.752
  123    H    ASP  16           H        ASP  16  11.159  -8.547   0.522
  124    HA   ASP  16           HA       ASP  16   9.984  -6.612   2.311
  125   1HB   ASP  16          HB2       ASP  16  12.496  -6.901   0.988
  126   2HB   ASP  16          HB3       ASP  16  11.737  -5.500   0.259
  127    HD2  ASP  16           HD2      ASP  16  11.676  -3.666   3.190
  128    H    ASP  17           H        ASP  17   8.723  -8.118  -0.166
  129    HA   ASP  17           HA       ASP  17   7.238  -5.914  -1.059
  130   1HB   ASP  17          HB2       ASP  17   9.593  -6.207  -2.468
  131   2HB   ASP  17          HB3       ASP  17   8.525  -7.230  -3.410
  132    HD2  ASP  17           HD2      ASP  17   8.126  -4.137  -5.032
  133    H    LEU  18           H        LEU  18   5.204  -6.846  -1.353
  134    HA   LEU  18           HA       LEU  18   5.156  -9.679  -2.127
  135   1HB   LEU  18          HB2       LEU  18   3.403  -8.054  -0.301
  136   2HB   LEU  18          HB3       LEU  18   2.845  -9.558  -1.009
  137    HG   LEU  18           HG       LEU  18   5.364  -9.342   0.657
  138   1HD1  LEU  18          HD11      LEU  18   2.509  -9.619   1.471
  139   2HD1  LEU  18          HD12      LEU  18   3.719 -10.604   2.325
  140   3HD1  LEU  18          HD13      LEU  18   3.874  -8.831   2.299
  141   1HD2  LEU  18          HD21      LEU  18   3.840 -11.601  -0.592
  142   2HD2  LEU  18          HD22      LEU  18   5.594 -11.304  -0.521
  143   3HD2  LEU  18          HD23      LEU  18   4.727 -11.871   0.926
  144    H    SER  19           H        SER  19   2.606 -10.035  -2.960
  145    HA   SER  19           HA       SER  19   2.614  -8.419  -5.345
  146   1HB   SER  19          HB2       SER  19   0.607 -10.614  -4.873
  147   2HB   SER  19          HB3       SER  19   1.407 -10.146  -6.360
  148    HG   SER  19           HG       SER  19   3.395 -10.930  -4.794
  149    H    PHE  20           H        PHE  20   1.129  -6.796  -5.744
  150    HA   PHE  20           HA       PHE  20  -1.112  -6.613  -3.854
  151   1HB   PHE  20          HB2       PHE  20   0.938  -4.714  -4.982
  152   2HB   PHE  20          HB3       PHE  20  -0.690  -4.070  -4.916
  153    HD1  PHE  20           HD1      PHE  20  -1.875  -3.981  -2.695
  154    HD2  PHE  20           HD2      PHE  20   2.257  -4.887  -3.027
  155    HE1  PHE  20           HE1      PHE  20  -1.557  -3.421  -0.268
  156    HE2  PHE  20           HE2      PHE  20   2.576  -4.326  -0.601
  157    HZ   PHE  20           HZ       PHE  20   0.664  -3.600   0.749
  158    H    HIS  21           H        HIS  21  -2.748  -4.800  -4.958
  159    HA   HIS  21           HA       HIS  21  -3.013  -5.275  -7.778
  160   1HB   HIS  21          HB2       HIS  21  -4.571  -6.782  -5.796
  161   2HB   HIS  21          HB3       HIS  21  -5.570  -5.934  -6.959
  162    HD1  HIS  21           HD1      HIS  21  -2.812  -8.551  -6.798
  163    HD2  HIS  21           HD2      HIS  21  -5.649  -7.052  -9.501
  164    HE1  HIS  21           HE1      HIS  21  -2.779 -10.119  -8.812
  165    H    LYS  22           H        LYS  22  -4.498  -3.772  -8.780
  166    HA   LYS  22           HA       LYS  22  -4.805  -1.391  -7.176
  167   1HB   LYS  22          HB2       LYS  22  -5.576  -0.451  -9.420
  168   2HB   LYS  22          HB3       LYS  22  -3.906  -0.964  -9.296
  169   1HG   LYS  22          HG2       LYS  22  -4.322  -3.001 -10.506
  170   2HG   LYS  22          HG3       LYS  22  -6.058  -2.861 -10.310
  171   1HD   LYS  22          HD2       LYS  22  -4.645  -0.613 -11.731
  172   2HD   LYS  22          HD3       LYS  22  -4.803  -2.133 -12.590
  173   1HE   LYS  22          HE2       LYS  22  -6.751  -0.153 -12.473
  174   2HE   LYS  22          HE3       LYS  22  -7.033  -1.815 -12.951
  175   1HZ   LYS  22          HZ1       LYS  22  -8.301  -0.693 -10.908
  176   2HZ   LYS  22          HZ2       LYS  22  -7.994  -2.292 -10.945
  177    H    GLY  23           H        GLY  23  -6.818  -0.285  -6.835
  178   1HA   GLY  23          HA3       GLY  23  -9.123  -0.116  -6.848
  179   2HA   GLY  23          HA2       GLY  23  -9.261  -1.747  -7.476
  180    H    GLU  24           H        GLU  24  -6.940  -1.555  -4.928
  181    HA   GLU  24           HA       GLU  24  -8.880  -2.797  -3.170
  182   1HB   GLU  24          HB2       GLU  24  -6.216  -3.422  -3.857
  183   2HB   GLU  24          HB3       GLU  24  -6.106  -2.804  -2.221
  184   1HG   GLU  24          HG2       GLU  24  -7.401  -4.527  -1.324
  185   2HG   GLU  24          HG3       GLU  24  -8.336  -4.739  -2.791
  186    HE2  GLU  24           HE2      GLU  24  -6.260  -7.609  -2.714
  187    H    LYS  25           H        LYS  25  -8.670  -2.287  -0.756
  188    HA   LYS  25           HA       LYS  25  -8.515   0.599  -0.492
  189   1HB   LYS  25          HB2       LYS  25  -9.804  -1.638   1.018
  190   2HB   LYS  25          HB3       LYS  25  -9.396  -0.179   1.899
  191   1HG   LYS  25          HG2       LYS  25 -11.626   0.167   1.085
  192   2HG   LYS  25          HG3       LYS  25 -10.597   1.150   0.062
  193   1HD   LYS  25          HD2       LYS  25 -11.035  -0.103  -1.808
  194   2HD   LYS  25          HD3       LYS  25 -10.934  -1.621  -0.941
  195   1HE   LYS  25          HE2       LYS  25 -13.278  -0.233   0.011
  196   2HE   LYS  25          HE3       LYS  25 -13.302  -0.171  -1.741
  197   1HZ   LYS  25          HZ1       LYS  25 -13.713  -2.375  -1.836
  198   2HZ   LYS  25          HZ2       LYS  25 -12.555  -2.765  -0.758
  199    H    PHE  26           H        PHE  26  -7.639   1.281   1.855
  200    HA   PHE  26           HA       PHE  26  -5.456  -0.269   2.800
  201   1HB   PHE  26          HB2       PHE  26  -4.856   1.057   0.512
  202   2HB   PHE  26          HB3       PHE  26  -4.748   2.437   1.586
  203    HD1  PHE  26           HD1      PHE  26  -2.662   2.945   2.409
  204    HD2  PHE  26           HD2      PHE  26  -3.532  -1.098   1.459
  205    HE1  PHE  26           HE1      PHE  26  -0.310   2.300   3.000
  206    HE2  PHE  26           HE2      PHE  26  -1.180  -1.743   2.050
  207    HZ   PHE  26           HZ       PHE  26   0.404  -0.037   2.814
  208    H    GLN  27           H        GLN  27  -5.624   0.085   4.959
  209    HA   GLN  27           HA       GLN  27  -6.847   2.490   5.865
  210   1HB   GLN  27          HB2       GLN  27  -5.596   0.193   7.437
  211   2HB   GLN  27          HB3       GLN  27  -6.594   1.462   8.119
  212   1HG   GLN  27          HG2       GLN  27  -7.905   0.193   5.813
  213   2HG   GLN  27          HG3       GLN  27  -7.490  -0.989   7.040
  214   1HE2  GLN  27          HE21      GLN  27 -10.092  -0.058   6.217
  215   2HE2  GLN  27          HE22      GLN  27 -10.885   0.614   7.602
  216    H    ILE  28           H        ILE  28  -5.856   3.984   7.457
  217    HA   ILE  28           HA       ILE  28  -3.129   4.531   6.715
  218    HB   ILE  28           HB       ILE  28  -3.550   6.506   8.291
  219   1HG1  ILE  28          HG12      ILE  28  -6.450   6.229   7.919
  220   2HG1  ILE  28          HG13      ILE  28  -5.778   5.047   9.024
  221   1HG2  ILE  28          HG21      ILE  28  -4.318   5.972   5.578
  222   2HG2  ILE  28          HG22      ILE  28  -5.486   7.095   6.315
  223   3HG2  ILE  28          HG23      ILE  28  -3.750   7.490   6.315
  224   1HD1  ILE  28          HD11      ILE  28  -6.506   7.428   9.921
  225   2HD1  ILE  28          HD12      ILE  28  -5.016   6.672  10.535
  226   3HD1  ILE  28          HD13      ILE  28  -4.923   7.935   9.284
  227    H    LEU  29           H        LEU  29  -1.335   3.964   7.835
  228    HA   LEU  29           HA       LEU  29  -1.703   3.235  10.647
  229   1HB   LEU  29          HB2       LEU  29  -1.618   1.283   8.902
  230   2HB   LEU  29          HB3       LEU  29   0.102   1.621   8.885
  231    HG   LEU  29           HG       LEU  29  -0.574   1.477  11.609
  232   1HD1  LEU  29          HD11      LEU  29  -2.430  -0.102  10.034
  233   2HD1  LEU  29          HD12      LEU  29  -1.452  -1.125  11.115
  234   3HD1  LEU  29          HD13      LEU  29  -2.401   0.225  11.784
  235   1HD2  LEU  29          HD21      LEU  29   0.583  -0.918  11.145
  236   2HD2  LEU  29          HD22      LEU  29   1.010  -0.068   9.641
  237   3HD2  LEU  29          HD23      LEU  29   1.475   0.621  11.215
  238    H    ASN  30           H        ASN  30   0.899   3.488   8.115
  239    HA   ASN  30           HA       ASN  30   2.565   4.736  10.079
  240   1HB   ASN  30          HB2       ASN  30   3.010   3.156   7.789
  241   2HB   ASN  30          HB3       ASN  30   3.527   4.750   7.274
  242   1HD2  ASN  30          HD21      ASN  30   5.397   2.904   7.361
  243   2HD2  ASN  30          HD22      ASN  30   6.479   3.094   8.701
  244    H    SER  31           H        SER  31   3.235   6.964   9.993
  245    HA   SER  31           HA       SER  31   2.601   8.557   7.750
  246   1HB   SER  31          HB2       SER  31   0.488   8.239   9.542
  247   2HB   SER  31          HB3       SER  31   1.226   9.732  10.090
  248    HG   SER  31           HG       SER  31  -0.459   9.490   8.082
  249    H    SER  32           H        SER  32   4.981   8.719   8.107
  250    HA   SER  32           HA       SER  32   5.719  10.168  10.492
  251   1HB   SER  32          HB2       SER  32   6.990   8.221   8.877
  252   2HB   SER  32          HB3       SER  32   7.882   9.698   8.574
  253    HG   SER  32           HG       SER  32   7.496   8.297  11.050
  254    H    GLU  33           H        GLU  33   7.060  10.466   7.145
  255    HA   GLU  33           HA       GLU  33   6.146  13.216   7.109
  256   1HB   GLU  33          HB2       GLU  33   8.977  12.282   7.230
  257   2HB   GLU  33          HB3       GLU  33   8.650  13.519   6.033
  258   1HG   GLU  33          HG2       GLU  33   7.257  14.489   8.233
  259   2HG   GLU  33          HG3       GLU  33   8.626  13.706   8.999
  260    HE2  GLU  33           HE2      GLU  33   9.323  16.384   9.241
  261    H    GLY  34           H        GLY  34   8.384  11.118   5.149
  262   1HA   GLY  34          HA3       GLY  34   6.501  10.630   3.093
  263   2HA   GLY  34          HA2       GLY  34   7.504  12.002   2.664
  264    H    ASP  35           H        ASP  35   7.366   8.518   3.122
  265    HA   ASP  35           HA       ASP  35   9.839   8.295   1.717
  266   1HB   ASP  35          HB2       ASP  35   9.558   7.644   4.622
  267   2HB   ASP  35          HB3       ASP  35  10.344   6.411   3.657
  268    HD2  ASP  35           HD2      ASP  35  11.562   8.905   2.040
  269    H    TRP  36           H        TRP  36   8.414   5.889   3.990
  270    HA   TRP  36           HA       TRP  36   7.322   4.455   1.662
  271   1HB   TRP  36          HB2       TRP  36   8.175   3.022   4.141
  272   2HB   TRP  36          HB3       TRP  36   8.042   2.437   2.494
  273    HD1  TRP  36           HD1      TRP  36  10.433   4.608   4.658
  274    HE1  TRP  36           HE1      TRP  36  12.874   4.595   3.658
  275    HE3  TRP  36           HE3      TRP  36   9.257   2.018   0.443
  276    HZ2  TRP  36           HZ2      TRP  36  14.015   3.527   1.271
  277    HZ3  TRP  36           HZ3      TRP  36  11.094   1.532  -1.172
  278    HH2  TRP  36           HH2      TRP  36  13.406   2.242  -0.812
  279    H    TRP  37           H        TRP  37   5.571   2.772   2.582
  280    HA   TRP  37           HA       TRP  37   4.097   3.942   4.802
  281   1HB   TRP  37          HB2       TRP  37   3.448   4.808   2.339
  282   2HB   TRP  37          HB3       TRP  37   2.481   3.346   2.385
  283    HD1  TRP  37           HD1      TRP  37   1.230   3.315   5.211
  284    HE1  TRP  37           HE1      TRP  37  -0.401   5.160   6.160
  285    HE3  TRP  37           HE3      TRP  37   2.706   7.002   2.036
  286    HZ2  TRP  37           HZ2      TRP  37  -0.880   7.893   5.492
  287    HZ3  TRP  37           HZ3      TRP  37   1.607   9.229   2.251
  288    HH2  TRP  37           HH2      TRP  37  -0.129   9.703   3.905
  289    H    GLU  38           H        GLU  38   3.225   2.310   6.051
  290    HA   GLU  38           HA       GLU  38   3.031  -0.299   4.770
  291   1HB   GLU  38          HB2       GLU  38   5.080   0.128   6.377
  292   2HB   GLU  38          HB3       GLU  38   3.895  -0.027   7.659
  293   1HG   GLU  38          HG2       GLU  38   3.631  -2.157   5.629
  294   2HG   GLU  38          HG3       GLU  38   5.219  -2.140   6.371
  295    HE2  GLU  38           HE2      GLU  38   5.281  -2.127   8.536
  296    H    ALA  39           H        ALA  39   1.070  -1.303   5.075
  297    HA   ALA  39           HA       ALA  39  -0.444  -0.904   7.449
  298   1HB   ALA  39          HB1       ALA  39  -0.748   1.190   5.808
  299   2HB   ALA  39          HB2       ALA  39  -1.896   0.082   5.019
  300   3HB   ALA  39          HB3       ALA  39  -2.111   0.517   6.732
  301    H    ARG  40           H        ARG  40  -3.003  -1.574   6.216
  302    HA   ARG  40           HA       ARG  40  -2.329  -4.051   4.872
  303   1HB   ARG  40          HB2       ARG  40  -3.629  -3.723   7.528
  304   2HB   ARG  40          HB3       ARG  40  -4.512  -4.780   6.444
  305   1HG   ARG  40          HG2       ARG  40  -2.054  -5.793   6.004
  306   2HG   ARG  40          HG3       ARG  40  -1.742  -5.114   7.590
  307   1HD   ARG  40          HD2       ARG  40  -3.962  -7.100   6.896
  308   2HD   ARG  40          HD3       ARG  40  -2.501  -7.463   7.792
  309    HE   ARG  40           HE       ARG  40  -4.823  -5.899   8.776
  310   1HH1  ARG  40          HH22      ARG  40  -1.551  -7.110   9.395
  311   2HH1  ARG  40          HH21      ARG  40  -1.647  -6.857  11.105
  312   1HH2  ARG  40          HH11      ARG  40  -3.655  -5.947  12.047
  313    H    SER  41           H        SER  41  -5.000  -5.084   4.724
  314    HA   SER  41           HA       SER  41  -6.473  -2.886   3.526
  315   1HB   SER  41          HB2       SER  41  -5.576  -5.448   2.205
  316   2HB   SER  41          HB3       SER  41  -7.116  -4.757   1.734
  317    HG   SER  41           HG       SER  41  -4.499  -3.550   1.552
  318    H    LEU  42           H        LEU  42  -8.841  -3.618   3.044
  319    HA   LEU  42           HA       LEU  42  -9.671  -5.336   5.269
  320   1HB   LEU  42          HB2       LEU  42 -10.575  -2.797   4.217
  321   2HB   LEU  42          HB3       LEU  42 -11.883  -3.964   4.234
  322    HG   LEU  42           HG       LEU  42 -11.453  -4.387   6.645
  323   1HD1  LEU  42          HD11      LEU  42  -9.981  -2.981   7.930
  324   2HD1  LEU  42          HD12      LEU  42  -9.050  -3.750   6.621
  325   3HD1  LEU  42          HD13      LEU  42  -9.538  -2.045   6.482
  326   1HD2  LEU  42          HD21      LEU  42 -13.150  -2.757   5.855
  327   2HD2  LEU  42          HD22      LEU  42 -12.482  -2.368   7.458
  328   3HD2  LEU  42          HD23      LEU  42 -11.939  -1.462   6.025
  329    H    THR  43           H        THR  43  -8.648  -6.126   2.493
  330    HA   THR  43           HA       THR  43 -11.087  -7.515   1.598
  331    HB   THR  43           HB       THR  43  -8.552  -6.912  -0.001
  332    HG1  THR  43           HG1      THR  43  -9.432  -4.885  -0.079
  333   1HG2  THR  43          HG21      THR  43 -11.443  -7.395  -0.881
  334   2HG2  THR  43          HG22      THR  43 -10.017  -7.231  -1.935
  335   3HG2  THR  43          HG23      THR  43 -10.193  -8.662  -0.891
  336    H    THR  44           H        THR  44  -7.482  -7.959   1.637
  337    HA   THR  44           HA       THR  44  -8.028 -10.774   2.321
  338    HB   THR  44           HB       THR  44  -5.463 -10.662   1.242
  339    HG1  THR  44           HG1      THR  44  -5.485  -8.906  -0.120
  340   1HG2  THR  44          HG21      THR  44  -6.758 -11.166  -1.019
  341   2HG2  THR  44          HG22      THR  44  -6.882 -12.329   0.323
  342   3HG2  THR  44          HG23      THR  44  -8.201 -11.170   0.025
  343    H    GLY  45           H        GLY  45  -5.537  -8.157   2.677
  344   1HA   GLY  45          HA3       GLY  45  -4.917  -7.455   4.874
  345   2HA   GLY  45          HA2       GLY  45  -5.185  -9.085   5.457
  346    H    GLU  46           H        GLU  46  -3.201  -7.268   3.015
  347    HA   GLU  46           HA       GLU  46  -1.048  -9.130   3.659
  348   1HB   GLU  46          HB2       GLU  46  -0.228  -8.225   1.270
  349   2HB   GLU  46          HB3       GLU  46  -1.313  -9.593   1.417
  350   1HG   GLU  46          HG2       GLU  46  -3.268  -7.953   1.231
  351   2HG   GLU  46          HG3       GLU  46  -2.103  -6.695   0.875
  352    HE2  GLU  46           HE2      GLU  46  -1.735  -7.716  -2.406
  353    H    THR  47           H        THR  47   0.788  -8.251   4.544
  354    HA   THR  47           HA       THR  47   0.993  -5.312   4.457
  355    HB   THR  47           HB       THR  47   0.536  -6.188   6.716
  356    HG1  THR  47           HG1      THR  47   3.388  -5.693   6.219
  357   1HG2  THR  47          HG21      THR  47   2.325  -7.656   7.787
  358   2HG2  THR  47          HG22      THR  47   1.343  -8.503   6.568
  359   3HG2  THR  47          HG23      THR  47   2.982  -7.943   6.158
  360    H    GLY  48           H        GLY  48   2.605  -4.463   3.311
  361   1HA   GLY  48          HA3       GLY  48   5.142  -5.900   3.165
  362   2HA   GLY  48          HA2       GLY  48   4.292  -5.636   1.656
  363    H    TYR  49           H        TYR  49   6.483  -4.404   1.343
  364    HA   TYR  49           HA       TYR  49   6.110  -1.649   2.313
  365   1HB   TYR  49          HB2       TYR  49   8.648  -3.129   1.389
  366   2HB   TYR  49          HB3       TYR  49   8.605  -1.564   2.176
  367    HD1  TYR  49           HD1      TYR  49   9.191  -4.980   2.680
  368    HD2  TYR  49           HD2      TYR  49   7.406  -1.590   4.584
  369    HE1  TYR  49           HE1      TYR  49   9.455  -6.104   4.945
  370    HE2  TYR  49           HE2      TYR  49   7.677  -2.725   6.843
  371    HH   TYR  49           HH       TYR  49   8.807  -6.049   7.065
  372    H    ILE  50           H        ILE  50   5.601  -0.198   0.755
  373    HA   ILE  50           HA       ILE  50   6.698  -0.651  -1.912
  374    HB   ILE  50           HB       ILE  50   4.505  -0.050  -2.900
  375   1HG1  ILE  50          HG12      ILE  50   2.805  -0.885  -0.747
  376   2HG1  ILE  50          HG13      ILE  50   3.803   0.439  -0.179
  377   1HG2  ILE  50          HG21      ILE  50   5.475  -2.452  -2.397
  378   2HG2  ILE  50          HG22      ILE  50   4.061  -2.550  -1.319
  379   3HG2  ILE  50          HG23      ILE  50   3.836  -2.234  -3.056
  380   1HD1  ILE  50          HD11      ILE  50   1.712   1.269  -1.236
  381   2HD1  ILE  50          HD12      ILE  50   3.147   1.812  -2.139
  382   3HD1  ILE  50          HD13      ILE  50   2.164   0.463  -2.756
  383    HA   PRO  51           HA       PRO  51   7.021   3.684  -1.768
  384   1HB   PRO  51          HB2       PRO  51   6.853   4.444  -4.387
  385   2HB   PRO  51          HB3       PRO  51   8.280   3.697  -3.696
  386   1HG   PRO  51          HG2       PRO  51   6.246   2.509  -5.482
  387   2HG   PRO  51          HG3       PRO  51   7.864   1.938  -5.129
  388   1HD   PRO  51          HD2       PRO  51   5.408   0.885  -4.088
  389   2HD   PRO  51          HD3       PRO  51   7.030   0.392  -3.647
  390    H    SER  52           H        SER  52   6.152   5.835  -1.811
  391    HA   SER  52           HA       SER  52   3.259   5.615  -2.052
  392   1HB   SER  52          HB2       SER  52   3.181   7.579  -0.518
  393   2HB   SER  52          HB3       SER  52   4.001   6.206   0.199
  394    HG   SER  52           HG       SER  52   6.058   7.235  -0.514
  395    H    ASN  53           H        ASN  53   5.041   5.995  -4.357
  396    HA   ASN  53           HA       ASN  53   4.670   8.804  -4.949
  397   1HB   ASN  53          HB2       ASN  53   6.883   7.511  -5.389
  398   2HB   ASN  53          HB3       ASN  53   6.038   6.694  -6.689
  399   1HD2  ASN  53          HD21      ASN  53   5.667   7.692  -8.581
  400   2HD2  ASN  53          HD22      ASN  53   6.186   9.293  -8.988
  401    H    TYR  54           H        TYR  54   3.224   5.700  -5.352
  402    HA   TYR  54           HA       TYR  54   1.842   6.546  -7.805
  403   1HB   TYR  54          HB2       TYR  54   2.132   3.830  -6.375
  404   2HB   TYR  54          HB3       TYR  54   1.390   4.057  -7.946
  405    HD1  TYR  54           HD1      TYR  54   4.543   3.788  -6.113
  406    HD2  TYR  54           HD2      TYR  54   2.779   4.578  -9.931
  407    HE1  TYR  54           HE1      TYR  54   6.793   3.421  -7.237
  408    HE2  TYR  54           HE2      TYR  54   5.036   4.209 -11.042
  409    HH   TYR  54           HH       TYR  54   7.266   2.668 -10.117
  410    H    VAL  55           H        VAL  55   1.082   7.771  -5.351
  411    HA   VAL  55           HA       VAL  55  -1.212   6.270  -4.405
  412    HB   VAL  55           HB       VAL  55  -1.433   8.277  -2.898
  413   1HG1  VAL  55          HG11      VAL  55   0.113   7.440  -1.371
  414   2HG1  VAL  55          HG12      VAL  55  -0.126   6.063  -2.473
  415   3HG1  VAL  55          HG13      VAL  55   1.322   7.087  -2.628
  416   1HG2  VAL  55          HG21      VAL  55   1.127   9.346  -2.931
  417   2HG2  VAL  55          HG22      VAL  55   0.704   9.232  -4.657
  418   3HG2  VAL  55          HG23      VAL  55  -0.350  10.132  -3.539
  419    H    ALA  56           H        ALA  56  -3.335   7.593  -4.164
  420    HA   ALA  56           HA       ALA  56  -3.723   9.517  -6.287
  421   1HB   ALA  56          HB1       ALA  56  -4.107   7.602  -7.613
  422   2HB   ALA  56          HB2       ALA  56  -4.908   6.729  -6.283
  423   3HB   ALA  56          HB3       ALA  56  -5.736   8.088  -7.083
  424    HA   PRO  57           HA       PRO  57  -6.419  10.590  -2.998
  425   1HB   PRO  57          HB2       PRO  57  -6.249  13.301  -3.298
  426   2HB   PRO  57          HB3       PRO  57  -5.112  12.370  -2.344
  427   1HG   PRO  57          HG2       PRO  57  -4.741  13.568  -5.021
  428   2HG   PRO  57          HG3       PRO  57  -3.524  13.017  -3.886
  429   1HD   PRO  57          HD2       PRO  57  -4.404  11.659  -6.256
  430   2HD   PRO  57          HD3       PRO  57  -3.272  11.056  -5.060
  431    H    VAL  58           H        VAL  58  -8.292   9.622  -3.791
  432    HA   VAL  58           HA       VAL  58  -9.706  11.187  -5.784
  433    HB   VAL  58           HB       VAL  58 -11.353   9.201  -5.406
  434   1HG1  VAL  58          HG11      VAL  58  -8.632   8.905  -6.717
  435   2HG1  VAL  58          HG12      VAL  58 -10.004   7.801  -6.979
  436   3HG1  VAL  58          HG13      VAL  58 -10.131   9.510  -7.463
  437   1HG2  VAL  58          HG21      VAL  58  -9.210   8.541  -3.572
  438   2HG2  VAL  58          HG22      VAL  58 -10.783   7.744  -3.814
  439   3HG2  VAL  58          HG23      VAL  58  -9.385   7.279  -4.815
  440    H    ASP  59           H        ASP  59 -12.120  11.576  -5.389
