NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
622848 5wpy cing 1-original 3 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1          1HT       MET   1  -0.582  15.890   2.090
    2    H2   MET   1          2HT       MET   1  -2.193  15.354   2.035
    3    H3   MET   1          3HT       MET   1  -1.156  15.073   0.719
    4    HA   MET   1           HA       MET   1  -0.200  13.290   1.651
    5    HB2  MET   1          2HB       MET   1  -0.538  14.769   4.272
    6    HB3  MET   1          1HB       MET   1   0.178  13.162   4.143
    7    HG2  MET   1          2HG       MET   1   1.854  14.091   2.535
    8    HG3  MET   1          1HG       MET   1   1.188  15.699   2.825
    9    HE1  MET   1          1HE       MET   1   1.836  16.567   6.350
   10    HE2  MET   1          2HE       MET   1   0.571  15.345   6.242
   11    HE3  MET   1          3HE       MET   1   0.705  16.576   4.989
   12    H    GLN   2           H        GLN   2  -2.834  14.509   3.740
   13    HA   GLN   2           HA       GLN   2  -4.786  13.438   4.481
   14    HB2  GLN   2          2HB       GLN   2  -4.410  11.922   1.877
   15    HB3  GLN   2          1HB       GLN   2  -5.891  11.962   2.833
   16    HG2  GLN   2          2HG       GLN   2  -6.015  14.410   2.545
   17    HG3  GLN   2          1HG       GLN   2  -4.538  14.370   1.582
   18   HE21  GLN   2          1HE2      GLN   2  -6.844  15.368   0.356
   19   HE22  GLN   2          2HE2      GLN   2  -7.414  14.256  -0.793
   20    H    HIS   3           H        HIS   3  -2.658  12.514   5.814
   21    HA   HIS   3           HA       HIS   3  -2.123  10.705   7.225
   22    HB2  HIS   3          2HB       HIS   3  -3.853   8.843   5.619
   23    HB3  HIS   3          1HB       HIS   3  -3.507   8.834   7.343
   24    HD1  HIS   3          1HD       HIS   3  -5.861  10.202   4.835
   25    HD2  HIS   3          2HD       HIS   3  -4.935  10.889   8.844
   26    HE1  HIS   3          1HE       HIS   3  -7.756  11.593   5.781
   27    HE2  HIS   3          2HE       HIS   3  -7.203  12.017   8.220
   28    H    ALA   4           H        ALA   4  -0.579  11.415   4.973
   29    HA   ALA   4           HA       ALA   4   0.096   9.223   3.278
   30    HB1  ALA   4          1HB       ALA   4   0.868  11.472   2.763
   31    HB2  ALA   4          2HB       ALA   4   2.274  10.431   2.985
   32    HB3  ALA   4          3HB       ALA   4   1.786  11.538   4.268
   33    H    SER   5           H        SER   5   1.120  10.082   6.548
   34    HA   SER   5           HA       SER   5   3.332   8.290   6.741
   35    HB2  SER   5          2HB       SER   5   3.105   8.536   9.141
   36    HB3  SER   5          1HB       SER   5   2.762  10.094   8.397
   37    HG   SER   5           HG       SER   5   1.202   8.626   9.967
   38    H    VAL   6           H        VAL   6  -0.145   7.793   7.193
   39    HA   VAL   6           HA       VAL   6   0.061   5.145   8.286
   40    HB   VAL   6           HB       VAL   6  -2.150   6.482   6.717
   41   HG11  VAL   6          1HG1      VAL   6  -3.260   4.443   8.241
   42   HG12  VAL   6          2HG1      VAL   6  -1.795   3.710   7.593
   43   HG13  VAL   6          3HG1      VAL   6  -2.997   4.391   6.498
   44   HG21  VAL   6          1HG2      VAL   6  -3.182   6.774   8.902
   45   HG22  VAL   6          2HG2      VAL   6  -1.549   7.437   8.959
   46   HG23  VAL   6          3HG2      VAL   6  -1.886   5.860   9.673
   47    H    ILE   7           H        ILE   7  -0.172   6.390   4.983
   48    HA   ILE   7           HA       ILE   7  -0.451   3.903   3.643
   49    HB   ILE   7           HB       ILE   7   0.995   6.406   2.726
   50   HG12  ILE   7          2HG1      ILE   7  -1.864   5.519   2.235
   51   HG13  ILE   7          1HG1      ILE   7  -1.403   6.674   3.484
   52   HG21  ILE   7          1HG2      ILE   7   0.498   5.554   0.460
   53   HG22  ILE   7          2HG2      ILE   7  -0.211   4.100   1.162
   54   HG23  ILE   7          3HG2      ILE   7   1.513   4.420   1.351
   55   HD11  ILE   7          1HD1      ILE   7  -0.140   7.555   1.120
   56   HD12  ILE   7          2HD1      ILE   7  -1.513   8.301   1.938
   57   HD13  ILE   7          3HD1      ILE   7  -1.784   7.120   0.656
   58    H    ALA   8           H        ALA   8   2.511   5.741   4.445
   59    HA   ALA   8           HA       ALA   8   4.330   3.757   3.450
   60    HB1  ALA   8          1HB       ALA   8   5.293   5.252   5.782
   61    HB2  ALA   8          2HB       ALA   8   4.576   6.291   4.550
   62    HB3  ALA   8          3HB       ALA   8   5.918   5.225   4.133
   63    H    GLN   9           H        GLN   9   2.884   4.329   6.628
   64    HA   GLN   9           HA       GLN   9   4.249   2.207   7.998
   65    HB2  GLN   9          2HB       GLN   9   3.042   4.035   9.165
   66    HB3  GLN   9          1HB       GLN   9   1.516   3.409   8.543
   67    HG2  GLN   9          2HG       GLN   9   2.853   1.214   9.732
   68    HG3  GLN   9          1HG       GLN   9   2.989   2.560  10.864
   69   HE21  GLN   9          1HE2      GLN   9   0.545   0.810   8.887
   70   HE22  GLN   9          2HE2      GLN   9  -0.747   1.113   9.947
   71    H    PHE  10           H        PHE  10   1.254   2.375   6.142
   72    HA   PHE  10           HA       PHE  10   0.191  -0.179   6.768
   73    HB2  PHE  10          2HB       PHE  10  -0.857   1.762   5.447
   74    HB3  PHE  10          1HB       PHE  10   0.027   1.142   4.056
   75    HD1  PHE  10          1HD       PHE  10  -2.665   0.473   6.479
   76    HD2  PHE  10          2HD       PHE  10  -0.590  -0.968   3.004
   77    HE1  PHE  10          1HE       PHE  10  -4.475  -1.174   6.082
   78    HE2  PHE  10          2HE       PHE  10  -2.400  -2.618   2.610
   79    HZ   PHE  10           HZ       PHE  10  -4.343  -2.717   4.150
   80    H    VAL  11           H        VAL  11   2.225   0.755   3.977
   81    HA   VAL  11           HA       VAL  11   2.570  -2.004   3.148
   82    HB   VAL  11           HB       VAL  11   2.756   0.107   1.683
   83   HG11  VAL  11          1HG1      VAL  11   5.612   0.039   2.676
   84   HG12  VAL  11          2HG1      VAL  11   4.415   1.173   3.300
   85   HG13  VAL  11          3HG1      VAL  11   4.869   1.221   1.599
   86   HG21  VAL  11          1HG2      VAL  11   3.408  -1.589   0.334
   87   HG22  VAL  11          2HG2      VAL  11   4.250  -2.405   1.651
   88   HG23  VAL  11          3HG2      VAL  11   5.064  -1.135   0.738
   89    H    VAL  12           H        VAL  12   4.583   0.334   4.919
   90    HA   VAL  12           HA       VAL  12   6.884  -1.342   5.154
   91    HB   VAL  12           HB       VAL  12   5.908   0.870   6.964
   92   HG11  VAL  12          1HG1      VAL  12   8.637   0.808   7.159
   93   HG12  VAL  12          2HG1      VAL  12   8.259  -0.910   7.026
   94   HG13  VAL  12          3HG1      VAL  12   7.543   0.053   8.315
   95   HG21  VAL  12          1HG2      VAL  12   7.115   2.350   5.619
   96   HG22  VAL  12          2HG2      VAL  12   6.482   1.227   4.416
   97   HG23  VAL  12          3HG2      VAL  12   8.148   1.075   4.974
   98    H    GLU  13           H        GLU  13   4.003  -1.009   7.196
   99    HA   GLU  13           HA       GLU  13   4.886  -2.517   9.412
  100    HB2  GLU  13          2HB       GLU  13   2.730  -1.289   9.350
  101    HB3  GLU  13          1HB       GLU  13   2.098  -2.504   8.246
  102    HG2  GLU  13          2HG       GLU  13   2.536  -4.253   9.956
  103    HG3  GLU  13          1HG       GLU  13   3.075  -2.992  11.062
  104    H    GLU  14           H        GLU  14   3.957  -3.562   6.213
  105    HA   GLU  14           HA       GLU  14   3.449  -6.320   6.819
  106    HB2  GLU  14          2HB       GLU  14   4.537  -5.008   4.311
  107    HB3  GLU  14          1HB       GLU  14   4.052  -6.700   4.409
  108    HG2  GLU  14          2HG       GLU  14   1.775  -5.995   5.078
  109    HG3  GLU  14          1HG       GLU  14   2.263  -4.306   4.915
  110    H    PHE  15           H        PHE  15   6.399  -4.472   6.341
  111    HA   PHE  15           HA       PHE  15   7.957  -6.727   7.412
  112    HB2  PHE  15          2HB       PHE  15   9.581  -6.149   5.316
  113    HB3  PHE  15          1HB       PHE  15   8.391  -7.447   5.284
  114    HD1  PHE  15          1HD       PHE  15   7.428  -7.512   3.159
  115    HD2  PHE  15          2HD       PHE  15   8.011  -3.719   5.090
  116    HE1  PHE  15          1HE       PHE  15   6.229  -6.384   1.307
  117    HE2  PHE  15          2HE       PHE  15   6.814  -2.592   3.235
  118    HZ   PHE  15           HZ       PHE  15   5.922  -3.925   1.345
  119    H    LEU  16           H        LEU  16   7.536  -4.409   8.752
  120    HA   LEU  16           HA       LEU  16   9.570  -2.441   8.100
  121    HB2  LEU  16          2HB       LEU  16   8.706  -1.151   9.851
  122    HB3  LEU  16          1HB       LEU  16   7.302  -2.009   9.249
  123    HG   LEU  16           HG       LEU  16   8.952  -2.844  11.653
  124   HD11  LEU  16          1HD1      LEU  16   7.703  -1.398  12.823
  125   HD12  LEU  16          2HD1      LEU  16   6.246  -2.230  12.277
  126   HD13  LEU  16          3HD1      LEU  16   6.894  -0.881  11.343
  127   HD21  LEU  16          1HD2      LEU  16   7.896  -4.765  10.533
  128   HD22  LEU  16          2HD2      LEU  16   6.361  -3.905  10.470
  129   HD23  LEU  16          3HD2      LEU  16   7.027  -4.405  12.023
  130    HA   PRO  17           HA       PRO  17  12.773  -4.520  10.400
  131    HB2  PRO  17          2HB       PRO  17  14.599  -2.491  10.495
  132    HB3  PRO  17          1HB       PRO  17  14.275  -3.415   9.017
  133    HG2  PRO  17          2HG       PRO  17  13.289  -0.724   9.817
  134    HG3  PRO  17          1HG       PRO  17  13.839  -1.299   8.236
  135    HD2  PRO  17          2HD       PRO  17  11.195  -1.047   8.909
  136    HD3  PRO  17          1HD       PRO  17  11.796  -2.219   7.717
  137    H    ASP  18           H        ASP  18  14.483  -2.990  12.183
  138    HA   ASP  18           HA       ASP  18  12.682  -2.810  14.486
  139    HB2  ASP  18          2HB       ASP  18  14.739  -2.500  15.773
  140    HB3  ASP  18          1HB       ASP  18  14.940  -3.851  14.662
  141    H    VAL  19           H        VAL  19  12.870  -0.808  12.109
  142    HA   VAL  19           HA       VAL  19  13.271   1.666  13.744
  143    HB   VAL  19           HB       VAL  19  13.280   1.357  10.730
  144   HG11  VAL  19          1HG1      VAL  19  14.628   3.642  11.269
  145   HG12  VAL  19          2HG1      VAL  19  13.500   3.637  12.625
  146   HG13  VAL  19          3HG1      VAL  19  12.891   3.601  10.970
  147   HG21  VAL  19          1HG2      VAL  19  15.802   1.895  11.176
  148   HG22  VAL  19          2HG2      VAL  19  15.236   0.242  11.411
  149   HG23  VAL  19          3HG2      VAL  19  15.469   1.301  12.802
  150    H    ALA  20           H        ALA  20  11.557   3.095  13.929
  151    HA   ALA  20           HA       ALA  20   8.911   2.186  13.318
  152    HB1  ALA  20          1HB       ALA  20   8.699   3.727  14.980
  153    HB2  ALA  20          2HB       ALA  20   8.614   4.888  13.655
  154    HB3  ALA  20          3HB       ALA  20  10.148   4.599  14.477
  155    HA   PRO  21           HA       PRO  21   8.676   3.159   8.944
  156    HB2  PRO  21          2HB       PRO  21   5.954   4.189   9.579
  157    HB3  PRO  21          1HB       PRO  21   6.455   3.002   8.362
  158    HG2  PRO  21          2HG       PRO  21   5.235   2.316  10.659
  159    HG3  PRO  21          1HG       PRO  21   6.395   1.271   9.832
  160    HD2  PRO  21          2HD       PRO  21   6.710   2.763  12.362
  161    HD3  PRO  21          1HD       PRO  21   7.603   1.353  11.752
  162    H    ALA  22           H        ALA  22   7.703   5.504  11.389
  163    HA   ALA  22           HA       ALA  22   7.623   7.808   9.672
  164    HB1  ALA  22          1HB       ALA  22   8.518   8.437  12.356
  165    HB2  ALA  22          2HB       ALA  22   7.198   7.268  12.404
  166    HB3  ALA  22          3HB       ALA  22   6.978   8.815  11.584
  167    H    ASP  23           H        ASP  23  10.216   5.998  11.106
  168    HA   ASP  23           HA       ASP  23  12.166   8.146  10.446
  169    HB2  ASP  23          2HB       ASP  23  12.446   5.576  12.030
  170    HB3  ASP  23          1HB       ASP  23  13.785   6.671  11.683
  171    H    VAL  24           H        VAL  24  10.691   5.832   8.783
  172    HA   VAL  24           HA       VAL  24  13.142   4.767   7.471
  173    HB   VAL  24           HB       VAL  24  10.232   3.992   7.088
  174   HG11  VAL  24          1HG1      VAL  24  12.814   2.725   6.120
  175   HG12  VAL  24          2HG1      VAL  24  11.626   3.551   5.111
  176   HG13  VAL  24          3HG1      VAL  24  11.203   2.037   5.912
  177   HG21  VAL  24          1HG2      VAL  24  12.435   2.463   8.499
  178   HG22  VAL  24          2HG2      VAL  24  10.715   2.073   8.457
  179   HG23  VAL  24          3HG2      VAL  24  11.278   3.485   9.351
  180    H    ASP  25           H        ASP  25  13.655   5.377   5.381
  181    HA   ASP  25           HA       ASP  25  12.497   7.784   4.334
  182    HB2  ASP  25          2HB       ASP  25  14.271   5.697   3.031
  183    HB3  ASP  25          1HB       ASP  25  13.864   7.249   2.297
  184    H    VAL  26           H        VAL  26  10.241   7.413   4.102
  185    HA   VAL  26           HA       VAL  26   9.090   5.194   2.720
  186    HB   VAL  26           HB       VAL  26   7.071   6.506   2.627
  187   HG11  VAL  26          1HG1      VAL  26   7.993   5.814   4.896
  188   HG12  VAL  26          2HG1      VAL  26   6.849   7.157   4.928
  189   HG13  VAL  26          3HG1      VAL  26   8.579   7.469   5.070
  190   HG21  VAL  26          1HG2      VAL  26   7.795   8.549   1.641
  191   HG22  VAL  26          2HG2      VAL  26   8.977   8.835   2.918
  192   HG23  VAL  26          3HG2      VAL  26   7.255   8.995   3.260
  193    H    ASP  27           H        ASP  27  11.285   7.215   1.468
  194    HA   ASP  27           HA       ASP  27   9.970   7.656  -1.145