  441    HA   ASP  59           HA       ASP  59 -12.313  12.785  -2.784
  442   1HB   ASP  59          HB2       ASP  59 -12.969  13.806  -5.142
  443   2HB   ASP  59          HB3       ASP  59 -14.450  12.892  -4.934
  444    HD2  ASP  59           HD2      ASP  59 -13.234  16.081  -3.191
  Start of MODEL   16
    1   1H    VAL   1           H        VAL   1 -14.094  10.958   4.591
    2    HA   VAL   1           HA       VAL   1 -12.245  10.959   5.803
    3    HB   VAL   1           HB       VAL   1 -11.167   8.513   5.933
    4   1HG1  VAL   1          HG11      VAL   1 -13.444   8.163   7.476
    5   2HG1  VAL   1          HG12      VAL   1 -11.958   9.009   7.971
    6   3HG1  VAL   1          HG13      VAL   1 -13.328   9.931   7.309
    7   1HG2  VAL   1          HG21      VAL   1 -13.728   8.189   4.452
    8   2HG2  VAL   1          HG22      VAL   1 -12.257   7.185   4.443
    9   3HG2  VAL   1          HG23      VAL   1 -13.422   7.046   5.783
   10    H    THR   2           H        THR   2  -9.837   9.227   5.414
   11    HA   THR   2           HA       THR   2  -8.855  10.535   2.964
   12    HB   THR   2           HB       THR   2  -6.628  10.400   4.185
   13    HG1  THR   2           HG1      THR   2  -8.463   9.676   6.356
   14   1HG2  THR   2          HG21      THR   2  -7.602  11.819   6.307
   15   2HG2  THR   2          HG22      THR   2  -7.417  12.532   4.687
   16   3HG2  THR   2          HG23      THR   2  -9.004  11.924   5.216
   17    H    LEU   3           H        LEU   3 -10.064   8.523   2.030
   18    HA   LEU   3           HA       LEU   3  -8.429   6.135   2.276
   19   1HB   LEU   3          HB2       LEU   3 -10.179   5.020   1.110
   20   2HB   LEU   3          HB3       LEU   3 -10.873   5.980   2.401
   21    HG   LEU   3           HG       LEU   3 -10.795   7.420  -0.150
   22   1HD1  LEU   3          HD11      LEU   3 -11.076   5.260  -1.159
   23   2HD1  LEU   3          HD12      LEU   3 -12.344   4.822   0.011
   24   3HD1  LEU   3          HD13      LEU   3 -12.642   6.106  -1.185
   25   1HD2  LEU   3          HD21      LEU   3 -12.310   7.360   2.238
   26   2HD2  LEU   3          HD22      LEU   3 -12.461   8.477   0.860
   27   3HD2  LEU   3          HD23      LEU   3 -13.427   6.982   0.904
   28    H    PHE   4           H        PHE   4  -7.405   5.119   0.452
   29    HA   PHE   4           HA       PHE   4  -7.091   6.887  -1.859
   30   1HB   PHE   4          HB2       PHE   4  -5.110   5.748   0.116
   31   2HB   PHE   4          HB3       PHE   4  -4.619   5.667  -1.565
   32    HD1  PHE   4           HD1      PHE   4  -5.365   8.087  -2.794
   33    HD2  PHE   4           HD2      PHE   4  -4.118   7.500   1.218
   34    HE1  PHE   4           HE1      PHE   4  -4.598  10.474  -2.684
   35    HE2  PHE   4           HE2      PHE   4  -3.350   9.887   1.329
   36    HZ   PHE   4           HZ       PHE   4  -3.599  11.345  -0.624
   37    H    VAL   5           H        VAL   5  -6.532   5.794  -3.853
   38    HA   VAL   5           HA       VAL   5  -7.116   2.917  -3.719
   39    HB   VAL   5           HB       VAL   5  -8.766   4.501  -4.831
   40   1HG1  VAL   5          HG11      VAL   5  -7.381   4.494  -7.381
   41   2HG1  VAL   5          HG12      VAL   5  -8.149   5.841  -6.507
   42   3HG1  VAL   5          HG13      VAL   5  -6.461   5.399  -6.156
   43   1HG2  VAL   5          HG21      VAL   5  -9.123   2.253  -5.295
   44   2HG2  VAL   5          HG22      VAL   5  -8.894   2.939  -6.921
   45   3HG2  VAL   5          HG23      VAL   5  -7.562   2.066  -6.127
   46    H    ALA   6           H        ALA   6  -6.084   1.658  -5.598
   47    HA   ALA   6           HA       ALA   6  -3.339   2.653  -5.903
   48   1HB   ALA   6          HB1       ALA   6  -4.490  -0.166  -5.932
   49   2HB   ALA   6          HB2       ALA   6  -2.779   0.243  -6.207
   50   3HB   ALA   6          HB3       ALA   6  -3.531   0.576  -4.629
   51    H    LEU   7           H        LEU   7  -2.500   2.985  -7.937
   52    HA   LEU   7           HA       LEU   7  -4.315   2.340 -10.154
   53   1HB   LEU   7          HB2       LEU   7  -3.610   4.796  -9.402
   54   2HB   LEU   7          HB3       LEU   7  -2.214   4.434 -10.399
   55    HG   LEU   7           HG       LEU   7  -4.238   3.674 -12.068
   56   1HD1  LEU   7          HD11      LEU   7  -5.702   5.914 -11.844
   57   2HD1  LEU   7          HD12      LEU   7  -6.160   4.364 -11.098
   58   3HD1  LEU   7          HD13      LEU   7  -5.356   5.617 -10.123
   59   1HD2  LEU   7          HD21      LEU   7  -2.950   6.402 -11.787
   60   2HD2  LEU   7          HD22      LEU   7  -2.353   5.016 -12.733
   61   3HD2  LEU   7          HD23      LEU   7  -3.854   5.843 -13.216
   62    H    TYR   8           H        TYR   8  -0.813   2.754  -9.282
   63    HA   TYR   8           HA       TYR   8  -0.166   0.879 -11.430
   64   1HB   TYR   8          HB2       TYR   8   0.922   3.281 -10.225
   65   2HB   TYR   8          HB3       TYR   8   2.041   1.991  -9.832
   66    HD1  TYR   8           HD1      TYR   8   2.915   0.534 -11.795
   67    HD2  TYR   8           HD2      TYR   8   1.003   4.324 -12.330
   68    HE1  TYR   8           HE1      TYR   8   3.953   0.739 -14.107
   69    HE2  TYR   8           HE2      TYR   8   2.048   4.517 -14.640
   70    HH   TYR   8           HH       TYR   8   4.537   3.071 -15.616
   71    H    ASP   9           H        ASP   9   0.178  -1.232 -10.970
   72    HA   ASP   9           HA       ASP   9   0.390  -1.975  -8.218
   73   1HB   ASP   9          HB2       ASP   9   0.588  -4.337  -9.396
   74   2HB   ASP   9          HB3       ASP   9  -0.952  -3.501  -9.366
   75    HD2  ASP   9           HD2      ASP   9  -1.070  -4.133 -12.735
   76    H    TYR  10           H        TYR  10   2.126  -3.838  -7.749
   77    HA   TYR  10           HA       TYR  10   4.556  -3.519  -9.305
   78   1HB   TYR  10          HB2       TYR  10   4.001  -1.952  -7.031
   79   2HB   TYR  10          HB3       TYR  10   4.832  -3.321  -6.319
   80    HD1  TYR  10           HD1      TYR  10   7.153  -3.258  -6.162
   81    HD2  TYR  10           HD2      TYR  10   5.217  -0.887  -9.151
   82    HE1  TYR  10           HE1      TYR  10   9.386  -2.224  -6.798
   83    HE2  TYR  10           HE2      TYR  10   7.458   0.140  -9.777
   84    HH   TYR  10           HH       TYR  10   9.635  -0.020  -9.546
   85    H    GLU  11           H        GLU  11   5.946  -5.308  -9.152
   86    HA   GLU  11           HA       GLU  11   4.915  -7.434  -7.439
   87   1HB   GLU  11          HB2       GLU  11   4.721  -7.616 -10.059
   88   2HB   GLU  11          HB3       GLU  11   6.437  -7.969 -10.002
   89   1HG   GLU  11          HG2       GLU  11   5.986  -9.835  -8.382
   90   2HG   GLU  11          HG3       GLU  11   4.270  -9.493  -8.478
   91    HE2  GLU  11           HE2      GLU  11   3.974 -11.526 -11.216
   92    H    ALA  12           H        ALA  12   6.497  -8.850  -6.436
   93    HA   ALA  12           HA       ALA  12   9.284  -8.254  -6.801
   94   1HB   ALA  12          HB1       ALA  12   9.516  -6.788  -5.117
   95   2HB   ALA  12          HB2       ALA  12   7.765  -6.858  -4.799
   96   3HB   ALA  12          HB3       ALA  12   8.865  -7.998  -3.984
   97    H    ARG  13           H        ARG  13  10.650  -9.813  -5.582
   98    HA   ARG  13           HA       ARG  13   9.063 -12.144  -4.854
   99   1HB   ARG  13          HB2       ARG  13  11.791 -12.034  -6.236
  100   2HB   ARG  13          HB3       ARG  13  11.041 -13.515  -5.675
  101   1HG   ARG  13          HG2       ARG  13   9.761 -13.641  -7.543
  102   2HG   ARG  13          HG3       ARG  13   9.108 -12.040  -7.258
  103   1HD   ARG  13          HD2       ARG  13  11.052 -11.001  -8.385
  104   2HD   ARG  13          HD3       ARG  13  11.816 -12.566  -8.577
  105    HE   ARG  13           HE       ARG  13   9.138 -12.040  -9.810
  106   1HH1  ARG  13          HH22      ARG  13  12.544 -12.954 -10.147
  107   2HH1  ARG  13          HH21      ARG  13  12.385 -13.417 -11.808
  108   1HH2  ARG  13          HH11      ARG  13  10.248 -13.231 -12.879
  109    H    THR  14           H        THR  14   9.920 -10.000  -3.058
  110    HA   THR  14           HA       THR  14  12.100 -11.294  -1.569
  111    HB   THR  14           HB       THR  14  11.013  -8.531  -0.982
  112    HG1  THR  14           HG1      THR  14  12.048  -9.591  -3.379
  113   1HG2  THR  14          HG21      THR  14  13.236  -8.074  -0.312
  114   2HG2  THR  14          HG22      THR  14  13.071  -9.782   0.158
  115   3HG2  THR  14          HG23      THR  14  13.911  -9.351  -1.351
  116    H    GLU  15           H        GLU  15  11.866 -10.956   0.917
  117    HA   GLU  15           HA       GLU  15   9.263 -12.061   1.530
  118   1HB   GLU  15          HB2       GLU  15  11.521 -11.879   3.527
  119   2HB   GLU  15          HB3       GLU  15  10.264 -13.092   3.394
  120   1HG   GLU  15          HG2       GLU  15  11.884 -14.355   2.388
  121   2HG   GLU  15          HG3       GLU  15  11.506 -13.410   0.961
  122    HE2  GLU  15           HE2      GLU  15  14.874 -12.565   2.988
  123    H    ASP  16           H        ASP  16  10.476  -9.042   1.263
  124    HA   ASP  16           HA       ASP  16   9.380  -8.120   3.787
  125   1HB   ASP  16          HB2       ASP  16  11.129  -6.831   1.654
  126   2HB   ASP  16          HB3       ASP  16  10.358  -5.868   2.898
  127    HD2  ASP  16           HD2      ASP  16  12.124  -7.945   5.310
  128    H    ASP  17           H        ASP  17   9.612  -6.624   0.478
  129    HA   ASP  17           HA       ASP  17   7.153  -5.367   0.711
  130   1HB   ASP  17          HB2       ASP  17   8.696  -6.124  -1.816
  131   2HB   ASP  17          HB3       ASP  17   7.423  -4.923  -1.736
  132    HD2  ASP  17           HD2      ASP  17   8.990  -3.253  -2.396
  133    H    LEU  18           H        LEU  18   5.073  -5.922  -0.219
  134    HA   LEU  18           HA       LEU  18   4.884  -8.723  -1.082
  135   1HB   LEU  18          HB2       LEU  18   3.560  -7.283   0.972
  136   2HB   LEU  18          HB3       LEU  18   2.371  -7.616  -0.272
  137    HG   LEU  18           HG       LEU  18   3.021 -10.038  -0.170
  138   1HD1  LEU  18          HD11      LEU  18   5.286  -9.698   0.770
  139   2HD1  LEU  18          HD12      LEU  18   4.547  -9.222   2.318
  140   3HD1  LEU  18          HD13      LEU  18   4.317 -10.872   1.691
  141   1HD2  LEU  18          HD21      LEU  18   2.194  -9.786   2.555
  142   2HD2  LEU  18          HD22      LEU  18   1.411  -8.506   1.597
  143   3HD2  LEU  18          HD23      LEU  18   1.229 -10.211   1.121
  144    H    SER  19           H        SER  19   3.264  -9.204  -2.764
  145    HA   SER  19           HA       SER  19   3.304  -7.079  -4.703
  146   1HB   SER  19          HB2       SER  19   3.981  -9.168  -5.609
  147   2HB   SER  19          HB3       SER  19   2.704 -10.047  -4.791
  148    HG   SER  19           HG       SER  19   2.313  -8.136  -6.936
  149    H    PHE  20           H        PHE  20   1.502  -5.891  -5.317
  150    HA   PHE  20           HA       PHE  20  -1.072  -6.820  -4.255
  151   1HB   PHE  20          HB2       PHE  20   0.394  -4.154  -4.250
  152   2HB   PHE  20          HB3       PHE  20  -1.354  -4.111  -4.357
  153    HD1  PHE  20           HD1      PHE  20   1.212  -3.807  -2.134
  154    HD2  PHE  20           HD2      PHE  20  -2.446  -5.916  -2.565
  155    HE1  PHE  20           HE1      PHE  20   1.053  -4.042   0.360
  156    HE2  PHE  20           HE2      PHE  20  -2.605  -6.151  -0.071
  157    HZ   PHE  20           HZ       PHE  20  -0.853  -5.212   1.362
  158    H    HIS  21           H        HIS  21  -2.969  -5.638  -5.428
  159    HA   HIS  21           HA       HIS  21  -2.247  -5.233  -8.233
  160   1HB   HIS  21          HB2       HIS  21  -4.416  -7.017  -7.115
  161   2HB   HIS  21          HB3       HIS  21  -4.451  -6.420  -8.763
  162    HD1  HIS  21           HD1      HIS  21  -2.504  -8.734  -6.488
  163    HD2  HIS  21           HD2      HIS  21  -2.676  -7.669 -10.541
  164    HE1  HIS  21           HE1      HIS  21  -1.072 -10.438  -7.736
  165    H    LYS  22           H        LYS  22  -4.334  -4.271  -9.421
  166    HA   LYS  22           HA       LYS  22  -4.946  -1.893  -7.942
  167   1HB   LYS  22          HB2       LYS  22  -6.064  -1.218 -10.056
  168   2HB   LYS  22          HB3       LYS  22  -4.386  -1.675 -10.264
  169   1HG   LYS  22          HG2       LYS  22  -5.708  -4.109 -10.610
  170   2HG   LYS  22          HG3       LYS  22  -6.835  -2.969 -11.319
  171   1HD   LYS  22          HD2       LYS  22  -3.866  -2.972 -12.014
  172   2HD   LYS  22          HD3       LYS  22  -5.036  -3.934 -12.895
  173   1HE   LYS  22          HE2       LYS  22  -5.203  -0.902 -12.541
  174   2HE   LYS  22          HE3       LYS  22  -4.583  -1.702 -13.971
  175   1HZ   LYS  22          HZ1       LYS  22  -6.675  -2.080 -14.673
  176   2HZ   LYS  22          HZ2       LYS  22  -7.155  -2.718 -13.254
  177    H    GLY  23           H        GLY  23  -7.205  -1.077  -7.694
  178   1HA   GLY  23          HA3       GLY  23  -9.391  -1.320  -7.162
  179   2HA   GLY  23          HA2       GLY  23  -9.373  -2.944  -7.818
  180    H    GLU  24           H        GLU  24  -7.263  -1.547  -5.230
  181    HA   GLU  24           HA       GLU  24  -8.529  -3.442  -3.409
  182   1HB   GLU  24          HB2       GLU  24  -5.970  -3.716  -4.343
  183   2HB   GLU  24          HB3       GLU  24  -5.669  -2.735  -2.923
  184   1HG   GLU  24          HG2       GLU  24  -6.105  -4.464  -1.505
  185   2HG   GLU  24          HG3       GLU  24  -7.589  -4.880  -2.339
  186    HE2  GLU  24           HE2      GLU  24  -4.503  -5.633  -1.812
  187    H    LYS  25           H        LYS  25  -8.798  -2.740  -1.216
  188    HA   LYS  25           HA       LYS  25  -8.878   0.131  -0.978
  189   1HB   LYS  25          HB2       LYS  25  -9.953  -2.199   0.582
  190   2HB   LYS  25          HB3       LYS  25  -9.836  -0.631   1.355
  191   1HG   LYS  25          HG2       LYS  25 -11.018   0.266  -0.831
  192   2HG   LYS  25          HG3       LYS  25 -11.460  -1.410  -1.087
  193   1HD   LYS  25          HD2       LYS  25 -13.265  -0.910   0.229
  194   2HD   LYS  25          HD3       LYS  25 -12.147  -1.129   1.560
  195   1HE   LYS  25          HE2       LYS  25 -11.674   1.522   0.744
  196   2HE   LYS  25          HE3       LYS  25 -13.410   1.346   0.572
  197   1HZ   LYS  25          HZ1       LYS  25 -13.105   0.224   2.947
  198   2HZ   LYS  25          HZ2       LYS  25 -11.803   1.201   3.006
  199    H    PHE  26           H        PHE  26  -7.300   1.364  -0.113
  200    HA   PHE  26           HA       PHE  26  -5.383  -0.010   1.635
  201   1HB   PHE  26          HB2       PHE  26  -5.153   1.941  -0.688
  202   2HB   PHE  26          HB3       PHE  26  -3.957   2.064   0.586
  203    HD1  PHE  26           HD1      PHE  26  -5.370  -0.227  -1.950
  204    HD2  PHE  26           HD2      PHE  26  -2.168   0.522   0.732
  205    HE1  PHE  26           HE1      PHE  26  -4.050  -2.079  -3.010
  206    HE2  PHE  26           HE2      PHE  26  -0.847  -1.330  -0.329
  207    HZ   PHE  26           HZ       PHE  26  -1.804  -2.609  -2.186
  208    H    GLN  27           H        GLN  27  -4.779   1.042   3.538
  209    HA   GLN  27           HA       GLN  27  -6.142   3.587   3.966
  210   1HB   GLN  27          HB2       GLN  27  -6.216   1.107   5.479
  211   2HB   GLN  27          HB3       GLN  27  -5.555   2.381   6.485
  212   1HG   GLN  27          HG2       GLN  27  -7.810   3.439   4.991
  213   2HG   GLN  27          HG3       GLN  27  -8.297   1.949   5.773
  214   1HE2  GLN  27          HE21      GLN  27  -7.050   5.178   6.210
  215   2HE2  GLN  27          HE22      GLN  27  -7.374   5.345   7.904
  216    H    ILE  28           H        ILE  28  -5.017   4.750   6.027
  217    HA   ILE  28           HA       ILE  28  -2.130   4.631   5.493
  218    HB   ILE  28           HB       ILE  28  -2.068   7.011   6.017
  219   1HG1  ILE  28          HG12      ILE  28  -4.826   7.713   5.753
  220   2HG1  ILE  28          HG13      ILE  28  -4.695   6.533   7.043
  221   1HG2  ILE  28          HG21      ILE  28  -2.974   5.807   3.681
  222   2HG2  ILE  28          HG22      ILE  28  -4.108   7.152   3.949
  223   3HG2  ILE  28          HG23      ILE  28  -2.358   7.467   3.859
  224   1HD1  ILE  28          HD11      ILE  28  -2.482   8.283   7.400
  225   2HD1  ILE  28          HD12      ILE  28  -3.878   9.324   7.033
  226   3HD1  ILE  28          HD13      ILE  28  -3.952   8.186   8.399
  227    H    LEU  29           H        LEU  29  -0.699   4.959   7.317
  228    HA   LEU  29           HA       LEU  29  -2.003   4.729   9.919
  229   1HB   LEU  29          HB2       LEU  29  -0.615   2.619   8.535
  230   2HB   LEU  29          HB3       LEU  29   0.257   3.050   9.992
  231    HG   LEU  29           HG       LEU  29  -2.655   2.222   9.837
  232   1HD1  LEU  29          HD11      LEU  29  -1.822   0.158   9.796
  233   2HD1  LEU  29          HD12      LEU  29  -0.168   0.729  10.125
  234   3HD1  LEU  29          HD13      LEU  29  -1.296   0.444  11.472
  235   1HD2  LEU  29          HD21      LEU  29  -1.884   3.945  11.644
  236   2HD2  LEU  29          HD22      LEU  29  -2.892   2.552  12.105
  237   3HD2  LEU  29          HD23      LEU  29  -1.138   2.520  12.408
  238    H    ASN  30           H        ASN  30   1.448   4.159   9.343
  239    HA   ASN  30           HA       ASN  30   1.916   6.746  10.583
  240   1HB   ASN  30          HB2       ASN  30   2.846   4.254  11.316
  241   2HB   ASN  30          HB3       ASN  30   4.163   4.780  10.287
  242   1HD2  ASN  30          HD21      ASN  30   5.528   4.847  12.085
  243   2HD2  ASN  30          HD22      ASN  30   5.501   6.149  13.228
  244    H    SER  31           H        SER  31   3.015   8.326   9.373
  245    HA   SER  31           HA       SER  31   4.385   7.382   6.984
  246   1HB   SER  31          HB2       SER  31   2.923  10.030   6.998
  247   2HB   SER  31          HB3       SER  31   3.418   9.059   5.625
  248    HG   SER  31           HG       SER  31   1.170   8.729   7.364
  249    H    SER  32           H        SER  32   6.092   7.568   8.886
  250    HA   SER  32           HA       SER  32   7.270  10.192   8.575
  251   1HB   SER  32          HB2       SER  32   7.975   9.721  11.159
  252   2HB   SER  32          HB3       SER  32   6.588  10.689  10.702
  253    HG   SER  32           HG       SER  32   6.678   8.226  11.981
  254    H    GLU  33           H        GLU  33   8.075   8.093   7.058
  255    HA   GLU  33           HA       GLU  33  10.585   7.389   8.329
  256   1HB   GLU  33          HB2       GLU  33   8.657   5.504   8.226
  257   2HB   GLU  33          HB3       GLU  33   9.286   5.299   6.603
  258   1HG   GLU  33          HG2       GLU  33  11.284   5.475   8.853
  259   2HG   GLU  33          HG3       GLU  33  10.340   4.003   8.725
  260    HE2  GLU  33           HE2      GLU  33  13.152   5.169   7.792
  261    H    GLY  34           H        GLY  34   8.993   6.452   5.206
  262   1HA   GLY  34          HA3       GLY  34  10.804   8.244   3.758
  263   2HA   GLY  34          HA2       GLY  34  10.924   6.525   3.446
  264    H    ASP  35           H        ASP  35  10.100   6.408   1.354
  265    HA   ASP  35           HA       ASP  35   7.625   7.768   0.820
  266   1HB   ASP  35          HB2       ASP  35   9.652   6.222  -0.821
  267   2HB   ASP  35          HB3       ASP  35   8.058   6.517  -1.487
  268    HD2  ASP  35           HD2      ASP  35   9.026   7.660  -3.025
  269    H    TRP  36           H        TRP  36   8.907   4.613   1.696
  270    HA   TRP  36           HA       TRP  36   6.436   3.282   0.862
  271   1HB   TRP  36          HB2       TRP  36   8.405   1.536   2.027
  272   2HB   TRP  36          HB3       TRP  36   7.666   1.497   0.439
  273    HD1  TRP  36           HD1      TRP  36   8.993   3.000  -1.524
  274    HE1  TRP  36           HE1      TRP  36  11.539   3.594  -1.884
  275    HE3  TRP  36           HE3      TRP  36  10.439   2.016   3.251
  276    HZ2  TRP  36           HZ2      TRP  36  13.820   3.587  -0.170
  277    HZ3  TRP  36           HZ3      TRP  36  12.844   2.336   3.824
  278    HH2  TRP  36           HH2      TRP  36  14.511   3.091   2.205
  279    H    TRP  37           H        TRP  37   4.864   3.019   2.388
  280    HA   TRP  37           HA       TRP  37   5.738   2.947   5.195
  281   1HB   TRP  37          HB2       TRP  37   3.158   3.967   5.212
  282   2HB   TRP  37          HB3       TRP  37   4.644   4.825   5.565
  283    HD1  TRP  37           HD1      TRP  37   5.728   6.261   3.418
  284    HE1  TRP  37           HE1      TRP  37   4.623   7.471   1.351
  285    HE3  TRP  37           HE3      TRP  37   1.295   3.782   3.668
  286    HZ2  TRP  37           HZ2      TRP  37   2.077   7.260   0.079
  287    HZ3  TRP  37           HZ3      TRP  37  -0.446   4.343   1.975
  288    HH2  TRP  37           HH2      TRP  37  -0.112   6.016   0.225
  289    H    GLU  38           H        GLU  38   3.012   2.453   6.132
  290    HA   GLU  38           HA       GLU  38   2.915  -0.316   5.445
  291   1HB   GLU  38          HB2       GLU  38   1.255   1.366   7.371
  292   2HB   GLU  38          HB3       GLU  38   1.099  -0.370   7.206
  293   1HG   GLU  38          HG2       GLU  38   2.787  -0.618   8.698
  294   2HG   GLU  38          HG3       GLU  38   3.882   0.076   7.519
  295    HE2  GLU  38           HE2      GLU  38   2.905   3.348   8.794
  296    H    ALA  39           H        ALA  39   0.668  -1.359   5.030
  297    HA   ALA  39           HA       ALA  39  -1.304   0.291   3.804
  298   1HB   ALA  39          HB1       ALA  39  -0.867  -1.218   1.592
  299   2HB   ALA  39          HB2       ALA  39  -0.190   0.413   1.811
  300   3HB   ALA  39          HB3       ALA  39   0.808  -1.019   2.159
  301    H    ARG  40           H        ARG  40  -2.936  -0.689   4.938
  302    HA   ARG  40           HA       ARG  40  -2.872  -3.566   5.101
  303   1HB   ARG  40          HB2       ARG  40  -3.454  -1.827   7.035
  304   2HB   ARG  40          HB3       ARG  40  -5.048  -1.829   6.309
  305   1HG   ARG  40          HG2       ARG  40  -5.427  -4.108   6.802
  306   2HG   ARG  40          HG3       ARG  40  -3.717  -4.481   6.898
  307   1HD   ARG  40          HD2       ARG  40  -3.689  -4.072   9.134
  308   2HD   ARG  40          HD3       ARG  40  -4.364  -2.472   8.902
  309    HE   ARG  40           HE       ARG  40  -6.154  -4.873   8.879
  310   1HH1  ARG  40          HH22      ARG  40  -5.247  -1.737  10.256
  311   2HH1  ARG  40          HH21      ARG  40  -6.666  -1.618  11.241
  312   1HH2  ARG  40          HH11      ARG  40  -8.289  -3.381  11.179
  313    H    SER  41           H        SER  41  -4.697  -4.893   4.388
  314    HA   SER  41           HA       SER  41  -6.522  -3.473   2.619
  315   1HB   SER  41          HB2       SER  41  -4.507  -4.879   1.561
  316   2HB   SER  41          HB3       SER  41  -5.564  -6.239   1.889
  317    HG   SER  41           HG       SER  41  -5.667  -4.614  -0.214
  318    H    LEU  42           H        LEU  42  -8.618  -4.603   2.298
  319    HA   LEU  42           HA       LEU  42  -9.273  -6.174   4.662
  320   1HB   LEU  42          HB2       LEU  42 -11.039  -4.829   2.613
  321   2HB   LEU  42          HB3       LEU  42 -11.598  -5.678   4.040
  322    HG   LEU  42           HG       LEU  42  -9.678  -3.662   4.808
  323   1HD1  LEU  42          HD11      LEU  42 -10.486  -1.692   3.953
  324   2HD1  LEU  42          HD12      LEU  42 -10.668  -2.765   2.545
  325   3HD1  LEU  42          HD13      LEU  42 -12.079  -2.381   3.560
  326   1HD2  LEU  42          HD21      LEU  42 -11.123  -3.337   6.512
  327   2HD2  LEU  42          HD22      LEU  42 -12.553  -3.335   5.451
  328   3HD2  LEU  42          HD23      LEU  42 -11.804  -4.876   5.933
  329    H    THR  43           H        THR  43  -7.902  -6.911   1.846
  330    HA   THR  43           HA       THR  43  -9.740  -9.045   1.082
  331    HB   THR  43           HB       THR  43  -7.235  -7.767  -0.096
  332    HG1  THR  43           HG1      THR  43  -8.896  -7.362  -1.737
  333   1HG2  THR  43          HG21      THR  43  -8.814 -10.018  -1.405
  334   2HG2  THR  43          HG22      THR  43  -7.233  -9.355  -1.882
  335   3HG2  THR  43          HG23      THR  43  -7.369 -10.375  -0.429
  336    H    THR  44           H        THR  44  -6.139  -9.000   1.396
  337    HA   THR  44           HA       THR  44  -6.268 -11.710   2.397
  338    HB   THR  44           HB       THR  44  -3.858 -11.638   2.026
  339    HG1  THR  44           HG1      THR  44  -2.849  -9.574   1.929
  340   1HG2  THR  44          HG21      THR  44  -4.683  -9.654  -0.090
  341   2HG2  THR  44          HG22      THR  44  -3.769 -11.171  -0.263
  342   3HG2  THR  44          HG23      THR  44  -5.537 -11.216  -0.061
  343    H    GLY  45           H        GLY  45  -5.189  -8.473   3.596
  344   1HA   GLY  45          HA3       GLY  45  -5.597  -7.782   5.795
  345   2HA   GLY  45          HA2       GLY  45  -5.692  -9.452   6.319
  346    H    GLU  46           H        GLU  46  -3.121  -8.556   4.069
  347    HA   GLU  46           HA       GLU  46  -1.264  -8.728   6.313
  348   1HB   GLU  46          HB2       GLU  46  -1.432 -10.389   4.084
  349   2HB   GLU  46          HB3       GLU  46  -0.162  -9.273   3.623
  350   1HG   GLU  46          HG2       GLU  46   1.311 -10.253   5.044
  351   2HG   GLU  46          HG3       GLU  46   0.218 -10.053   6.400
  352    HE2  GLU  46           HE2      GLU  46   0.515 -13.508   4.465
  353    H    THR  47           H        THR  47   0.178  -7.048   6.624
  354    HA   THR  47           HA       THR  47  -0.108  -4.779   4.820
  355    HB   THR  47           HB       THR  47   1.236  -3.695   6.749
  356    HG1  THR  47           HG1      THR  47   0.970  -5.288   8.682
  357   1HG2  THR  47          HG21      THR  47  -0.821  -4.631   8.435
  358   2HG2  THR  47          HG22      THR  47  -0.898  -3.180   7.407
  359   3HG2  THR  47          HG23      THR  47  -1.524  -4.733   6.803
  360    H    GLY  48           H        GLY  48   1.555  -3.802   3.671
  361   1HA   GLY  48          HA3       GLY  48   4.101  -5.300   3.614
  362   2HA   GLY  48          HA2       GLY  48   3.236  -4.913   2.140
  363    H    TYR  49           H        TYR  49   5.854  -3.992   2.499
  364    HA   TYR  49           HA       TYR  49   5.459  -1.144   3.121
  365   1HB   TYR  49          HB2       TYR  49   7.290  -3.106   4.027
  366   2HB   TYR  49          HB3       TYR  49   8.195  -2.310   2.755
  367    HD1  TYR  49           HD1      TYR  49   6.282  -1.620   5.890
  368    HD2  TYR  49           HD2      TYR  49   9.289  -0.266   3.164
  369    HE1  TYR  49           HE1      TYR  49   6.902   0.253   7.493
  370    HE2  TYR  49           HE2      TYR  49   9.898   1.604   4.777
  371    HH   TYR  49           HH       TYR  49   9.240   1.623   7.841
  372    H    ILE  50           H        ILE  50   4.787  -0.328   1.125
  373    HA   ILE  50           HA       ILE  50   6.854  -0.369  -0.916
  374    HB   ILE  50           HB       ILE  50   4.886  -0.685  -2.600
  375   1HG1  ILE  50          HG12      ILE  50   3.618  -2.714  -1.072
  376   2HG1  ILE  50          HG13      ILE  50   3.583  -1.258  -0.096
  377   1HG2  ILE  50          HG21      ILE  50   5.307  -3.342  -1.978
  378   2HG2  ILE  50          HG22      ILE  50   6.345  -2.323  -3.004
  379   3HG2  ILE  50          HG23      ILE  50   6.729  -2.530  -1.278
  380   1HD1  ILE  50          HD11      ILE  50   2.703   0.003  -2.121
  381   2HD1  ILE  50          HD12      ILE  50   2.579  -1.562  -2.960
  382   3HD1  ILE  50          HD13      ILE  50   1.605  -1.255  -1.502
  383    HA   PRO  51           HA       PRO  51   5.720   3.787  -1.110
  384   1HB   PRO  51          HB2       PRO  51   6.641   4.483  -3.587
  385   2HB   PRO  51          HB3       PRO  51   7.676   4.366  -2.177
  386   1HG   PRO  51          HG2       PRO  51   7.430   2.499  -4.456
  387   2HG   PRO  51          HG3       PRO  51   8.722   2.632  -3.280
  388   1HD   PRO  51          HD2       PRO  51   6.661   0.638  -3.349
  389   2HD   PRO  51          HD3       PRO  51   7.884   0.839  -2.109
  390    H    SER  52           H        SER  52   3.825   4.807  -1.249
  391    HA   SER  52           HA       SER  52   2.361   4.248  -3.692
  392   1HB   SER  52          HB2       SER  52   1.565   3.551  -0.915
  393   2HB   SER  52          HB3       SER  52   0.329   4.401  -1.820
  394    HG   SER  52           HG       SER  52   0.505   1.919  -1.962
  395    H    ASN  53           H        ASN  53   3.897   6.539  -3.247
  396    HA   ASN  53           HA       ASN  53   2.127   8.522  -2.151
  397   1HB   ASN  53          HB2       ASN  53   4.712   8.455  -1.849
  398   2HB   ASN  53          HB3       ASN  53   4.824   8.977  -3.518
  399   1HD2  ASN  53          HD21      ASN  53   3.060   9.760  -0.523
  400   2HD2  ASN  53          HD22      ASN  53   3.156  11.484  -0.655
  401    H    TYR  54           H        TYR  54   2.399   6.861  -5.031
  402    HA   TYR  54           HA       TYR  54   1.799   9.216  -6.685
  403   1HB   TYR  54          HB2       TYR  54   2.560   6.319  -7.406
  404   2HB   TYR  54          HB3       TYR  54   2.508   7.665  -8.527
  405    HD1  TYR  54           HD1      TYR  54   4.424   6.047  -5.844
  406    HD2  TYR  54           HD2      TYR  54   4.290   9.350  -8.559
  407    HE1  TYR  54           HE1      TYR  54   6.882   6.520  -5.401
  408    HE2  TYR  54           HE2      TYR  54   6.749   9.813  -8.106
  409    HH   TYR  54           HH       TYR  54   8.527   9.207  -7.052
  410    H    VAL  55           H        VAL  55  -0.159   8.035  -4.847
  411    HA   VAL  55           HA       VAL  55  -1.913   6.614  -6.709
  412    HB   VAL  55           HB       VAL  55  -3.238   6.211  -4.600
  413   1HG1  VAL  55          HG11      VAL  55  -1.125   4.842  -5.700
  414   2HG1  VAL  55          HG12      VAL  55  -0.624   4.994  -3.999
  415   3HG1  VAL  55          HG13      VAL  55  -2.181   4.233  -4.403
  416   1HG2  VAL  55          HG21      VAL  55  -2.312   6.628  -2.466
  417   2HG2  VAL  55          HG22      VAL  55  -0.718   7.042  -3.145
  418   3HG2  VAL  55          HG23      VAL  55  -2.097   8.146  -3.371
  419    H    ALA  56           H        ALA  56  -4.368   7.235  -6.294
  420    HA   ALA  56           HA       ALA  56  -4.498  10.171  -6.198
  421   1HB   ALA  56          HB1       ALA  56  -5.277   8.249  -8.283
  422   2HB   ALA  56          HB2       ALA  56  -6.604   9.337  -7.809
  423   3HB   ALA  56          HB3       ALA  56  -5.060  10.013  -8.381
  424    HA   PRO  57           HA       PRO  57  -7.827   9.443  -3.494
  425   1HB   PRO  57          HB2       PRO  57  -9.199  11.801  -3.643
  426   2HB   PRO  57          HB3       PRO  57  -7.707  11.616  -2.743
  427   1HG   PRO  57          HG2       PRO  57  -8.147  12.940  -5.350
  428   2HG   PRO  57          HG3       PRO  57  -6.793  13.105  -4.249
  429   1HD   PRO  57          HD2       PRO  57  -6.848  11.598  -6.689
  430   2HD   PRO  57          HD3       PRO  57  -5.534  11.671  -5.530
  431    H    VAL  58           H        VAL  58  -9.948   8.742  -3.129
  432    HA   VAL  58           HA       VAL  58 -11.283   8.247  -5.674
  433    HB   VAL  58           HB       VAL  58 -12.318   7.087  -3.161
  434   1HG1  VAL  58          HG11      VAL  58 -11.474   5.566  -5.615
  435   2HG1  VAL  58          HG12      VAL  58 -12.827   5.264  -4.498
  436   3HG1  VAL  58          HG13      VAL  58 -12.920   6.603  -5.668
  437   1HG2  VAL  58          HG21      VAL  58 -10.399   5.297  -3.411
  438   2HG2  VAL  58          HG22      VAL  58  -9.488   6.674  -4.076
  439   3HG2  VAL  58          HG23      VAL  58 -10.153   6.760  -2.428
  440    H    ASP  59           H        ASP  59 -12.256   9.103  -2.271
  441    HA   ASP  59           HA       ASP  59 -14.165  10.930  -3.500
  442   1HB   ASP  59          HB2       ASP  59 -14.739   8.636  -1.952
  443   2HB   ASP  59          HB3       ASP  59 -14.925   9.965  -0.826
  444    HD2  ASP  59           HD2      ASP  59 -17.970   9.413  -1.691
  Start of MODEL   17
    1   1H    VAL   1           H        VAL   1 -13.273   9.910   2.842
    2    HA   VAL   1           HA       VAL   1 -11.548  11.256   2.047
    3    HB   VAL   1           HB       VAL   1 -11.172  12.504   4.741
    4   1HG1  VAL   1          HG11      VAL   1  -9.588  12.741   2.727
    5   2HG1  VAL   1          HG12      VAL   1 -10.858  13.763   2.010
    6   3HG1  VAL   1          HG13      VAL   1 -10.104  14.232   3.552
    7   1HG2  VAL   1          HG21      VAL   1 -13.437  13.015   2.856
    8   2HG2  VAL   1          HG22      VAL   1 -13.375  13.126   4.631
    9   3HG2  VAL   1          HG23      VAL   1 -12.660  14.415   3.632
   10    H    THR   2           H        THR   2 -12.033   8.720   3.810
   11    HA   THR   2           HA       THR   2  -9.184   8.340   4.463
   12    HB   THR   2           HB       THR   2 -11.431   6.897   5.905
   13    HG1  THR   2           HG1      THR   2 -11.679   8.784   7.172
   14   1HG2  THR   2          HG21      THR   2  -9.849   6.692   7.654
   15   2HG2  THR   2          HG22      THR   2  -8.806   6.565   6.217
   16   3HG2  THR   2          HG23      THR   2  -8.918   8.105   7.102
   17    H    LEU   3           H        LEU   3  -9.364   7.815   2.012
   18    HA   LEU   3           HA       LEU   3  -9.208   5.009   1.826
   19   1HB   LEU   3          HB2       LEU   3 -11.780   5.727   1.755
   20   2HB   LEU   3          HB3       LEU   3 -11.392   6.003   0.068
   21    HG   LEU   3           HG       LEU   3 -10.537   3.392   1.218
   22   1HD1  LEU   3          HD11      LEU   3 -13.336   4.321   1.239
   23   2HD1  LEU   3          HD12      LEU   3 -13.067   2.745   0.456
   24   3HD1  LEU   3          HD13      LEU   3 -12.547   3.002   2.138
   25   1HD2  LEU   3          HD21      LEU   3 -11.926   4.033  -1.392
   26   2HD2  LEU   3          HD22      LEU   3 -10.164   4.123  -1.162
   27   3HD2  LEU   3          HD23      LEU   3 -11.008   2.569  -0.963
   28    H    PHE   4           H        PHE   4  -7.862   4.479   0.134
   29    HA   PHE   4           HA       PHE   4  -7.425   6.581  -1.860
   30   1HB   PHE   4          HB2       PHE   4  -5.431   4.886  -0.243
   31   2HB   PHE   4          HB3       PHE   4  -4.948   5.820  -1.645
   32    HD1  PHE   4           HD1      PHE   4  -5.430   8.365  -1.567
   33    HD2  PHE   4           HD2      PHE   4  -5.426   5.870   1.867
   34    HE1  PHE   4           HE1      PHE   4  -5.082  10.376  -0.106
   35    HE2  PHE   4           HE2      PHE   4  -5.079   7.882   3.328
   36    HZ   PHE   4           HZ       PHE   4  -4.911  10.110   2.324
   37    H    VAL   5           H        VAL   5  -7.519   5.839  -3.934
   38    HA   VAL   5           HA       VAL   5  -8.008   3.069  -4.365
   39    HB   VAL   5           HB       VAL   5  -9.045   5.003  -5.580
   40   1HG1  VAL   5          HG11      VAL   5  -7.912   6.283  -7.140
   41   2HG1  VAL   5          HG12      VAL   5  -6.671   6.085  -5.878
   42   3HG1  VAL   5          HG13      VAL   5  -6.615   5.081  -7.347
   43   1HG2  VAL   5          HG21      VAL   5  -9.395   3.768  -7.522
   44   2HG2  VAL   5          HG22      VAL   5  -7.718   3.175  -7.573
   45   3HG2  VAL   5          HG23      VAL   5  -8.855   2.524  -6.367
   46    H    ALA   6           H        ALA   6  -6.746   1.720  -5.925
   47    HA   ALA   6           HA       ALA   6  -3.898   2.144  -5.426
   48   1HB   ALA   6          HB1       ALA   6  -5.719  -0.159  -5.651
   49   2HB   ALA   6          HB2       ALA   6  -4.210  -0.359  -6.573
   50   3HB   ALA   6          HB3       ALA   6  -4.148  -0.022  -4.826
   51    H    LEU   7           H        LEU   7  -2.654   2.992  -7.014
   52    HA   LEU   7           HA       LEU   7  -3.766   3.378  -9.610
   53   1HB   LEU   7          HB2       LEU   7  -2.446   5.118  -8.803
   54   2HB   LEU   7          HB3       LEU   7  -1.174   4.043  -8.255
   55    HG   LEU   7           HG       LEU   7  -1.057   3.534 -10.906
   56   1HD1  LEU   7          HD11      LEU   7  -1.128   6.126 -11.731
   57   2HD1  LEU   7          HD12      LEU   7  -2.428   4.939 -11.996
   58   3HD1  LEU   7          HD13      LEU   7  -2.527   6.076 -10.630
   59   1HD2  LEU   7          HD21      LEU   7   0.303   5.718  -9.319
   60   2HD2  LEU   7          HD22      LEU   7   0.882   4.068  -9.657
   61   3HD2  LEU   7          HD23      LEU   7   0.787   5.265 -10.971
   62    H    TYR   8           H        TYR   8  -0.696   1.740  -8.551
   63    HA   TYR   8           HA       TYR   8  -1.334  -0.450 -10.359
   64   1HB   TYR   8          HB2       TYR   8   0.554   1.774 -10.789
   65   2HB   TYR   8          HB3       TYR   8   1.453   0.274 -10.657
   66    HD1  TYR   8           HD1      TYR   8   0.752  -1.683 -12.193
   67    HD2  TYR   8           HD2      TYR   8  -0.510   2.358 -12.808
   68    HE1  TYR   8           HE1      TYR   8   0.211  -2.215 -14.619
   69    HE2  TYR   8           HE2      TYR   8  -1.047   1.813 -15.233
   70    HH   TYR   8           HH       TYR   8  -1.507   0.036 -16.617
   71    H    ASP   9           H        ASP   9   0.018  -2.365  -9.980
   72    HA   ASP   9           HA       ASP   9   0.959  -2.343  -7.239
   73   1HB   ASP   9          HB2       ASP   9   1.002  -4.952  -7.820
   74   2HB   ASP   9          HB3       ASP   9  -0.492  -4.146  -7.385
   75    HD2  ASP   9           HD2      ASP   9   1.236  -5.001 -10.426
   76    H    TYR  10           H        TYR  10   2.931  -3.957  -6.886
   77    HA   TYR  10           HA       TYR  10   4.767  -3.755  -9.174
   78   1HB   TYR  10          HB2       TYR  10   4.790  -2.399  -6.663
   79   2HB   TYR  10          HB3       TYR  10   5.903  -3.730  -6.419
   80    HD1  TYR  10           HD1      TYR  10   5.402  -0.497  -7.970
   81    HD2  TYR  10           HD2      TYR  10   7.910  -3.962  -7.939
   82    HE1  TYR  10           HE1      TYR  10   7.237   0.813  -9.144
   83    HE2  TYR  10           HE2      TYR  10   9.737  -2.641  -9.115
   84    HH   TYR  10           HH       TYR  10   9.547   0.778  -9.464
   85    H    GLU  11           H        GLU  11   5.693  -5.662  -9.752
   86    HA   GLU  11           HA       GLU  11   5.026  -7.958  -8.230
   87   1HB   GLU  11          HB2       GLU  11   5.634  -7.437 -10.903
   88   2HB   GLU  11          HB3       GLU  11   7.052  -8.307 -10.353
   89   1HG   GLU  11          HG2       GLU  11   5.859 -10.219 -10.641
   90   2HG   GLU  11          HG3       GLU  11   4.945  -9.765  -9.216
   91    HE2  GLU  11           HE2      GLU  11   3.549  -9.281 -12.912
   92    H    ALA  12           H        ALA  12   6.324  -9.177  -6.852
   93    HA   ALA  12           HA       ALA  12   9.158  -8.548  -6.732
   94   1HB   ALA  12          HB1       ALA  12   7.238  -7.433  -4.922
   95   2HB   ALA  12          HB2       ALA  12   8.184  -8.654  -4.036
   96   3HB   ALA  12          HB3       ALA  12   9.014  -7.314  -4.863
   97    H    ARG  13           H        ARG  13  10.398 -10.320  -6.075
   98    HA   ARG  13           HA       ARG  13   8.803 -12.701  -5.565
   99   1HB   ARG  13          HB2       ARG  13  10.364 -12.442  -7.692
  100   2HB   ARG  13          HB3       ARG  13  11.672 -12.755  -6.569
  101   1HG   ARG  13          HG2       ARG  13  11.236 -14.977  -6.642
  102   2HG   ARG  13          HG3       ARG  13   9.613 -14.697  -6.043
  103   1HD   ARG  13          HD2       ARG  13   8.663 -14.866  -8.135
  104   2HD   ARG  13          HD3       ARG  13   9.976 -14.006  -8.917
  105    HE   ARG  13           HE       ARG  13  11.153 -16.404  -8.195
  106   1HH1  ARG  13          HH22      ARG  13   8.231 -15.583 -10.023
  107   2HH1  ARG  13          HH21      ARG  13   8.293 -17.011 -11.002
  108   1HH2  ARG  13          HH11      ARG  13  10.067 -18.587 -10.670
  109    H    THR  14           H        THR  14  10.511 -10.406  -3.956
  110    HA   THR  14           HA       THR  14  12.187 -12.162  -2.365
  111    HB   THR  14           HB       THR  14  12.544  -9.822  -1.201
  112    HG1  THR  14           HG1      THR  14  11.895  -8.204  -3.012
  113   1HG2  THR  14          HG21      THR  14  14.318 -10.494  -2.676
  114   2HG2  THR  14          HG22      THR  14  13.254 -10.443  -4.102
  115   3HG2  THR  14          HG23      THR  14  13.776  -8.929  -3.325
  116    H    GLU  15           H        GLU  15  12.049 -11.651   0.146
  117    HA   GLU  15           HA       GLU  15   9.310 -12.333   0.793
  118   1HB   GLU  15          HB2       GLU  15  11.515 -12.440   2.835
  119   2HB   GLU  15          HB3       GLU  15  10.142 -13.510   2.626
  120   1HG   GLU  15          HG2       GLU  15  11.453 -13.958   0.257
  121   2HG   GLU  15          HG3       GLU  15  12.817 -13.567   1.286
  122    HE2  GLU  15           HE2      GLU  15  10.975 -16.390   0.539
  123    H    ASP  16           H        ASP  16  11.429  -9.652   0.768
  124    HA   ASP  16           HA       ASP  16  10.741  -8.445   3.173
  125   1HB   ASP  16          HB2       ASP  16  12.585  -7.878   1.369
  126   2HB   ASP  16          HB3       ASP  16  11.331  -6.908   0.622
  127    HD2  ASP  16           HD2      ASP  16  12.697  -4.401   2.389
  128    H    ASP  17           H        ASP  17   9.471  -8.193  -0.220
  129    HA   ASP  17           HA       ASP  17   6.998  -7.189   0.914
  130   1HB   ASP  17          HB2       ASP  17   7.200  -5.919  -1.584
  131   2HB   ASP  17          HB3       ASP  17   7.349  -5.151  -0.017
  132    HD2  ASP  17           HD2      ASP  17   8.931  -4.878  -2.733
  133    H    LEU  18           H        LEU  18   5.109  -7.747  -0.448
  134    HA   LEU  18           HA       LEU  18   5.745  -9.862  -2.377
  135   1HB   LEU  18          HB2       LEU  18   2.989  -9.811  -1.635
  136   2HB   LEU  18          HB3       LEU  18   4.183 -11.075  -1.413
  137    HG   LEU  18           HG       LEU  18   4.823  -9.330   0.620
  138   1HD1  LEU  18          HD11      LEU  18   1.802  -9.364   0.380
  139   2HD1  LEU  18          HD12      LEU  18   2.743  -8.744   1.757
  140   3HD1  LEU  18          HD13      LEU  18   2.857  -7.945   0.171
  141   1HD2  LEU  18          HD21      LEU  18   4.843 -11.503   1.267
  142   2HD2  LEU  18          HD22      LEU  18   3.264 -11.050   1.949
  143   3HD2  LEU  18          HD23      LEU  18   3.348 -11.901   0.389
  144    H    SER  19           H        SER  19   3.439  -9.995  -3.853
  145    HA   SER  19           HA       SER  19   3.553  -7.422  -5.195
  146   1HB   SER  19          HB2       SER  19   2.171  -9.279  -6.826
  147   2HB   SER  19          HB3       SER  19   3.809  -8.693  -7.042
  148    HG   SER  19           HG       SER  19   3.964 -10.931  -6.915
  149    H    PHE  20           H        PHE  20   1.824  -6.058  -4.942
  150    HA   PHE  20           HA       PHE  20  -0.595  -7.128  -3.784
  151   1HB   PHE  20          HB2       PHE  20   0.878  -4.580  -4.087
  152   2HB   PHE  20          HB3       PHE  20  -0.813  -4.355  -4.485
  153    HD1  PHE  20           HD1      PHE  20   1.579  -4.772  -1.843
  154    HD2  PHE  20           HD2      PHE  20  -2.557  -4.989  -2.767
  155    HE1  PHE  20           HE1      PHE  20   1.025  -4.615   0.600
  156    HE2  PHE  20           HE2      PHE  20  -3.111  -4.832  -0.324
  157    HZ   PHE  20           HZ       PHE  20  -1.314  -4.647   1.331
  158    H    HIS  21           H        HIS  21  -2.519  -5.347  -4.834
  159    HA   HIS  21           HA       HIS  21  -2.462  -5.576  -7.691
  160   1HB   HIS  21          HB2       HIS  21  -3.230  -7.843  -6.686
  161   2HB   HIS  21          HB3       HIS  21  -4.715  -7.004  -6.287
  162    HD1  HIS  21           HD1      HIS  21  -5.123  -5.305  -8.844
  163    HD2  HIS  21           HD2      HIS  21  -3.977  -9.341  -8.856
  164    HE1  HIS  21           HE1      HIS  21  -5.796  -6.233 -11.125
  165    H    LYS  22           H        LYS  22  -3.822  -4.052  -8.661
  166    HA   LYS  22           HA       LYS  22  -4.812  -2.044  -6.887
  167   1HB   LYS  22          HB2       LYS  22  -5.420  -0.896  -9.020
  168   2HB   LYS  22          HB3       LYS  22  -3.728  -1.334  -8.891
  169   1HG   LYS  22          HG2       LYS  22  -4.422  -3.534 -10.147
  170   2HG   LYS  22          HG3       LYS  22  -5.891  -2.671 -10.555
  171   1HD   LYS  22          HD2       LYS  22  -4.040  -0.763 -11.215
  172   2HD   LYS  22          HD3       LYS  22  -3.088  -2.205 -11.501
  173   1HE   LYS  22          HE2       LYS  22  -5.604  -1.286 -12.888
  174   2HE   LYS  22          HE3       LYS  22  -4.126  -1.918 -13.587
  175   1HZ   LYS  22          HZ1       LYS  22  -5.265  -3.916 -11.964
  176   2HZ   LYS  22          HZ2       LYS  22  -6.436  -3.356 -12.947
  177    H    GLY  23           H        GLY  23  -7.105  -1.117  -7.285
  178   1HA   GLY  23          HA3       GLY  23  -9.357  -1.457  -7.671
  179   2HA   GLY  23          HA2       GLY  23  -9.072  -3.159  -7.972
  180    H    GLU  24           H        GLU  24  -7.253  -2.388  -5.246
  181    HA   GLU  24           HA       GLU  24  -9.376  -3.424  -3.561
  182   1HB   GLU  24          HB2       GLU  24  -6.463  -3.783  -3.705
  183   2HB   GLU  24          HB3       GLU  24  -6.989  -3.411  -2.076
  184   1HG   GLU  24          HG2       GLU  24  -8.815  -5.225  -2.414
  185   2HG   GLU  24          HG3       GLU  24  -7.930  -5.701  -3.851
  186    HE2  GLU  24           HE2      GLU  24  -6.721  -7.502  -0.816
  187    H    LYS  25           H        LYS  25  -8.374  -2.613  -1.024