  195    HB2  ASP  27          2HB       ASP  27  12.726   8.378  -0.101
  196    HB3  ASP  27          1HB       ASP  27  12.149   8.762  -1.723
  197    H    LEU  28           H        LEU  28  11.054   5.006   0.205
  198    HA   LEU  28           HA       LEU  28  12.979   4.102  -1.825
  199    HB2  LEU  28          2HB       LEU  28  13.107   3.357   0.558
  200    HB3  LEU  28          1HB       LEU  28  11.577   2.513   0.339
  201    HG   LEU  28           HG       LEU  28  12.639   1.247  -1.569
  202   HD11  LEU  28          1HD1      LEU  28  15.266   1.255  -1.243
  203   HD12  LEU  28          2HD1      LEU  28  14.976   2.885  -0.639
  204   HD13  LEU  28          3HD1      LEU  28  14.495   2.454  -2.280
  205   HD21  LEU  28          1HD2      LEU  28  13.173   1.011   1.297
  206   HD22  LEU  28          2HD2      LEU  28  14.418   0.234   0.319
  207   HD23  LEU  28          3HD2      LEU  28  12.728  -0.239   0.135
  208    H    ASP  29           H        ASP  29  12.470   2.923  -3.618
  209    HA   ASP  29           HA       ASP  29   9.752   2.762  -4.485
  210    HB2  ASP  29          2HB       ASP  29  10.678   1.300  -6.307
  211    HB3  ASP  29          1HB       ASP  29  11.542   2.826  -6.125
  212    H    LEU  30           H        LEU  30   8.235   1.347  -3.818
  213    HA   LEU  30           HA       LEU  30   8.811  -0.790  -2.017
  214    HB2  LEU  30          2HB       LEU  30   6.352  -0.437  -3.762
  215    HB3  LEU  30          1HB       LEU  30   6.464  -1.437  -2.313
  216    HG   LEU  30           HG       LEU  30   6.785   1.576  -2.435
  217   HD11  LEU  30          1HD1      LEU  30   4.560   1.615  -2.103
  218   HD12  LEU  30          2HD1      LEU  30   4.777   0.682  -0.622
  219   HD13  LEU  30          3HD1      LEU  30   4.509  -0.147  -2.155
  220   HD21  LEU  30          1HD2      LEU  30   8.191   1.007  -0.675
  221   HD22  LEU  30          2HD2      LEU  30   7.311  -0.479  -0.317
  222   HD23  LEU  30          3HD2      LEU  30   6.648   1.079   0.174
  223    H    VAL  31           H        VAL  31   9.328  -0.594  -5.345
  224    HA   VAL  31           HA       VAL  31   8.594  -3.102  -6.350
  225    HB   VAL  31           HB       VAL  31   9.809  -1.190  -7.567
  226   HG11  VAL  31          1HG1      VAL  31  12.265  -2.699  -6.648
  227   HG12  VAL  31          2HG1      VAL  31  11.709  -1.222  -5.861
  228   HG13  VAL  31          3HG1      VAL  31  12.200  -1.188  -7.555
  229   HG21  VAL  31          1HG2      VAL  31  10.183  -4.124  -7.896
  230   HG22  VAL  31          2HG2      VAL  31  11.240  -3.088  -8.854
  231   HG23  VAL  31          3HG2      VAL  31   9.489  -2.948  -9.011
  232    H    ASP  32           H        ASP  32  11.410  -2.261  -4.357
  233    HA   ASP  32           HA       ASP  32  12.635  -4.844  -4.369
  234    HB2  ASP  32          2HB       ASP  32  12.553  -2.713  -2.203
  235    HB3  ASP  32          1HB       ASP  32  13.597  -4.134  -2.153
  236    H    ASN  33           H        ASN  33   9.986  -3.423  -2.588
  237    HA   ASN  33           HA       ASN  33   9.566  -5.800  -0.922
  238    HB2  ASN  33          2HB       ASN  33   7.962  -3.264  -1.265
  239    HB3  ASN  33          1HB       ASN  33   7.575  -4.540  -0.115
  240   HD21  ASN  33          1HD2      ASN  33   8.132  -2.007   0.900
  241   HD22  ASN  33          2HD2      ASN  33   9.642  -2.010   1.673
  242    H    GLY  34           H        GLY  34   9.303  -5.594  -4.007
  243    HA2  GLY  34          2HA       GLY  34   6.748  -5.811  -4.987
  244    HA3  GLY  34          1HA       GLY  34   8.039  -6.881  -5.534
  245    H    VAL  35           H        VAL  35   8.082  -7.756  -2.506
  246    HA   VAL  35           HA       VAL  35   6.730 -10.214  -2.804
  247    HB   VAL  35           HB       VAL  35   7.300  -8.569  -0.318
  248   HG11  VAL  35          1HG1      VAL  35   7.056 -11.201   0.484
  249   HG12  VAL  35          2HG1      VAL  35   5.738 -11.030  -0.675
  250   HG13  VAL  35          3HG1      VAL  35   5.834  -9.951   0.718
  251   HG21  VAL  35          1HG2      VAL  35   9.237  -9.888  -0.099
  252   HG22  VAL  35          2HG2      VAL  35   9.149  -9.606  -1.838
  253   HG23  VAL  35          3HG2      VAL  35   8.614 -11.146  -1.166
  254    H    ILE  36           H        ILE  36   5.574  -7.088  -1.618
  255    HA   ILE  36           HA       ILE  36   2.926  -7.995  -0.903
  256    HB   ILE  36           HB       ILE  36   4.186  -5.816  -0.223
  257   HG12  ILE  36          2HG1      ILE  36   1.269  -5.855  -1.050
  258   HG13  ILE  36          1HG1      ILE  36   1.930  -6.285   0.525
  259   HG21  ILE  36          1HG2      ILE  36   4.408  -5.255  -2.752
  260   HG22  ILE  36          2HG2      ILE  36   3.966  -3.950  -1.650
  261   HG23  ILE  36          3HG2      ILE  36   2.727  -4.736  -2.630
  262   HD11  ILE  36          1HD1      ILE  36   1.125  -4.060   0.781
  263   HD12  ILE  36          2HD1      ILE  36   1.823  -3.555  -0.757
  264   HD13  ILE  36          3HD1      ILE  36   2.874  -3.906   0.615
  265    H    ASP  37           H        ASP  37   4.425  -6.991  -3.883
  266    HA   ASP  37           HA       ASP  37   2.132  -6.161  -5.323
  267    HB2  ASP  37          2HB       ASP  37   4.649  -7.512  -6.319
  268    HB3  ASP  37          1HB       ASP  37   3.438  -6.778  -7.365
  269    H    SER  38           H        SER  38   3.296  -9.440  -4.652
  270    HA   SER  38           HA       SER  38   1.118 -10.484  -6.394
  271    HB2  SER  38          2HB       SER  38   3.799 -11.368  -5.774
  272    HB3  SER  38          1HB       SER  38   2.629 -12.635  -5.419
  273    H    LEU  39           H        LEU  39   2.574 -11.539  -3.297
  274    HA   LEU  39           HA       LEU  39   0.132 -12.865  -2.524
  275    HB2  LEU  39          2HB       LEU  39   2.459 -12.113  -0.767
  276    HB3  LEU  39          1HB       LEU  39   1.273 -13.377  -0.466
  277    HG   LEU  39           HG       LEU  39   3.397 -13.303  -2.605
  278   HD11  LEU  39          1HD1      LEU  39   4.157 -14.169  -0.495
  279   HD12  LEU  39          2HD1      LEU  39   3.901 -15.547  -1.566
  280   HD13  LEU  39          3HD1      LEU  39   2.709 -15.161  -0.325
  281   HD21  LEU  39          1HD2      LEU  39   2.345 -15.583  -3.224
  282   HD22  LEU  39          2HD2      LEU  39   1.522 -14.132  -3.796
  283   HD23  LEU  39          3HD2      LEU  39   0.907 -14.999  -2.387
  284    H    GLY  40           H        GLY  40   1.763  -9.980  -1.221
  285    HA2  GLY  40          2HA       GLY  40  -0.345  -9.345   0.610
  286    HA3  GLY  40          1HA       GLY  40   0.893  -8.222   0.065
  287    H    LEU  41           H        LEU  41   0.246  -8.436  -2.754
  288    HA   LEU  41           HA       LEU  41  -1.684  -6.369  -2.960
  289    HB2  LEU  41          2HB       LEU  41   0.023  -7.072  -4.708
  290    HB3  LEU  41          1HB       LEU  41  -1.063  -8.391  -5.128
  291    HG   LEU  41           HG       LEU  41  -2.161  -5.596  -5.028
  292   HD11  LEU  41          1HD1      LEU  41  -0.665  -6.737  -7.403
  293   HD12  LEU  41          2HD1      LEU  41  -0.025  -5.491  -6.333
  294   HD13  LEU  41          3HD1      LEU  41  -1.455  -5.164  -7.310
  295   HD21  LEU  41          1HD2      LEU  41  -3.430  -6.562  -7.030
  296   HD22  LEU  41          2HD2      LEU  41  -3.781  -7.304  -5.474
  297   HD23  LEU  41          3HD2      LEU  41  -2.715  -8.118  -6.618
  298    H    LEU  42           H        LEU  42  -2.033  -9.889  -3.316
  299    HA   LEU  42           HA       LEU  42  -4.806  -9.831  -4.035
  300    HB2  LEU  42          2HB       LEU  42  -3.171 -11.939  -2.606
  301    HB3  LEU  42          1HB       LEU  42  -4.810 -12.195  -3.177
  302    HG   LEU  42           HG       LEU  42  -2.477 -11.376  -4.925
  303   HD11  LEU  42          1HD1      LEU  42  -1.938 -13.566  -4.926
  304   HD12  LEU  42          2HD1      LEU  42  -3.504 -13.897  -5.666
  305   HD13  LEU  42          3HD1      LEU  42  -3.328 -13.951  -3.912
  306   HD21  LEU  42          1HD2      LEU  42  -4.234 -10.672  -6.195
  307   HD22  LEU  42          2HD2      LEU  42  -5.397 -11.643  -5.295
  308   HD23  LEU  42          3HD2      LEU  42  -4.411 -12.389  -6.552
  309    H    LYS  43           H        LYS  43  -3.159 -10.075  -0.885
  310    HA   LYS  43           HA       LYS  43  -5.590 -10.222   0.646
  311    HB2  LYS  43          2HB       LYS  43  -2.807  -9.323   1.407
  312    HB3  LYS  43          1HB       LYS  43  -4.110  -9.602   2.556
  313    HG2  LYS  43          2HG       LYS  43  -4.292 -11.948   1.717
  314    HG3  LYS  43          1HG       LYS  43  -2.893 -11.650   0.685
  315    HD2  LYS  43          2HD       LYS  43  -1.569 -11.061   2.721
  316    HD3  LYS  43          1HD       LYS  43  -2.960 -11.505   3.712
  317    HE2  LYS  43          2HE       LYS  43  -2.219 -13.631   3.674
  318    HE3  LYS  43          1HE       LYS  43  -2.582 -13.665   1.949
  319    HZ1  LYS  43          1HZ       LYS  43  -0.060 -13.621   3.244
  320    HZ2  LYS  43          2HZ       LYS  43  -0.203 -12.297   2.189
  321    HZ3  LYS  43          3HZ       LYS  43  -0.417 -13.879   1.607
  322    H    VAL  44           H        VAL  44  -3.488  -7.535  -0.339
  323    HA   VAL  44           HA       VAL  44  -4.896  -5.503   1.123
  324    HB   VAL  44           HB       VAL  44  -3.147  -5.356  -1.345
  325   HG11  VAL  44          1HG1      VAL  44  -3.944  -3.250  -1.549
  326   HG12  VAL  44          2HG1      VAL  44  -3.074  -2.897  -0.056
  327   HG13  VAL  44          3HG1      VAL  44  -4.781  -3.335   0.000
  328   HG21  VAL  44          1HG2      VAL  44  -1.480  -5.626   0.145
  329   HG22  VAL  44          2HG2      VAL  44  -2.644  -5.714   1.466
  330   HG23  VAL  44          3HG2      VAL  44  -2.002  -4.152   0.959
  331    H    ILE  45           H        ILE  45  -5.106  -6.553  -2.285
  332    HA   ILE  45           HA       ILE  45  -7.114  -4.692  -3.060
  333    HB   ILE  45           HB       ILE  45  -6.041  -7.259  -4.103
  334   HG12  ILE  45          2HG1      ILE  45  -5.718  -5.942  -6.089
  335   HG13  ILE  45          1HG1      ILE  45  -6.824  -4.696  -5.514
  336   HG21  ILE  45          1HG2      ILE  45  -7.864  -7.196  -5.899
  337   HG22  ILE  45          2HG2      ILE  45  -8.787  -6.193  -4.781
  338   HG23  ILE  45          3HG2      ILE  45  -8.338  -7.838  -4.328
  339   HD11  ILE  45          1HD1      ILE  45  -5.277  -3.795  -4.070
  340   HD12  ILE  45          2HD1      ILE  45  -4.163  -4.466  -5.259
  341   HD13  ILE  45          3HD1      ILE  45  -4.497  -5.347  -3.771
  342    H    ALA  46           H        ALA  46  -7.388  -8.011  -1.785
  343    HA   ALA  46           HA       ALA  46 -10.226  -8.183  -1.930
  344    HB1  ALA  46          1HB       ALA  46  -9.180 -10.222  -1.482
  345    HB2  ALA  46          2HB       ALA  46  -9.821  -9.795   0.104
  346    HB3  ALA  46          3HB       ALA  46  -8.117  -9.521  -0.262
  347    H    TRP  47           H        TRP  47  -8.097  -6.955   0.647
  348    HA   TRP  47           HA       TRP  47 -10.328  -6.372   2.426
  349    HB2  TRP  47          2HB       TRP  47  -8.441  -6.639   3.700
  350    HB3  TRP  47          1HB       TRP  47  -7.378  -6.002   2.446
  351    HD1  TRP  47           HD       TRP  47  -9.779  -4.850   5.203
  352    HE1  TRP  47          1HE       TRP  47  -9.220  -2.406   5.796
  353    HE3  TRP  47          3HE       TRP  47  -6.311  -3.833   1.610
  354    HZ2  TRP  47          2HZ       TRP  47  -7.521  -0.297   4.874
  355    HZ3  TRP  47          3HZ       TRP  47  -5.233  -1.609   1.485
  356    HH2  TRP  47           HH       TRP  47  -5.833   0.159   3.110
  357    H    LEU  48           H        LEU  48  -8.128  -4.369   0.449
  358    HA   LEU  48           HA       LEU  48  -9.343  -1.873   1.061
  359    HB2  LEU  48          2HB       LEU  48  -7.125  -2.219  -0.082
  360    HB3  LEU  48          1HB       LEU  48  -8.005  -2.652  -1.539
  361    HG   LEU  48           HG       LEU  48  -9.229  -0.373  -1.153
  362   HD11  LEU  48          1HD1      LEU  48  -7.677  -0.342   1.075
  363   HD12  LEU  48          2HD1      LEU  48  -8.286   1.116   0.293
  364   HD13  LEU  48          3HD1      LEU  48  -6.650   0.550  -0.045
  365   HD21  LEU  48          1HD2      LEU  48  -8.042  -0.303  -3.105
  366   HD22  LEU  48          2HD2      LEU  48  -6.620  -1.051  -2.378
  367   HD23  LEU  48          3HD2      LEU  48  -6.919   0.673  -2.157
  368    H    GLU  49           H        GLU  49 -10.024  -4.207  -1.543
  369    HA   GLU  49           HA       GLU  49 -12.007  -2.547  -2.813
  370    HB2  GLU  49          2HB       GLU  49 -12.379  -4.371  -4.230
  371    HB3  GLU  49          1HB       GLU  49 -10.710  -4.597  -3.750
  372    HG2  GLU  49          2HG       GLU  49 -11.541  -6.106  -1.911
  373    HG3  GLU  49          1HG       GLU  49 -13.137  -5.999  -2.643
  374    H    ASP  50           H        ASP  50 -12.132  -5.025  -0.297
  375    HA   ASP  50           HA       ASP  50 -14.958  -5.353  -0.223
  376    HB2  ASP  50          2HB       ASP  50 -13.262  -6.781   0.970
  377    HB3  ASP  50          1HB       ASP  50 -13.083  -5.474   2.138
  378    H    ARG  51           H        ARG  51 -12.843  -3.041   1.453
  379    HA   ARG  51           HA       ARG  51 -14.891  -1.845   3.038
  380    HB2  ARG  51          2HB       ARG  51 -12.226  -0.834   2.047
  381    HB3  ARG  51          1HB       ARG  51 -13.274   0.125   3.087
  382    HG2  ARG  51          2HG       ARG  51 -13.295  -1.798   4.714
  383    HG3  ARG  51          1HG       ARG  51 -12.080  -2.587   3.707
  384    HD2  ARG  51          2HD       ARG  51 -10.593  -0.619   3.989
  385    HD3  ARG  51          1HD       ARG  51 -11.795   0.118   5.048
  386    HE   ARG  51           HE       ARG  51 -10.955  -2.552   5.900
  387   HH11  ARG  51          1HH1      ARG  51  -9.839  -2.613   7.866
  388   HH12  ARG  51          2HH1      ARG  51  -9.225  -1.142   8.544
  389   HH21  ARG  51          1HH2      ARG  51 -10.395   0.850   5.959
  390   HH22  ARG  51          2HH2      ARG  51  -9.539   0.818   7.465
  391    H    PHE  52           H        PHE  52 -13.729  -1.072  -0.249
  392    HA   PHE  52           HA       PHE  52 -15.789   1.068  -0.377
  393    HB2  PHE  52          2HB       PHE  52 -13.412   0.419  -2.135
  394    HB3  PHE  52          1HB       PHE  52 -14.573   1.698  -2.481
  395    HD1  PHE  52          1HD       PHE  52 -14.801   3.644  -0.959
  396    HD2  PHE  52          2HD       PHE  52 -11.787   0.641  -0.367
  397    HE1  PHE  52          1HE       PHE  52 -13.594   5.160   0.589
  398    HE2  PHE  52          2HE       PHE  52 -10.581   2.157   1.181
  399    HZ   PHE  52           HZ       PHE  52 -11.485   4.416   1.658
  400    H    GLY  53           H        GLY  53 -15.467  -2.172  -1.133
  401    HA2  GLY  53          2HA       GLY  53 -16.767  -3.599  -2.470
  402    HA3  GLY  53          1HA       GLY  53 -17.929  -2.274  -2.573
  403    H    ILE  54           H        ILE  54 -14.568  -2.107  -3.661
  404    HA   ILE  54           HA       ILE  54 -15.552  -1.338  -6.345
  405    HB   ILE  54           HB       ILE  54 -12.733  -1.438  -5.227
  406   HG12  ILE  54          2HG1      ILE  54 -14.483   0.980  -5.727
  407   HG13  ILE  54          1HG1      ILE  54 -14.405   0.174  -4.162
  408   HG21  ILE  54          1HG2      ILE  54 -12.228   0.028  -7.178
  409   HG22  ILE  54          2HG2      ILE  54 -13.876  -0.214  -7.757
  410   HG23  ILE  54          3HG2      ILE  54 -12.763  -1.579  -7.669
  411   HD11  ILE  54          1HD1      ILE  54 -12.808   1.991  -4.129
  412   HD12  ILE  54          2HD1      ILE  54 -12.113   1.468  -5.663
  413   HD13  ILE  54          3HD1      ILE  54 -11.900   0.481  -4.217
  414    H    ALA  55           H        ALA  55 -15.195  -2.557  -8.211
  415    HA   ALA  55           HA       ALA  55 -14.753  -5.395  -7.874
  416    HB1  ALA  55          1HB       ALA  55 -16.099  -4.138  -9.726
  417    HB2  ALA  55          2HB       ALA  55 -15.184  -5.575 -10.181
  418    HB3  ALA  55          3HB       ALA  55 -14.534  -3.971 -10.522
  419    H    ALA  56           H        ALA  56 -12.852  -6.550  -8.128
  420    HA   ALA  56           HA       ALA  56 -10.348  -5.175  -7.975
  421    HB1  ALA  56          1HB       ALA  56 -10.158  -7.891  -9.047
  422    HB2  ALA  56          2HB       ALA  56 -11.203  -7.795  -7.629
  423    HB3  ALA  56          3HB       ALA  56  -9.532  -7.237  -7.533
  424    H    ASP  57           H        ASP  57 -12.149  -6.548 -10.685
  425    HA   ASP  57           HA       ASP  57 -10.058  -6.317 -12.627
  426    HB2  ASP  57          2HB       ASP  57 -11.858  -6.535 -14.282
  427    HB3  ASP  57          1HB       ASP  57 -12.074  -7.697 -12.979
  428    H    ASP  58           H        ASP  58 -12.262  -3.993 -11.241
  429    HA   ASP  58           HA       ASP  58 -12.296  -2.001 -13.227
  430    HB2  ASP  58          2HB       ASP  58 -13.534  -1.960 -11.027
  431    HB3  ASP  58          1HB       ASP  58 -12.021  -1.474 -10.268
  432    H    VAL  59           H        VAL  59  -9.767  -2.809 -10.897
  433    HA   VAL  59           HA       VAL  59  -8.036  -0.717 -12.147
  434    HB   VAL  59           HB       VAL  59  -7.697  -2.103  -9.482
  435   HG11  VAL  59          1HG1      VAL  59  -6.142  -0.074 -11.035
  436   HG12  VAL  59          2HG1      VAL  59  -5.560  -1.383 -10.005
  437   HG13  VAL  59          3HG1      VAL  59  -6.203   0.091  -9.280
  438   HG21  VAL  59          1HG2      VAL  59  -9.579  -0.722  -9.183
  439   HG22  VAL  59          2HG2      VAL  59  -8.973   0.499 -10.302
  440   HG23  VAL  59          3HG2      VAL  59  -8.244   0.328  -8.706
  441    H    GLU  60           H        GLU  60  -6.158  -1.364 -13.155
  442    HA   GLU  60           HA       GLU  60  -5.777  -4.267 -13.519
  443    HB2  GLU  60          2HB       GLU  60  -5.655  -2.684 -15.454
  444    HB3  GLU  60          1HB       GLU  60  -4.224  -1.961 -14.727
  445    HG2  GLU  60          2HG       GLU  60  -3.123  -4.184 -14.767
  446    HG3  GLU  60          1HG       GLU  60  -4.532  -4.839 -15.591
  447    H    LEU  61           H        LEU  61  -3.965  -5.398 -12.785
  448    HA   LEU  61           HA       LEU  61  -2.421  -4.048 -10.657
  449    HB2  LEU  61          2HB       LEU  61  -2.359  -6.961 -11.488
  450    HB3  LEU  61          1HB       LEU  61  -1.766  -6.273  -9.979
  451    HG   LEU  61           HG       LEU  61  -4.640  -6.364 -10.906
  452   HD11  LEU  61          1HD1      LEU  61  -4.182  -8.477 -10.026
  453   HD12  LEU  61          2HD1      LEU  61  -4.730  -7.606  -8.594
  454   HD13  LEU  61          3HD1      LEU  61  -3.005  -7.849  -8.872
  455   HD21  LEU  61          1HD2      LEU  61  -4.889  -5.486  -8.428
  456   HD22  LEU  61          2HD2      LEU  61  -4.568  -4.350  -9.738
  457   HD23  LEU  61          3HD2      LEU  61  -3.252  -4.887  -8.694
  458    H    SER  62           H        SER  62  -0.256  -3.569 -10.853
  459    HA   SER  62           HA       SER  62   1.426  -4.884 -12.831
  460    HB2  SER  62          2HB       SER  62  -0.019  -2.630 -13.692
  461    HB3  SER  62          1HB       SER  62   1.613  -2.043 -13.384
  462    HG   SER  62           HG       SER  62   1.706  -4.435 -14.597
  463    HA   PRO  63           HA       PRO  63   4.459  -3.743  -9.818
  464    HB2  PRO  63          2HB       PRO  63   6.679  -3.439 -11.455
  465    HB3  PRO  63          1HB       PRO  63   6.069  -4.992 -10.858
  466    HG2  PRO  63          2HG       PRO  63   5.711  -3.709 -13.510
  467    HG3  PRO  63          1HG       PRO  63   5.906  -5.421 -13.095
  468    HD2  PRO  63          2HD       PRO  63   3.490  -4.344 -13.739
  469    HD3  PRO  63          1HD       PRO  63   3.660  -5.698 -12.601
  470    H    GLU  64           H        GLU  64   4.040  -1.717 -12.652
  471    HA   GLU  64           HA       GLU  64   5.655   0.493 -11.835
  472    HB2  GLU  64          2HB       GLU  64   3.169   0.416 -13.548
  473    HB3  GLU  64          1HB       GLU  64   4.230   1.809 -13.401
  474    HG2  GLU  64          2HG       GLU  64   6.114   0.424 -14.214
  475    HG3  GLU  64          1HG       GLU  64   5.004  -0.924 -14.430
  476    H    HIS  65           H        HIS  65   2.403  -0.509 -10.968
  477    HA   HIS  65           HA       HIS  65   1.580   1.983  -9.786
  478    HB2  HIS  65          2HB       HIS  65   0.012   0.143 -10.392
  479    HB3  HIS  65          1HB       HIS  65   0.687  -0.829  -9.084
  480    HD1  HIS  65          1HD       HIS  65  -0.847   2.652  -9.485
  481    HD2  HIS  65          2HD       HIS  65  -0.680  -0.463  -6.716
  482    HE1  HIS  65          1HE       HIS  65  -2.319   3.340  -7.541
  483    HE2  HIS  65          2HE       HIS  65  -2.224   1.452  -5.850
  484    H    PHE  66           H        PHE  66   3.561  -0.670  -8.661
  485    HA   PHE  66           HA       PHE  66   3.570   0.478  -5.912
  486    HB2  PHE  66          2HB       PHE  66   4.646  -2.153  -6.971
  487    HB3  PHE  66          1HB       PHE  66   4.715  -1.636  -5.286
  488    HD1  PHE  66          1HD       PHE  66   2.691  -1.495  -3.918
  489    HD2  PHE  66          2HD       PHE  66   2.523  -2.757  -8.021
  490    HE1  PHE  66          1HE       PHE  66   0.381  -2.325  -3.568
  491    HE2  PHE  66          2HE       PHE  66   0.214  -3.589  -7.670
  492    HZ   PHE  66           HZ       PHE  66  -0.858  -3.372  -5.444
  493    H    ARG  67           H        ARG  67   5.124   1.173  -8.617
  494    HA   ARG  67           HA       ARG  67   7.880   0.808  -8.188
  495    HB2  ARG  67          2HB       ARG  67   6.859   1.797 -10.247
  496    HB3  ARG  67          1HB       ARG  67   6.554   3.279  -9.349
  497    HG2  ARG  67          2HG       ARG  67   8.586   3.744 -10.417
  498    HG3  ARG  67          1HG       ARG  67   9.112   3.192  -8.831
  499    HD2  ARG  67          2HD       ARG  67   9.490   0.926  -9.734
  500    HD3  ARG  67          1HD       ARG  67   8.946   1.469 -11.320
  501    HE   ARG  67           HE       ARG  67  11.069   2.440 -11.632
  502   HH11  ARG  67          1HH1      ARG  67  13.136   3.046 -10.948
  503   HH12  ARG  67          2HH1      ARG  67  13.526   2.992  -9.262
  504   HH21  ARG  67          1HH2      ARG  67  10.393   1.860  -8.301
  505   HH22  ARG  67          2HH2      ARG  67  11.973   2.321  -7.763
  506    H    SER  68           H        SER  68   5.709   3.288  -6.852
  507    HA   SER  68           HA       SER  68   7.724   3.790  -4.741
  508    HB2  SER  68          2HB       SER  68   7.718   6.188  -5.055
  509    HB3  SER  68          1HB       SER  68   8.140   5.445  -6.595
  510    HG   SER  68           HG       SER  68   5.536   6.274  -5.809
  511    H    ILE  69           H        ILE  69   6.787   4.715  -2.827
  512    HA   ILE  69           HA       ILE  69   4.071   3.960  -2.326
  513    HB   ILE  69           HB       ILE  69   5.882   5.824  -0.762
  514   HG12  ILE  69          2HG1      ILE  69   5.358   2.877  -0.372
  515   HG13  ILE  69          1HG1      ILE  69   6.766   3.509  -1.211
  516   HG21  ILE  69          1HG2      ILE  69   4.077   4.278   0.813
  517   HG22  ILE  69          2HG2      ILE  69   3.153   5.106  -0.438
  518   HG23  ILE  69          3HG2      ILE  69   4.169   6.032   0.666
  519   HD11  ILE  69          1HD1      ILE  69   6.216   4.704   1.441
  520   HD12  ILE  69          2HD1      ILE  69   7.755   4.240   0.715
  521   HD13  ILE  69          3HD1      ILE  69   6.724   3.016   1.456
  522    H    ARG  70           H        ARG  70   5.615   7.057  -3.102
  523    HA   ARG  70           HA       ARG  70   3.379   8.737  -2.575
  524    HB2  ARG  70          2HB       ARG  70   5.601   9.037  -4.616
  525    HB3  ARG  70          1HB       ARG  70   4.478  10.320  -4.162
  526    HG2  ARG  70          2HG       ARG  70   5.224  10.075  -1.789
  527    HG3  ARG  70          1HG       ARG  70   6.425   8.898  -2.324
  528    HD2  ARG  70          2HD       ARG  70   6.243  11.793  -3.206
  529    HD3  ARG  70          1HD       ARG  70   7.467  11.103  -2.141
  530    HE   ARG  70           HE       ARG  70   7.382   9.710  -4.675
  531   HH11  ARG  70          1HH1      ARG  70   9.113  10.071  -6.082
  532   HH12  ARG  70          2HH1      ARG  70  10.145  11.440  -5.833
  533   HH21  ARG  70          1HH2      ARG  70   8.424  12.561  -3.039
  534   HH22  ARG  70          2HH2      ARG  70   9.754  12.849  -4.110
  535    H    SER  71           H        SER  71   4.257   6.884  -5.487
  536    HA   SER  71           HA       SER  71   2.251   7.988  -7.190
  537    HB2  SER  71          2HB       SER  71   2.634   6.056  -8.589
  538    HB3  SER  71          1HB       SER  71   4.183   6.540  -7.911
  539    HG   SER  71           HG       SER  71   2.879   4.215  -7.665
  540    H    ILE  72           H        ILE  72   2.185   5.242  -4.927
  541    HA   ILE  72           HA       ILE  72  -0.477   4.397  -5.598
  542    HB   ILE  72           HB       ILE  72   1.090   4.043  -3.026
  543   HG12  ILE  72          2HG1      ILE  72   0.808   2.201  -5.423
  544   HG13  ILE  72          1HG1      ILE  72   2.226   3.198  -5.094
  545   HG21  ILE  72          1HG2      ILE  72  -0.773   3.048  -2.269
  546   HG22  ILE  72          2HG2      ILE  72  -0.635   1.873  -3.577
  547   HG23  ILE  72          3HG2      ILE  72  -1.587   3.339  -3.805
  548   HD11  ILE  72          1HD1      ILE  72   1.505   0.635  -3.959
  549   HD12  ILE  72          2HD1      ILE  72   1.682   1.842  -2.685
  550   HD13  ILE  72          3HD1      ILE  72   3.014   1.534  -3.799
  551    H    ASP  73           H        ASP  73   0.841   6.595  -3.136
  552    HA   ASP  73           HA       ASP  73  -1.565   7.081  -1.713
  553    HB2  ASP  73          2HB       ASP  73   0.743   7.823  -1.031
  554    HB3  ASP  73          1HB       ASP  73   0.634   9.095  -2.248
  555    H    ALA  74           H        ALA  74  -0.262   8.659  -4.630
  556    HA   ALA  74           HA       ALA  74  -2.299  10.672  -4.780
  557    HB1  ALA  74          1HB       ALA  74  -0.478  11.167  -6.138
  558    HB2  ALA  74          2HB       ALA  74  -1.613  10.530  -7.329
  559    HB3  ALA  74          3HB       ALA  74  -0.321   9.504  -6.706
  560    H    PHE  75           H        PHE  75  -2.045   7.435  -6.241
  561    HA   PHE  75           HA       PHE  75  -4.454   7.592  -7.764
  562    HB2  PHE  75          2HB       PHE  75  -2.712   5.809  -8.008
  563    HB3  PHE  75          1HB       PHE  75  -3.266   5.128  -6.480
  564    HD1  PHE  75          1HD       PHE  75  -4.235   5.867  -9.978
  565    HD2  PHE  75          2HD       PHE  75  -5.328   3.897  -6.321
  566    HE1  PHE  75          1HE       PHE  75  -6.050   4.665 -11.167
  567    HE2  PHE  75          2HE       PHE  75  -7.143   2.695  -7.510
  568    HZ   PHE  75           HZ       PHE  75  -7.503   3.080  -9.934
  569    H    VAL  76           H        VAL  76  -3.868   6.243  -4.503
  570    HA   VAL  76           HA       VAL  76  -6.618   5.640  -3.992
  571    HB   VAL  76           HB       VAL  76  -4.276   6.161  -2.142
  572   HG11  VAL  76          1HG1      VAL  76  -5.882   4.794  -0.575
  573   HG12  VAL  76          2HG1      VAL  76  -7.140   5.448  -1.623
  574   HG13  VAL  76          3HG1      VAL  76  -6.082   6.538  -0.728
  575   HG21  VAL  76          1HG2      VAL  76  -5.668   3.558  -2.813
  576   HG22  VAL  76          2HG2      VAL  76  -4.106   3.779  -2.023
  577   HG23  VAL  76          3HG2      VAL  76  -4.289   4.154  -3.737
  578    H    VAL  77           H        VAL  77  -4.588   8.471  -3.169
  579    HA   VAL  77           HA       VAL  77  -6.570   9.897  -1.718
  580    HB   VAL  77           HB       VAL  77  -4.223  10.817  -3.392
  581   HG11  VAL  77          1HG1      VAL  77  -6.399  12.334  -2.106
  582   HG12  VAL  77          2HG1      VAL  77  -5.278  12.826  -3.374
  583   HG13  VAL  77          3HG1      VAL  77  -4.775  12.877  -1.685
  584   HG21  VAL  77          1HG2      VAL  77  -3.043  10.890  -1.379
  585   HG22  VAL  77          2HG2      VAL  77  -4.076   9.484  -1.122