  188    HA   LYS  25           HA       LYS  25  -8.755   0.293  -1.228
  189   1HB   LYS  25          HB2       LYS  25  -9.533  -0.158   1.268
  190   2HB   LYS  25          HB3       LYS  25 -10.629  -0.308  -0.089
  191   1HG   LYS  25          HG2       LYS  25 -10.595  -2.661  -0.046
  192   2HG   LYS  25          HG3       LYS  25  -9.017  -2.732   0.713
  193   1HD   LYS  25          HD2       LYS  25 -10.584  -3.367   2.417
  194   2HD   LYS  25          HD3       LYS  25 -10.087  -1.735   2.818
  195   1HE   LYS  25          HE2       LYS  25 -12.157  -0.818   2.299
  196   2HE   LYS  25          HE3       LYS  25 -12.473  -1.969   1.017
  197   1HZ   LYS  25          HZ1       LYS  25 -12.389  -3.420   3.396
  198   2HZ   LYS  25          HZ2       LYS  25 -13.309  -2.114   3.708
  199    H    PHE  26           H        PHE  26  -7.679   1.575   0.537
  200    HA   PHE  26           HA       PHE  26  -5.230   0.235   1.435
  201   1HB   PHE  26          HB2       PHE  26  -5.359   2.045  -0.630
  202   2HB   PHE  26          HB3       PHE  26  -5.303   3.178   0.705
  203    HD1  PHE  26           HD1      PHE  26  -3.376   2.739   2.455
  204    HD2  PHE  26           HD2      PHE  26  -3.367   1.293  -1.534
  205    HE1  PHE  26           HE1      PHE  26  -0.878   2.511   2.543
  206    HE2  PHE  26           HE2      PHE  26  -0.869   1.065  -1.447
  207    HZ   PHE  26           HZ       PHE  26   0.345   1.677   0.591
  208    H    GLN  27           H        GLN  27  -4.894   0.420   3.602
  209    HA   GLN  27           HA       GLN  27  -6.517   2.410   4.965
  210   1HB   GLN  27          HB2       GLN  27  -5.071   0.133   6.343
  211   2HB   GLN  27          HB3       GLN  27  -6.498   1.001   6.874
  212   1HG   GLN  27          HG2       GLN  27  -6.822  -0.354   4.247
  213   2HG   GLN  27          HG3       GLN  27  -6.519  -1.452   5.578
  214   1HE2  GLN  27          HE21      GLN  27  -8.376  -2.303   6.136
  215   2HE2  GLN  27          HE22      GLN  27  -9.851  -1.461   6.473
  216    H    ILE  28           H        ILE  28  -5.507   4.239   5.661
  217    HA   ILE  28           HA       ILE  28  -2.710   4.508   5.475
  218    HB   ILE  28           HB       ILE  28  -4.569   6.256   5.255
  219   1HG1  ILE  28          HG12      ILE  28  -2.162   7.030   6.920
  220   2HG1  ILE  28          HG13      ILE  28  -2.061   6.617   5.221
  221   1HG2  ILE  28          HG21      ILE  28  -5.834   6.224   7.166
  222   2HG2  ILE  28          HG22      ILE  28  -4.437   5.921   8.226
  223   3HG2  ILE  28          HG23      ILE  28  -4.704   7.545   7.549
  224   1HD1  ILE  28          HD11      ILE  28  -4.224   8.540   5.725
  225   2HD1  ILE  28          HD12      ILE  28  -2.646   9.149   6.277
  226   3HD1  ILE  28          HD13      ILE  28  -2.863   8.644   4.583
  227    H    LEU  29           H        LEU  29  -1.084   4.417   7.014
  228    HA   LEU  29           HA       LEU  29  -1.864   3.957   9.771
  229   1HB   LEU  29          HB2       LEU  29  -1.612   1.767   8.295
  230   2HB   LEU  29          HB3       LEU  29   0.092   2.032   8.606
  231    HG   LEU  29           HG       LEU  29  -0.493   2.112  11.084
  232   1HD1  LEU  29          HD11      LEU  29  -2.779   0.491  11.096
  233   2HD1  LEU  29          HD12      LEU  29  -2.638   2.177  11.649
  234   3HD1  LEU  29          HD13      LEU  29  -3.151   1.828   9.980
  235   1HD2  LEU  29          HD21      LEU  29   0.477   0.151   9.711
  236   2HD2  LEU  29          HD22      LEU  29  -0.191  -0.182  11.326
  237   3HD2  LEU  29          HD23      LEU  29  -1.144  -0.566   9.873
  238    H    ASN  30           H        ASN  30   1.141   3.529   7.777
  239    HA   ASN  30           HA       ASN  30   2.442   5.311   9.636
  240   1HB   ASN  30          HB2       ASN  30   3.393   3.022   8.801
  241   2HB   ASN  30          HB3       ASN  30   3.725   3.840   7.287
  242   1HD2  ASN  30          HD21      ASN  30   4.377   3.761  10.734
  243   2HD2  ASN  30          HD22      ASN  30   5.881   4.619  10.716
  244    H    SER  31           H        SER  31   2.718   7.475   9.065
  245    HA   SER  31           HA       SER  31   3.435   8.178   6.437
  246   1HB   SER  31          HB2       SER  31   0.737   7.885   6.640
  247   2HB   SER  31          HB3       SER  31   0.877   9.543   7.190
  248    HG   SER  31           HG       SER  31   1.891   8.482   4.690
  249    H    SER  32           H        SER  32   5.200   9.073   7.705
  250    HA   SER  32           HA       SER  32   4.382  11.458   9.172
  251   1HB   SER  32          HB2       SER  32   5.805   9.230  10.153
  252   2HB   SER  32          HB3       SER  32   7.042  10.443   9.884
  253    HG   SER  32           HG       SER  32   5.177  10.307  11.885
  254    H    GLU  33           H        GLU  33   7.694  10.327   8.333
  255    HA   GLU  33           HA       GLU  33   8.197  12.835   7.096
  256   1HB   GLU  33          HB2       GLU  33   9.740  10.637   8.202
  257   2HB   GLU  33          HB3       GLU  33  10.361  11.037   6.614
  258   1HG   GLU  33          HG2       GLU  33   9.766  13.483   8.095
  259   2HG   GLU  33          HG3       GLU  33  10.809  12.446   9.048
  260    HE2  GLU  33           HE2      GLU  33  12.515  13.457   8.810
  261    H    GLY  34           H        GLY  34   9.580   9.879   5.685
  262   1HA   GLY  34          HA3       GLY  34   7.852   9.398   3.584
  263   2HA   GLY  34          HA2       GLY  34   8.900  10.695   3.047
  264    H    ASP  35           H        ASP  35   8.544   7.392   3.008
  265    HA   ASP  35           HA       ASP  35  11.012   6.934   1.921
  266   1HB   ASP  35          HB2       ASP  35  11.546   7.249   4.501
  267   2HB   ASP  35          HB3       ASP  35  10.886   5.634   4.659
  268    HD2  ASP  35           HD2      ASP  35  12.103   3.996   3.998
  269    H    TRP  36           H        TRP  36   9.549   4.860   4.501
  270    HA   TRP  36           HA       TRP  36   8.449   3.151   2.374
  271   1HB   TRP  36          HB2       TRP  36   9.724   2.412   5.008
  272   2HB   TRP  36          HB3       TRP  36   8.755   1.297   4.066
  273    HD1  TRP  36           HD1      TRP  36  10.180   2.642   1.228
  274    HE1  TRP  36           HE1      TRP  36  12.520   1.692   0.462
  275    HE3  TRP  36           HE3      TRP  36  11.417   0.607   5.721
  276    HZ2  TRP  36           HZ2      TRP  36  14.579   0.230   1.790
  277    HZ3  TRP  36           HZ3      TRP  36  13.610  -0.564   5.901
  278    HH2  TRP  36           HH2      TRP  36  15.168  -0.770   4.029
  279    H    TRP  37           H        TRP  37   6.256   2.749   2.497
  280    HA   TRP  37           HA       TRP  37   4.923   3.605   4.976
  281   1HB   TRP  37          HB2       TRP  37   4.316   4.231   2.119
  282   2HB   TRP  37          HB3       TRP  37   2.978   4.016   3.231
  283    HD1  TRP  37           HD1      TRP  37   5.420   5.476   5.435
  284    HE1  TRP  37           HE1      TRP  37   5.297   8.103   5.662
  285    HE3  TRP  37           HE3      TRP  37   2.572   6.227   1.289
  286    HZ2  TRP  37           HZ2      TRP  37   4.050  10.154   4.118
  287    HZ3  TRP  37           HZ3      TRP  37   1.946   8.573   0.720
  288    HH2  TRP  37           HH2      TRP  37   2.637  10.498   2.058
  289    H    GLU  38           H        GLU  38   3.188   2.244   5.671
  290    HA   GLU  38           HA       GLU  38   3.460  -0.430   4.737
  291   1HB   GLU  38          HB2       GLU  38   1.738   0.867   6.887
  292   2HB   GLU  38          HB3       GLU  38   1.670  -0.849   6.533
  293   1HG   GLU  38          HG2       GLU  38   4.173  -0.978   6.939
  294   2HG   GLU  38          HG3       GLU  38   4.144   0.707   7.422
  295    HE2  GLU  38           HE2      GLU  38   3.540   0.076  10.500
  296    H    ALA  39           H        ALA  39   1.315  -1.767   4.405
  297    HA   ALA  39           HA       ALA  39  -0.744  -0.197   3.087
  298   1HB   ALA  39          HB1       ALA  39   0.331  -2.538   1.556
  299   2HB   ALA  39          HB2       ALA  39  -0.426  -1.038   0.967
  300   3HB   ALA  39          HB3       ALA  39   1.267  -1.023   1.517
  301    H    ARG  40           H        ARG  40  -2.412  -0.838   4.397
  302    HA   ARG  40           HA       ARG  40  -2.586  -3.699   4.887
  303   1HB   ARG  40          HB2       ARG  40  -2.561  -1.797   6.784
  304   2HB   ARG  40          HB3       ARG  40  -4.262  -1.669   6.384
  305   1HG   ARG  40          HG2       ARG  40  -4.774  -3.666   7.377
  306   2HG   ARG  40          HG3       ARG  40  -3.383  -4.476   6.683
  307   1HD   ARG  40          HD2       ARG  40  -1.954  -3.162   8.418
  308   2HD   ARG  40          HD3       ARG  40  -3.470  -2.762   9.203
  309    HE   ARG  40           HE       ARG  40  -2.218  -5.437   9.050
  310   1HH1  ARG  40          HH22      ARG  40  -5.101  -3.561   9.897
  311   2HH1  ARG  40          HH21      ARG  40  -5.761  -4.800  10.912
  312   1HH2  ARG  40          HH11      ARG  40  -4.560  -6.855  11.187
  313    H    SER  41           H        SER  41  -4.696  -4.752   4.622
  314    HA   SER  41           HA       SER  41  -6.656  -3.126   3.230
  315   1HB   SER  41          HB2       SER  41  -4.976  -4.983   1.925
  316   2HB   SER  41          HB3       SER  41  -6.496  -5.833   2.113
  317    HG   SER  41           HG       SER  41  -7.431  -4.547   0.666
  318    H    LEU  42           H        LEU  42  -8.865  -3.988   3.390
  319    HA   LEU  42           HA       LEU  42  -9.150  -5.669   5.748
  320   1HB   LEU  42          HB2       LEU  42 -10.282  -3.467   5.578
  321   2HB   LEU  42          HB3       LEU  42 -11.206  -4.070   4.217
  322    HG   LEU  42           HG       LEU  42 -11.992  -5.934   5.850
  323   1HD1  LEU  42          HD11      LEU  42 -11.171  -3.843   7.883
  324   2HD1  LEU  42          HD12      LEU  42 -12.001  -5.387   8.191
  325   3HD1  LEU  42          HD13      LEU  42 -10.320  -5.382   7.606
  326   1HD2  LEU  42          HD21      LEU  42 -13.071  -3.228   6.567
  327   2HD2  LEU  42          HD22      LEU  42 -13.224  -3.834   4.901
  328   3HD2  LEU  42          HD23      LEU  42 -13.931  -4.754   6.251
  329    H    THR  43           H        THR  43  -8.792  -6.099   2.459
  330    HA   THR  43           HA       THR  43 -10.847  -8.135   2.187
  331    HB   THR  43           HB       THR  43  -8.649  -7.450   0.195
  332    HG1  THR  43           HG1      THR  43 -10.919  -5.997  -0.192
  333   1HG2  THR  43          HG21      THR  43 -11.399  -8.650   0.165
  334   2HG2  THR  43          HG22      THR  43 -11.036  -7.502  -1.146
  335   3HG2  THR  43          HG23      THR  43 -10.025  -8.951  -0.926
  336    H    THR  44           H        THR  44  -7.226  -7.949   2.072
  337    HA   THR  44           HA       THR  44  -7.189 -10.850   2.476
  338    HB   THR  44           HB       THR  44  -4.735  -9.154   1.985
  339    HG1  THR  44           HG1      THR  44  -5.442  -9.044  -0.258
  340   1HG2  THR  44          HG21      THR  44  -3.967 -11.270   1.557
  341   2HG2  THR  44          HG22      THR  44  -5.614 -11.942   1.619
  342   3HG2  THR  44          HG23      THR  44  -4.993 -11.245   0.103
  343    H    GLY  45           H        GLY  45  -5.533  -7.887   3.771
  344   1HA   GLY  45          HA3       GLY  45  -5.474  -7.428   6.081
  345   2HA   GLY  45          HA2       GLY  45  -5.669  -9.134   6.432
  346    H    GLU  46           H        GLU  46  -3.484  -8.238   3.812
  347    HA   GLU  46           HA       GLU  46  -1.272  -8.894   5.596
  348   1HB   GLU  46          HB2       GLU  46  -1.927  -9.656   2.780
  349   2HB   GLU  46          HB3       GLU  46  -0.238  -9.315   3.101
  350   1HG   GLU  46          HG2       GLU  46  -0.403 -11.622   3.583
  351   2HG   GLU  46          HG3       GLU  46  -0.505 -10.888   5.171
  352    HE2  GLU  46           HE2      GLU  46  -3.211 -12.896   5.576
  353    H    THR  47           H        THR  47   0.660  -7.624   5.497
  354    HA   THR  47           HA       THR  47   0.318  -5.088   4.032
  355    HB   THR  47           HB       THR  47   0.150  -4.968   6.560
  356    HG1  THR  47           HG1      THR  47   1.659  -3.192   6.521
  357   1HG2  THR  47          HG21      THR  47   2.048  -5.418   7.940
  358   2HG2  THR  47          HG22      THR  47   1.977  -6.839   6.868
  359   3HG2  THR  47          HG23      THR  47   3.143  -5.533   6.540
  360    H    GLY  48           H        GLY  48   2.074  -4.204   2.925
  361   1HA   GLY  48          HA3       GLY  48   4.472  -5.912   2.769
  362   2HA   GLY  48          HA2       GLY  48   3.608  -5.461   1.313
  363    H    TYR  49           H        TYR  49   6.356  -4.761   1.872
  364    HA   TYR  49           HA       TYR  49   6.263  -1.951   2.615
  365   1HB   TYR  49          HB2       TYR  49   8.230  -4.214   2.218
  366   2HB   TYR  49          HB3       TYR  49   8.854  -2.618   1.851
  367    HD1  TYR  49           HD1      TYR  49   6.569  -3.878   4.555
  368    HD2  TYR  49           HD2      TYR  49  10.238  -1.910   3.573
  369    HE1  TYR  49           HE1      TYR  49   7.025  -3.482   7.024
  370    HE2  TYR  49           HE2      TYR  49  10.682  -1.520   6.045
  371    HH   TYR  49           HH       TYR  49   9.402  -1.331   8.094
  372    H    ILE  50           H        ILE  50   5.310  -0.812   0.916
  373    HA   ILE  50           HA       ILE  50   6.885  -0.825  -1.542
  374    HB   ILE  50           HB       ILE  50   4.581  -0.511  -2.708
  375   1HG1  ILE  50          HG12      ILE  50   3.512  -2.453  -0.736
  376   2HG1  ILE  50          HG13      ILE  50   3.585  -0.787  -0.198
  377   1HG2  ILE  50          HG21      ILE  50   5.067  -2.477  -3.635
  378   2HG2  ILE  50          HG22      ILE  50   6.381  -2.604  -2.441
  379   3HG2  ILE  50          HG23      ILE  50   4.802  -3.354  -2.109
  380   1HD1  ILE  50          HD11      ILE  50   1.684  -0.395  -1.362
  381   2HD1  ILE  50          HD12      ILE  50   2.605  -0.660  -2.861
  382   3HD1  ILE  50          HD13      ILE  50   1.748  -2.017  -2.091
  383    HA   PRO  51           HA       PRO  51   6.367   3.444  -1.024
  384   1HB   PRO  51          HB2       PRO  51   7.239   4.355  -3.449
  385   2HB   PRO  51          HB3       PRO  51   8.324   3.840  -2.172
  386   1HG   PRO  51          HG2       PRO  51   7.591   2.427  -4.663
  387   2HG   PRO  51          HG3       PRO  51   8.960   2.148  -3.605
  388   1HD   PRO  51          HD2       PRO  51   6.567   0.574  -3.769
  389   2HD   PRO  51          HD3       PRO  51   7.884   0.364  -2.632
  390    H    SER  52           H        SER  52   4.349   4.143  -0.618
  391    HA   SER  52           HA       SER  52   2.598   4.140  -2.918
  392   1HB   SER  52          HB2       SER  52   2.189   3.540  -0.232
  393   2HB   SER  52          HB3       SER  52   1.534   5.161  -0.348
  394    HG   SER  52           HG       SER  52   0.597   2.752  -1.467
  395    H    ASN  53           H        ASN  53   4.575   5.956  -3.369
  396    HA   ASN  53           HA       ASN  53   3.746   8.488  -2.296
  397   1HB   ASN  53          HB2       ASN  53   6.050   7.492  -4.000
  398   2HB   ASN  53          HB3       ASN  53   5.683   9.205  -4.014
  399   1HD2  ASN  53          HD21      ASN  53   6.343   6.448  -1.898
  400   2HD2  ASN  53          HD22      ASN  53   7.099   7.323  -0.608
  401    H    TYR  54           H        TYR  54   2.459   6.516  -4.543
  402    HA   TYR  54           HA       TYR  54   1.887   8.706  -6.423
  403   1HB   TYR  54          HB2       TYR  54   1.894   5.676  -6.940
  404   2HB   TYR  54          HB3       TYR  54   1.857   6.938  -8.156
  405    HD1  TYR  54           HD1      TYR  54   3.926   4.655  -6.419
  406    HD2  TYR  54           HD2      TYR  54   3.955   8.549  -8.190
  407    HE1  TYR  54           HE1      TYR  54   6.459   4.560  -6.604
  408    HE2  TYR  54           HE2      TYR  54   6.488   8.441  -8.369
  409    HH   TYR  54           HH       TYR  54   8.275   7.317  -7.920
  410    H    VAL  55           H        VAL  55   0.412   8.239  -4.002
  411    HA   VAL  55           HA       VAL  55  -1.847   6.605  -4.635
  412    HB   VAL  55           HB       VAL  55  -2.735   7.569  -2.528
  413   1HG1  VAL  55          HG11      VAL  55  -1.438   5.532  -2.431
  414   2HG1  VAL  55          HG12      VAL  55   0.087   6.450  -2.450
  415   3HG1  VAL  55          HG13      VAL  55  -1.001   6.558  -1.045
  416   1HG2  VAL  55          HG21      VAL  55  -1.302   9.758  -2.966
  417   2HG2  VAL  55          HG22      VAL  55  -1.703   9.226  -1.315
  418   3HG2  VAL  55          HG23      VAL  55  -0.095   8.881  -1.994
  419    H    ALA  56           H        ALA  56  -4.135   7.727  -4.328
  420    HA   ALA  56           HA       ALA  56  -4.160  10.330  -5.640
  421   1HB   ALA  56          HB1       ALA  56  -6.173   9.061  -6.984
  422   2HB   ALA  56          HB2       ALA  56  -4.521   9.259  -7.617
  423   3HB   ALA  56          HB3       ALA  56  -4.993   7.737  -6.825
  424    HA   PRO  57           HA       PRO  57  -7.204  10.715  -2.550
  425   1HB   PRO  57          HB2       PRO  57  -7.919  13.307  -3.039
  426   2HB   PRO  57          HB3       PRO  57  -6.540  12.864  -2.054
  427   1HG   PRO  57          HG2       PRO  57  -6.581  13.918  -4.815
  428   2HG   PRO  57          HG3       PRO  57  -5.249  13.872  -3.678
  429   1HD   PRO  57          HD2       PRO  57  -5.649  12.133  -5.924
  430   2HD   PRO  57          HD3       PRO  57  -4.381  12.016  -4.720
  431    H    VAL  58           H        VAL  58  -9.402  10.483  -2.227
  432    HA   VAL  58           HA       VAL  58 -10.781  10.020  -4.734
  433    HB   VAL  58           HB       VAL  58 -12.519   9.069  -3.238
  434   1HG1  VAL  58          HG11      VAL  58 -10.642   7.721  -4.209
  435   2HG1  VAL  58          HG12      VAL  58  -9.753   7.948  -2.683
  436   3HG1  VAL  58          HG13      VAL  58 -11.300   7.066  -2.690
  437   1HG2  VAL  58          HG21      VAL  58 -11.545  10.623  -1.277
  438   2HG2  VAL  58          HG22      VAL  58 -12.440   9.117  -0.961
  439   3HG2  VAL  58          HG23      VAL  58 -10.661   9.123  -0.909
  440    H    ASP  59           H        ASP  59 -13.213  10.740  -4.734
  441    HA   ASP  59           HA       ASP  59 -13.117  13.575  -4.336
  442   1HB   ASP  59          HB2       ASP  59 -14.957  11.622  -5.728
  443   2HB   ASP  59          HB3       ASP  59 -15.582  13.210  -5.332
  444    HD2  ASP  59           HD2      ASP  59 -14.238  13.335  -8.690
  Start of MODEL   18
    1   1H    VAL   1           H        VAL   1 -13.442  10.671   5.367
    2    HA   VAL   1           HA       VAL   1 -13.790   8.000   4.190
    3    HB   VAL   1           HB       VAL   1 -13.906  10.501   2.548
    4   1HG1  VAL   1          HG11      VAL   1 -15.714   8.726   1.526
    5   2HG1  VAL   1          HG12      VAL   1 -14.007   8.832   1.032
    6   3HG1  VAL   1          HG13      VAL   1 -14.512   7.626   2.240
    7   1HG2  VAL   1          HG21      VAL   1 -15.971   9.567   4.479
    8   2HG2  VAL   1          HG22      VAL   1 -15.634  11.199   3.853
    9   3HG2  VAL   1          HG23      VAL   1 -16.538  10.032   2.857
   10    H    THR   2           H        THR   2 -11.654   7.357   4.683
   11    HA   THR   2           HA       THR   2  -9.603   8.904   3.238
   12    HB   THR   2           HB       THR   2  -9.021   7.255   5.720
   13    HG1  THR   2           HG1      THR   2 -10.153   9.935   5.372
   14   1HG2  THR   2          HG21      THR   2  -6.996   8.285   5.498
   15   2HG2  THR   2          HG22      THR   2  -7.575   9.094   4.021
   16   3HG2  THR   2          HG23      THR   2  -7.799   9.869   5.608
   17    H    LEU   3           H        LEU   3  -9.971   7.654   1.335
   18    HA   LEU   3           HA       LEU   3  -8.682   5.046   1.554
   19   1HB   LEU   3          HB2       LEU   3 -11.464   5.585   0.670
   20   2HB   LEU   3          HB3       LEU   3 -10.533   4.457  -0.295
   21    HG   LEU   3           HG       LEU   3 -10.319   3.903   2.570
   22   1HD1  LEU   3          HD11      LEU   3 -12.665   4.915   2.326
   23   2HD1  LEU   3          HD12      LEU   3 -13.059   3.445   1.399
   24   3HD1  LEU   3          HD13      LEU   3 -12.520   3.313   3.091
   25   1HD2  LEU   3          HD21      LEU   3 -11.268   1.650   1.552
   26   2HD2  LEU   3          HD22      LEU   3 -10.800   2.424   0.019
   27   3HD2  LEU   3          HD23      LEU   3  -9.582   2.160   1.291
   28    H    PHE   4           H        PHE   4  -7.081   4.845   0.073
   29    HA   PHE   4           HA       PHE   4  -6.915   6.933  -1.941
   30   1HB   PHE   4          HB2       PHE   4  -5.142   5.024  -0.441
   31   2HB   PHE   4          HB3       PHE   4  -4.658   5.286  -2.105
   32    HD1  PHE   4           HD1      PHE   4  -4.507   7.810  -2.841
   33    HD2  PHE   4           HD2      PHE   4  -4.379   6.480   1.187
   34    HE1  PHE   4           HE1      PHE   4  -3.365   9.943  -2.173
   35    HE2  PHE   4           HE2      PHE   4  -3.237   8.614   1.855
   36    HZ   PHE   4           HZ       PHE   4  -2.744  10.319   0.167
   37    H    VAL   5           H        VAL   5  -5.407   5.757  -3.930
   38    HA   VAL   5           HA       VAL   5  -6.872   3.388  -4.781
   39    HB   VAL   5           HB       VAL   5  -8.187   5.223  -5.633
   40   1HG1  VAL   5          HG11      VAL   5  -5.573   6.426  -6.112
   41   2HG1  VAL   5          HG12      VAL   5  -6.622   6.510  -7.548
   42   3HG1  VAL   5          HG13      VAL   5  -7.177   7.187  -5.998
   43   1HG2  VAL   5          HG21      VAL   5  -7.436   3.125  -7.068
   44   2HG2  VAL   5          HG22      VAL   5  -8.422   4.427  -7.776
   45   3HG2  VAL   5          HG23      VAL   5  -6.667   4.378  -8.072
   46    H    ALA   6           H        ALA   6  -5.490   1.916  -5.648
   47    HA   ALA   6           HA       ALA   6  -2.732   2.626  -5.858
   48   1HB   ALA   6          HB1       ALA   6  -3.940   0.036  -6.832
   49   2HB   ALA   6          HB2       ALA   6  -2.379   0.321  -6.026
   50   3HB   ALA   6          HB3       ALA   6  -3.891   0.399  -5.091
   51    H    LEU   7           H        LEU   7  -1.454   1.963  -7.891
   52    HA   LEU   7           HA       LEU   7  -2.727   3.284 -10.122
   53   1HB   LEU   7          HB2       LEU   7  -0.372   3.707  -9.267
   54   2HB   LEU   7          HB3       LEU   7   0.064   2.160  -9.964
   55    HG   LEU   7           HG       LEU   7  -1.318   3.732 -11.943
   56   1HD1  LEU   7          HD11      LEU   7  -0.670   5.712 -10.761
   57   2HD1  LEU   7          HD12      LEU   7   0.995   5.115 -10.565
   58   3HD1  LEU   7          HD13      LEU   7   0.387   5.540 -12.182
   59   1HD2  LEU   7          HD21      LEU   7   0.062   1.990 -12.672
   60   2HD2  LEU   7          HD22      LEU   7   0.964   3.469 -13.084
   61   3HD2  LEU   7          HD23      LEU   7   1.424   2.514 -11.653