  586   HG23  VAL  77          3HG2      VAL  77  -4.508  11.038  -0.409
  587    H    GLY  78           H        GLY  78  -5.849   9.747  -5.184
  588    HA2  GLY  78          2HA       GLY  78  -7.581  11.804  -6.061
  589    HA3  GLY  78          1HA       GLY  78  -7.134  10.400  -7.029
  590    H    ALA  79           H        ALA  79  -8.297   8.459  -5.122
  591    HA   ALA  79           HA       ALA  79 -11.148   8.930  -5.851
  592    HB1  ALA  79          1HB       ALA  79 -11.440   6.560  -5.818
  593    HB2  ALA  79          2HB       ALA  79  -9.905   6.319  -4.984
  594    HB3  ALA  79          3HB       ALA  79  -9.921   6.855  -6.664
  595    H    THR  80           H        THR  80  -9.198   7.641  -3.147
  596    HA   THR  80           HA       THR  80 -10.980   8.943  -1.229
  597    HB   THR  80           HB       THR  80 -12.157   6.788  -1.899
  598    HG1  THR  80          1HG       THR  80 -11.574   6.398   0.740
  599   HG21  THR  80          1HG2      THR  80 -10.313   5.269  -0.152
  600   HG22  THR  80          2HG2      THR  80  -9.684   5.679  -1.746
  601   HG23  THR  80          3HG2      THR  80 -11.176   4.752  -1.599
  602    H    THR  81           H        THR  81 -10.086   8.916   0.919
  603    HA   THR  81           HA       THR  81  -7.362   7.719   1.135
  604    HB   THR  81           HB       THR  81  -7.217  10.154   0.643
  605    HG1  THR  81          1HG       THR  81  -5.667   9.140   1.984
  606   HG21  THR  81          1HG2      THR  81  -8.403  11.724   1.787
  607   HG22  THR  81          2HG2      THR  81  -8.216  10.885   3.327
  608   HG23  THR  81          3HG2      THR  81  -9.458  10.368   2.186
  609    HA   PRO  82           HA       PRO  82  -9.771   6.618   4.877
  610    HB2  PRO  82          2HB       PRO  82  -9.387   3.968   4.810
  611    HB3  PRO  82          1HB       PRO  82 -10.528   4.760   3.706
  612    HG2  PRO  82          2HG       PRO  82  -7.815   3.691   3.172
  613    HG3  PRO  82          1HG       PRO  82  -9.235   3.757   2.115
  614    HD2  PRO  82          2HD       PRO  82  -7.049   5.571   2.116
  615    HD3  PRO  82          1HD       PRO  82  -8.584   5.765   1.245
  616    HA   PRO  83           HA       PRO  83  -5.765   6.426   7.093
  617    HB2  PRO  83          2HB       PRO  83  -6.636   7.478   9.448
  618    HB3  PRO  83          1HB       PRO  83  -6.240   8.475   8.038
  619    HG2  PRO  83          2HG       PRO  83  -8.882   7.681   9.110
  620    HG3  PRO  83          1HG       PRO  83  -8.391   9.175   8.297
  621    HD2  PRO  83          2HD       PRO  83  -9.786   7.077   7.094
  622    HD3  PRO  83          1HD       PRO  83  -8.891   8.342   6.224
  623    H    VAL  84           H        VAL  84  -5.000   4.675   8.242
  624    HA   VAL  84           HA       VAL  84  -6.963   3.130   9.894
  625    HB   VAL  84           HB       VAL  84  -4.709   1.972   8.229
  626   HG11  VAL  84          1HG1      VAL  84  -5.441   0.747  10.326
  627   HG12  VAL  84          2HG1      VAL  84  -5.638  -0.166   8.830
  628   HG13  VAL  84          3HG1      VAL  84  -7.037   0.592   9.591
  629   HG21  VAL  84          1HG2      VAL  84  -6.399   2.802   6.720
  630   HG22  VAL  84          2HG2      VAL  84  -7.694   2.164   7.734
  631   HG23  VAL  84          3HG2      VAL  84  -6.635   1.060   6.856
  632    H    GLU  85           H        GLU  85  -6.269   2.678  11.949
  633    HA   GLU  85           HA       GLU  85  -3.885   3.899  12.975
  634    HB2  GLU  85          2HB       GLU  85  -5.644   1.722  14.147
  635    HB3  GLU  85          1HB       GLU  85  -4.392   2.586  15.039
  636    HG2  GLU  85          2HG       GLU  85  -5.550   4.729  14.551
  637    HG3  GLU  85          1HG       GLU  85  -6.827   3.831  13.730
  638    H    ALA  86           H        ALA  86  -4.629   0.614  11.890
  639    HA   ALA  86           HA       ALA  86  -1.731   0.068  11.715
  640    HB1  ALA  86          1HB       ALA  86  -3.336  -0.924  13.869
  641    HB2  ALA  86          2HB       ALA  86  -1.642  -1.272  13.521
  642    HB3  ALA  86          3HB       ALA  86  -2.911  -2.282  12.827
  643    H    LYS  87           H        LYS  87  -1.276  -1.670  10.229
  644    HA   LYS  87           HA       LYS  87  -3.091  -1.910   8.055
  645    HB2  LYS  87          2HB       LYS  87  -0.615  -2.348   7.948
  646    HB3  LYS  87          1HB       LYS  87  -0.903  -3.879   8.778
  647    HG2  LYS  87          2HG       LYS  87  -2.443  -4.564   6.967
  648    HG3  LYS  87          1HG       LYS  87  -2.124  -3.046   6.133
  649    HD2  LYS  87          2HD       LYS  87   0.343  -3.690   6.173
  650    HD3  LYS  87          1HD       LYS  87  -0.184  -5.296   6.681
  651    HE2  LYS  87          2HE       LYS  87  -0.325  -4.040   4.033
  652    HE3  LYS  87          1HE       LYS  87  -0.399  -5.748   4.470
  653    HZ1  LYS  87          1HZ       LYS  87  -2.614  -3.778   4.563
  654    HZ2  LYS  87          2HZ       LYS  87  -2.715  -5.344   5.214
  655    HZ3  LYS  87          3HZ       LYS  87  -2.484  -5.128   3.545
  656    H    LEU  88           H        LEU  88  -2.558  -3.987  10.880
  657    HA   LEU  88           HA       LEU  88  -4.105  -6.215  10.075
  658    HB2  LEU  88          2HB       LEU  88  -2.717  -6.105  12.156
  659    HB3  LEU  88          1HB       LEU  88  -3.933  -5.047  12.869
  660    HG   LEU  88           HG       LEU  88  -5.644  -6.849  12.448
  661   HD11  LEU  88          1HD1      LEU  88  -5.011  -8.476  11.011
  662   HD12  LEU  88          2HD1      LEU  88  -4.061  -9.134  12.342
  663   HD13  LEU  88          3HD1      LEU  88  -3.306  -8.057  11.168
  664   HD21  LEU  88          1HD2      LEU  88  -4.473  -8.448  14.217
  665   HD22  LEU  88          2HD2      LEU  88  -4.988  -6.824  14.674
  666   HD23  LEU  88          3HD2      LEU  88  -3.296  -7.136  14.286
  667    H    GLN  89           H        GLN  89  -5.106  -3.113  11.472
  668    HA   GLN  89           HA       GLN  89  -7.939  -3.973  11.421
  669    HB2  GLN  89          2HB       GLN  89  -6.629  -1.385  12.311
  670    HB3  GLN  89          1HB       GLN  89  -8.357  -1.724  12.422
  671    HG2  GLN  89          2HG       GLN  89  -7.908  -3.648  13.879
  672    HG3  GLN  89          1HG       GLN  89  -6.172  -3.362  13.742
  673   HE21  GLN  89          1HE2      GLN  89  -7.457  -3.292  16.292
  674   HE22  GLN  89          2HE2      GLN  89  -7.427  -1.696  16.869
  675    H1   PN7 101          3HO       SAT 101   2.220 -10.390 -12.806
  676    H2   PN7 101          1H1       SAT 101   3.624  -9.825 -11.027
  677    H3   PN7 101          2H1       SAT 101   3.859  -8.938  -9.522
  678    H5   PN7 101          1HE1      SAT 101   3.641  -7.005 -10.722
  679    H6   PN7 101          2HE1      SAT 101   2.482  -6.663  -9.438
  680    H7   PN7 101          3HE1      SAT 101   2.047  -6.364 -11.120
  681    H8   PN7 101          2HE2      SAT 101   0.242  -9.435  -9.973
  682    H9   PN7 101          3HE2      SAT 101   0.233  -7.693  -9.697
  683    H10  PN7 101          1HE2      SAT 101   1.163  -8.750  -8.634
  684    H11  PN7 101          3H        SAT 101   0.686  -8.235 -12.209
  685    H12  PN7 101          5H        SAT 101   2.256  -6.292 -13.493
  686    H13  PN7 101          1H6       SAT 101   2.118  -6.645 -15.818
  687    H14  PN7 101          2H6       SAT 101   2.886  -8.214 -15.573
  688    H15  PN7 101          1H7       SAT 101   0.361  -8.049 -16.387
  689    H16  PN7 101          2H7       SAT 101   0.056  -7.860 -14.660
  690    H17  PN7 101          9H        SAT 101  -1.020 -10.033 -14.853
  691    H18  PN7 101          1H10      SAT 101   1.081 -12.102 -14.349
  692    H19  PN7 101          2H10      SAT 101  -0.217 -11.806 -13.193
  693    H20  PN7 101          1H11      SAT 101  -1.867 -12.403 -14.992
  694    H21  PN7 101          2H11      SAT 101  -0.814 -13.742 -14.533
  695    H22  PN7 101          2HS1      SAT 101   0.671 -13.052 -16.699
  Start of MODEL    2
    1    H1   MET   1          1HT       MET   1  -0.121  12.115  -1.308
    2    H2   MET   1          2HT       MET   1  -1.124  12.933  -0.207
    3    H3   MET   1          3HT       MET   1  -1.540  11.375  -0.745
    4    HA   MET   1           HA       MET   1   0.236  10.376   0.426
    5    HB2  MET   1          2HB       MET   1   1.086  13.229   1.009
    6    HB3  MET   1          1HB       MET   1   1.833  11.792   1.710
    7    HG2  MET   1          2HG       MET   1   2.277  10.986  -0.640
    8    HG3  MET   1          1HG       MET   1   1.734  12.559  -1.217
    9    HE1  MET   1          1HE       MET   1   3.703  10.626   1.093
   10    HE2  MET   1          2HE       MET   1   4.428  11.875   2.100
   11    HE3  MET   1          3HE       MET   1   5.378  11.124   0.821
   12    H    GLN   2           H        GLN   2  -2.467  11.952   0.906
   13    HA   GLN   2           HA       GLN   2  -2.585  12.646   3.659
   14    HB2  GLN   2          2HB       GLN   2  -4.745  11.465   1.882
   15    HB3  GLN   2          1HB       GLN   2  -5.030  12.221   3.450
   16    HG2  GLN   2          2HG       GLN   2  -4.078  14.334   2.616
   17    HG3  GLN   2          1HG       GLN   2  -3.772  13.581   1.050
   18   HE21  GLN   2          1HE2      GLN   2  -5.481  15.848   1.228
   19   HE22  GLN   2          2HE2      GLN   2  -7.071  15.363   0.889
   20    H    HIS   3           H        HIS   3  -2.944   9.525   2.023
   21    HA   HIS   3           HA       HIS   3  -3.040   8.208   4.711
   22    HB2  HIS   3          2HB       HIS   3  -3.856   6.922   2.102
   23    HB3  HIS   3          1HB       HIS   3  -4.285   6.436   3.742
   24    HD1  HIS   3          1HD       HIS   3  -5.490   8.740   5.051
   25    HD2  HIS   3          2HD       HIS   3  -6.045   8.137   0.963
   26    HE1  HIS   3          1HE       HIS   3  -7.544  10.077   4.400
   27    HE2  HIS   3          2HE       HIS   3  -7.894   9.710   1.916
   28    H    ALA   4           H        ALA   4  -0.813   9.059   2.593
   29    HA   ALA   4           HA       ALA   4   0.469   6.716   1.673
   30    HB1  ALA   4          1HB       ALA   4   1.300   9.503   2.261
   31    HB2  ALA   4          2HB       ALA   4   1.551   8.536   0.807
   32    HB3  ALA   4          3HB       ALA   4   2.596   8.309   2.210
   33    H    SER   5           H        SER   5   0.684   8.316   4.850
   34    HA   SER   5           HA       SER   5   2.777   6.652   5.873
   35    HB2  SER   5          2HB       SER   5   2.098   7.444   8.065
   36    HB3  SER   5          1HB       SER   5   1.974   8.785   6.931
   37    HG   SER   5           HG       SER   5   0.119   8.391   8.373
   38    H    VAL   6           H        VAL   6  -0.728   6.265   5.738
   39    HA   VAL   6           HA       VAL   6  -0.835   3.911   7.402
   40    HB   VAL   6           HB       VAL   6  -2.708   4.953   5.269
   41   HG11  VAL   6          1HG1      VAL   6  -4.194   3.340   6.923
   42   HG12  VAL   6          2HG1      VAL   6  -2.679   2.444   6.813
   43   HG13  VAL   6          3HG1      VAL   6  -3.571   2.850   5.347
   44   HG21  VAL   6          1HG2      VAL   6  -3.458   6.326   6.890
   45   HG22  VAL   6          2HG2      VAL   6  -2.149   5.764   7.931
   46   HG23  VAL   6          3HG2      VAL   6  -3.714   4.953   7.967
   47    H    ILE   7           H        ILE   7  -0.380   4.442   3.935
   48    HA   ILE   7           HA       ILE   7  -0.703   1.761   3.073
   49    HB   ILE   7           HB       ILE   7   1.151   3.904   2.002
   50   HG12  ILE   7          2HG1      ILE   7  -1.608   3.039   1.082
   51   HG13  ILE   7          1HG1      ILE   7  -1.306   4.448   2.099
   52   HG21  ILE   7          1HG2      ILE   7   1.955   2.160   0.781
   53   HG22  ILE   7          2HG2      ILE   7   0.439   2.306  -0.109
   54   HG23  ILE   7          3HG2      ILE   7   0.588   1.123   1.190
   55   HD11  ILE   7          1HD1      ILE   7   0.500   4.664  -0.053
   56   HD12  ILE   7          2HD1      ILE   7  -0.939   5.642   0.230
   57   HD13  ILE   7          3HD1      ILE   7  -1.041   4.192  -0.769
   58    H    ALA   8           H        ALA   8   2.306   3.442   4.061
   59    HA   ALA   8           HA       ALA   8   3.971   1.121   3.815
   60    HB1  ALA   8          1HB       ALA   8   4.185   3.767   5.186
   61    HB2  ALA   8          2HB       ALA   8   5.267   3.026   4.008
   62    HB3  ALA   8          3HB       ALA   8   5.295   2.492   5.689
   63    H    GLN   9           H        GLN   9   2.319   2.559   6.607
   64    HA   GLN   9           HA       GLN   9   3.119   0.584   8.508
   65    HB2  GLN   9          2HB       GLN   9   2.154   2.791   9.107
   66    HB3  GLN   9          1HB       GLN   9   0.600   2.272   8.454
   67    HG2  GLN   9          2HG       GLN   9   1.375   0.222  10.205
   68    HG3  GLN   9          1HG       GLN   9   1.764   1.718  11.050
   69   HE21  GLN   9          1HE2      GLN   9  -0.923   0.215   9.174
   70   HE22  GLN   9          2HE2      GLN   9  -2.161   0.962  10.066
   71    H    PHE  10           H        PHE  10   0.286   0.810   6.393
   72    HA   PHE  10           HA       PHE  10  -1.073  -1.479   7.431
   73    HB2  PHE  10          2HB       PHE  10  -2.149   0.259   6.031
   74    HB3  PHE  10          1HB       PHE  10  -1.214  -0.299   4.645
   75    HD1  PHE  10          1HD       PHE  10  -3.834  -1.250   7.094
   76    HD2  PHE  10          2HD       PHE  10  -1.799  -2.297   3.460
   77    HE1  PHE  10          1HE       PHE  10  -5.536  -2.999   6.645
   78    HE2  PHE  10          2HE       PHE  10  -3.499  -4.046   3.011
   79    HZ   PHE  10           HZ       PHE  10  -5.368  -4.397   4.602
   80    H    VAL  11           H        VAL  11   0.965  -1.163   4.506
   81    HA   VAL  11           HA       VAL  11   0.838  -3.989   3.938
   82    HB   VAL  11           HB       VAL  11   2.502  -3.514   2.233
   83   HG11  VAL  11          1HG1      VAL  11   0.158  -2.792   1.851
   84   HG12  VAL  11          2HG1      VAL  11   1.312  -1.748   1.019
   85   HG13  VAL  11          3HG1      VAL  11   0.556  -1.210   2.517