   62    H    TYR   8           H        TYR   8  -0.637   0.324 -10.012
   63    HA   TYR   8           HA       TYR   8  -2.750  -1.188 -11.302
   64   1HB   TYR   8          HB2       TYR   8  -0.292  -0.004 -12.542
   65   2HB   TYR   8          HB3       TYR   8  -0.426  -1.729 -12.821
   66    HD1  TYR   8           HD1      TYR   8  -2.669  -2.595 -13.817
   67    HD2  TYR   8           HD2      TYR   8  -1.463   1.509 -13.903
   68    HE1  TYR   8           HE1      TYR   8  -4.284  -2.153 -15.731
   69    HE2  TYR   8           HE2      TYR   8  -3.082   1.937 -15.816
   70    HH   TYR   8           HH       TYR   8  -4.880   1.102 -16.869
   71    H    ASP   9           H        ASP   9  -1.356  -3.434 -12.063
   72    HA   ASP   9           HA       ASP   9  -0.776  -4.538  -9.544
   73   1HB   ASP   9          HB2       ASP   9  -0.502  -5.573 -12.398
   74   2HB   ASP   9          HB3       ASP   9  -0.105  -6.563 -11.008
   75    HD2  ASP   9           HD2      ASP   9  -2.924  -5.621  -9.591
   76    H    TYR  10           H        TYR  10   1.319  -5.426  -8.835
   77    HA   TYR  10           HA       TYR  10   3.602  -4.243 -10.268
   78   1HB   TYR  10          HB2       TYR  10   2.785  -4.690  -7.360
   79   2HB   TYR  10          HB3       TYR  10   4.497  -4.654  -7.735
   80    HD1  TYR  10           HD1      TYR  10   4.342  -2.529  -9.953
   81    HD2  TYR  10           HD2      TYR  10   2.659  -2.720  -6.025
   82    HE1  TYR  10           HE1      TYR  10   4.310   0.011  -9.835
   83    HE2  TYR  10           HE2      TYR  10   2.632  -0.181  -5.919
   84    HH   TYR  10           HH       TYR  10   4.224   1.739  -8.330
   85    H    GLU  11           H        GLU  11   5.686  -5.540  -9.000
   86    HA   GLU  11           HA       GLU  11   5.078  -8.360  -9.331
   87   1HB   GLU  11          HB2       GLU  11   6.453  -6.835 -11.264
   88   2HB   GLU  11          HB3       GLU  11   7.723  -7.679 -10.400
   89   1HG   GLU  11          HG2       GLU  11   6.691  -9.845 -10.830
   90   2HG   GLU  11          HG3       GLU  11   5.234  -9.095 -11.450
   91    HE2  GLU  11           HE2      GLU  11   6.675 -10.841 -12.787
   92    H    ALA  12           H        ALA  12   5.545  -9.239  -7.360
   93    HA   ALA  12           HA       ALA  12   7.659  -8.021  -5.778
   94   1HB   ALA  12          HB1       ALA  12   5.152  -8.986  -5.167
   95   2HB   ALA  12          HB2       ALA  12   6.192 -10.356  -4.712
   96   3HB   ALA  12          HB3       ALA  12   6.468  -8.753  -3.991
   97    H    ARG  13           H        ARG  13   9.687  -8.854  -5.667
   98    HA   ARG  13           HA       ARG  13   9.957 -11.637  -6.468
   99   1HB   ARG  13          HB2       ARG  13  12.272 -10.884  -7.397
  100   2HB   ARG  13          HB3       ARG  13  10.856 -10.475  -8.343
  101   1HG   ARG  13          HG2       ARG  13  10.906  -8.193  -7.686
  102   2HG   ARG  13          HG3       ARG  13  11.869  -8.522  -6.259
  103   1HD   ARG  13          HD2       ARG  13  12.777  -8.446  -9.159
  104   2HD   ARG  13          HD3       ARG  13  13.396  -7.521  -7.806
  105    HE   ARG  13           HE       ARG  13  13.996 -10.013  -6.959
  106   1HH1  ARG  13          HH22      ARG  13  14.392  -8.587 -10.179
  107   2HH1  ARG  13          HH21      ARG  13  15.753  -9.579 -10.586
  108   1HH2  ARG  13          HH11      ARG  13  16.557 -11.180  -8.995
  109    H    THR  14           H        THR  14  10.224  -9.359  -4.031
  110    HA   THR  14           HA       THR  14  12.641 -10.549  -2.868
  111    HB   THR  14           HB       THR  14  11.222  -8.260  -1.557
  112    HG1  THR  14           HG1      THR  14  12.716  -8.045  -4.067
  113   1HG2  THR  14          HG21      THR  14  14.027  -9.150  -2.199
  114   2HG2  THR  14          HG22      THR  14  13.736  -7.396  -2.133
  115   3HG2  THR  14          HG23      THR  14  13.393  -8.408  -0.710
  116    H    GLU  15           H        GLU  15  12.325 -10.424  -0.233
  117    HA   GLU  15           HA       GLU  15   9.900 -11.985   0.216
  118   1HB   GLU  15          HB2       GLU  15  12.756 -12.542   0.906
  119   2HB   GLU  15          HB3       GLU  15  11.581 -12.933   2.147
  120   1HG   GLU  15          HG2       GLU  15  10.769 -13.801  -0.577
  121   2HG   GLU  15          HG3       GLU  15  12.240 -14.564  -0.007
  122    HE2  GLU  15           HE2      GLU  15   9.726 -15.884  -0.260
  123    H    ASP  16           H        ASP  16   9.639  -9.304   0.527
  124    HA   ASP  16           HA       ASP  16   9.649  -9.068   3.420
  125   1HB   ASP  16          HB2       ASP  16  11.069  -7.380   1.470
  126   2HB   ASP  16          HB3       ASP  16   9.953  -6.437   2.436
  127    HD2  ASP  16           HD2      ASP  16  10.936  -5.572   3.921
  128    H    ASP  17           H        ASP  17   8.791  -7.069   0.485
  129    HA   ASP  17           HA       ASP  17   6.286  -6.411   1.665
  130   1HB   ASP  17          HB2       ASP  17   5.947  -5.142  -0.486
  131   2HB   ASP  17          HB3       ASP  17   7.429  -4.718   0.349
  132    HD2  ASP  17           HD2      ASP  17   7.678  -5.361  -3.308
  133    H    LEU  18           H        LEU  18   4.525  -6.370  -0.552
  134    HA   LEU  18           HA       LEU  18   4.542  -9.082  -1.625
  135   1HB   LEU  18          HB2       LEU  18   2.703  -8.029   0.399
  136   2HB   LEU  18          HB3       LEU  18   1.891  -8.695  -1.004
  137    HG   LEU  18           HG       LEU  18   3.838 -10.119   0.826
  138   1HD1  LEU  18          HD11      LEU  18   0.905 -10.638   0.264
  139   2HD1  LEU  18          HD12      LEU  18   1.949 -11.527   1.400
  140   3HD1  LEU  18          HD13      LEU  18   1.554  -9.818   1.705
  141   1HD2  LEU  18          HD21      LEU  18   3.210 -12.148  -0.598
  142   2HD2  LEU  18          HD22      LEU  18   2.671 -10.974  -1.822
  143   3HD2  LEU  18          HD23      LEU  18   4.369 -10.986  -1.289
  144    H    SER  19           H        SER  19   2.245  -9.099  -3.069
  145    HA   SER  19           HA       SER  19   2.686  -6.811  -4.805
  146   1HB   SER  19          HB2       SER  19   1.739  -8.208  -6.598
  147   2HB   SER  19          HB3       SER  19   3.064  -9.042  -5.809
  148    HG   SER  19           HG       SER  19   0.517  -9.524  -4.689
  149    H    PHE  20           H        PHE  20   0.853  -5.625  -5.666
  150    HA   PHE  20           HA       PHE  20  -1.579  -6.024  -4.070
  151   1HB   PHE  20          HB2       PHE  20   0.103  -3.710  -4.968
  152   2HB   PHE  20          HB3       PHE  20  -1.615  -3.449  -5.199
  153    HD1  PHE  20           HD1      PHE  20   1.074  -3.412  -2.860
  154    HD2  PHE  20           HD2      PHE  20  -3.144  -3.756  -3.164
  155    HE1  PHE  20           HE1      PHE  20   0.847  -2.772  -0.443
  156    HE2  PHE  20           HE2      PHE  20  -3.371  -3.116  -0.748
  157    HZ   PHE  20           HZ       PHE  20  -1.373  -2.632   0.584
  158    H    HIS  21           H        HIS  21  -3.648  -5.392  -5.165
  159    HA   HIS  21           HA       HIS  21  -3.456  -6.024  -8.018
  160   1HB   HIS  21          HB2       HIS  21  -5.303  -6.887  -5.859
  161   2HB   HIS  21          HB3       HIS  21  -6.045  -6.546  -7.410
  162    HD1  HIS  21           HD1      HIS  21  -2.890  -8.462  -6.313
  163    HD2  HIS  21           HD2      HIS  21  -6.183  -8.822  -8.887
  164    HE1  HIS  21           HE1      HIS  21  -2.645 -10.719  -7.477
  165    H    LYS  22           H        LYS  22  -4.940  -4.895  -9.478
  166    HA   LYS  22           HA       LYS  22  -5.084  -2.146  -8.860
  167   1HB   LYS  22          HB2       LYS  22  -4.916  -3.540 -11.147
  168   2HB   LYS  22          HB3       LYS  22  -6.649  -3.289 -11.127
  169   1HG   LYS  22          HG2       LYS  22  -5.596  -0.778 -10.389
  170   2HG   LYS  22          HG3       LYS  22  -4.494  -1.350 -11.626
  171   1HD   LYS  22          HD2       LYS  22  -6.039  -1.091 -13.285
  172   2HD   LYS  22          HD3       LYS  22  -7.303  -1.862 -12.349
  173   1HE   LYS  22          HE2       LYS  22  -6.423   1.054 -12.223
  174   2HE   LYS  22          HE3       LYS  22  -7.988   0.433 -12.709
  175   1HZ   LYS  22          HZ1       LYS  22  -7.902  -0.560 -10.271
  176   2HZ   LYS  22          HZ2       LYS  22  -6.898   0.695 -10.008
  177    H    GLY  23           H        GLY  23  -6.745  -0.882  -8.099
  178   1HA   GLY  23          HA3       GLY  23  -8.752  -0.336  -7.243
  179   2HA   GLY  23          HA2       GLY  23  -9.462  -1.658  -8.147
  180    H    GLU  24           H        GLU  24  -7.304  -1.125  -5.266
  181    HA   GLU  24           HA       GLU  24  -8.855  -3.225  -3.963
  182   1HB   GLU  24          HB2       GLU  24  -5.889  -2.808  -4.139
  183   2HB   GLU  24          HB3       GLU  24  -6.515  -3.372  -2.602
  184   1HG   GLU  24          HG2       GLU  24  -7.409  -4.717  -5.167
  185   2HG   GLU  24          HG3       GLU  24  -5.850  -5.121  -4.475
  186    HE2  GLU  24           HE2      GLU  24  -7.129  -4.800  -1.620
  187    H    LYS  25           H        LYS  25  -7.675  -2.902  -1.362
  188    HA   LYS  25           HA       LYS  25  -8.744  -0.251  -0.711
  189   1HB   LYS  25          HB2       LYS  25  -8.428  -2.648   1.116
  190   2HB   LYS  25          HB3       LYS  25  -9.266  -1.151   1.469
  191   1HG   LYS  25          HG2       LYS  25 -10.072  -2.876  -0.904
  192   2HG   LYS  25          HG3       LYS  25 -10.685  -3.208   0.704
  193   1HD   LYS  25          HD2       LYS  25 -11.881  -1.172   0.823
  194   2HD   LYS  25          HD3       LYS  25 -10.871  -0.387  -0.373
  195   1HE   LYS  25          HE2       LYS  25 -11.830  -2.177  -2.045
  196   2HE   LYS  25          HE3       LYS  25 -13.061  -2.445  -0.827
  197   1HZ   LYS  25          HZ1       LYS  25 -13.711  -0.729  -2.452
  198   2HZ   LYS  25          HZ2       LYS  25 -13.647  -0.096  -0.953
  199    H    PHE  26           H        PHE  26  -7.521   1.244   0.420
  200    HA   PHE  26           HA       PHE  26  -4.843   0.363   1.208
  201   1HB   PHE  26          HB2       PHE  26  -5.474   1.865  -1.073
  202   2HB   PHE  26          HB3       PHE  26  -5.215   3.136   0.106
  203    HD1  PHE  26           HD1      PHE  26  -3.003   3.395   1.182
  204    HD2  PHE  26           HD2      PHE  26  -3.644   0.566  -1.915
  205    HE1  PHE  26           HE1      PHE  26  -0.524   3.212   0.836
  206    HE2  PHE  26           HE2      PHE  26  -1.165   0.384  -2.262
  207    HZ   PHE  26           HZ       PHE  26   0.366   1.709  -0.882
  208    H    GLN  27           H        GLN  27  -5.123   0.483   3.428
  209    HA   GLN  27           HA       GLN  27  -6.432   2.843   4.457
  210   1HB   GLN  27          HB2       GLN  27  -5.627   0.172   5.628
  211   2HB   GLN  27          HB3       GLN  27  -5.975   1.516   6.696
  212   1HG   GLN  27          HG2       GLN  27  -8.217   1.792   5.618
  213   2HG   GLN  27          HG3       GLN  27  -7.870   0.447   4.552
  214   1HE2  GLN  27          HE21      GLN  27  -7.684  -1.651   5.376
  215   2HE2  GLN  27          HE22      GLN  27  -8.373  -2.118   6.896
  216    H    ILE  28           H        ILE  28  -5.415   4.244   6.054
  217    HA   ILE  28           HA       ILE  28  -2.484   4.145   5.871
  218    HB   ILE  28           HB       ILE  28  -3.551   6.035   4.716
  219   1HG1  ILE  28          HG12      ILE  28  -2.300   7.681   6.653
  220   2HG1  ILE  28          HG13      ILE  28  -1.468   6.139   6.707
  221   1HG2  ILE  28          HG21      ILE  28  -5.515   6.559   5.805
  222   2HG2  ILE  28          HG22      ILE  28  -4.771   6.487   7.420
  223   3HG2  ILE  28          HG23      ILE  28  -4.439   7.868   6.347
  224   1HD1  ILE  28          HD11      ILE  28  -2.096   7.461   4.046
  225   2HD1  ILE  28          HD12      ILE  28  -0.650   7.912   4.980
  226   3HD1  ILE  28          HD13      ILE  28  -0.856   6.238   4.414
  227    H    LEU  29           H        LEU  29  -1.295   4.909   7.808
  228    HA   LEU  29           HA       LEU  29  -2.644   5.234  10.259
  229   1HB   LEU  29          HB2       LEU  29  -2.869   2.703   9.625
  230   2HB   LEU  29          HB3       LEU  29  -1.200   2.613  10.152
  231    HG   LEU  29           HG       LEU  29  -2.624   4.023  12.170
  232   1HD1  LEU  29          HD11      LEU  29  -4.240   2.173  12.815
  233   2HD1  LEU  29          HD12      LEU  29  -4.723   3.217  11.457
  234   3HD1  LEU  29          HD13      LEU  29  -4.083   1.586  11.142
  235   1HD2  LEU  29          HD21      LEU  29  -2.090   1.836  13.443
  236   2HD2  LEU  29          HD22      LEU  29  -1.266   1.349  11.942
  237   3HD2  LEU  29          HD23      LEU  29  -0.745   2.813  12.807
  238    H    ASN  30           H        ASN  30   0.396   3.686   8.989
  239    HA   ASN  30           HA       ASN  30   1.946   5.067  10.887
  240   1HB   ASN  30          HB2       ASN  30   2.410   2.827   9.523
  241   2HB   ASN  30          HB3       ASN  30   3.064   3.906   8.307
  242   1HD2  ASN  30          HD21      ASN  30   3.120   3.552  11.856
  243   2HD2  ASN  30          HD22      ASN  30   4.825   3.769  12.070
  244    H    SER  31           H        SER  31   3.052   7.057  10.631
  245    HA   SER  31           HA       SER  31   3.623   8.097   8.087
  246   1HB   SER  31          HB2       SER  31   2.177  10.224   8.466
  247   2HB   SER  31          HB3       SER  31   1.383   8.791   7.843
  248    HG   SER  31           HG       SER  31   0.770  10.172  10.067
  249    H    SER  32           H        SER  32   5.703   8.078   9.233
  250    HA   SER  32           HA       SER  32   5.862   9.936  11.447
  251   1HB   SER  32          HB2       SER  32   8.220   8.365  10.403
  252   2HB   SER  32          HB3       SER  32   7.881   8.881  12.042
  253    HG   SER  32           HG       SER  32   6.150   6.995  10.729
  254    H    GLU  33           H        GLU  33   8.000   9.126   8.608
  255    HA   GLU  33           HA       GLU  33   8.280  12.008   8.231
  256   1HB   GLU  33          HB2       GLU  33  10.390   9.859   7.737
  257   2HB   GLU  33          HB3       GLU  33  10.599  11.573   7.445
  258   1HG   GLU  33          HG2       GLU  33  10.597  12.110   9.749
  259   2HG   GLU  33          HG3       GLU  33   9.729  10.655  10.194
  260    HE2  GLU  33           HE2      GLU  33  13.084  10.839   8.510
  261    H    GLY  34           H        GLY  34  10.069  10.253   5.938
  262   1HA   GLY  34          HA3       GLY  34   7.819   9.866   4.102
  263   2HA   GLY  34          HA2       GLY  34   9.036  11.051   3.668
  264    H    ASP  35           H        ASP  35   8.193   7.691   3.722
  265    HA   ASP  35           HA       ASP  35  10.524   7.087   2.236
  266   1HB   ASP  35          HB2       ASP  35  10.809   6.772   4.974
  267   2HB   ASP  35          HB3       ASP  35  10.235   5.183   4.510
  268    HD2  ASP  35           HD2      ASP  35  12.683   7.434   3.262
  269    H    TRP  36           H        TRP  36   8.535   5.028   4.473
  270    HA   TRP  36           HA       TRP  36   7.161   3.943   2.111
  271   1HB   TRP  36          HB2       TRP  36   8.286   2.420   4.467
  272   2HB   TRP  36          HB3       TRP  36   7.189   1.741   3.280
  273    HD1  TRP  36           HD1      TRP  36   8.746   3.252   0.726
  274    HE1  TRP  36           HE1      TRP  36  10.997   2.241  -0.206
  275    HE3  TRP  36           HE3      TRP  36   9.880   0.573   4.896
  276    HZ2  TRP  36           HZ2      TRP  36  12.957   0.474   0.881
  277    HZ3  TRP  36           HZ3      TRP  36  11.981  -0.769   4.878
  278    HH2  TRP  36           HH2      TRP  36  13.496  -0.846   2.962
  279    H    TRP  37           H        TRP  37   4.944   3.269   2.533
  280    HA   TRP  37           HA       TRP  37   3.889   4.363   5.053
  281   1HB   TRP  37          HB2       TRP  37   3.030   4.769   2.232
  282   2HB   TRP  37          HB3       TRP  37   1.775   4.608   3.445
  283    HD1  TRP  37           HD1      TRP  37   1.828   6.538   5.474
  284    HE1  TRP  37           HE1      TRP  37   2.598   9.062   5.506
  285    HE3  TRP  37           HE3      TRP  37   4.669   6.271   1.265
  286    HZ2  TRP  37           HZ2      TRP  37   4.273  10.628   3.806
  287    HZ3  TRP  37           HZ3      TRP  37   5.839   8.343   0.520
  288    HH2  TRP  37           HH2      TRP  37   5.675  10.468   1.716
  289    H    GLU  38           H        GLU  38   2.346   3.058   6.116
  290    HA   GLU  38           HA       GLU  38   2.408   0.326   5.293
  291   1HB   GLU  38          HB2       GLU  38   2.086   1.747   7.746
  292   2HB   GLU  38          HB3       GLU  38   0.606   0.838   7.514
  293   1HG   GLU  38          HG2       GLU  38   2.097  -1.207   6.992
  294   2HG   GLU  38          HG3       GLU  38   3.452  -0.254   7.564
  295    HE2  GLU  38           HE2      GLU  38   0.704  -1.945   8.471
  296    H    ALA  39           H        ALA  39   0.826  -0.770   4.182
  297    HA   ALA  39           HA       ALA  39  -1.743   0.630   3.871
  298   1HB   ALA  39          HB1       ALA  39  -1.019   0.763   1.711
  299   2HB   ALA  39          HB2       ALA  39   0.153  -0.561   1.911
  300   3HB   ALA  39          HB3       ALA  39  -1.568  -0.929   1.646
  301    H    ARG  40           H        ARG  40  -2.534  -0.520   5.767
  302    HA   ARG  40           HA       ARG  40  -2.403  -3.325   5.818
  303   1HB   ARG  40          HB2       ARG  40  -3.016  -1.325   7.650
  304   2HB   ARG  40          HB3       ARG  40  -4.599  -2.017   7.354
  305   1HG   ARG  40          HG2       ARG  40  -3.985  -3.550   8.938
  306   2HG   ARG  40          HG3       ARG  40  -3.115  -4.314   7.623
  307   1HD   ARG  40          HD2       ARG  40  -1.135  -3.914   8.658
  308   2HD   ARG  40          HD3       ARG  40  -1.453  -2.191   8.662
  309    HE   ARG  40           HE       ARG  40  -2.488  -2.400  10.848
  310   1HH1  ARG  40          HH22      ARG  40  -1.043  -5.414   9.670
  311   2HH1  ARG  40          HH21      ARG  40  -0.992  -6.147  11.238
  312   1HH2  ARG  40          HH11      ARG  40  -1.806  -4.927  13.133
  313    H    SER  41           H        SER  41  -3.830  -4.842   4.958
  314    HA   SER  41           HA       SER  41  -5.967  -3.756   3.360
  315   1HB   SER  41          HB2       SER  41  -4.203  -5.600   2.678
  316   2HB   SER  41          HB3       SER  41  -5.262  -6.695   3.544
  317    HG   SER  41           HG       SER  41  -5.780  -6.561   1.259
  318    H    LEU  42           H        LEU  42  -8.190  -4.277   3.661
  319    HA   LEU  42           HA       LEU  42  -8.769  -5.383   6.304
  320   1HB   LEU  42          HB2       LEU  42 -10.908  -4.269   6.102
  321   2HB   LEU  42          HB3       LEU  42  -9.575  -3.147   5.912
  322    HG   LEU  42           HG       LEU  42 -10.219  -3.966   3.297
  323   1HD1  LEU  42          HD11      LEU  42 -12.658  -3.697   5.030
  324   2HD1  LEU  42          HD12      LEU  42 -12.694  -3.157   3.334
  325   3HD1  LEU  42          HD13      LEU  42 -12.311  -4.852   3.721
  326   1HD2  LEU  42          HD21      LEU  42  -9.490  -1.801   3.516
  327   2HD2  LEU  42          HD22      LEU  42 -11.239  -1.543   3.305
  328   3HD2  LEU  42          HD23      LEU  42 -10.519  -1.474   4.931
  329    H    THR  43           H        THR  43  -8.107  -6.749   3.538
  330    HA   THR  43           HA       THR  43 -10.538  -8.408   3.454
  331    HB   THR  43           HB       THR  43  -8.644  -8.719   1.229
  332    HG1  THR  43           HG1      THR  43  -8.157  -6.553   1.211
  333   1HG2  THR  43          HG21      THR  43 -10.945  -9.294   0.812
  334   2HG2  THR  43          HG22      THR  43 -11.533  -7.794   1.569
  335   3HG2  THR  43          HG23      THR  43 -10.715  -7.732  -0.011
  336    H    THR  44           H        THR  44  -7.168  -9.076   2.381
  337    HA   THR  44           HA       THR  44  -7.328 -11.639   3.695
  338    HB   THR  44           HB       THR  44  -4.794 -10.662   2.425
  339    HG1  THR  44           HG1      THR  44  -7.463 -10.841   1.241
  340   1HG2  THR  44          HG21      THR  44  -4.753 -12.820   1.485
  341   2HG2  THR  44          HG22      THR  44  -5.654 -13.143   2.986
  342   3HG2  THR  44          HG23      THR  44  -6.528 -12.944   1.449
  343    H    GLY  45           H        GLY  45  -5.418  -8.595   4.039
  344   1HA   GLY  45          HA3       GLY  45  -4.770  -7.747   6.106
  345   2HA   GLY  45          HA2       GLY  45  -4.952  -9.330   6.835
  346    H    GLU  46           H        GLU  46  -3.157  -8.237   3.870
  347    HA   GLU  46           HA       GLU  46  -0.854  -9.630   4.953
  348   1HB   GLU  46          HB2       GLU  46  -0.010  -9.178   2.501
  349   2HB   GLU  46          HB3       GLU  46  -1.201 -10.432   2.787
  350   1HG   GLU  46          HG2       GLU  46  -3.033  -8.907   2.149
  351   2HG   GLU  46          HG3       GLU  46  -1.912  -7.567   2.000
  352    HE2  GLU  46           HE2      GLU  46  -1.363 -10.748   1.113
  353    H    THR  47           H        THR  47   1.022  -8.562   5.550
  354    HA   THR  47           HA       THR  47   0.918  -5.639   5.368
  355    HB   THR  47           HB       THR  47   1.145  -6.565   7.627
  356    HG1  THR  47           HG1      THR  47   2.503  -4.744   7.240
  357   1HG2  THR  47          HG21      THR  47   3.077  -7.972   8.248
  358   2HG2  THR  47          HG22      THR  47   2.144  -8.802   6.979
  359   3HG2  THR  47          HG23      THR  47   3.657  -7.961   6.565
  360    H    GLY  48           H        GLY  48   2.637  -4.389   4.569
  361   1HA   GLY  48          HA3       GLY  48   5.012  -5.548   3.541
  362   2HA   GLY  48          HA2       GLY  48   3.846  -5.320   2.254
  363    H    TYR  49           H        TYR  49   6.290  -3.903   2.279
  364    HA   TYR  49           HA       TYR  49   5.316  -1.180   2.808
  365   1HB   TYR  49          HB2       TYR  49   8.034  -2.567   3.196
  366   2HB   TYR  49          HB3       TYR  49   7.905  -0.819   3.167
  367    HD1  TYR  49           HD1      TYR  49   7.894  -3.674   5.241
  368    HD2  TYR  49           HD2      TYR  49   6.140   0.210   4.864
  369    HE1  TYR  49           HE1      TYR  49   7.362  -3.665   7.727
  370    HE2  TYR  49           HE2      TYR  49   5.615   0.206   7.351
  371    HH   TYR  49           HH       TYR  49   5.687  -2.559   9.203
  372    H    ILE  50           H        ILE  50   5.062  -0.096   0.925
  373    HA   ILE  50           HA       ILE  50   7.137  -0.405  -1.090
  374    HB   ILE  50           HB       ILE  50   5.088  -0.405  -2.762
  375   1HG1  ILE  50          HG12      ILE  50   3.780  -2.383  -1.097
  376   2HG1  ILE  50          HG13      ILE  50   3.764  -0.818  -0.309
  377   1HG2  ILE  50          HG21      ILE  50   6.920  -1.999  -2.788
  378   2HG2  ILE  50          HG22      ILE  50   6.211  -2.875  -1.410
  379   3HG2  ILE  50          HG23      ILE  50   5.364  -2.842  -2.975