   86   HG21  VAL  11          1HG2      VAL  11   2.964  -1.109   3.949
   87   HG22  VAL  11          2HG2      VAL  11   3.191  -0.940   2.209
   88   HG23  VAL  11          3HG2      VAL  11   4.134  -2.127   3.111
   89    H    VAL  12           H        VAL  12   3.327  -1.936   5.472
   90    HA   VAL  12           HA       VAL  12   5.270  -4.004   5.797
   91    HB   VAL  12           HB       VAL  12   4.750  -1.511   7.411
   92   HG11  VAL  12          1HG1      VAL  12   6.051  -2.752   8.888
   93   HG12  VAL  12          2HG1      VAL  12   7.299  -1.959   7.927
   94   HG13  VAL  12          3HG1      VAL  12   6.858  -3.633   7.590
   95   HG21  VAL  12          1HG2      VAL  12   5.435  -1.484   4.887
   96   HG22  VAL  12          2HG2      VAL  12   7.013  -1.989   5.489
   97   HG23  VAL  12          3HG2      VAL  12   6.317  -0.457   6.017
   98    H    GLU  13           H        GLU  13   2.526  -3.018   7.787
   99    HA   GLU  13           HA       GLU  13   3.139  -4.502  10.118
  100    HB2  GLU  13          2HB       GLU  13   1.256  -2.879   9.926
  101    HB3  GLU  13          1HB       GLU  13   0.395  -4.050   8.936
  102    HG2  GLU  13          2HG       GLU  13   0.556  -5.686  10.824
  103    HG3  GLU  13          1HG       GLU  13   1.260  -4.403  11.805
  104    H    GLU  14           H        GLU  14   1.623  -5.507   7.088
  105    HA   GLU  14           HA       GLU  14   0.921  -8.149   7.986
  106    HB2  GLU  14          2HB       GLU  14   1.426  -7.067   5.201
  107    HB3  GLU  14          1HB       GLU  14   0.737  -8.654   5.546
  108    HG2  GLU  14          2HG       GLU  14  -1.111  -7.559   6.795
  109    HG3  GLU  14          1HG       GLU  14  -0.440  -5.983   6.369
  110    H    PHE  15           H        PHE  15   3.832  -6.801   6.472
  111    HA   PHE  15           HA       PHE  15   5.044  -9.494   6.344
  112    HB2  PHE  15          2HB       PHE  15   6.289  -6.825   5.629
  113    HB3  PHE  15          1HB       PHE  15   6.872  -8.427   5.173
  114    HD1  PHE  15          1HD       PHE  15   5.186  -9.940   3.851
  115    HD2  PHE  15          2HD       PHE  15   4.848  -5.676   4.211
  116    HE1  PHE  15          1HE       PHE  15   3.715  -9.888   1.855
  117    HE2  PHE  15          2HE       PHE  15   3.373  -5.621   2.223
  118    HZ   PHE  15           HZ       PHE  15   2.807  -7.730   1.040
  119    H    LEU  16           H        LEU  16   6.040  -6.333   7.743
  120    HA   LEU  16           HA       LEU  16   7.329  -7.889   9.952
  121    HB2  LEU  16          2HB       LEU  16   8.538  -6.152   7.999
  122    HB3  LEU  16          1HB       LEU  16   8.749  -5.466   9.608
  123    HG   LEU  16           HG       LEU  16   9.423  -8.319   8.828
  124   HD11  LEU  16          1HD1      LEU  16  11.728  -7.010   9.670
  125   HD12  LEU  16          2HD1      LEU  16  10.905  -5.801   8.684
  126   HD13  LEU  16          3HD1      LEU  16  11.304  -7.375   7.997
  127   HD21  LEU  16          1HD2      LEU  16   9.404  -8.695  11.051
  128   HD22  LEU  16          2HD2      LEU  16   9.006  -7.007  11.368
  129   HD23  LEU  16          3HD2      LEU  16  10.692  -7.504  11.225
  130    HA   PRO  17           HA       PRO  17   4.745  -4.666  11.928
  131    HB2  PRO  17          2HB       PRO  17   3.286  -6.337  13.505
  132    HB3  PRO  17          1HB       PRO  17   2.870  -5.998  11.817
  133    HG2  PRO  17          2HG       PRO  17   3.940  -8.431  13.005
  134    HG3  PRO  17          1HG       PRO  17   3.127  -8.190  11.456
  135    HD2  PRO  17          2HD       PRO  17   5.972  -8.441  11.961
  136    HD3  PRO  17          1HD       PRO  17   5.137  -8.297  10.398
  137    H    ASP  18           H        ASP  18   6.786  -7.196  13.193
  138    HA   ASP  18           HA       ASP  18   6.700  -6.302  15.959
  139    HB2  ASP  18          2HB       ASP  18   8.634  -8.064  14.444
  140    HB3  ASP  18          1HB       ASP  18   8.723  -7.776  16.178
  141    H    VAL  19           H        VAL  19   7.937  -5.001  13.179
  142    HA   VAL  19           HA       VAL  19  10.087  -3.528  14.648
  143    HB   VAL  19           HB       VAL  19   9.770  -3.907  11.650
  144   HG11  VAL  19          1HG1      VAL  19  12.261  -3.138  11.852
  145   HG12  VAL  19          2HG1      VAL  19  11.761  -2.505  13.420
  146   HG13  VAL  19          3HG1      VAL  19  10.987  -1.923  11.947
  147   HG21  VAL  19          1HG2      VAL  19  10.346  -6.003  12.930
  148   HG22  VAL  19          2HG2      VAL  19  11.783  -5.177  13.533
  149   HG23  VAL  19          3HG2      VAL  19  11.604  -5.488  11.806
  150    H    ALA  20           H        ALA  20   9.915  -1.238  14.626
  151    HA   ALA  20           HA       ALA  20   7.318  -0.143  14.283
  152    HB1  ALA  20          1HB       ALA  20   8.247   1.763  15.104
  153    HB2  ALA  20          2HB       ALA  20   9.547   1.750  13.914
  154    HB3  ALA  20          3HB       ALA  20   9.670   0.755  15.364
  155    HA   PRO  21           HA       PRO  21   7.600  -0.097   9.754
  156    HB2  PRO  21          2HB       PRO  21   5.088   1.204   9.488
  157    HB3  PRO  21          1HB       PRO  21   5.430  -0.523   9.316
  158    HG2  PRO  21          2HG       PRO  21   4.064   0.836  11.439
  159    HG3  PRO  21          1HG       PRO  21   4.267  -0.900  11.170
  160    HD2  PRO  21          2HD       PRO  21   5.555   0.718  13.141
  161    HD3  PRO  21          1HD       PRO  21   5.810  -1.006  12.815
  162    H    ALA  22           H        ALA  22   7.003   2.597  11.863
  163    HA   ALA  22           HA       ALA  22   7.278   4.660   9.840
  164    HB1  ALA  22          1HB       ALA  22   6.990   6.165  11.572
  165    HB2  ALA  22          2HB       ALA  22   7.928   5.195  12.708
  166    HB3  ALA  22          3HB       ALA  22   6.275   4.730  12.309
  167    H    ASP  23           H        ASP  23   9.503   2.597  11.413
  168    HA   ASP  23           HA       ASP  23  11.743   4.481  11.293
  169    HB2  ASP  23          2HB       ASP  23  13.111   2.646  12.090
  170    HB3  ASP  23          1HB       ASP  23  11.613   2.662  13.019
  171    H    VAL  24           H        VAL  24  10.052   3.132   8.940
  172    HA   VAL  24           HA       VAL  24  12.392   2.299   7.301
  173    HB   VAL  24           HB       VAL  24   9.428   2.126   6.668
  174   HG11  VAL  24          1HG1      VAL  24  10.173   0.602   4.882
  175   HG12  VAL  24          2HG1      VAL  24  11.852   0.853   5.361
  176   HG13  VAL  24          3HG1      VAL  24  10.917   2.190   4.692
  177   HG21  VAL  24          1HG2      VAL  24  10.312  -0.440   6.975
  178   HG22  VAL  24          2HG2      VAL  24   9.518   0.483   8.252
  179   HG23  VAL  24          3HG2      VAL  24  11.279   0.391   8.193
  180    H    ASP  25           H        ASP  25  13.087   3.606   5.629
  181    HA   ASP  25           HA       ASP  25  12.245   6.342   5.561
  182    HB2  ASP  25          2HB       ASP  25  13.827   4.701   3.560
  183    HB3  ASP  25          1HB       ASP  25  13.626   6.451   3.466
  184    H    VAL  26           H        VAL  26   9.928   6.230   5.258
  185    HA   VAL  26           HA       VAL  26   8.675   4.904   3.057
  186    HB   VAL  26           HB       VAL  26   6.756   6.332   3.511
  187   HG11  VAL  26          1HG1      VAL  26   8.259   4.952   5.580
  188   HG12  VAL  26          2HG1      VAL  26   6.516   4.992   5.309
  189   HG13  VAL  26          3HG1      VAL  26   7.289   6.256   6.265
  190   HG21  VAL  26          1HG2      VAL  26   8.871   8.150   4.405
  191   HG22  VAL  26          2HG2      VAL  26   7.542   8.040   5.560
  192   HG23  VAL  26          3HG2      VAL  26   7.223   8.516   3.892
  193    H    ASP  27           H        ASP  27  11.018   7.136   2.827
  194    HA   ASP  27           HA       ASP  27   9.817   8.595   0.526
  195    HB2  ASP  27          2HB       ASP  27  12.415   8.999   2.043
  196    HB3  ASP  27          1HB       ASP  27  11.924   9.956   0.644
  197    H    LEU  28           H        LEU  28  11.204   5.737   1.033
  198    HA   LEU  28           HA       LEU  28  13.088   5.803  -1.259
  199    HB2  LEU  28          2HB       LEU  28  13.768   4.648   0.833
  200    HB3  LEU  28          1HB       LEU  28  12.403   3.550   0.650
  201    HG   LEU  28           HG       LEU  28  13.710   3.505  -1.836
  202   HD11  LEU  28          1HD1      LEU  28  15.671   3.382   0.473
  203   HD12  LEU  28          2HD1      LEU  28  15.670   4.565  -0.836
  204   HD13  LEU  28          3HD1      LEU  28  16.028   2.872  -1.177
  205   HD21  LEU  28          1HD2      LEU  28  13.839   1.591   0.518
  206   HD22  LEU  28          2HD2      LEU  28  14.267   1.179  -1.143
  207   HD23  LEU  28          3HD2      LEU  28  12.603   1.606  -0.741
  208    H    ASP  29           H        ASP  29  12.661   4.696  -3.175
  209    HA   ASP  29           HA       ASP  29   9.942   4.232  -3.892
  210    HB2  ASP  29          2HB       ASP  29  12.517   3.191  -5.118
  211    HB3  ASP  29          1HB       ASP  29  10.931   3.020  -5.869
  212    H    LEU  30           H        LEU  30   8.664   2.574  -3.217
  213    HA   LEU  30           HA       LEU  30   9.728   0.397  -1.675
  214    HB2  LEU  30          2HB       LEU  30   7.460  -0.409  -1.551
  215    HB3  LEU  30          1HB       LEU  30   7.394   1.350  -1.471
  216    HG   LEU  30           HG       LEU  30   7.300   0.785  -4.210
  217   HD11  LEU  30          1HD1      LEU  30   5.696  -0.922  -4.539
  218   HD12  LEU  30          2HD1      LEU  30   5.259  -0.960  -2.832
  219   HD13  LEU  30          3HD1      LEU  30   6.807  -1.616  -3.363
  220   HD21  LEU  30          1HD2      LEU  30   4.999   1.621  -4.016
  221   HD22  LEU  30          2HD2      LEU  30   6.071   2.543  -2.963
  222   HD23  LEU  30          3HD2      LEU  30   5.016   1.305  -2.282
  223    H    VAL  31           H        VAL  31  10.229   0.865  -4.813
  224    HA   VAL  31           HA       VAL  31   9.371  -1.404  -6.218
  225    HB   VAL  31           HB       VAL  31  10.792   0.564  -7.070
  226   HG11  VAL  31          1HG1      VAL  31  13.167   0.380  -6.935
  227   HG12  VAL  31          2HG1      VAL  31  13.076  -1.261  -6.295
  228   HG13  VAL  31          3HG1      VAL  31  12.580   0.105  -5.295
  229   HG21  VAL  31          1HG2      VAL  31  11.666  -2.228  -7.878
  230   HG22  VAL  31          2HG2      VAL  31  11.714  -0.777  -8.880
  231   HG23  VAL  31          3HG2      VAL  31  10.163  -1.469  -8.406
  232    H    ASP  32           H        ASP  32  12.091  -1.088  -3.964
  233    HA   ASP  32           HA       ASP  32  13.189  -3.692  -4.316
  234    HB2  ASP  32          2HB       ASP  32  14.180  -1.816  -2.914
  235    HB3  ASP  32          1HB       ASP  32  12.981  -2.204  -1.679
  236    H    ASN  33           H        ASN  33  10.449  -2.483  -2.492
  237    HA   ASN  33           HA       ASN  33   9.847  -5.110  -1.327
  238    HB2  ASN  33          2HB       ASN  33   8.243  -2.547  -1.310
  239    HB3  ASN  33          1HB       ASN  33   7.929  -3.970  -0.320
  240   HD21  ASN  33          1HD2      ASN  33   9.046  -1.008   0.122
  241   HD22  ASN  33          2HD2      ASN  33  10.307  -1.275   1.225
  242    H    GLY  34           H        GLY  34   9.773  -4.251  -4.334
  243    HA2  GLY  34          2HA       GLY  34   7.254  -4.233  -5.450
  244    HA3  GLY  34          1HA       GLY  34   8.583  -5.150  -6.164
  245    H    VAL  35           H        VAL  35   8.531  -6.655  -3.409
  246    HA   VAL  35           HA       VAL  35   7.258  -9.011  -4.278
  247    HB   VAL  35           HB       VAL  35   7.710  -7.938  -1.479
  248   HG11  VAL  35          1HG1      VAL  35   6.236 -10.307  -2.420
  249   HG12  VAL  35          2HG1      VAL  35   6.221  -9.527  -0.838
  250   HG13  VAL  35          3HG1      VAL  35   7.501 -10.670  -1.246
  251   HG21  VAL  35          1HG2      VAL  35   9.100 -10.234  -2.859
  252   HG22  VAL  35          2HG2      VAL  35   9.657  -9.278  -1.486
  253   HG23  VAL  35          3HG2      VAL  35   9.633  -8.572  -3.102
  254    H    ILE  36           H        ILE  36   5.932  -6.210  -2.586
  255    HA   ILE  36           HA       ILE  36   3.331  -7.351  -2.079
  256    HB   ILE  36           HB       ILE  36   4.496  -5.201  -1.101
  257   HG12  ILE  36          2HG1      ILE  36   1.556  -5.399  -1.812
  258   HG13  ILE  36          1HG1      ILE  36   2.337  -5.978  -0.343
  259   HG21  ILE  36          1HG2      ILE  36   2.827  -3.915  -3.259
  260   HG22  ILE  36          2HG2      ILE  36   4.539  -4.252  -3.521
  261   HG23  ILE  36          3HG2      ILE  36   4.044  -3.172  -2.219
  262   HD11  ILE  36          1HD1      ILE  36   3.074  -3.539   0.020
  263   HD12  ILE  36          2HD1      ILE  36   1.372  -3.914   0.288
  264   HD13  ILE  36          3HD1      ILE  36   1.877  -3.128  -1.207
  265    H    ASP  37           H        ASP  37   4.803  -5.835  -4.839
  266    HA   ASP  37           HA       ASP  37   2.501  -4.919  -6.203
  267    HB2  ASP  37          2HB       ASP  37   5.081  -6.037  -7.328
  268    HB3  ASP  37          1HB       ASP  37   3.867  -5.179  -8.273
  269    H    SER  38           H        SER  38   3.849  -8.194  -6.008
  270    HA   SER  38           HA       SER  38   1.694  -9.102  -7.849
  271    HB2  SER  38          2HB       SER  38   4.085 -10.674  -6.885
  272    HB3  SER  38          1HB       SER  38   2.996 -11.092  -8.203
  273    H    LEU  39           H        LEU  39   3.308 -10.501  -4.966
  274    HA   LEU  39           HA       LEU  39   1.010 -12.123  -4.368
  275    HB2  LEU  39          2HB       LEU  39   3.514 -11.444  -2.862
  276    HB3  LEU  39          1HB       LEU  39   2.245 -12.412  -2.119
  277    HG   LEU  39           HG       LEU  39   4.024 -13.789  -3.229
  278   HD11  LEU  39          1HD1      LEU  39   1.355 -14.231  -3.147
  279   HD12  LEU  39          2HD1      LEU  39   2.496 -15.379  -3.846
  280   HD13  LEU  39          3HD1      LEU  39   1.609 -14.270  -4.892