  380   1HD1  ILE  50          HD11      ILE  50   3.188  -0.545  -3.169
  381   2HD1  ILE  50          HD12      ILE  50   2.055  -1.667  -2.378
  382   3HD1  ILE  50          HD13      ILE  50   2.231  -0.004  -1.769
  383    HA   PRO  51           HA       PRO  51   6.624   3.879  -1.169
  384   1HB   PRO  51          HB2       PRO  51   7.824   4.480  -3.550
  385   2HB   PRO  51          HB3       PRO  51   8.719   4.203  -2.068
  386   1HG   PRO  51          HG2       PRO  51   8.404   2.420  -4.406
  387   2HG   PRO  51          HG3       PRO  51   9.606   2.358  -3.132
  388   1HD   PRO  51          HD2       PRO  51   7.308   0.664  -3.407
  389   2HD   PRO  51          HD3       PRO  51   8.444   0.680  -2.074
  390    H    SER  52           H        SER  52   4.708   4.849  -1.264
  391    HA   SER  52           HA       SER  52   3.207   4.268  -3.675
  392   1HB   SER  52          HB2       SER  52   2.538   4.754  -0.860
  393   2HB   SER  52          HB3       SER  52   1.587   5.773  -1.923
  394    HG   SER  52           HG       SER  52   1.072   3.767  -3.156
  395    H    ASN  53           H        ASN  53   4.805   5.783  -4.824
  396    HA   ASN  53           HA       ASN  53   4.229   8.561  -4.220
  397   1HB   ASN  53          HB2       ASN  53   6.295   7.398  -6.160
  398   2HB   ASN  53          HB3       ASN  53   6.198   9.067  -5.636
  399   1HD2  ASN  53          HD21      ASN  53   7.157   9.699  -3.819
  400   2HD2  ASN  53          HD22      ASN  53   7.982   8.675  -2.692
  401    H    TYR  54           H        TYR  54   3.123   6.010  -6.127
  402    HA   TYR  54           HA       TYR  54   2.362   7.820  -8.321
  403   1HB   TYR  54          HB2       TYR  54   3.230   4.916  -8.048
  404   2HB   TYR  54          HB3       TYR  54   2.055   5.274  -9.298
  405    HD1  TYR  54           HD1      TYR  54   2.823   7.671 -10.579
  406    HD2  TYR  54           HD2      TYR  54   5.372   4.681  -8.885
  407    HE1  TYR  54           HE1      TYR  54   4.704   8.383 -12.135
  408    HE2  TYR  54           HE2      TYR  54   7.244   5.402 -10.448
  409    HH   TYR  54           HH       TYR  54   6.742   8.064 -12.752
  410    H    VAL  55           H        VAL  55   0.727   8.160  -6.264
  411    HA   VAL  55           HA       VAL  55  -1.553   6.417  -6.892
  412    HB   VAL  55           HB       VAL  55  -2.189   7.058  -4.436
  413   1HG1  VAL  55          HG11      VAL  55  -1.819   4.772  -5.298
  414   2HG1  VAL  55          HG12      VAL  55  -0.070   4.961  -5.022
  415   3HG1  VAL  55          HG13      VAL  55  -1.196   4.973  -3.643
  416   1HG2  VAL  55          HG21      VAL  55   0.302   6.801  -3.278
  417   2HG2  VAL  55          HG22      VAL  55   0.613   7.919  -4.627
  418   3HG2  VAL  55          HG23      VAL  55  -0.630   8.312  -3.414
  419    H    ALA  56           H        ALA  56  -3.641   7.685  -5.857
  420    HA   ALA  56           HA       ALA  56  -3.381  10.486  -6.695
  421   1HB   ALA  56          HB1       ALA  56  -5.344   8.370  -7.595
  422   2HB   ALA  56          HB2       ALA  56  -5.781  10.095  -7.626
  423   3HB   ALA  56          HB3       ALA  56  -4.396   9.509  -8.579
  424    HA   PRO  57           HA       PRO  57  -5.628  11.065  -3.021
  425   1HB   PRO  57          HB2       PRO  57  -6.049  13.761  -3.176
  426   2HB   PRO  57          HB3       PRO  57  -4.534  13.056  -2.652
  427   1HG   PRO  57          HG2       PRO  57  -5.188  14.332  -5.237
  428   2HG   PRO  57          HG3       PRO  57  -3.612  14.013  -4.538
  429   1HD   PRO  57          HD2       PRO  57  -4.887  12.536  -6.640
  430   2HD   PRO  57          HD3       PRO  57  -3.365  12.151  -5.862
  431    H    VAL  58           H        VAL  58  -7.422   9.720  -3.427
  432    HA   VAL  58           HA       VAL  58  -9.688  11.253  -4.490
  433    HB   VAL  58           HB       VAL  58 -10.690   9.020  -4.881
  434   1HG1  VAL  58          HG11      VAL  58  -9.198   8.411  -6.800
  435   2HG1  VAL  58          HG12      VAL  58  -9.621  10.139  -6.728
  436   3HG1  VAL  58          HG13      VAL  58  -8.014   9.593  -6.192
  437   1HG2  VAL  58          HG21      VAL  58  -9.672   7.031  -4.403
  438   2HG2  VAL  58          HG22      VAL  58  -8.031   7.698  -4.574
  439   3HG2  VAL  58          HG23      VAL  58  -8.971   8.016  -3.096
  440    H    ASP  59           H        ASP  59 -11.690  11.250  -3.340
  441    HA   ASP  59           HA       ASP  59 -11.318  10.508  -0.547
  442   1HB   ASP  59          HB2       ASP  59 -12.408  12.880  -1.895
  443   2HB   ASP  59          HB3       ASP  59 -13.570  12.211  -0.767
  444    HD2  ASP  59           HD2      ASP  59 -10.309  11.970   0.767
  Start of MODEL   19
    1   1H    VAL   1           H        VAL   1 -14.706   9.692   4.169
    2    HA   VAL   1           HA       VAL   1 -13.601   7.632   5.511
    3    HB   VAL   1           HB       VAL   1 -13.139   6.054   3.498
    4   1HG1  VAL   1          HG11      VAL   1 -14.585   4.555   4.439
    5   2HG1  VAL   1          HG12      VAL   1 -14.630   5.809   5.701
    6   3HG1  VAL   1          HG13      VAL   1 -15.934   5.715   4.494
    7   1HG2  VAL   1          HG21      VAL   1 -14.368   7.593   1.891
    8   2HG2  VAL   1          HG22      VAL   1 -14.827   5.873   1.834
    9   3HG2  VAL   1          HG23      VAL   1 -15.876   7.047   2.664
   10    H    THR   2           H        THR   2 -11.374   7.859   5.431
   11    HA   THR   2           HA       THR   2 -10.401   9.690   3.340
   12    HB   THR   2           HB       THR   2  -8.717  10.338   5.074
   13    HG1  THR   2           HG1      THR   2 -10.333   8.374   6.543
   14   1HG2  THR   2          HG21      THR   2 -10.187  11.767   6.095
   15   2HG2  THR   2          HG22      THR   2 -11.481  10.926   5.210
   16   3HG2  THR   2          HG23      THR   2 -11.053  10.415   6.861
   17    H    LEU   3           H        LEU   3 -10.651   7.192   2.393
   18    HA   LEU   3           HA       LEU   3  -8.111   5.851   2.865
   19   1HB   LEU   3          HB2       LEU   3 -10.369   4.943   1.092
   20   2HB   LEU   3          HB3       LEU   3  -9.054   3.989   1.748
   21    HG   LEU   3           HG       LEU   3 -11.167   5.289   3.480
   22   1HD1  LEU   3          HD11      LEU   3 -12.181   3.709   1.845
   23   2HD1  LEU   3          HD12      LEU   3 -11.142   2.422   2.503
   24   3HD1  LEU   3          HD13      LEU   3 -12.357   3.204   3.542
   25   1HD2  LEU   3          HD21      LEU   3 -10.213   4.289   5.262
   26   2HD2  LEU   3          HD22      LEU   3  -9.726   2.847   4.337
   27   3HD2  LEU   3          HD23      LEU   3  -8.758   4.338   4.238
   28    H    PHE   4           H        PHE   4  -7.484   4.730   0.459
   29    HA   PHE   4           HA       PHE   4  -7.324   6.986  -1.399
   30   1HB   PHE   4          HB2       PHE   4  -5.152   5.218  -0.160
   31   2HB   PHE   4          HB3       PHE   4  -4.875   5.969  -1.719
   32    HD1  PHE   4           HD1      PHE   4  -6.324   8.588  -1.149
   33    HD2  PHE   4           HD2      PHE   4  -3.513   6.348   1.107
   34    HE1  PHE   4           HE1      PHE   4  -5.569  10.690  -0.004
   35    HE2  PHE   4           HE2      PHE   4  -2.760   8.450   2.254
   36    HZ   PHE   4           HZ       PHE   4  -3.797  10.596   1.685
   37    H    VAL   5           H        VAL   5  -6.030   5.991  -3.505
   38    HA   VAL   5           HA       VAL   5  -7.160   3.340  -4.018
   39    HB   VAL   5           HB       VAL   5  -8.638   5.228  -4.834
   40   1HG1  VAL   5          HG11      VAL   5  -6.239   6.248  -5.831
   41   2HG1  VAL   5          HG12      VAL   5  -7.094   5.647  -7.271
   42   3HG1  VAL   5          HG13      VAL   5  -7.880   6.830  -6.199
   43   1HG2  VAL   5          HG21      VAL   5  -9.057   3.111  -5.756
   44   2HG2  VAL   5          HG22      VAL   5  -8.844   4.164  -7.175
   45   3HG2  VAL   5          HG23      VAL   5  -7.521   3.093  -6.655
   46    H    ALA   6           H        ALA   6  -5.808   1.990  -5.170
   47    HA   ALA   6           HA       ALA   6  -3.347   3.240  -6.186
   48   1HB   ALA   6          HB1       ALA   6  -3.755   0.696  -4.578
   49   2HB   ALA   6          HB2       ALA   6  -2.269   1.025  -5.501
   50   3HB   ALA   6          HB3       ALA   6  -2.749   2.106  -4.170
   51    H    LEU   7           H        LEU   7  -3.120   2.985  -8.347
   52    HA   LEU   7           HA       LEU   7  -4.394   0.616  -9.530
   53   1HB   LEU   7          HB2       LEU   7  -4.377   3.471 -10.493
   54   2HB   LEU   7          HB3       LEU   7  -4.687   2.122 -11.568
   55    HG   LEU   7           HG       LEU   7  -6.316   2.524  -9.061
   56   1HD1  LEU   7          HD11      LEU   7  -7.433   4.263  -9.874
   57   2HD1  LEU   7          HD12      LEU   7  -6.174   4.405 -11.123
   58   3HD1  LEU   7          HD13      LEU   7  -7.651   3.468 -11.452
   59   1HD2  LEU   7          HD21      LEU   7  -7.280   0.643  -9.728
   60   2HD2  LEU   7          HD22      LEU   7  -7.829   1.476 -11.203
   61   3HD2  LEU   7          HD23      LEU   7  -6.277   0.606 -11.197
   62    H    TYR   8           H        TYR   8  -1.695   0.839  -8.457
   63    HA   TYR   8           HA       TYR   8  -0.287   0.183 -10.904
   64   1HB   TYR   8          HB2       TYR   8  -0.130   2.752 -10.019
   65   2HB   TYR   8          HB3       TYR   8   0.971   2.056  -8.847
   66    HD1  TYR   8           HD1      TYR   8   2.813   0.411  -9.984
   67    HD2  TYR   8           HD2      TYR   8   0.809   3.647 -11.937
   68    HE1  TYR   8           HE1      TYR   8   4.704   0.571 -11.676
   69    HE2  TYR   8           HE2      TYR   8   2.707   3.796 -13.623
   70    HH   TYR   8           HH       TYR   8   5.575   2.731 -13.203
   71    H    ASP   9           H        ASP   9   0.284  -1.887 -10.394
   72    HA   ASP   9           HA       ASP   9   1.120  -2.384  -7.672
   73   1HB   ASP   9          HB2       ASP   9   1.238  -4.828  -8.812
   74   2HB   ASP   9          HB3       ASP   9  -0.259  -4.154  -8.201
   75    HD2  ASP   9           HD2      ASP   9   0.812  -2.794 -11.209
   76    H    TYR  10           H        TYR  10   3.048  -4.153  -7.611
   77    HA   TYR  10           HA       TYR  10   4.959  -3.723  -9.762
   78   1HB   TYR  10          HB2       TYR  10   4.962  -2.073  -7.566
   79   2HB   TYR  10          HB3       TYR  10   5.817  -3.430  -6.860
   80    HD1  TYR  10           HD1      TYR  10   5.909  -1.295  -9.948
   81    HD2  TYR  10           HD2      TYR  10   8.135  -3.472  -7.014
   82    HE1  TYR  10           HE1      TYR  10   8.083  -0.467 -10.974
   83    HE2  TYR  10           HE2      TYR  10  10.302  -2.638  -8.051
   84    HH   TYR  10           HH       TYR  10  10.297  -0.170 -10.497
   85    H    GLU  11           H        GLU  11   6.690  -5.304  -9.779
   86    HA   GLU  11           HA       GLU  11   5.832  -7.731  -8.493
   87   1HB   GLU  11          HB2       GLU  11   8.026  -7.203 -10.547
   88   2HB   GLU  11          HB3       GLU  11   7.572  -8.792  -9.966
   89   1HG   GLU  11          HG2       GLU  11   5.429  -8.704 -10.993
   90   2HG   GLU  11          HG3       GLU  11   5.453  -6.955 -11.121
   91    HE2  GLU  11           HE2      GLU  11   6.810  -9.833 -12.694
   92    H    ALA  12           H        ALA  12   6.750  -8.537  -6.650
   93    HA   ALA  12           HA       ALA  12   9.240  -7.260  -5.772
   94   1HB   ALA  12          HB1       ALA  12   8.393  -8.389  -3.538
   95   2HB   ALA  12          HB2       ALA  12   7.665  -6.866  -4.105
   96   3HB   ALA  12          HB3       ALA  12   6.828  -8.412  -4.385
   97    H    ARG  13           H        ARG  13  11.089  -8.440  -5.803
   98    HA   ARG  13           HA       ARG  13  10.745 -11.293  -6.213
   99   1HB   ARG  13          HB2       ARG  13  12.444  -9.304  -7.425
  100   2HB   ARG  13          HB3       ARG  13  13.489 -10.423  -6.573
  101   1HG   ARG  13          HG2       ARG  13  11.774 -12.201  -7.766
  102   2HG   ARG  13          HG3       ARG  13  11.721 -10.901  -8.939
  103   1HD   ARG  13          HD2       ARG  13  14.088 -12.575  -8.073
  104   2HD   ARG  13          HD3       ARG  13  13.547 -12.197  -9.696
  105    HE   ARG  13           HE       ARG  13  15.194 -10.477  -7.945
  106   1HH1  ARG  13          HH22      ARG  13  13.294 -10.705 -10.927
  107   2HH1  ARG  13          HH21      ARG  13  14.035  -9.318 -11.653
  108   1HH2  ARG  13          HH11      ARG  13  15.725  -8.124 -10.444
  109    H    THR  14           H        THR  14  11.186  -9.163  -3.725
  110    HA   THR  14           HA       THR  14  13.296 -10.679  -2.382
  111    HB   THR  14           HB       THR  14  12.436  -8.617  -0.705
  112    HG1  THR  14           HG1      THR  14  12.294  -6.877  -2.462
  113   1HG2  THR  14          HG21      THR  14  14.809  -9.190  -1.766
  114   2HG2  THR  14          HG22      THR  14  14.324  -8.004  -3.001
  115   3HG2  THR  14          HG23      THR  14  14.446  -7.513  -1.295
  116    H    GLU  15           H        GLU  15  12.693 -10.658   0.215
  117    HA   GLU  15           HA       GLU  15  10.228 -12.215   0.252
  118   1HB   GLU  15          HB2       GLU  15  12.182 -12.517   2.488
  119   2HB   GLU  15          HB3       GLU  15  11.229 -13.736   1.663
  120   1HG   GLU  15          HG2       GLU  15  13.426 -12.356   0.116
  121   2HG   GLU  15          HG3       GLU  15  13.882 -13.560   1.305
  122    HE2  GLU  15           HE2      GLU  15  13.392 -14.264  -2.094
  123    H    ASP  16           H        ASP  16  11.229  -9.173   0.864
  124    HA   ASP  16           HA       ASP  16  10.316  -8.904   3.542
  125   1HB   ASP  16          HB2       ASP  16  12.073  -7.449   2.375
  126   2HB   ASP  16          HB3       ASP  16  10.771  -6.733   1.445
  127    HD2  ASP  16           HD2      ASP  16  10.517  -4.771   2.275
  128    H    ASP  17           H        ASP  17   9.275  -7.583   0.297
  129    HA   ASP  17           HA       ASP  17   6.595  -7.347   1.403
  130   1HB   ASP  17          HB2       ASP  17   6.525  -6.073  -1.051
  131   2HB   ASP  17          HB3       ASP  17   6.802  -5.273   0.483
  132    HD2  ASP  17           HD2      ASP  17   7.825  -4.711  -2.215
  133    H    LEU  18           H        LEU  18   4.786  -7.821  -0.286
  134    HA   LEU  18           HA       LEU  18   5.656  -9.995  -2.063
  135   1HB   LEU  18          HB2       LEU  18   3.096 -10.626  -1.589
  136   2HB   LEU  18          HB3       LEU  18   4.455 -11.265  -0.684
  137    HG   LEU  18           HG       LEU  18   3.990  -9.109   0.827
  138   1HD1  LEU  18          HD11      LEU  18   1.829  -8.320   0.887
  139   2HD1  LEU  18          HD12      LEU  18   2.064  -8.561  -0.860
  140   3HD1  LEU  18          HD13      LEU  18   1.158  -9.763   0.090
  141   1HD2  LEU  18          HD21      LEU  18   3.458 -10.631   2.372
  142   2HD2  LEU  18          HD22      LEU  18   2.029 -11.186   1.469
  143   3HD2  LEU  18          HD23      LEU  18   3.640 -11.832   1.071
  144    H    SER  19           H        SER  19   3.420 -10.383  -3.576
  145    HA   SER  19           HA       SER  19   3.407  -7.933  -5.068
  146   1HB   SER  19          HB2       SER  19   3.645 -10.406  -5.956
  147   2HB   SER  19          HB3       SER  19   1.896 -10.443  -5.838
  148    HG   SER  19           HG       SER  19   1.825  -8.546  -7.237
  149    H    PHE  20           H        PHE  20   1.387  -6.892  -5.808
  150    HA   PHE  20           HA       PHE  20  -0.998  -7.657  -4.330
  151   1HB   PHE  20          HB2       PHE  20   0.784  -5.325  -3.894
  152   2HB   PHE  20          HB3       PHE  20  -0.842  -4.803  -4.290
  153    HD1  PHE  20           HD1      PHE  20   1.081  -5.026  -1.624
  154    HD2  PHE  20           HD2      PHE  20  -2.542  -6.762  -2.990
  155    HE1  PHE  20           HE1      PHE  20   0.376  -5.423   0.752
  156    HE2  PHE  20           HE2      PHE  20  -3.248  -7.159  -0.614
  157    HZ   PHE  20           HZ       PHE  20  -1.780  -6.484   1.229
  158    H    HIS  21           H        HIS  21  -2.948  -7.075  -5.373
  159    HA   HIS  21           HA       HIS  21  -2.525  -6.042  -8.075
  160   1HB   HIS  21          HB2       HIS  21  -4.149  -8.197  -6.941
  161   2HB   HIS  21          HB3       HIS  21  -5.083  -7.125  -7.965
  162    HD1  HIS  21           HD1      HIS  21  -3.810 -10.203  -8.425
  163    HD2  HIS  21           HD2      HIS  21  -2.874  -6.600 -10.359
  164    HE1  HIS  21           HE1      HIS  21  -2.795 -10.843 -10.678
  165    H    LYS  22           H        LYS  22  -3.882  -4.368  -8.895
  166    HA   LYS  22           HA       LYS  22  -4.704  -2.520  -6.902
  167   1HB   LYS  22          HB2       LYS  22  -5.500  -1.243  -8.975
  168   2HB   LYS  22          HB3       LYS  22  -3.784  -1.556  -8.817
  169   1HG   LYS  22          HG2       LYS  22  -3.769  -2.711 -10.767
  170   2HG   LYS  22          HG3       LYS  22  -4.987  -3.816 -10.163
  171   1HD   LYS  22          HD2       LYS  22  -6.788  -2.490 -10.998
  172   2HD   LYS  22          HD3       LYS  22  -5.787  -1.061 -11.157
  173   1HE   LYS  22          HE2       LYS  22  -5.812  -3.541 -12.912
  174   2HE   LYS  22          HE3       LYS  22  -6.053  -1.872 -13.391
  175   1HZ   LYS  22          HZ1       LYS  22  -3.696  -1.457 -12.794
  176   2HZ   LYS  22          HZ2       LYS  22  -3.488  -3.033 -12.442
  177    H    GLY  23           H        GLY  23  -6.979  -1.437  -7.129
  178   1HA   GLY  23          HA3       GLY  23  -9.265  -1.663  -7.411
  179   2HA   GLY  23          HA2       GLY  23  -9.074  -3.364  -7.783
  180    H    GLU  24           H        GLU  24  -7.897  -1.364  -4.985
  181    HA   GLU  24           HA       GLU  24  -9.752  -2.678  -3.260
  182   1HB   GLU  24          HB2       GLU  24  -6.978  -3.625  -3.508
  183   2HB   GLU  24          HB3       GLU  24  -7.360  -3.149  -1.865
  184   1HG   GLU  24          HG2       GLU  24  -8.832  -4.883  -1.561
  185   2HG   GLU  24          HG3       GLU  24  -9.514  -4.721  -3.167
  186    HE2  GLU  24           HE2      GLU  24  -8.932  -7.019  -2.057
  187    H    LYS  25           H        LYS  25  -9.632  -1.761  -0.996
  188    HA   LYS  25           HA       LYS  25  -8.693   0.999  -1.169
  189   1HB   LYS  25          HB2       LYS  25 -10.695  -0.322   0.687
  190   2HB   LYS  25          HB3       LYS  25 -10.235   1.368   0.745
  191   1HG   LYS  25          HG2       LYS  25 -11.786   1.820  -0.841
  192   2HG   LYS  25          HG3       LYS  25 -10.876   0.850  -1.983
  193   1HD   LYS  25          HD2       LYS  25 -12.563  -0.686  -0.045
  194   2HD   LYS  25          HD3       LYS  25 -13.445   0.283  -1.207
  195   1HE   LYS  25          HE2       LYS  25 -11.654  -0.846  -2.908
  196   2HE   LYS  25          HE3       LYS  25 -11.663  -2.093  -1.677
  197   1HZ   LYS  25          HZ1       LYS  25 -13.560  -2.798  -2.628
  198   2HZ   LYS  25          HZ2       LYS  25 -14.318  -1.466  -2.076
  199    H    PHE  26           H        PHE  26  -7.215   1.872   0.285
  200    HA   PHE  26           HA       PHE  26  -5.977  -0.109   2.064
  201   1HB   PHE  26          HB2       PHE  26  -4.914   2.331   0.521
  202   2HB   PHE  26          HB3       PHE  26  -3.944   1.464   1.695
  203    HD1  PHE  26           HD1      PHE  26  -2.785  -0.495   1.089
  204    HD2  PHE  26           HD2      PHE  26  -5.728   1.081  -1.530
  205    HE1  PHE  26           HE1      PHE  26  -2.044  -2.088  -0.703
  206    HE2  PHE  26           HE2      PHE  26  -4.987  -0.513  -3.323
  207    HZ   PHE  26           HZ       PHE  26  -3.153  -2.079  -2.887
  208    H    GLN  27           H        GLN  27  -4.716   1.022   3.936
  209    HA   GLN  27           HA       GLN  27  -6.306   3.291   4.842
  210   1HB   GLN  27          HB2       GLN  27  -6.488   0.777   5.935
  211   2HB   GLN  27          HB3       GLN  27  -5.225   1.466   6.934
  212   1HG   GLN  27          HG2       GLN  27  -7.701   3.115   6.402
  213   2HG   GLN  27          HG3       GLN  27  -7.808   1.796   7.551
  214   1HE2  GLN  27          HE21      GLN  27  -7.441   4.964   7.376
  215   2HE2  GLN  27          HE22      GLN  27  -6.428   5.306   8.738
  216    H    ILE  28           H        ILE  28  -5.076   5.072   5.279
  217    HA   ILE  28           HA       ILE  28  -2.229   4.823   5.194
  218    HB   ILE  28           HB       ILE  28  -3.182   6.673   4.098
  219   1HG1  ILE  28          HG12      ILE  28  -2.343   8.417   6.214
  220   2HG1  ILE  28          HG13      ILE  28  -1.322   6.993   6.232
  221   1HG2  ILE  28          HG21      ILE  28  -4.917   6.806   6.468
  222   2HG2  ILE  28          HG22      ILE  28  -4.367   8.389   5.868
  223   3HG2  ILE  28          HG23      ILE  28  -5.229   7.275   4.780
  224   1HD1  ILE  28          HD11      ILE  28  -0.170   8.107   4.593
  225   2HD1  ILE  28          HD12      ILE  28  -1.445   7.466   3.529
  226   3HD1  ILE  28          HD13      ILE  28  -1.569   9.123   4.167
  227    H    LEU  29           H        LEU  29  -0.868   4.503   6.872
  228    HA   LEU  29           HA       LEU  29  -1.933   5.089   9.547
  229   1HB   LEU  29          HB2       LEU  29  -1.332   2.585   8.498
  230   2HB   LEU  29          HB3       LEU  29   0.077   2.990   9.458
  231    HG   LEU  29           HG       LEU  29  -2.519   3.486  10.788
  232   1HD1  LEU  29          HD11      LEU  29  -2.059   0.725  11.192
  233   2HD1  LEU  29          HD12      LEU  29  -3.469   1.514  10.443
  234   3HD1  LEU  29          HD13      LEU  29  -2.099   0.992   9.432
  235   1HD2  LEU  29          HD21      LEU  29  -0.643   3.815  12.136
  236   2HD2  LEU  29          HD22      LEU  29  -1.234   2.207  12.616
  237   3HD2  LEU  29          HD23      LEU  29   0.171   2.352  11.532
  238    H    ASN  30           H        ASN  30   1.198   4.288   7.873
  239    HA   ASN  30           HA       ASN  30   2.541   6.076   9.635
  240   1HB   ASN  30          HB2       ASN  30   3.262   3.840   8.066
  241   2HB   ASN  30          HB3       ASN  30   4.052   5.177   7.254
  242   1HD2  ASN  30          HD21      ASN  30   3.261   5.021  10.683
  243   2HD2  ASN  30          HD22      ASN  30   4.881   4.981  11.298
  244    H    SER  31           H        SER  31   3.532   8.103   8.993
  245    HA   SER  31           HA       SER  31   3.438   8.926   6.291
  246   1HB   SER  31          HB2       SER  31   1.109   9.441   7.851
  247   2HB   SER  31          HB3       SER  31   1.949  10.973   7.727
  248    HG   SER  31           HG       SER  31   0.974   9.290   5.601
  249    H    SER  32           H        SER  32   5.651   8.648   7.791
  250    HA   SER  32           HA       SER  32   6.177  10.991   9.314
  251   1HB   SER  32          HB2       SER  32   8.257   9.009   8.330
  252   2HB   SER  32          HB3       SER  32   8.304   9.993   9.780
  253    HG   SER  32           HG       SER  32   6.260   8.695  10.382
  254    H    GLU  33           H        GLU  33   8.602   9.750   7.015
  255    HA   GLU  33           HA       GLU  33   8.779  12.410   5.922
  256   1HB   GLU  33          HB2       GLU  33  10.660  10.423   6.598
  257   2HB   GLU  33          HB3       GLU  33  10.674  10.444   4.845
  258   1HG   GLU  33          HG2       GLU  33  11.419  12.661   4.729
  259   2HG   GLU  33          HG3       GLU  33  10.696  13.103   6.263
  260    HE2  GLU  33           HE2      GLU  33  14.435  11.997   6.070
  261    H    GLY  34           H        GLY  34   9.609   9.428   4.122
  262   1HA   GLY  34          HA3       GLY  34   7.386   8.999   2.598
  263   2HA   GLY  34          HA2       GLY  34   8.171  10.358   1.817
  264    H    ASP  35           H        ASP  35   8.268   6.909   2.448
  265    HA   ASP  35           HA       ASP  35  10.004   6.499   0.315
  266   1HB   ASP  35          HB2       ASP  35  11.324   7.025   2.782
  267   2HB   ASP  35          HB3       ASP  35  11.413   5.287   2.577
  268    HD2  ASP  35           HD2      ASP  35  13.570   6.652   2.600
  269    H    TRP  36           H        TRP  36   9.060   5.224   3.595
  270    HA   TRP  36           HA       TRP  36   8.064   2.809   2.249
  271   1HB   TRP  36          HB2       TRP  36   9.995   3.056   4.483
  272   2HB   TRP  36          HB3       TRP  36   8.741   1.849   4.676
  273    HD1  TRP  36           HD1      TRP  36   8.631   0.868   1.569
  274    HE1  TRP  36           HE1      TRP  36  10.554  -0.607   0.528
  275    HE3  TRP  36           HE3      TRP  36  12.184   2.176   4.962
  276    HZ2  TRP  36           HZ2      TRP  36  13.286  -1.052   1.226
  277    HZ3  TRP  36           HZ3      TRP  36  14.454   1.175   4.711
  278    HH2  TRP  36           HH2      TRP  36  15.030  -0.387   2.922
  279    H    TRP  37           H        TRP  37   5.953   2.325   2.793
  280    HA   TRP  37           HA       TRP  37   4.861   3.641   5.174
  281   1HB   TRP  37          HB2       TRP  37   3.792   3.770   2.363
  282   2HB   TRP  37          HB3       TRP  37   2.745   3.963   3.755
  283    HD1  TRP  37           HD1      TRP  37   4.938   5.747   5.490
  284    HE1  TRP  37           HE1      TRP  37   5.337   8.289   4.908
  285    HE3  TRP  37           HE3      TRP  37   3.131   5.486   0.744
  286    HZ2  TRP  37           HZ2      TRP  37   4.863   9.871   2.580
  287    HZ3  TRP  37           HZ3      TRP  37   3.135   7.574  -0.616
  288    HH2  TRP  37           HH2      TRP  37   3.962   9.714   0.230
  289    H    GLU  38           H        GLU  38   2.684   2.551   5.762
  290    HA   GLU  38           HA       GLU  38   3.144  -0.261   5.634
  291   1HB   GLU  38          HB2       GLU  38   2.085   1.423   7.538
  292   2HB   GLU  38          HB3       GLU  38   0.621   0.739   6.859
  293   1HG   GLU  38          HG2       GLU  38   1.420  -1.546   7.284
  294   2HG   GLU  38          HG3       GLU  38   2.989  -0.950   7.789
  295    HE2  GLU  38           HE2      GLU  38   3.152   0.019   9.605
  296    H    ALA  39           H        ALA  39   1.151  -1.761   5.232
  297    HA   ALA  39           HA       ALA  39  -0.649  -0.668   3.224
  298   1HB   ALA  39          HB1       ALA  39   1.531  -1.609   2.172
  299   2HB   ALA  39          HB2       ALA  39   0.899  -3.204   2.644
  300   3HB   ALA  39          HB3       ALA  39  -0.026  -2.177   1.523
  301    H    ARG  40           H        ARG  40  -2.255  -0.940   4.884
  302    HA   ARG  40           HA       ARG  40  -2.639  -3.693   5.700
  303   1HB   ARG  40          HB2       ARG  40  -2.634  -1.561   7.295
  304   2HB   ARG  40          HB3       ARG  40  -4.281  -1.358   6.732
  305   1HG   ARG  40          HG2       ARG  40  -4.973  -3.475   7.622
  306   2HG   ARG  40          HG3       ARG  40  -3.324  -4.040   7.798
  307   1HD   ARG  40          HD2       ARG  40  -3.039  -2.019   9.462
  308   2HD   ARG  40          HD3       ARG  40  -4.790  -1.976   9.481
  309    HE   ARG  40           HE       ARG  40  -4.600  -4.494  10.108
  310   1HH1  ARG  40          HH22      ARG  40  -2.174  -2.073  11.007
  311   2HH1  ARG  40          HH21      ARG  40  -1.650  -2.939  12.412
  312   1HH2  ARG  40          HH11      ARG  40  -2.683  -5.032  12.954
  313    H    SER  41           H        SER  41  -3.908  -4.813   4.235
  314    HA   SER  41           HA       SER  41  -6.013  -3.335   2.911
  315   1HB   SER  41          HB2       SER  41  -5.204  -6.218   2.384
  316   2HB   SER  41          HB3       SER  41  -6.076  -5.138   1.315
  317    HG   SER  41           HG       SER  41  -3.302  -5.300   1.856
  318    H    LEU  42           H        LEU  42  -8.090  -3.451   3.681
  319    HA   LEU  42           HA       LEU  42  -8.678  -5.524   5.634
  320   1HB   LEU  42          HB2       LEU  42 -10.628  -3.396   4.920
  321   2HB   LEU  42          HB3       LEU  42 -10.283  -4.140   6.469
  322    HG   LEU  42           HG       LEU  42  -8.353  -2.242   5.123
  323   1HD1  LEU  42          HD11      LEU  42 -10.668  -1.247   5.527
  324   2HD1  LEU  42          HD12      LEU  42 -10.320  -1.430   7.263
  325   3HD1  LEU  42          HD13      LEU  42  -9.280  -0.401   6.252
  326   1HD2  LEU  42          HD21      LEU  42  -7.735  -1.927   7.624
  327   2HD2  LEU  42          HD22      LEU  42  -8.580  -3.477   7.855
  328   3HD2  LEU  42          HD23      LEU  42  -7.178  -3.382   6.763
  329    H    THR  43           H        THR  43  -8.562  -5.494   2.400
  330    HA   THR  43           HA       THR  43 -11.225  -6.607   1.951
  331    HB   THR  43           HB       THR  43 -10.182  -6.617  -0.477
  332    HG1  THR  43           HG1      THR  43  -8.549  -4.525   0.162
  333   1HG2  THR  43          HG21      THR  43 -10.860  -4.378  -0.841
  334   2HG2  THR  43          HG22      THR  43 -11.752  -4.782   0.646
  335   3HG2  THR  43          HG23      THR  43 -10.246  -3.839   0.739
  336    H    THR  44           H        THR  44  -7.751  -7.532   1.475
  337    HA   THR  44           HA       THR  44  -8.626 -10.311   1.270
  338    HB   THR  44           HB       THR  44  -6.202  -8.673   0.515
  339    HG1  THR  44           HG1      THR  44  -7.015 -10.922  -0.945
  340   1HG2  THR  44          HG21      THR  44  -5.792 -11.082   1.870
  341   2HG2  THR  44          HG22      THR  44  -5.926 -11.609   0.174
  342   3HG2  THR  44          HG23      THR  44  -4.697 -10.409   0.638
  343    H    GLY  45           H        GLY  45  -5.975  -8.539   3.009
  344   1HA   GLY  45          HA3       GLY  45  -6.061  -8.684   5.459
  345   2HA   GLY  45          HA2       GLY  45  -6.465 -10.380   5.275
  346    H    GLU  46           H        GLU  46  -3.997  -8.163   3.767
  347    HA   GLU  46           HA       GLU  46  -1.955  -9.899   4.854
  348   1HB   GLU  46          HB2       GLU  46  -2.672  -9.676   1.994
  349   2HB   GLU  46          HB3       GLU  46  -0.973  -9.372   2.299
  350   1HG   GLU  46          HG2       GLU  46  -0.756 -11.521   3.497
  351   2HG   GLU  46          HG3       GLU  46  -2.478 -11.812   3.355
  352    HE2  GLU  46           HE2      GLU  46  -0.743 -13.772   1.380
  353    H    THR  47           H        THR  47   0.094  -8.840   5.157
  354    HA   THR  47           HA       THR  47  -0.056  -5.922   4.771
  355    HB   THR  47           HB       THR  47  -0.119  -6.956   7.162
  356    HG1  THR  47           HG1      THR  47   1.346  -4.924   5.905
  357   1HG2  THR  47          HG21      THR  47   1.861  -7.828   8.086
  358   2HG2  THR  47          HG22      THR  47   1.944  -8.522   6.449
  359   3HG2  THR  47          HG23      THR  47   2.888  -7.066   6.848
  360    H    GLY  48           H        GLY  48   2.369  -5.001   4.951
  361   1HA   GLY  48          HA3       GLY  48   4.583  -6.286   4.111
  362   2HA   GLY  48          HA2       GLY  48   3.679  -6.107   2.620
  363    H    TYR  49           H        TYR  49   6.043  -4.820   2.621
  364    HA   TYR  49           HA       TYR  49   5.349  -2.024   3.226
  365   1HB   TYR  49          HB2       TYR  49   7.896  -3.727   3.226
  366   2HB   TYR  49          HB3       TYR  49   8.031  -1.989   3.053
  367    HD1  TYR  49           HD1      TYR  49   7.967  -4.644   5.364
  368    HD2  TYR  49           HD2      TYR  49   6.725  -0.576   4.899
  369    HE1  TYR  49           HE1      TYR  49   7.871  -4.377   7.890
  370    HE2  TYR  49           HE2      TYR  49   6.633  -0.324   7.427
  371    HH   TYR  49           HH       TYR  49   8.071  -2.472   9.506
  372    H    ILE  50           H        ILE  50   4.937  -0.815   1.449
  373    HA   ILE  50           HA       ILE  50   6.640  -1.133  -0.857
  374    HB   ILE  50           HB       ILE  50   4.331  -1.128  -2.206
  375   1HG1  ILE  50          HG12      ILE  50   3.692  -3.075   0.006
  376   2HG1  ILE  50          HG13      ILE  50   3.147  -1.411   0.088
  377   1HG2  ILE  50          HG21      ILE  50   5.431  -2.830  -3.102
  378   2HG2  ILE  50          HG22      ILE  50   6.436  -2.984  -1.640
  379   3HG2  ILE  50          HG23      ILE  50   4.898  -3.871  -1.761
  380   1HD1  ILE  50          HD11      ILE  50   1.475  -1.825  -1.380
  381   2HD1  ILE  50          HD12      ILE  50   2.625  -2.476  -2.573
  382   3HD1  ILE  50          HD13      ILE  50   1.930  -3.546  -1.332
  383    HA   PRO  51           HA       PRO  51   6.080   3.144  -0.775
  384   1HB   PRO  51          HB2       PRO  51   6.861   3.801  -3.310
  385   2HB   PRO  51          HB3       PRO  51   7.991   3.517  -2.003
  386   1HG   PRO  51          HG2       PRO  51   7.322   1.764  -4.287
  387   2HG   PRO  51          HG3       PRO  51   8.719   1.705  -3.229
  388   1HD   PRO  51          HD2       PRO  51   6.432  -0.026  -3.151
  389   2HD   PRO  51          HD3       PRO  51   7.772  -0.009  -2.023
  390    H    SER  52           H        SER  52   3.990   3.665  -0.395
  391    HA   SER  52           HA       SER  52   2.257   3.351  -2.690
  392   1HB   SER  52          HB2       SER  52   1.854   2.806  -0.029
  393   2HB   SER  52          HB3       SER  52   1.162   4.412  -0.125
  394    HG   SER  52           HG       SER  52  -0.465   2.867  -0.588
  395    H    ASN  53           H        ASN  53   4.201   5.344  -3.045
  396    HA   ASN  53           HA       ASN  53   3.071   7.833  -2.210
  397   1HB   ASN  53          HB2       ASN  53   5.639   6.935  -2.962
  398   2HB   ASN  53          HB3       ASN  53   5.155   7.942  -4.312
  399   1HD2  ASN  53          HD21      ASN  53   6.695   7.934  -1.442
  400   2HD2  ASN  53          HD22      ASN  53   6.527   9.585  -0.948
  401    H    TYR  54           H        TYR  54   2.296   5.574  -4.542
  402    HA   TYR  54           HA       TYR  54   1.813   7.492  -6.689
  403   1HB   TYR  54          HB2       TYR  54   1.467   4.450  -6.323
  404   2HB   TYR  54          HB3       TYR  54   1.165   5.278  -7.838
  405    HD1  TYR  54           HD1      TYR  54   3.317   3.074  -6.687
  406    HD2  TYR  54           HD2      TYR  54   3.450   7.133  -8.033
  407    HE1  TYR  54           HE1      TYR  54   5.759   2.787  -7.336
  408    HE2  TYR  54           HE2      TYR  54   5.890   6.833  -8.677
  409    HH   TYR  54           HH       TYR  54   7.761   4.414  -7.568
  410    H    VAL  55           H        VAL  55   0.316   7.404  -4.004
  411    HA   VAL  55           HA       VAL  55  -2.291   6.451  -4.754
  412    HB   VAL  55           HB       VAL  55  -2.895   7.439  -2.525
  413   1HG1  VAL  55          HG11      VAL  55  -2.549   5.262  -2.092
  414   2HG1  VAL  55          HG12      VAL  55  -1.076   5.202  -3.088
  415   3HG1  VAL  55          HG13      VAL  55  -0.991   5.784  -1.408
  416   1HG2  VAL  55          HG21      VAL  55  -1.471   9.117  -1.933
  417   2HG2  VAL  55          HG22      VAL  55  -0.623   7.770  -1.136
  418   3HG2  VAL  55          HG23      VAL  55  -0.066   8.358  -2.721
  419    H    ALA  56           H        ALA  56  -4.221   8.015  -4.456
  420    HA   ALA  56           HA       ALA  56  -3.533  10.710  -5.351
  421   1HB   ALA  56          HB1       ALA  56  -5.805   9.307  -6.714
  422   2HB   ALA  56          HB2       ALA  56  -4.720  10.580  -7.322
  423   3HB   ALA  56          HB3       ALA  56  -4.151   8.897  -7.225
  424    HA   PRO  57           HA       PRO  57  -6.825  11.654  -2.693
  425   1HB   PRO  57          HB2       PRO  57  -7.483  14.178  -3.506
  426   2HB   PRO  57          HB3       PRO  57  -6.097  13.828  -2.493
  427   1HG   PRO  57          HG2       PRO  57  -6.166  14.515  -5.367
  428   2HG   PRO  57          HG3       PRO  57  -4.813  14.580  -4.256
  429   1HD   PRO  57          HD2       PRO  57  -5.301  12.576  -6.248
  430   2HD   PRO  57          HD3       PRO  57  -4.013  12.580  -5.059
  431    H    VAL  58           H        VAL  58  -8.638  10.484  -2.665
  432    HA   VAL  58           HA       VAL  58 -10.292  10.665  -5.042
  433    HB   VAL  58           HB       VAL  58 -10.955   9.036  -2.622
  434   1HG1  VAL  58          HG11      VAL  58 -11.189   8.570  -5.614
  435   2HG1  VAL  58          HG12      VAL  58 -11.708   7.428  -4.352
  436   3HG1  VAL  58          HG13      VAL  58 -12.504   9.013  -4.499
  437   1HG2  VAL  58          HG21      VAL  58  -9.371   7.365  -3.053
  438   2HG2  VAL  58          HG22      VAL  58  -8.970   8.021  -4.658
  439   3HG2  VAL  58          HG23      VAL  58  -8.437   8.874  -3.189
  440    H    ASP  59           H        ASP  59 -12.381  11.534  -5.098
  441    HA   ASP  59           HA       ASP  59 -12.882  13.379  -2.950
  442   1HB   ASP  59          HB2       ASP  59 -13.707  13.051  -5.795
  443   2HB   ASP  59          HB3       ASP  59 -14.965  13.681  -4.753
  444    HD2  ASP  59           HD2      ASP  59 -11.651  15.653  -4.311
  Start of MODEL   20
    1   1H    VAL   1           H        VAL   1 -12.474   9.200   4.357
    2    HA   VAL   1           HA       VAL   1 -11.243  11.126   4.053
    3    HB   VAL   1           HB       VAL   1  -9.764  10.365   6.481
    4   1HG1  VAL   1          HG11      VAL   1 -10.713  12.393   7.344
    5   2HG1  VAL   1          HG12      VAL   1 -10.208  12.704   5.666
    6   3HG1  VAL   1          HG13      VAL   1 -11.928  12.445   6.045
    7   1HG2  VAL   1          HG21      VAL   1 -11.336   9.138   7.479
    8   2HG2  VAL   1          HG22      VAL   1 -12.429  10.540   7.394
    9   3HG2  VAL   1          HG23      VAL   1 -12.431   9.330   6.090
   10    H    THR   2           H        THR   2  -8.877   8.682   5.352
   11    HA   THR   2           HA       THR   2  -6.937   9.771   3.423
   12    HB   THR   2           HB       THR   2  -6.310   8.157   5.931
   13    HG1  THR   2           HG1      THR   2  -7.528  10.643   5.582
   14   1HG2  THR   2          HG21      THR   2  -4.291   9.685   5.893
   15   2HG2  THR   2          HG22      THR   2  -4.388   8.641   4.453
   16   3HG2  THR   2          HG23      THR   2  -4.872  10.351   4.348
   17    H    LEU   3           H        LEU   3  -8.857   8.063   2.374
   18    HA   LEU   3           HA       LEU   3  -7.612   5.434   2.353
   19   1HB   LEU   3          HB2       LEU   3 -10.136   6.390   0.999
   20   2HB   LEU   3          HB3       LEU   3  -9.589   4.733   1.153
   21    HG   LEU   3           HG       LEU   3 -10.247   6.475   3.538
   22   1HD1  LEU   3          HD11      LEU   3 -12.428   6.193   3.239
   23   2HD1  LEU   3          HD12      LEU   3 -12.073   5.558   1.615
   24   3HD1  LEU   3          HD13      LEU   3 -12.226   4.442   2.992
   25   1HD2  LEU   3          HD21      LEU   3 -10.653   4.012   4.427
   26   2HD2  LEU   3          HD22      LEU   3  -9.489   3.615   3.141
   27   3HD2  LEU   3          HD23      LEU   3  -9.037   4.758   4.429
   28    H    PHE   4           H        PHE   4  -6.583   4.533   0.566
   29    HA   PHE   4           HA       PHE   4  -6.441   6.199  -1.823
   30   1HB   PHE   4          HB2       PHE   4  -4.164   5.067  -0.097
   31   2HB   PHE   4          HB3       PHE   4  -3.894   5.602  -1.744
   32    HD1  PHE   4           HD1      PHE   4  -4.186   6.607   1.681
   33    HD2  PHE   4           HD2      PHE   4  -4.365   8.032  -2.312
   34    HE1  PHE   4           HE1      PHE   4  -3.833   8.952   2.503
   35    HE2  PHE   4           HE2      PHE   4  -4.012  10.377  -1.491
   36    HZ   PHE   4           HZ       PHE   4  -3.749  10.810   0.906
   37    H    VAL   5           H        VAL   5  -6.475   5.017  -3.711
   38    HA   VAL   5           HA       VAL   5  -6.518   2.116  -3.364
   39    HB   VAL   5           HB       VAL   5  -7.372   3.731  -5.764
   40   1HG1  VAL   5          HG11      VAL   5  -7.545   1.659  -6.613
   41   2HG1  VAL   5          HG12      VAL   5  -7.395   0.892  -5.013
   42   3HG1  VAL   5          HG13      VAL   5  -8.976   1.493  -5.568
   43   1HG2  VAL   5          HG21      VAL   5  -8.869   4.658  -4.319
   44   2HG2  VAL   5          HG22      VAL   5  -9.728   3.127  -4.618
   45   3HG2  VAL   5          HG23      VAL   5  -8.739   3.322  -3.150
   46    H    ALA   6           H        ALA   6  -5.559   0.835  -5.266
   47    HA   ALA   6           HA       ALA   6  -2.885   1.878  -5.697
   48   1HB   ALA   6          HB1       ALA   6  -2.269  -0.349  -6.039
   49   2HB   ALA   6          HB2       ALA   6  -3.609  -0.514  -4.880
   50   3HB   ALA   6          HB3       ALA   6  -3.888  -0.817  -6.612
   51    H    LEU   7           H        LEU   7  -1.885   1.732  -7.886
   52    HA   LEU   7           HA       LEU   7  -3.912   2.133  -9.975
   53   1HB   LEU   7          HB2       LEU   7  -2.992   4.260  -9.370
   54   2HB   LEU   7          HB3       LEU   7  -1.354   3.647  -9.465
   55    HG   LEU   7           HG       LEU   7  -2.871   3.350 -11.970
   56   1HD1  LEU   7          HD11      LEU   7  -3.803   5.370 -12.031
   57   2HD1  LEU   7          HD12      LEU   7  -2.950   5.895 -10.559
   58   3HD1  LEU   7          HD13      LEU   7  -2.153   6.027 -12.145
   59   1HD2  LEU   7          HD21      LEU   7  -0.632   2.899 -12.224
   60   2HD2  LEU   7          HD22      LEU   7  -0.693   4.606 -12.724
   61   3HD2  LEU   7          HD23      LEU   7  -0.129   4.177 -11.092
   62    H    TYR   8           H        TYR   8  -0.302   1.779  -9.812
   63    HA   TYR   8           HA       TYR   8  -0.481  -0.123 -11.999
   64   1HB   TYR   8          HB2       TYR   8   1.209   1.953 -11.288
   65   2HB   TYR   8          HB3       TYR   8   2.059   0.624 -10.522
   66    HD1  TYR   8           HD1      TYR   8   2.642  -1.426 -12.017
   67    HD2  TYR   8           HD2      TYR   8   1.537   2.405 -13.569
   68    HE1  TYR   8           HE1      TYR   8   3.730  -2.005 -14.240
   69    HE2  TYR   8           HE2      TYR   8   2.631   1.813 -15.787
   70    HH   TYR   8           HH       TYR   8   3.136  -0.351 -17.021
   71    H    ASP   9           H        ASP   9   0.589  -2.224 -11.926
   72    HA   ASP   9           HA       ASP   9   0.261  -3.386  -9.314
   73   1HB   ASP   9          HB2       ASP   9   1.177  -5.092 -11.578
   74   2HB   ASP   9          HB3       ASP   9  -0.110  -5.376 -10.424
   75    HD2  ASP   9           HD2      ASP   9  -2.222  -5.290 -12.672
   76    H    TYR  10           H        TYR  10   2.020  -4.291  -8.124
   77    HA   TYR  10           HA       TYR  10   4.666  -4.009  -9.384
   78   1HB   TYR  10          HB2       TYR  10   3.513  -3.491  -6.588
   79   2HB   TYR  10          HB3       TYR  10   5.236  -3.742  -6.789
   80    HD1  TYR  10           HD1      TYR  10   6.655  -1.984  -7.530
   81    HD2  TYR  10           HD2      TYR  10   2.407  -1.536  -7.784
   82    HE1  TYR  10           HE1      TYR  10   6.940   0.480  -8.086
   83    HE2  TYR  10           HE2      TYR  10   2.707   0.927  -8.338
   84    HH   TYR  10           HH       TYR  10   4.704   2.672  -7.753
   85    H    GLU  11           H        GLU  11   5.356  -6.038  -9.896
   86    HA   GLU  11           HA       GLU  11   4.452  -8.258  -8.379
   87   1HB   GLU  11          HB2       GLU  11   6.632  -8.170 -10.508
   88   2HB   GLU  11          HB3       GLU  11   5.769  -9.593  -9.959
   89   1HG   GLU  11          HG2       GLU  11   3.631  -8.655 -10.813
   90   2HG   GLU  11          HG3       GLU  11   4.451  -7.186 -11.305
   91    HE2  GLU  11           HE2      GLU  11   4.333 -10.504 -11.714
   92    H    ALA  12           H        ALA  12   5.537  -9.424  -6.787
   93    HA   ALA  12           HA       ALA  12   8.335  -9.134  -6.383
   94   1HB   ALA  12          HB1       ALA  12   6.944  -8.181  -3.957
   95   2HB   ALA  12          HB2       ALA  12   8.442  -7.595  -4.721
   96   3HB   ALA  12          HB3       ALA  12   6.860  -7.052  -5.332
   97    H    ARG  13           H        ARG  13   8.998 -10.409  -4.354
   98    HA   ARG  13           HA       ARG  13   6.948 -12.182  -3.430
   99   1HB   ARG  13          HB2       ARG  13   8.720 -14.137  -3.976
  100   2HB   ARG  13          HB3       ARG  13   7.502 -13.660  -5.141
  101   1HG   ARG  13          HG2       ARG  13   9.465 -11.847  -5.755
  102   2HG   ARG  13          HG3       ARG  13  10.455 -13.170  -5.169
  103   1HD   ARG  13          HD2       ARG  13   9.332 -14.731  -6.766
  104   2HD   ARG  13          HD3       ARG  13   8.315 -13.425  -7.339
  105    HE   ARG  13           HE       ARG  13  10.203 -12.417  -8.416
  106   1HH1  ARG  13          HH22      ARG  13  11.099 -15.378  -6.687
  107   2HH1  ARG  13          HH21      ARG  13  12.626 -15.532  -7.489
  108   1HH2  ARG  13          HH11      ARG  13  13.264 -13.899  -9.124
  109    H    THR  14           H        THR  14   8.863 -10.045  -2.426
  110    HA   THR  14           HA       THR  14  10.776 -11.533  -0.838
  111    HB   THR  14           HB       THR  14  10.836  -8.884  -0.015
  112    HG1  THR  14           HG1      THR  14   9.039  -8.635  -1.664
  113   1HG2  THR  14          HG21      THR  14  12.397  -8.594  -2.145
  114   2HG2  THR  14          HG22      THR  14  12.889  -9.722  -0.859
  115   3HG2  THR  14          HG23      THR  14  12.129 -10.342  -2.345
  116    H    GLU  15           H        GLU  15  10.923 -11.081   1.561
  117    HA   GLU  15           HA       GLU  15   8.413 -11.809   2.654
  118   1HB   GLU  15          HB2       GLU  15  10.734 -12.651   3.375
  119   2HB   GLU  15          HB3       GLU  15  10.955 -11.109   4.179
  120   1HG   GLU  15          HG2       GLU  15   8.896 -11.513   5.536
  121   2HG   GLU  15          HG3       GLU  15   8.652 -13.045   4.720
  122    HE2  GLU  15           HE2      GLU  15   9.764 -14.780   5.699
  123    H    ASP  16           H        ASP  16  10.222  -8.836   2.192
  124    HA   ASP  16           HA       ASP  16   8.787  -7.473   4.261
  125   1HB   ASP  16          HB2       ASP  16  10.401  -6.107   2.091
  126   2HB   ASP  16          HB3       ASP  16  10.172  -5.608   3.755