  281   HD21  LEU  39          1HD2      LEU  39   4.319 -12.069  -5.101
  282   HD22  LEU  39          2HD2      LEU  39   2.859 -12.750  -5.821
  283   HD23  LEU  39          3HD2      LEU  39   4.289 -13.758  -5.601
  284    H    GLY  40           H        GLY  40   2.338  -9.262  -2.696
  285    HA2  GLY  40          2HA       GLY  40   0.171  -9.088  -0.825
  286    HA3  GLY  40          1HA       GLY  40   1.289  -7.784  -1.205
  287    H    LEU  41           H        LEU  41   0.716  -7.672  -4.014
  288    HA   LEU  41           HA       LEU  41  -1.452  -5.843  -4.031
  289    HB2  LEU  41          2HB       LEU  41   0.347  -6.017  -5.775
  290    HB3  LEU  41          1HB       LEU  41  -0.440  -7.476  -6.378
  291    HG   LEU  41           HG       LEU  41  -2.572  -5.878  -6.395
  292   HD11  LEU  41          1HD1      LEU  41  -0.295  -3.956  -6.920
  293   HD12  LEU  41          2HD1      LEU  41  -1.193  -4.006  -5.402
  294   HD13  LEU  41          3HD1      LEU  41  -2.021  -3.591  -6.903
  295   HD21  LEU  41          1HD2      LEU  41  -2.017  -5.347  -8.771
  296   HD22  LEU  41          2HD2      LEU  41  -1.676  -7.029  -8.361
  297   HD23  LEU  41          3HD2      LEU  41  -0.357  -5.863  -8.470
  298    H    LEU  42           H        LEU  42  -1.321  -9.304  -4.812
  299    HA   LEU  42           HA       LEU  42  -4.051  -9.524  -5.675
  300    HB2  LEU  42          2HB       LEU  42  -2.269 -11.267  -6.037
  301    HB3  LEU  42          1HB       LEU  42  -2.370 -11.655  -4.326
  302    HG   LEU  42           HG       LEU  42  -4.937 -11.906  -4.809
  303   HD11  LEU  42          1HD1      LEU  42  -4.099 -12.875  -7.472
  304   HD12  LEU  42          2HD1      LEU  42  -4.162 -11.122  -7.295
  305   HD13  LEU  42          3HD1      LEU  42  -5.600 -12.092  -6.980
  306   HD21  LEU  42          1HD2      LEU  42  -2.705 -13.816  -5.478
  307   HD22  LEU  42          2HD2      LEU  42  -4.384 -14.310  -5.684
  308   HD23  LEU  42          3HD2      LEU  42  -3.795 -13.832  -4.093
  309    H    LYS  43           H        LYS  43  -2.486  -9.934  -2.503
  310    HA   LYS  43           HA       LYS  43  -4.852 -10.668  -1.075
  311    HB2  LYS  43          2HB       LYS  43  -2.326  -9.290  -0.151
  312    HB3  LYS  43          1HB       LYS  43  -3.559  -9.929   0.929
  313    HG2  LYS  43          2HG       LYS  43  -3.230 -12.182  -0.005
  314    HG3  LYS  43          1HG       LYS  43  -2.012 -11.550  -1.112
  315    HD2  LYS  43          2HD       LYS  43  -0.892 -12.541   0.813
  316    HD3  LYS  43          1HD       LYS  43  -0.674 -10.792   0.856
  317    HE2  LYS  43          2HE       LYS  43  -3.098 -11.771   2.235
  318    HE3  LYS  43          1HE       LYS  43  -1.574 -12.267   2.971
  319    HZ1  LYS  43          1HZ       LYS  43  -2.632 -10.004   3.600
  320    HZ2  LYS  43          2HZ       LYS  43  -1.943  -9.471   2.142
  321    HZ3  LYS  43          3HZ       LYS  43  -0.955 -10.109   3.368
  322    H    VAL  44           H        VAL  44  -3.404  -7.547  -1.885
  323    HA   VAL  44           HA       VAL  44  -5.030  -5.898  -0.233
  324    HB   VAL  44           HB       VAL  44  -3.759  -5.378  -2.930
  325   HG11  VAL  44          1HG1      VAL  44  -5.546  -3.794  -2.719
  326   HG12  VAL  44          2HG1      VAL  44  -4.074  -2.948  -2.242
  327   HG13  VAL  44          3HG1      VAL  44  -5.196  -3.532  -1.012
  328   HG21  VAL  44          1HG2      VAL  44  -2.814  -4.019  -0.491
  329   HG22  VAL  44          2HG2      VAL  44  -1.890  -4.827  -1.758
  330   HG23  VAL  44          3HG2      VAL  44  -2.618  -5.771  -0.458
  331    H    ILE  45           H        ILE  45  -5.567  -7.090  -3.545
  332    HA   ILE  45           HA       ILE  45  -8.001  -5.704  -4.025
  333    HB   ILE  45           HB       ILE  45  -6.645  -8.115  -5.125
  334   HG12  ILE  45          2HG1      ILE  45  -7.126  -6.878  -7.249
  335   HG13  ILE  45          1HG1      ILE  45  -7.943  -5.638  -6.300
  336   HG21  ILE  45          1HG2      ILE  45  -8.714  -8.451  -6.612
  337   HG22  ILE  45          2HG2      ILE  45  -9.603  -7.569  -5.372
  338   HG23  ILE  45          3HG2      ILE  45  -8.800  -9.087  -4.970
  339   HD11  ILE  45          1HD1      ILE  45  -5.815  -5.341  -4.988
  340   HD12  ILE  45          2HD1      ILE  45  -5.670  -4.901  -6.689
  341   HD13  ILE  45          3HD1      ILE  45  -5.028  -6.442  -6.119
  342    H    ALA  46           H        ALA  46  -7.447  -8.987  -2.734
  343    HA   ALA  46           HA       ALA  46 -10.208  -9.584  -2.278
  344    HB1  ALA  46          1HB       ALA  46  -9.036 -11.126  -0.441
  345    HB2  ALA  46          2HB       ALA  46  -7.586 -10.660  -1.332
  346    HB3  ALA  46          3HB       ALA  46  -8.905 -11.489  -2.161
  347    H    TRP  47           H        TRP  47  -7.710  -8.160  -0.180
  348    HA   TRP  47           HA       TRP  47  -9.439  -7.986   2.131
  349    HB2  TRP  47          2HB       TRP  47  -7.219  -7.879   2.762
  350    HB3  TRP  47          1HB       TRP  47  -6.756  -6.921   1.357
  351    HD1  TRP  47           HD       TRP  47  -8.339  -6.596   4.824
  352    HE1  TRP  47          1HE       TRP  47  -8.262  -4.117   5.532
  353    HE3  TRP  47          3HE       TRP  47  -6.662  -4.496   0.488
  354    HZ2  TRP  47          2HZ       TRP  47  -7.573  -1.577   4.401
  355    HZ3  TRP  47          3HZ       TRP  47  -6.300  -2.052   0.329
  356    HH2  TRP  47           HH       TRP  47  -6.752  -0.596   2.274
  357    H    LEU  48           H        LEU  48  -8.518  -5.717  -0.445
  358    HA   LEU  48           HA       LEU  48  -9.780  -3.412   0.605
  359    HB2  LEU  48          2HB       LEU  48  -8.270  -3.497  -1.409
  360    HB3  LEU  48          1HB       LEU  48  -9.599  -4.202  -2.314
  361    HG   LEU  48           HG       LEU  48 -10.933  -2.124  -1.453
  362   HD11  LEU  48          1HD1      LEU  48  -9.750  -0.376  -0.594
  363   HD12  LEU  48          2HD1      LEU  48  -8.356  -0.692  -1.627
  364   HD13  LEU  48          3HD1      LEU  48  -8.594  -1.633  -0.158
  365   HD21  LEU  48          1HD2      LEU  48  -9.029  -2.474  -3.699
  366   HD22  LEU  48          2HD2      LEU  48  -9.554  -0.817  -3.398
  367   HD23  LEU  48          3HD2      LEU  48 -10.746  -2.073  -3.735
  368    H    GLU  49           H        GLU  49 -11.093  -5.956  -1.531
  369    HA   GLU  49           HA       GLU  49 -13.727  -4.819  -1.685
  370    HB2  GLU  49          2HB       GLU  49 -13.039  -6.485  -3.305
  371    HB3  GLU  49          1HB       GLU  49 -12.738  -7.665  -2.040
  372    HG2  GLU  49          2HG       GLU  49 -15.136  -7.649  -1.464
  373    HG3  GLU  49          1HG       GLU  49 -15.433  -6.481  -2.743
  374    H    ASP  50           H        ASP  50 -12.205  -7.125   0.521
  375    HA   ASP  50           HA       ASP  50 -14.582  -7.767   1.994
  376    HB2  ASP  50          2HB       ASP  50 -12.426  -9.061   2.026
  377    HB3  ASP  50          1HB       ASP  50 -11.741  -7.768   3.009
  378    H    ARG  51           H        ARG  51 -12.141  -5.228   2.358
  379    HA   ARG  51           HA       ARG  51 -13.339  -4.298   4.869
  380    HB2  ARG  51          2HB       ARG  51 -10.891  -4.207   4.479
  381    HB3  ARG  51          1HB       ARG  51 -11.161  -3.035   3.188
  382    HG2  ARG  51          2HG       ARG  51 -12.245  -1.509   4.806
  383    HG3  ARG  51          1HG       ARG  51 -11.944  -2.674   6.096
  384    HD2  ARG  51          2HD       ARG  51  -9.499  -2.514   5.613
  385    HD3  ARG  51          1HD       ARG  51  -9.847  -1.256   4.427
  386    HE   ARG  51           HE       ARG  51 -11.030  -0.219   6.639
  387   HH11  ARG  51          1HH1      ARG  51  -9.986   0.935   8.276
  388   HH12  ARG  51          2HH1      ARG  51  -8.307   0.643   8.588
  389   HH21  ARG  51          1HH2      ARG  51  -7.989  -1.759   6.109
  390   HH22  ARG  51          2HH2      ARG  51  -7.177  -0.881   7.362
  391    H    PHE  52           H        PHE  52 -12.924  -2.818   1.601
  392    HA   PHE  52           HA       PHE  52 -14.816  -0.707   2.422
  393    HB2  PHE  52          2HB       PHE  52 -13.198  -1.096  -0.108
  394    HB3  PHE  52          1HB       PHE  52 -14.207   0.304   0.238
  395    HD1  PHE  52          1HD       PHE  52 -11.066  -1.403   0.971
  396    HD2  PHE  52          2HD       PHE  52 -13.649   1.830   2.121
  397    HE1  PHE  52          1HE       PHE  52  -9.214  -0.384   2.266
  398    HE2  PHE  52          2HE       PHE  52 -11.797   2.850   3.416
  399    HZ   PHE  52           HZ       PHE  52  -9.578   1.743   3.490
  400    H    GLY  53           H        GLY  53 -15.083  -3.746   0.997
  401    HA2  GLY  53          2HA       GLY  53 -16.955  -4.763  -0.022
  402    HA3  GLY  53          1HA       GLY  53 -17.849  -3.276   0.298
  403    H    ILE  54           H        ILE  54 -14.840  -3.084  -1.428
  404    HA   ILE  54           HA       ILE  54 -16.328  -2.145  -3.814
  405    HB   ILE  54           HB       ILE  54 -13.353  -2.126  -3.216
  406   HG12  ILE  54          2HG1      ILE  54 -15.346   0.156  -3.097
  407   HG13  ILE  54          1HG1      ILE  54 -14.830  -0.757  -1.679
  408   HG21  ILE  54          1HG2      ILE  54 -13.591  -0.229  -5.022
  409   HG22  ILE  54          2HG2      ILE  54 -15.063  -1.095  -5.462
  410   HG23  ILE  54          3HG2      ILE  54 -13.502  -1.912  -5.539
  411   HD11  ILE  54          1HD1      ILE  54 -13.506   1.333  -2.001
  412   HD12  ILE  54          2HD1      ILE  54 -12.953   0.709  -3.555
  413   HD13  ILE  54          3HD1      ILE  54 -12.507  -0.119  -2.062
  414    H    ALA  55           H        ALA  55 -16.143  -3.153  -5.844
  415    HA   ALA  55           HA       ALA  55 -15.749  -5.971  -5.880
  416    HB1  ALA  55          1HB       ALA  55 -15.530  -5.495  -8.461
  417    HB2  ALA  55          2HB       ALA  55 -15.985  -3.854  -8.000
  418    HB3  ALA  55          3HB       ALA  55 -17.067  -5.202  -7.647
  419    H    ALA  56           H        ALA  56 -14.000  -7.228  -6.618
  420    HA   ALA  56           HA       ALA  56 -11.399  -6.318  -5.990
  421    HB1  ALA  56          1HB       ALA  56 -11.520  -8.633  -6.028
  422    HB2  ALA  56          2HB       ALA  56 -10.774  -8.342  -7.600
  423    HB3  ALA  56          3HB       ALA  56 -12.506  -8.660  -7.491
  424    H    ASP  57           H        ASP  57 -13.178  -6.258  -9.036
  425    HA   ASP  57           HA       ASP  57 -12.650  -5.271 -11.097
  426    HB2  ASP  57          2HB       ASP  57 -10.937  -3.576  -9.268
  427    HB3  ASP  57          1HB       ASP  57 -11.276  -3.193 -10.953
  428    H    ASP  58           H        ASP  58 -11.302  -7.623 -10.679
  429    HA   ASP  58           HA       ASP  58  -8.553  -7.765 -10.676
  430    HB2  ASP  58          2HB       ASP  58 -10.490  -9.201 -12.492
  431    HB3  ASP  58          1HB       ASP  58  -8.790  -9.645 -12.344
  432    H    VAL  59           H        VAL  59  -7.619  -5.853 -11.541
  433    HA   VAL  59           HA       VAL  59  -7.636  -5.723 -14.529
  434    HB   VAL  59           HB       VAL  59  -7.378  -3.389 -12.622
  435   HG11  VAL  59          1HG1      VAL  59  -6.176  -3.132 -14.771
  436   HG12  VAL  59          2HG1      VAL  59  -7.557  -2.040 -14.671
  437   HG13  VAL  59          3HG1      VAL  59  -7.664  -3.510 -15.638
  438   HG21  VAL  59          1HG2      VAL  59  -9.627  -3.267 -12.608
  439   HG22  VAL  59          2HG2      VAL  59  -9.693  -4.792 -13.492
  440   HG23  VAL  59          3HG2      VAL  59  -9.655  -3.263 -14.371
  441    H    GLU  60           H        GLU  60  -5.590  -5.585 -15.476
  442    HA   GLU  60           HA       GLU  60  -3.323  -6.231 -13.776
  443    HB2  GLU  60          2HB       GLU  60  -3.534  -7.081 -16.102
  444    HB3  GLU  60          1HB       GLU  60  -3.349  -5.435 -16.699
  445    HG2  GLU  60          2HG       GLU  60  -1.153  -5.289 -15.598
  446    HG3  GLU  60          1HG       GLU  60  -1.332  -6.945 -15.037
  447    H    LEU  61           H        LEU  61  -1.893  -4.845 -12.875
  448    HA   LEU  61           HA       LEU  61  -2.065  -1.968 -13.652
  449    HB2  LEU  61          2HB       LEU  61  -1.108  -3.131 -11.023
  450    HB3  LEU  61          1HB       LEU  61  -1.421  -1.433 -11.380
  451    HG   LEU  61           HG       LEU  61  -3.447  -3.671 -11.270
  452   HD11  LEU  61          1HD1      LEU  61  -3.034  -2.931  -9.071
  453   HD12  LEU  61          2HD1      LEU  61  -4.437  -1.986  -9.569
  454   HD13  LEU  61          3HD1      LEU  61  -2.832  -1.254  -9.580
  455   HD21  LEU  61          1HD2      LEU  61  -3.591  -0.870 -12.351
  456   HD22  LEU  61          2HD2      LEU  61  -5.023  -1.608 -11.631
  457   HD23  LEU  61          3HD2      LEU  61  -4.255  -2.356 -13.030
  458    H    SER  62           H        SER  62  -0.131  -0.874 -14.099
  459    HA   SER  62           HA       SER  62   2.145  -2.571 -14.781
  460    HB2  SER  62          2HB       SER  62   1.158  -0.092 -15.661
  461    HB3  SER  62          1HB       SER  62   2.703   0.273 -14.900
  462    HG   SER  62           HG       SER  62   2.473  -0.550 -17.265
  463    HA   PRO  63           HA       PRO  63   4.408  -2.114 -11.003
  464    HB2  PRO  63          2HB       PRO  63   6.987  -1.977 -12.008
  465    HB3  PRO  63          1HB       PRO  63   6.075  -3.478 -11.767
  466    HG2  PRO  63          2HG       PRO  63   6.549  -1.927 -14.252
  467    HG3  PRO  63          1HG       PRO  63   6.444  -3.678 -14.013
  468    HD2  PRO  63          2HD       PRO  63   4.405  -2.230 -15.084
  469    HD3  PRO  63          1HD       PRO  63   4.130  -3.693 -14.114
  470    H    GLU  64           H        GLU  64   4.744   0.244 -13.541
  471    HA   GLU  64           HA       GLU  64   6.473   2.100 -12.239
  472    HB2  GLU  64          2HB       GLU  64   4.249   2.572 -14.224
  473    HB3  GLU  64          1HB       GLU  64   5.438   3.780 -13.762
  474    HG2  GLU  64          2HG       GLU  64   7.238   2.263 -14.530
  475    HG3  GLU  64          1HG       GLU  64   6.014   1.115 -15.061
  476    H    HIS  65           H        HIS  65   3.011   1.519 -11.929
  477    HA   HIS  65           HA       HIS  65   2.427   3.940 -10.479
  478    HB2  HIS  65          2HB       HIS  65   0.662   2.580 -11.543
  479    HB3  HIS  65          1HB       HIS  65   0.994   1.268 -10.411
  480    HD1  HIS  65          1HD       HIS  65   0.306   5.020 -10.066
  481    HD2  HIS  65          2HD       HIS  65  -0.757   1.397  -8.292
  482    HE1  HIS  65          1HE       HIS  65  -1.295   5.584  -8.184
  483    HE2  HIS  65          2HE       HIS  65  -1.952   3.387  -7.101
  484    H    PHE  66           H        PHE  66   3.771   0.851  -9.555
  485    HA   PHE  66           HA       PHE  66   3.457   1.513  -6.676
  486    HB2  PHE  66          2HB       PHE  66   4.621  -0.962  -7.989
  487    HB3  PHE  66          1HB       PHE  66   4.235  -0.769  -6.278
  488    HD1  PHE  66          1HD       PHE  66   2.843  -1.117  -9.670
  489    HD2  PHE  66          2HD       PHE  66   1.933  -0.784  -5.487
  490    HE1  PHE  66          1HE       PHE  66   0.509  -1.807 -10.125
  491    HE2  PHE  66          2HE       PHE  66  -0.405  -1.477  -5.941
  492    HZ   PHE  66           HZ       PHE  66  -1.117  -1.989  -8.263
  493    H    ARG  67           H        ARG  67   5.534   2.418  -8.997
  494    HA   ARG  67           HA       ARG  67   8.123   1.751  -8.098
  495    HB2  ARG  67          2HB       ARG  67   7.602   3.002 -10.202
  496    HB3  ARG  67          1HB       ARG  67   7.234   4.423  -9.231
  497    HG2  ARG  67          2HG       ARG  67   9.464   4.794  -9.836
  498    HG3  ARG  67          1HG       ARG  67   9.627   4.053  -8.250
  499    HD2  ARG  67          2HD       ARG  67   9.998   1.851  -9.313
  500    HD3  ARG  67          1HD       ARG  67   9.839   2.598 -10.900
  501    HE   ARG  67           HE       ARG  67  11.853   4.040  -9.594
  502   HH11  ARG  67          1HH1      ARG  67  14.031   3.500  -9.861
  503   HH12  ARG  67          2HH1      ARG  67  14.458   1.893 -10.347
  504   HH21  ARG  67          1HH2      ARG  67  11.176   0.784 -10.501
  505   HH22  ARG  67          2HH2      ARG  67  12.841   0.355 -10.709
  506    H    SER  68           H        SER  68   5.945   4.345  -6.995
  507    HA   SER  68           HA       SER  68   7.730   4.653  -4.610
  508    HB2  SER  68          2HB       SER  68   6.221   6.854  -6.046
  509    HB3  SER  68          1HB       SER  68   7.183   7.054  -4.585
  510    HG   SER  68           HG       SER  68   8.418   5.790  -6.725
  511    H    ILE  69           H        ILE  69   6.648   4.986  -2.624
  512    HA   ILE  69           HA       ILE  69   4.093   3.778  -2.325
  513    HB   ILE  69           HB       ILE  69   5.522   5.700  -0.466
  514   HG12  ILE  69          2HG1      ILE  69   5.550   2.678  -0.533
  515   HG13  ILE  69          1HG1      ILE  69   6.846   3.693  -1.149
  516   HG21  ILE  69          1HG2      ILE  69   4.017   3.672   0.841
  517   HG22  ILE  69          2HG2      ILE  69   2.969   4.450  -0.344
  518   HG23  ILE  69          3HG2      ILE  69   3.768   5.416   0.896
  519   HD11  ILE  69          1HD1      ILE  69   7.699   3.888   0.920
  520   HD12  ILE  69          2HD1      ILE  69   6.415   2.850   1.538
  521   HD13  ILE  69          3HD1      ILE  69   6.185   4.597   1.479
  522    H    ARG  70           H        ARG  70   5.081   7.160  -2.664
  523    HA   ARG  70           HA       ARG  70   2.606   8.380  -1.981
  524    HB2  ARG  70          2HB       ARG  70   4.723   9.267  -3.963
  525    HB3  ARG  70          1HB       ARG  70   3.424  10.293  -3.353
  526    HG2  ARG  70          2HG       ARG  70   4.251   9.900  -1.033
  527    HG3  ARG  70          1HG       ARG  70   5.598   8.976  -1.698
  528    HD2  ARG  70          2HD       ARG  70   4.987  11.893  -2.263
  529    HD3  ARG  70          1HD       ARG  70   6.307  11.282  -1.264
  530    HE   ARG  70           HE       ARG  70   6.739  10.041  -3.684
  531   HH11  ARG  70          1HH1      ARG  70   7.962  10.956  -5.351
  532   HH12  ARG  70          2HH1      ARG  70   8.108  12.678  -5.455
  533   HH21  ARG  70          1HH2      ARG  70   6.150  13.279  -2.657
  534   HH22  ARG  70          2HH2      ARG  70   7.082  13.994  -3.930
  535    H    SER  71           H        SER  71   3.745   7.016  -5.059
  536    HA   SER  71           HA       SER  71   1.651   7.991  -6.712
  537    HB2  SER  71          2HB       SER  71   3.721   6.786  -7.499
  538    HB3  SER  71          1HB       SER  71   2.994   5.283  -6.940
  539    HG   SER  71           HG       SER  71   1.449   5.455  -8.464
  540    H    ILE  72           H        ILE  72   1.824   5.020  -4.744
  541    HA   ILE  72           HA       ILE  72  -0.716   3.983  -5.514
  542    HB   ILE  72           HB       ILE  72   0.792   3.655  -2.902
  543   HG12  ILE  72          2HG1      ILE  72   0.772   1.918  -5.391
  544   HG13  ILE  72          1HG1      ILE  72   2.067   3.041  -4.973
  545   HG21  ILE  72          1HG2      ILE  72  -1.777   2.737  -3.796
  546   HG22  ILE  72          2HG2      ILE  72  -0.969   2.422  -2.261
  547   HG23  ILE  72          3HG2      ILE  72  -0.692   1.356  -3.639
  548   HD11  ILE  72          1HD1      ILE  72   1.200   0.562  -3.477
  549   HD12  ILE  72          2HD1      ILE  72   2.206   1.803  -2.731
  550   HD13  ILE  72          3HD1      ILE  72   2.790   0.929  -4.147
  551    H    ASP  73           H        ASP  73   0.265   6.221  -2.941
  552    HA   ASP  73           HA       ASP  73  -2.188   6.361  -1.540
  553    HB2  ASP  73          2HB       ASP  73  -0.013   7.433  -0.848
  554    HB3  ASP  73          1HB       ASP  73  -0.311   8.682  -2.057
  555    H    ALA  74           H        ALA  74  -1.136   8.049  -4.484
  556    HA   ALA  74           HA       ALA  74  -3.391   9.805  -4.650
  557    HB1  ALA  74          1HB       ALA  74  -2.692  10.246  -6.886
  558    HB2  ALA  74          2HB       ALA  74  -1.907   8.674  -7.028
  559    HB3  ALA  74          3HB       ALA  74  -1.209   9.918  -5.992
  560    H    PHE  75           H        PHE  75  -2.811   6.569  -6.029
  561    HA   PHE  75           HA       PHE  75  -5.312   6.399  -7.414
  562    HB2  PHE  75          2HB       PHE  75  -3.405   4.848  -7.798
  563    HB3  PHE  75          1HB       PHE  75  -3.702   4.139  -6.214
  564    HD1  PHE  75          1HD       PHE  75  -5.126   4.665  -9.597
  565    HD2  PHE  75          2HD       PHE  75  -5.526   2.622  -5.840
  566    HE1  PHE  75          1HE       PHE  75  -6.863   3.194 -10.582
  567    HE2  PHE  75          2HE       PHE  75  -7.263   1.152  -6.823
  568    HZ   PHE  75           HZ       PHE  75  -7.931   1.438  -9.194
  569    H    VAL  76           H        VAL  76  -4.343   5.344  -4.154
  570    HA   VAL  76           HA       VAL  76  -6.872   4.235  -3.436
  571    HB   VAL  76           HB       VAL  76  -4.624   5.396  -1.775
  572   HG11  VAL  76          1HG1      VAL  76  -6.604   5.539  -0.431
  573   HG12  VAL  76          2HG1      VAL  76  -5.743   4.089   0.085
  574   HG13  VAL  76          3HG1      VAL  76  -7.152   3.951  -0.965
  575   HG21  VAL  76          1HG2      VAL  76  -4.141   3.348  -3.115
  576   HG22  VAL  76          2HG2      VAL  76  -5.492   2.540  -2.322
  577   HG23  VAL  76          3HG2      VAL  76  -4.087   3.039  -1.380
  578    H    VAL  77           H        VAL  77  -5.509   7.512  -2.964
  579    HA   VAL  77           HA       VAL  77  -7.719   8.546  -1.486
  580    HB   VAL  77           HB       VAL  77  -5.662   9.862  -3.275
  581   HG11  VAL  77          1HG1      VAL  77  -7.520  11.346  -3.315
  582   HG12  VAL  77          2HG1      VAL  77  -6.450  11.969  -2.059
  583   HG13  VAL  77          3HG1      VAL  77  -7.888  11.049  -1.617
  584   HG21  VAL  77          1HG2      VAL  77  -5.075   8.742  -1.020
  585   HG22  VAL  77          2HG2      VAL  77  -5.986  10.057  -0.276
  586   HG23  VAL  77          3HG2      VAL  77  -4.557  10.412  -1.248
  587    H    GLY  78           H        GLY  78  -7.042   8.467  -4.976
  588    HA2  GLY  78          2HA       GLY  78  -9.272  10.006  -5.822
  589    HA3  GLY  78          1HA       GLY  78  -8.461   8.792  -6.808
  590    H    ALA  79           H        ALA  79  -9.057   6.619  -4.854
  591    HA   ALA  79           HA       ALA  79 -11.868   6.205  -5.708
  592    HB1  ALA  79          1HB       ALA  79  -9.568   4.425  -5.085
  593    HB2  ALA  79          2HB       ALA  79 -10.776   4.296  -6.364
  594    HB3  ALA  79          3HB       ALA  79 -11.178   3.808  -4.717
  595    H    THR  80           H        THR  80  -9.847   5.844  -2.789
  596    HA   THR  80           HA       THR  80 -12.283   6.403  -1.180
  597    HB   THR  80           HB       THR  80 -11.902   3.910  -1.343
  598    HG1  THR  80          1HG       THR  80 -12.752   3.894   0.557
  599   HG21  THR  80          1HG2      THR  80  -9.458   4.522   0.334
  600   HG22  THR  80          2HG2      THR  80  -9.396   4.106  -1.377
  601   HG23  THR  80          3HG2      THR  80 -10.006   2.937  -0.207
  602    H    THR  81           H        THR  81 -11.802   7.261   0.934
  603    HA   THR  81           HA       THR  81  -8.960   7.961   1.426
  604    HB   THR  81           HB       THR  81 -10.019   9.848   0.208
  605    HG1  THR  81          1HG       THR  81  -8.892  11.102   1.444
  606   HG21  THR  81          1HG2      THR  81 -11.703  10.610   2.501
  607   HG22  THR  81          2HG2      THR  81 -12.265   9.179   1.637
  608   HG23  THR  81          3HG2      THR  81 -12.044  10.701   0.773
  609    HA   PRO  82           HA       PRO  82 -11.048   6.642   5.296
  610    HB2  PRO  82          2HB       PRO  82  -8.981   5.134   6.260
  611    HB3  PRO  82          1HB       PRO  82 -10.180   4.519   5.109
  612    HG2  PRO  82          2HG       PRO  82  -7.380   5.335   4.670
  613    HG3  PRO  82          1HG       PRO  82  -8.361   4.140   3.811
  614    HD2  PRO  82          2HD       PRO  82  -7.771   6.743   2.920
  615    HD3  PRO  82          1HD       PRO  82  -9.008   5.665   2.246
  616    HA   PRO  83           HA       PRO  83  -9.286   9.524   8.182
  617    HB2  PRO  83          2HB       PRO  83  -8.905   7.435  10.251
  618    HB3  PRO  83          1HB       PRO  83  -9.878   8.914  10.309
  619    HG2  PRO  83          2HG       PRO  83 -10.969   6.470  10.096
  620    HG3  PRO  83          1HG       PRO  83 -11.700   7.914   9.378
  621    HD2  PRO  83          2HD       PRO  83 -10.245   5.682   8.046
  622    HD3  PRO  83          1HD       PRO  83 -11.551   6.716   7.430
  623    H    VAL  84           H        VAL  84  -7.238  10.241   8.971
  624    HA   VAL  84           HA       VAL  84  -4.970   8.449   8.243
  625    HB   VAL  84           HB       VAL  84  -4.953  11.436   8.765
  626   HG11  VAL  84          1HG1      VAL  84  -2.767  11.331   7.634
  627   HG12  VAL  84          2HG1      VAL  84  -2.938   9.586   7.453
  628   HG13  VAL  84          3HG1      VAL  84  -2.780  10.293   9.060
  629   HG21  VAL  84          1HG2      VAL  84  -5.021  11.739   6.380
  630   HG22  VAL  84          2HG2      VAL  84  -6.359  10.665   6.791
  631   HG23  VAL  84          3HG2      VAL  84  -4.879  10.004   6.097
  632    H    GLU  85           H        GLU  85  -3.642   7.683   9.820
  633    HA   GLU  85           HA       GLU  85  -3.767   8.961  12.512
  634    HB2  GLU  85          2HB       GLU  85  -3.684   5.988  11.915
  635    HB3  GLU  85          1HB       GLU  85  -3.626   6.710  13.522
  636    HG2  GLU  85          2HG       GLU  85  -5.843   7.757  13.105
  637    HG3  GLU  85          1HG       GLU  85  -5.908   6.948  11.539
  638    H    ALA  86           H        ALA  86  -1.779   8.871  13.696
  639    HA   ALA  86           HA       ALA  86   0.597   8.973  12.081
  640    HB1  ALA  86          1HB       ALA  86   0.952   8.470  14.974
  641    HB2  ALA  86          2HB       ALA  86  -0.059   9.861  14.582
  642    HB3  ALA  86          3HB       ALA  86   1.593   9.772  13.971
  643    H    LYS  87           H        LYS  87   2.290   7.447  11.892
  644    HA   LYS  87           HA       LYS  87   1.586   4.701  11.850
  645    HB2  LYS  87          2HB       LYS  87   4.318   6.004  12.029
  646    HB3  LYS  87          1HB       LYS  87   4.057   4.293  11.693
  647    HG2  LYS  87          2HG       LYS  87   2.674   4.936   9.711
  648    HG3  LYS  87          1HG       LYS  87   3.083   6.625  10.018
  649    HD2  LYS  87          2HD       LYS  87   5.490   6.062   9.807
  650    HD3  LYS  87          1HD       LYS  87   5.052   4.396   9.429
  651    HE2  LYS  87          2HE       LYS  87   5.399   5.469   7.322
  652    HE3  LYS  87          1HE       LYS  87   3.652   5.341   7.515
  653    HZ1  LYS  87          1HZ       LYS  87   5.318   7.682   7.416
  654    HZ2  LYS  87          2HZ       LYS  87   4.225   7.693   8.717
  655    HZ3  LYS  87          3HZ       LYS  87   3.655   7.524   7.125
  656    H    LEU  88           H        LEU  88   3.041   6.674  14.392
  657    HA   LEU  88           HA       LEU  88   3.876   4.589  16.130
  658    HB2  LEU  88          2HB       LEU  88   2.722   7.290  16.899
  659    HB3  LEU  88          1HB       LEU  88   3.725   6.259  17.920
  660    HG   LEU  88           HG       LEU  88   4.561   7.541  15.301
  661   HD11  LEU  88          1HD1      LEU  88   4.933   8.186  18.190
  662   HD12  LEU  88          2HD1      LEU  88   4.797   9.269  16.804
  663   HD13  LEU  88          3HD1      LEU  88   6.316   8.434  17.124
  664   HD21  LEU  88          1HD2      LEU  88   5.803   5.465  17.079
  665   HD22  LEU  88          2HD2      LEU  88   6.852   6.623  16.261
  666   HD23  LEU  88          3HD2      LEU  88   5.799   5.567  15.319
  667    H    GLN  89           H        GLN  89   0.695   6.039  15.596
  668    HA   GLN  89           HA       GLN  89  -0.480   4.388  17.750
  669    HB2  GLN  89          2HB       GLN  89  -1.236   6.746  17.378
  670    HB3  GLN  89          1HB       GLN  89  -1.847   6.263  15.796
  671    HG2  GLN  89          2HG       GLN  89  -3.345   4.625  16.857