  127    HD2  ASP  16           HD2      ASP  16  12.766  -7.600   4.947
  128    H    ASP  17           H        ASP  17   9.402  -6.595   0.780
  129    HA   ASP  17           HA       ASP  17   6.976  -5.209   0.604
  130   1HB   ASP  17          HB2       ASP  17   9.277  -5.871  -1.138
  131   2HB   ASP  17          HB3       ASP  17   7.769  -5.772  -2.024
  132    HD2  ASP  17           HD2      ASP  17   7.711  -2.410  -2.052
  133    H    LEU  18           H        LEU  18   5.372  -5.782  -1.329
  134    HA   LEU  18           HA       LEU  18   5.136  -8.659  -1.709
  135   1HB   LEU  18          HB2       LEU  18   3.592  -7.206   0.174
  136   2HB   LEU  18          HB3       LEU  18   2.536  -7.584  -1.172
  137    HG   LEU  18           HG       LEU  18   3.524 -10.011  -0.897
  138   1HD1  LEU  18          HD11      LEU  18   3.607  -9.941   1.911
  139   2HD1  LEU  18          HD12      LEU  18   4.940 -10.296   0.787
  140   3HD1  LEU  18          HD13      LEU  18   4.678  -8.631   1.358
  141   1HD2  LEU  18          HD21      LEU  18   1.557  -9.061   1.187
  142   2HD2  LEU  18          HD22      LEU  18   1.151  -9.146  -0.544
  143   3HD2  LEU  18          HD23      LEU  18   1.617 -10.623   0.335
  144    H    SER  19           H        SER  19   2.717  -8.705  -3.076
  145    HA   SER  19           HA       SER  19   3.382  -6.959  -5.312
  146   1HB   SER  19          HB2       SER  19   2.277  -8.660  -6.746
  147   2HB   SER  19          HB3       SER  19   3.611  -9.344  -5.838
  148    HG   SER  19           HG       SER  19   2.071 -10.205  -4.303
  149    H    PHE  20           H        PHE  20   2.014  -5.215  -5.428
  150    HA   PHE  20           HA       PHE  20  -0.704  -5.573  -4.423
  151   1HB   PHE  20          HB2       PHE  20   0.833  -3.059  -5.301
  152   2HB   PHE  20          HB3       PHE  20  -0.639  -3.083  -4.350
  153    HD1  PHE  20           HD1      PHE  20  -0.526  -4.157  -2.021
  154    HD2  PHE  20           HD2      PHE  20   2.922  -3.077  -4.247
  155    HE1  PHE  20           HE1      PHE  20   0.835  -4.158   0.087
  156    HE2  PHE  20           HE2      PHE  20   4.284  -3.079  -2.139
  157    HZ   PHE  20           HZ       PHE  20   3.224  -3.619   0.004
  158    H    HIS  21           H        HIS  21  -2.472  -5.518  -5.760
  159    HA   HIS  21           HA       HIS  21  -1.915  -4.835  -8.556
  160   1HB   HIS  21          HB2       HIS  21  -3.757  -6.915  -7.361
  161   2HB   HIS  21          HB3       HIS  21  -3.887  -6.382  -9.026
  162    HD1  HIS  21           HD1      HIS  21  -2.446  -7.577 -10.702
  163    HD2  HIS  21           HD2      HIS  21  -1.083  -8.092  -6.768
  164    HE1  HIS  21           HE1      HIS  21  -0.532  -9.261 -10.822
  165    H    LYS  22           H        LYS  22  -3.749  -3.842  -9.756
  166    HA   LYS  22           HA       LYS  22  -4.883  -1.758  -8.222
  167   1HB   LYS  22          HB2       LYS  22  -4.183  -1.938 -10.768
  168   2HB   LYS  22          HB3       LYS  22  -5.846  -2.448 -10.976
  169   1HG   LYS  22          HG2       LYS  22  -6.204  -0.278  -9.322
  170   2HG   LYS  22          HG3       LYS  22  -4.765   0.223 -10.186
  171   1HD   LYS  22          HD2       LYS  22  -6.310  -0.760 -12.261
  172   2HD   LYS  22          HD3       LYS  22  -7.547  -0.135 -11.188
  173   1HE   LYS  22          HE2       LYS  22  -7.100   1.861 -12.233
  174   2HE   LYS  22          HE3       LYS  22  -5.771   1.948 -11.094
  175   1HZ   LYS  22          HZ1       LYS  22  -5.106   2.254 -13.469
  176   2HZ   LYS  22          HZ2       LYS  22  -4.295   1.042 -12.746
  177    H    GLY  23           H        GLY  23  -7.028  -1.396  -7.560
  178   1HA   GLY  23          HA3       GLY  23  -9.330  -2.031  -7.604
  179   2HA   GLY  23          HA2       GLY  23  -8.853  -3.699  -7.846
  180    H    GLU  24           H        GLU  24  -6.514  -2.941  -5.783
  181    HA   GLU  24           HA       GLU  24  -8.147  -3.689  -3.510
  182   1HB   GLU  24          HB2       GLU  24  -5.339  -4.171  -4.366
  183   2HB   GLU  24          HB3       GLU  24  -5.533  -3.877  -2.649
  184   1HG   GLU  24          HG2       GLU  24  -6.402  -5.947  -2.332
  185   2HG   GLU  24          HG3       GLU  24  -7.647  -5.659  -3.532
  186    HE2  GLU  24           HE2      GLU  24  -6.378  -8.025  -5.430
  187    H    LYS  25           H        LYS  25  -7.564  -2.707  -1.332
  188    HA   LYS  25           HA       LYS  25  -6.416  -0.038  -1.575
  189   1HB   LYS  25          HB2       LYS  25  -8.339   0.859  -0.204
  190   2HB   LYS  25          HB3       LYS  25  -8.699   0.485  -1.877
  191   1HG   LYS  25          HG2       LYS  25  -9.260  -1.938  -0.680
  192   2HG   LYS  25          HG3       LYS  25  -9.680  -0.832   0.613
  193   1HD   LYS  25          HD2       LYS  25 -10.674   0.063  -2.028
  194   2HD   LYS  25          HD3       LYS  25 -11.311  -1.501  -1.559
  195   1HE   LYS  25          HE2       LYS  25 -12.860   0.020  -0.606
  196   2HE   LYS  25          HE3       LYS  25 -11.833  -0.404   0.750
  197   1HZ   LYS  25          HZ1       LYS  25 -11.042   1.700   0.853
  198   2HZ   LYS  25          HZ2       LYS  25 -10.843   1.847  -0.757
  199    H    PHE  26           H        PHE  26  -5.972   0.906   0.653
  200    HA   PHE  26           HA       PHE  26  -5.842  -1.070   2.758
  201   1HB   PHE  26          HB2       PHE  26  -3.314  -0.481   2.964
  202   2HB   PHE  26          HB3       PHE  26  -3.738  -1.514   1.612
  203    HD1  PHE  26           HD1      PHE  26  -2.392   1.682   2.612
  204    HD2  PHE  26           HD2      PHE  26  -3.883  -0.536  -0.683
  205    HE1  PHE  26           HE1      PHE  26  -1.320   3.310   1.032
  206    HE2  PHE  26           HE2      PHE  26  -2.811   1.092  -2.264
  207    HZ   PHE  26           HZ       PHE  26  -1.542   2.996  -1.388
  208    H    GLN  27           H        GLN  27  -5.343  -0.114   4.862
  209    HA   GLN  27           HA       GLN  27  -5.968   2.722   4.828
  210   1HB   GLN  27          HB2       GLN  27  -5.962   1.382   7.455
  211   2HB   GLN  27          HB3       GLN  27  -7.207   2.362   6.705
  212   1HG   GLN  27          HG2       GLN  27  -7.645   0.304   5.160
  213   2HG   GLN  27          HG3       GLN  27  -6.675  -0.606   6.301
  214   1HE2  GLN  27          HE21      GLN  27  -9.719   0.179   5.479
  215   2HE2  GLN  27          HE22      GLN  27 -10.548   0.016   6.991
  216    H    ILE  28           H        ILE  28  -4.686   4.259   5.974
  217    HA   ILE  28           HA       ILE  28  -1.936   3.626   6.073
  218    HB   ILE  28           HB       ILE  28  -1.736   5.928   6.987
  219   1HG1  ILE  28          HG12      ILE  28  -4.670   6.335   6.521
  220   2HG1  ILE  28          HG13      ILE  28  -4.143   5.682   8.060
  221   1HG2  ILE  28          HG21      ILE  28  -3.418   6.568   4.751
  222   2HG2  ILE  28          HG22      ILE  28  -1.642   6.533   4.857
  223   3HG2  ILE  28          HG23      ILE  28  -2.536   5.058   4.418
  224   1HD1  ILE  28          HD11      ILE  28  -2.692   8.094   6.978
  225   2HD1  ILE  28          HD12      ILE  28  -4.313   8.318   7.676
  226   3HD1  ILE  28          HD13      ILE  28  -3.006   7.627   8.667
  227    H    LEU  29           H        LEU  29  -0.511   3.611   7.929
  228    HA   LEU  29           HA       LEU  29  -1.825   3.287  10.502
  229   1HB   LEU  29          HB2       LEU  29  -1.611   1.054   9.228
  230   2HB   LEU  29          HB3       LEU  29   0.106   1.190   9.550
  231    HG   LEU  29           HG       LEU  29  -1.480   1.599  11.966
  232   1HD1  LEU  29          HD11      LEU  29  -2.247  -0.604  10.189
  233   2HD1  LEU  29          HD12      LEU  29  -1.789  -1.127  11.828
  234   3HD1  LEU  29          HD13      LEU  29  -3.078   0.079  11.607
  235   1HD2  LEU  29          HD21      LEU  29   1.059   0.935  11.450
  236   2HD2  LEU  29          HD22      LEU  29   0.229   0.487  12.960
  237   3HD2  LEU  29          HD23      LEU  29   0.380  -0.700  11.642
  238    H    ASN  30           H        ASN  30   1.474   2.448   9.283
  239    HA   ASN  30           HA       ASN  30   2.663   3.861  11.369
  240   1HB   ASN  30          HB2       ASN  30   3.628   2.573   8.797
  241   2HB   ASN  30          HB3       ASN  30   4.742   3.590   9.688
  242   1HD2  ASN  30          HD21      ASN  30   5.411   3.027  11.753
  243   2HD2  ASN  30          HD22      ASN  30   5.255   1.425  12.393
  244    H    SER  31           H        SER  31   4.180   5.783  11.067
  245    HA   SER  31           HA       SER  31   3.950   7.280   8.678
  246   1HB   SER  31          HB2       SER  31   2.570   8.327  11.190
  247   2HB   SER  31          HB3       SER  31   2.910   9.304   9.775
  248    HG   SER  31           HG       SER  31   1.587   7.795   8.514
  249    H    SER  32           H        SER  32   6.299   6.773   9.082
  250    HA   SER  32           HA       SER  32   7.421   8.306  11.266
  251   1HB   SER  32          HB2       SER  32   9.445   7.036  10.923
  252   2HB   SER  32          HB3       SER  32   8.107   5.906  10.878
  253    HG   SER  32           HG       SER  32   9.566   5.489   9.136
  254    H    GLU  33           H        GLU  33   6.227   9.401   8.646
  255    HA   GLU  33           HA       GLU  33   6.641  10.959   7.193
  256   1HB   GLU  33          HB2       GLU  33   8.583  11.542   9.365
  257   2HB   GLU  33          HB3       GLU  33   8.977  12.291   7.830
  258   1HG   GLU  33          HG2       GLU  33   7.486  13.915   8.394
  259   2HG   GLU  33          HG3       GLU  33   6.233  12.749   8.015
  260    HE2  GLU  33           HE2      GLU  33   7.170  13.338  11.888
  261    H    GLY  34           H        GLY  34   7.004   9.639   5.363
  262   1HA   GLY  34          HA3       GLY  34   9.631   9.791   4.237
  263   2HA   GLY  34          HA2       GLY  34   9.231   8.165   4.750
  264    H    ASP  35           H        ASP  35   9.315   7.554   2.444
  265    HA   ASP  35           HA       ASP  35   6.925   8.456   1.037
  266   1HB   ASP  35          HB2       ASP  35   9.426   7.203  -0.182
  267   2HB   ASP  35          HB3       ASP  35   8.096   7.941  -1.053
  268    HD2  ASP  35           HD2      ASP  35  10.026   9.231  -1.920
  269    H    TRP  36           H        TRP  36   8.251   5.969   2.860
  270    HA   TRP  36           HA       TRP  36   6.970   3.863   1.262
  271   1HB   TRP  36          HB2       TRP  36   8.968   3.517   3.498
  272   2HB   TRP  36          HB3       TRP  36   8.364   2.289   2.404
  273    HD1  TRP  36           HD1      TRP  36  10.339   5.652   2.002
  274    HE1  TRP  36           HE1      TRP  36  12.180   5.415   0.126
  275    HE3  TRP  36           HE3      TRP  36   9.169   0.872   0.722
  276    HZ2  TRP  36           HZ2      TRP  36  12.924   3.302  -1.643
  277    HZ3  TRP  36           HZ3      TRP  36  10.501  -0.204  -1.089
  278    HH2  TRP  36           HH2      TRP  36  12.323   0.931  -2.258
  279    H    TRP  37           H        TRP  37   4.807   4.331   1.956
  280    HA   TRP  37           HA       TRP  37   4.326   4.356   4.823
  281   1HB   TRP  37          HB2       TRP  37   2.745   5.049   2.381
  282   2HB   TRP  37          HB3       TRP  37   1.893   4.615   3.850
  283    HD1  TRP  37           HD1      TRP  37   3.516   6.127   6.069
  284    HE1  TRP  37           HE1      TRP  37   3.670   8.756   6.243
  285    HE3  TRP  37           HE3      TRP  37   2.365   7.043   1.202
  286    HZ2  TRP  37           HZ2      TRP  37   3.301  10.875   4.369
  287    HZ3  TRP  37           HZ3      TRP  37   2.283   9.420   0.455
  288    HH2  TRP  37           HH2      TRP  37   2.727  11.302   1.950
  289    H    GLU  38           H        GLU  38   2.927   2.769   5.838
  290    HA   GLU  38           HA       GLU  38   3.315   0.192   4.740
  291   1HB   GLU  38          HB2       GLU  38   2.420   1.372   7.290
  292   2HB   GLU  38          HB3       GLU  38   1.537  -0.086   6.883
  293   1HG   GLU  38          HG2       GLU  38   4.559  -0.038   6.628
  294   2HG   GLU  38          HG3       GLU  38   3.824  -0.262   8.203
  295    HE2  GLU  38           HE2      GLU  38   2.013  -1.756   8.053
  296    H    ALA  39           H        ALA  39   1.444  -1.428   4.552
  297    HA   ALA  39           HA       ALA  39  -1.045  -0.132   3.735
  298   1HB   ALA  39          HB1       ALA  39   0.677  -1.974   2.034
  299   2HB   ALA  39          HB2       ALA  39  -1.028  -1.611   1.680
  300   3HB   ALA  39          HB3       ALA  39   0.180  -0.304   1.667
  301    H    ARG  40           H        ARG  40  -2.675  -1.107   4.819
  302    HA   ARG  40           HA       ARG  40  -2.219  -3.889   5.547
  303   1HB   ARG  40          HB2       ARG  40  -2.383  -2.133   7.435
  304   2HB   ARG  40          HB3       ARG  40  -4.063  -1.920   6.985
  305   1HG   ARG  40          HG2       ARG  40  -4.520  -3.638   8.405
  306   2HG   ARG  40          HG3       ARG  40  -3.857  -4.694   7.175
  307   1HD   ARG  40          HD2       ARG  40  -1.524  -4.118   8.276
  308   2HD   ARG  40          HD3       ARG  40  -2.479  -3.585   9.643
  309    HE   ARG  40           HE       ARG  40  -3.449  -5.882   9.757
  310   1HH1  ARG  40          HH22      ARG  40  -0.496  -5.455   7.846
  311   2HH1  ARG  40          HH21      ARG  40  -0.033  -7.121   7.959
  312   1HH2  ARG  40          HH11      ARG  40  -1.425  -8.645   9.176
  313    H    SER  41           H        SER  41  -3.696  -5.378   4.750
  314    HA   SER  41           HA       SER  41  -5.909  -4.271   3.261
  315   1HB   SER  41          HB2       SER  41  -4.136  -6.197   2.577
  316   2HB   SER  41          HB3       SER  41  -5.347  -7.222   3.322
  317    HG   SER  41           HG       SER  41  -6.632  -5.440   1.712
  318    H    LEU  42           H        LEU  42  -7.943  -4.217   4.142
  319    HA   LEU  42           HA       LEU  42  -8.393  -5.614   6.622
  320   1HB   LEU  42          HB2       LEU  42  -9.219  -3.212   5.533
  321   2HB   LEU  42          HB3       LEU  42 -10.652  -4.211   5.415
  322    HG   LEU  42           HG       LEU  42 -10.482  -4.705   7.849
  323   1HD1  LEU  42          HD11      LEU  42  -8.636  -4.284   8.999
  324   2HD1  LEU  42          HD12      LEU  42  -7.889  -3.580   7.545
  325   3HD1  LEU  42          HD13      LEU  42  -8.806  -2.543   8.664
  326   1HD2  LEU  42          HD21      LEU  42 -11.828  -2.973   8.254
  327   2HD2  LEU  42          HD22      LEU  42 -10.542  -1.783   7.937
  328   3HD2  LEU  42          HD23      LEU  42 -11.481  -2.461   6.586
  329    H    THR  43           H        THR  43  -8.443  -6.488   3.397
  330    HA   THR  43           HA       THR  43 -10.869  -8.090   3.579
  331    HB   THR  43           HB       THR  43  -8.792  -7.649   1.367
  332    HG1  THR  43           HG1      THR  43 -10.082  -5.872   1.111
  333   1HG2  THR  43          HG21      THR  43 -10.488  -9.781   1.438
  334   2HG2  THR  43          HG22      THR  43 -11.619  -8.540   0.850
  335   3HG2  THR  43          HG23      THR  43 -10.137  -8.900  -0.068
  336    H    THR  44           H        THR  44  -7.650  -9.019   2.256
  337    HA   THR  44           HA       THR  44  -7.974 -11.580   3.609
  338    HB   THR  44           HB       THR  44  -5.930 -10.608   1.544
  339    HG1  THR  44           HG1      THR  44  -8.508 -12.008   1.477
  340   1HG2  THR  44          HG21      THR  44  -6.928 -13.447   1.964
  341   2HG2  THR  44          HG22      THR  44  -5.432 -12.899   1.170
  342   3HG2  THR  44          HG23      THR  44  -5.575 -12.834   2.943
  343    H    GLY  45           H        GLY  45  -5.172  -9.337   3.071
  344   1HA   GLY  45          HA3       GLY  45  -4.396  -8.481   5.377
  345   2HA   GLY  45          HA2       GLY  45  -4.157 -10.187   5.699
  346    H    GLU  46           H        GLU  46  -3.351  -7.631   3.250
  347    HA   GLU  46           HA       GLU  46  -0.769  -8.965   2.989
  348   1HB   GLU  46          HB2       GLU  46  -2.252  -7.445   0.799
  349   2HB   GLU  46          HB3       GLU  46  -0.706  -8.251   0.627
  350   1HG   GLU  46          HG2       GLU  46  -1.786 -10.442   1.172
  351   2HG   GLU  46          HG3       GLU  46  -3.333  -9.636   1.348
  352    HE2  GLU  46           HE2      GLU  46  -3.345 -11.156  -1.669
  353    H    THR  47           H        THR  47   0.902  -7.724   3.711
  354    HA   THR  47           HA       THR  47   0.541  -4.802   3.595
  355    HB   THR  47           HB       THR  47   0.345  -5.338   5.910
  356    HG1  THR  47           HG1      THR  47   3.205  -5.155   5.266
  357   1HG2  THR  47          HG21      THR  47   2.347  -6.836   6.878
  358   2HG2  THR  47          HG22      THR  47   0.876  -7.609   6.241
  359   3HG2  THR  47          HG23      THR  47   2.340  -7.513   5.233
  360    H    GLY  48           H        GLY  48   2.590  -3.560   3.513
  361   1HA   GLY  48          HA3       GLY  48   5.087  -4.554   3.053
  362   2HA   GLY  48          HA2       GLY  48   4.291  -4.695   1.497
  363    H    TYR  49           H        TYR  49   6.404  -3.035   1.477
  364    HA   TYR  49           HA       TYR  49   5.544  -0.343   2.113
  365   1HB   TYR  49          HB2       TYR  49   8.003  -1.782   0.972
  366   2HB   TYR  49          HB3       TYR  49   7.929  -0.032   0.953
  367    HD1  TYR  49           HD1      TYR  49   6.853   0.749   3.503
  368    HD2  TYR  49           HD2      TYR  49   9.487  -2.500   2.601
  369    HE1  TYR  49           HE1      TYR  49   7.751   0.806   5.881
  370    HE2  TYR  49           HE2      TYR  49  10.376  -2.431   4.982
  371    HH   TYR  49           HH       TYR  49   8.826  -0.606   7.431
  372    H    ILE  50           H        ILE  50   4.968   1.245   0.641
  373    HA   ILE  50           HA       ILE  50   5.431   0.947  -2.133
  374    HB   ILE  50           HB       ILE  50   3.610  -0.723  -1.759
  375   1HG1  ILE  50          HG12      ILE  50   2.086   0.597  -3.574
  376   2HG1  ILE  50          HG13      ILE  50   3.558   1.544  -3.674
  377   1HG2  ILE  50          HG21      ILE  50   1.867  -0.210  -0.491
  378   2HG2  ILE  50          HG22      ILE  50   2.427   1.474  -0.343
  379   3HG2  ILE  50          HG23      ILE  50   1.368   1.003  -1.695
  380   1HD1  ILE  50          HD11      ILE  50   4.304  -0.079  -5.085
  381   2HD1  ILE  50          HD12      ILE  50   4.542  -1.061  -3.621
  382   3HD1  ILE  50          HD13      ILE  50   3.043  -1.223  -4.566
  383    HA   PRO  51           HA       PRO  51   5.032   5.198  -1.317
  384   1HB   PRO  51          HB2       PRO  51   5.706   6.120  -3.800
  385   2HB   PRO  51          HB3       PRO  51   6.891   5.697  -2.580
  386   1HG   PRO  51          HG2       PRO  51   6.114   4.199  -5.007
  387   2HG   PRO  51          HG3       PRO  51   7.555   4.025  -4.024
  388   1HD   PRO  51          HD2       PRO  51   5.263   2.299  -4.031
  389   2HD   PRO  51          HD3       PRO  51   6.652   2.193  -2.967
  390    H    SER  52           H        SER  52   3.377   6.604  -1.180
  391    HA   SER  52           HA       SER  52   1.116   5.833  -2.766
  392   1HB   SER  52          HB2       SER  52   1.608   7.490  -0.330
  393   2HB   SER  52          HB3       SER  52   0.261   8.002  -1.327
  394    HG   SER  52           HG       SER  52  -0.817   6.113  -0.951
  395    H    ASN  53           H        ASN  53   3.492   7.040  -4.102
  396    HA   ASN  53           HA       ASN  53   2.555   9.685  -4.759
  397   1HB   ASN  53          HB2       ASN  53   5.107   8.390  -4.670
  398   2HB   ASN  53          HB3       ASN  53   4.818   8.744  -6.363
  399   1HD2  ASN  53          HD21      ASN  53   3.566  10.514  -3.575
  400   2HD2  ASN  53          HD22      ASN  53   4.397  12.008  -3.854
  401    H    TYR  54           H        TYR  54   1.688   6.624  -5.602
  402    HA   TYR  54           HA       TYR  54   1.065   7.416  -8.350
  403   1HB   TYR  54          HB2       TYR  54   2.672   5.114  -7.231
  404   2HB   TYR  54          HB3       TYR  54   1.511   4.664  -8.465
  405    HD1  TYR  54           HD1      TYR  54   4.770   6.002  -7.826
  406    HD2  TYR  54           HD2      TYR  54   1.629   5.910 -10.729
  407    HE1  TYR  54           HE1      TYR  54   6.411   6.707  -9.635
  408    HE2  TYR  54           HE2      TYR  54   3.281   6.615 -12.529
  409    HH   TYR  54           HH       TYR  54   6.254   6.260 -12.482
  410    H    VAL  55           H        VAL  55  -0.768   7.752  -6.355
  411    HA   VAL  55           HA       VAL  55  -2.540   5.452  -6.785
  412    HB   VAL  55           HB       VAL  55  -3.409   5.756  -4.534
  413   1HG1  VAL  55          HG11      VAL  55  -1.823   4.076  -4.512
  414   2HG1  VAL  55          HG12      VAL  55  -0.490   5.177  -4.937
  415   3HG1  VAL  55          HG13      VAL  55  -1.161   5.186  -3.288
  416   1HG2  VAL  55          HG21      VAL  55  -2.903   7.456  -3.137
  417   2HG2  VAL  55          HG22      VAL  55  -1.183   7.463  -3.597
  418   3HG2  VAL  55          HG23      VAL  55  -2.383   8.282  -4.625
  419    H    ALA  56           H        ALA  56  -4.807   6.653  -5.506
  420    HA   ALA  56           HA       ALA  56  -5.181   9.257  -6.640
  421   1HB   ALA  56          HB1       ALA  56  -6.308   8.736  -8.529
  422   2HB   ALA  56          HB2       ALA  56  -5.579   7.120  -8.365
  423   3HB   ALA  56          HB3       ALA  56  -7.213   7.429  -7.728
  424    HA   PRO  57           HA       PRO  57  -7.685   8.660  -3.047
  425   1HB   PRO  57          HB2       PRO  57  -7.604  11.249  -2.177
  426   2HB   PRO  57          HB3       PRO  57  -6.414  10.047  -1.719
  427   1HG   PRO  57          HG2       PRO  57  -6.152  12.275  -3.645
  428   2HG   PRO  57          HG3       PRO  57  -4.889  11.344  -2.864
  429   1HD   PRO  57          HD2       PRO  57  -5.791  11.078  -5.574
  430   2HD   PRO  57          HD3       PRO  57  -4.611  10.071  -4.758
  431    H    VAL  58           H        VAL  58  -9.553  10.302  -2.068
  432    HA   VAL  58           HA       VAL  58 -11.439  10.222  -4.243
  433    HB   VAL  58           HB       VAL  58 -11.924  11.248  -1.456
  434   1HG1  VAL  58          HG11      VAL  58 -13.887   9.501  -2.796
  435   2HG1  VAL  58          HG12      VAL  58 -14.117  11.042  -1.935
  436   3HG1  VAL  58          HG13      VAL  58 -13.578  11.041  -3.631
  437   1HG2  VAL  58          HG21      VAL  58 -11.664   8.363  -2.350
  438   2HG2  VAL  58          HG22      VAL  58 -10.765   9.196  -1.060
  439   3HG2  VAL  58          HG23      VAL  58 -12.501   8.860  -0.860
  440    H    ASP  59           H        ASP  59 -11.553  11.859  -5.686
  441    HA   ASP  59           HA       ASP  59 -10.637  14.452  -4.830
  442   1HB   ASP  59          HB2       ASP  59 -11.738  13.859  -7.584
  443   2HB   ASP  59          HB3       ASP  59 -10.476  14.987  -7.130
  444    HD2  ASP  59           HD2      ASP  59 -10.628  12.977  -9.025