  672    HG3  GLN  89          1HG       GLN  89  -2.723   5.074  18.445
  673   HE21  GLN  89          1HE2      GLN  89  -5.431   5.421  18.136
  674   HE22  GLN  89          2HE2      GLN  89  -5.816   7.064  17.951
  675    H1   PN7 101          3HO       SAT 101   3.846  -7.705 -13.976
  676    H2   PN7 101          1H1       SAT 101   4.612  -6.850  -9.646
  677    H3   PN7 101          2H1       SAT 101   3.046  -7.627  -9.413
  678    H5   PN7 101          1HE1      SAT 101   4.990  -5.547 -11.887
  679    H6   PN7 101          2HE1      SAT 101   4.387  -4.723 -10.449
  680    H7   PN7 101          3HE1      SAT 101   3.623  -4.440 -12.012
  681    H8   PN7 101          2HE2      SAT 101   1.049  -6.511 -10.681
  682    H9   PN7 101          3HE2      SAT 101   1.580  -4.866 -11.032
  683    H10  PN7 101          1HE2      SAT 101   1.972  -5.608  -9.481
  684    H11  PN7 101          3H        SAT 101   2.357  -7.998 -12.234
  685    H12  PN7 101          5H        SAT 101   2.373  -4.396 -14.020
  686    H13  PN7 101          1H6       SAT 101   4.382  -5.833 -14.915
  687    H14  PN7 101          2H6       SAT 101   3.089  -6.915 -15.435
  688    H15  PN7 101          1H7       SAT 101   3.548  -4.056 -16.330
  689    H16  PN7 101          2H7       SAT 101   2.099  -4.985 -16.722
  690    H17  PN7 101          9H        SAT 101   4.907  -7.086 -16.661
  691    H18  PN7 101          1H10      SAT 101   3.069  -8.124 -18.574
  692    H19  PN7 101          2H10      SAT 101   4.555  -7.689 -19.418
  693    H20  PN7 101          1H11      SAT 101   5.623  -9.042 -17.347
  694    H21  PN7 101          2H11      SAT 101   5.130  -9.839 -18.841
  695    H22  PN7 101          2HS1      SAT 101   2.697 -10.000 -17.367
  Start of MODEL    3
    1    H1   MET   1          1HT       MET   1  -0.621  13.353   0.258
    2    H2   MET   1          2HT       MET   1  -0.422  12.069  -0.838
    3    H3   MET   1          3HT       MET   1   0.880  13.106  -0.493
    4    HA   MET   1           HA       MET   1   0.535  10.728   0.662
    5    HB2  MET   1          2HB       MET   1   1.757  13.243   1.836
    6    HB3  MET   1          1HB       MET   1   2.071  11.611   2.430
    7    HG2  MET   1          2HG       MET   1   2.822  10.997   0.106
    8    HG3  MET   1          1HG       MET   1   2.694  12.702  -0.326
    9    HE1  MET   1          1HE       MET   1   5.165  14.552   1.729
   10    HE2  MET   1          2HE       MET   1   3.789  14.026   2.695
   11    HE3  MET   1          3HE       MET   1   3.548  14.497   1.014
   12    H    GLN   2           H        GLN   2  -2.045  12.175   0.847
   13    HA   GLN   2           HA       GLN   2  -2.655  12.920   3.524
   14    HB2  GLN   2          2HB       GLN   2  -4.433  11.635   1.427
   15    HB3  GLN   2          1HB       GLN   2  -5.012  12.402   2.906
   16    HG2  GLN   2          2HG       GLN   2  -4.007  14.537   2.209
   17    HG3  GLN   2          1HG       GLN   2  -3.395  13.776   0.739
   18   HE21  GLN   2          1HE2      GLN   2  -5.192  15.977   0.564
   19   HE22  GLN   2          2HE2      GLN   2  -6.675  15.423  -0.049
   20    H    HIS   3           H        HIS   3  -2.642   9.753   1.926
   21    HA   HIS   3           HA       HIS   3  -2.944   8.502   4.629
   22    HB2  HIS   3          2HB       HIS   3  -3.935   7.301   2.033
   23    HB3  HIS   3          1HB       HIS   3  -4.259   6.735   3.672
   24    HD1  HIS   3          1HD       HIS   3  -5.365   8.899   5.208
   25    HD2  HIS   3          2HD       HIS   3  -6.094   8.731   1.104
   26    HE1  HIS   3          1HE       HIS   3  -7.415  10.330   4.783
   27    HE2  HIS   3          2HE       HIS   3  -7.865  10.235   2.289
   28    H    ALA   4           H        ALA   4  -0.706   9.158   2.458
   29    HA   ALA   4           HA       ALA   4   0.401   6.683   1.615
   30    HB1  ALA   4          1HB       ALA   4   2.620   8.033   1.728
   31    HB2  ALA   4          2HB       ALA   4   1.592   9.389   2.189
   32    HB3  ALA   4          3HB       ALA   4   1.359   8.594   0.632
   33    H    SER   5           H        SER   5   0.723   8.434   4.686
   34    HA   SER   5           HA       SER   5   2.817   6.829   5.779
   35    HB2  SER   5          2HB       SER   5   2.131   7.699   7.936
   36    HB3  SER   5          1HB       SER   5   1.972   8.991   6.751
   37    HG   SER   5           HG       SER   5   0.117   8.041   8.339
   38    H    VAL   6           H        VAL   6  -0.676   6.369   5.613
   39    HA   VAL   6           HA       VAL   6  -0.807   4.123   7.396
   40    HB   VAL   6           HB       VAL   6  -2.573   4.937   5.083
   41   HG11  VAL   6          1HG1      VAL   6  -2.743   2.685   7.067
   42   HG12  VAL   6          2HG1      VAL   6  -3.088   2.667   5.338
   43   HG13  VAL   6          3HG1      VAL   6  -4.221   3.428   6.455
   44   HG21  VAL   6          1HG2      VAL   6  -3.991   5.894   6.765
   45   HG22  VAL   6          2HG2      VAL   6  -2.356   6.452   7.121
   46   HG23  VAL   6          3HG2      VAL   6  -3.065   5.139   8.062
   47    H    ILE   7           H        ILE   7  -0.178   4.446   3.943
   48    HA   ILE   7           HA       ILE   7  -0.293   1.661   3.307
   49    HB   ILE   7           HB       ILE   7   1.333   3.861   2.005
   50   HG12  ILE   7          2HG1      ILE   7  -1.405   2.762   1.291
   51   HG13  ILE   7          1HG1      ILE   7  -1.144   4.266   2.175
   52   HG21  ILE   7          1HG2      ILE   7   0.584   1.051   1.187
   53   HG22  ILE   7          2HG2      ILE   7   2.181   1.801   1.193
   54   HG23  ILE   7          3HG2      ILE   7   0.984   2.282  -0.011
   55   HD11  ILE   7          1HD1      ILE   7  -0.962   3.768  -0.679
   56   HD12  ILE   7          2HD1      ILE   7   0.544   4.445  -0.059
   57   HD13  ILE   7          3HD1      ILE   7  -0.976   5.305   0.183
   58    H    ALA   8           H        ALA   8   2.416   3.741   4.338
   59    HA   ALA   8           HA       ALA   8   4.449   1.755   4.036
   60    HB1  ALA   8          1HB       ALA   8   4.225   4.407   5.180
   61    HB2  ALA   8          2HB       ALA   8   5.641   3.604   4.504
   62    HB3  ALA   8          3HB       ALA   8   5.219   3.364   6.200
   63    H    GLN   9           H        GLN   9   2.628   2.724   6.968
   64    HA   GLN   9           HA       GLN   9   3.822   0.632   8.557
   65    HB2  GLN   9          2HB       GLN   9   1.797   1.115  10.089
   66    HB3  GLN   9          1HB       GLN   9   2.953   2.421   9.826
   67    HG2  GLN   9          2HG       GLN   9   1.400   3.706   8.822
   68    HG3  GLN   9          1HG       GLN   9   0.891   2.385   7.776
   69   HE21  GLN   9          1HE2      GLN   9  -0.109   0.505   9.551
   70   HE22  GLN   9          2HE2      GLN   9  -1.406   1.154  10.432
   71    H    PHE  10           H        PHE  10   0.733   0.914   6.830
   72    HA   PHE  10           HA       PHE  10  -0.355  -1.579   7.646
   73    HB2  PHE  10          2HB       PHE  10  -1.590   0.197   6.381
   74    HB3  PHE  10          1HB       PHE  10  -0.674  -0.245   4.941
   75    HD1  PHE  10          1HD       PHE  10  -1.156  -2.259   3.712
   76    HD2  PHE  10          2HD       PHE  10  -3.174  -1.421   7.411
   77    HE1  PHE  10          1HE       PHE  10  -2.772  -4.081   3.244
   78    HE2  PHE  10          2HE       PHE  10  -4.788  -3.245   6.944
   79    HZ   PHE  10           HZ       PHE  10  -4.588  -4.573   4.859
   80    H    VAL  11           H        VAL  11   1.765  -0.761   4.914
   81    HA   VAL  11           HA       VAL  11   1.881  -3.465   3.901
   82    HB   VAL  11           HB       VAL  11   3.758  -1.122   3.489
   83   HG11  VAL  11          1HG1      VAL  11   4.415  -2.361   1.441
   84   HG12  VAL  11          2HG1      VAL  11   3.396  -3.706   1.951
   85   HG13  VAL  11          3HG1      VAL  11   4.810  -3.261   2.906
   86   HG21  VAL  11          1HG2      VAL  11   1.845  -2.024   1.405
   87   HG22  VAL  11          2HG2      VAL  11   2.338  -0.389   1.848
   88   HG23  VAL  11          3HG2      VAL  11   1.133  -1.240   2.815
   89    H    VAL  12           H        VAL  12   4.197  -1.504   5.806
   90    HA   VAL  12           HA       VAL  12   6.141  -3.584   6.117
   91    HB   VAL  12           HB       VAL  12   5.523  -1.150   7.787
   92   HG11  VAL  12          1HG1      VAL  12   6.673  -2.525   9.308
   93   HG12  VAL  12          2HG1      VAL  12   7.977  -1.613   8.548
   94   HG13  VAL  12          3HG1      VAL  12   7.647  -3.268   8.038
   95   HG21  VAL  12          1HG2      VAL  12   8.010  -1.474   6.190
   96   HG22  VAL  12          2HG2      VAL  12   7.025  -0.036   6.454
   97   HG23  VAL  12          3HG2      VAL  12   6.516  -1.250   5.280
   98    H    GLU  13           H        GLU  13   3.301  -2.699   8.022
   99    HA   GLU  13           HA       GLU  13   3.826  -4.377  10.257
  100    HB2  GLU  13          2HB       GLU  13   1.324  -3.253   9.042
  101    HB3  GLU  13          1HB       GLU  13   1.230  -4.370  10.398
  102    HG2  GLU  13          2HG       GLU  13   2.689  -2.913  11.729
  103    HG3  GLU  13          1HG       GLU  13   2.817  -1.795  10.377
  104    H    GLU  14           H        GLU  14   2.518  -5.058   7.075
  105    HA   GLU  14           HA       GLU  14   1.460  -7.655   7.681
  106    HB2  GLU  14          2HB       GLU  14   0.967  -6.364   5.589
  107    HB3  GLU  14          1HB       GLU  14   2.615  -6.688   5.049
  108    HG2  GLU  14          2HG       GLU  14   2.161  -9.132   5.244
  109    HG3  GLU  14          1HG       GLU  14   0.489  -8.760   5.667
  110    H    PHE  15           H        PHE  15   4.694  -6.483   6.936
  111    HA   PHE  15           HA       PHE  15   5.696  -9.288   6.917
  112    HB2  PHE  15          2HB       PHE  15   7.213  -6.747   6.278
  113    HB3  PHE  15          1HB       PHE  15   7.727  -8.403   5.953
  114    HD1  PHE  15          1HD       PHE  15   6.416  -9.807   4.305
  115    HD2  PHE  15          2HD       PHE  15   5.754  -5.599   4.816
  116    HE1  PHE  15          1HE       PHE  15   5.220  -9.731   2.131
  117    HE2  PHE  15          2HE       PHE  15   4.557  -5.519   2.654
  118    HZ   PHE  15           HZ       PHE  15   4.290  -7.585   1.304
  119    H    LEU  16           H        LEU  16   6.743  -6.130   8.291
  120    HA   LEU  16           HA       LEU  16   7.620  -7.642  10.720
  121    HB2  LEU  16          2HB       LEU  16   9.288  -6.471   8.829
  122    HB3  LEU  16          1HB       LEU  16   9.248  -5.294  10.138
  123    HG   LEU  16           HG       LEU  16  11.041  -6.872  10.578
  124   HD11  LEU  16          1HD1      LEU  16   9.053  -6.230  12.351
  125   HD12  LEU  16          2HD1      LEU  16  10.537  -7.078  12.787
  126   HD13  LEU  16          3HD1      LEU  16   9.063  -7.990  12.461
  127   HD21  LEU  16          1HD2      LEU  16   9.506  -9.268  11.039
  128   HD22  LEU  16          2HD2      LEU  16  10.877  -9.032   9.954
  129   HD23  LEU  16          3HD2      LEU  16   9.238  -8.711   9.387
  130    HA   PRO  17           HA       PRO  17   5.172  -4.057  12.208
  131    HB2  PRO  17          2HB       PRO  17   3.625  -5.554  13.953
  132    HB3  PRO  17          1HB       PRO  17   3.177  -5.161  12.287
  133    HG2  PRO  17          2HG       PRO  17   3.900  -7.704  13.411
  134    HG3  PRO  17          1HG       PRO  17   3.292  -7.331  11.797
  135    HD2  PRO  17          2HD       PRO  17   6.035  -7.908  12.621
  136    HD3  PRO  17          1HD       PRO  17   5.363  -7.791  10.980
  137    H    ASP  18           H        ASP  18   7.147  -6.443  13.718
  138    HA   ASP  18           HA       ASP  18   6.980  -5.392  16.424
  139    HB2  ASP  18          2HB       ASP  18   8.979  -7.202  15.060
  140    HB3  ASP  18          1HB       ASP  18   9.019  -6.813  16.775
  141    H    VAL  19           H        VAL  19   8.261  -4.196  13.616
  142    HA   VAL  19           HA       VAL  19  10.379  -2.656  15.062
  143    HB   VAL  19           HB       VAL  19  10.094  -3.123  12.074
  144   HG11  VAL  19          1HG1      VAL  19  12.725  -2.429  12.802
  145   HG12  VAL  19          2HG1      VAL  19  11.682  -1.325  13.699
  146   HG13  VAL  19          3HG1      VAL  19  11.563  -1.420  11.941
  147   HG21  VAL  19          1HG2      VAL  19  10.877  -4.977  13.972
  148   HG22  VAL  19          2HG2      VAL  19  12.412  -4.263  13.477
  149   HG23  VAL  19          3HG2      VAL  19  11.354  -5.001  12.274
  150    H    ALA  20           H        ALA  20  10.223  -0.363  14.940
  151    HA   ALA  20           HA       ALA  20   7.629   0.724  14.564
  152    HB1  ALA  20          1HB       ALA  20   8.662   2.417  15.622
  153    HB2  ALA  20          2HB       ALA  20   9.509   2.799  14.123
  154    HB3  ALA  20          3HB       ALA  20  10.236   1.693  15.289
  155    HA   PRO  21           HA       PRO  21   7.891   0.601  10.038
  156    HB2  PRO  21          2HB       PRO  21   5.372   1.842   9.712
  157    HB3  PRO  21          1HB       PRO  21   5.730   0.112   9.654
  158    HG2  PRO  21          2HG       PRO  21   4.375   1.614  11.700
  159    HG3  PRO  21          1HG       PRO  21   4.541  -0.137  11.516
  160    HD2  PRO  21          2HD       PRO  21   5.863   1.535  13.406
  161    HD3  PRO  21          1HD       PRO  21   6.114  -0.201  13.138
  162    H    ALA  22           H        ALA  22   7.212   3.387  12.023
  163    HA   ALA  22           HA       ALA  22   7.485   5.356   9.908
  164    HB1  ALA  22          1HB       ALA  22   6.306   5.947  11.957
  165    HB2  ALA  22          2HB       ALA  22   7.742   6.961  11.817
  166    HB3  ALA  22          3HB       ALA  22   7.737   5.587  12.923
  167    H    ASP  23           H        ASP  23   9.672   3.375  11.605
  168    HA   ASP  23           HA       ASP  23  11.959   5.200  11.420
  169    HB2  ASP  23          2HB       ASP  23  11.750   2.255  12.115
  170    HB3  ASP  23          1HB       ASP  23  13.254   3.176  12.158
  171    H    VAL  24           H        VAL  24  10.242   3.613   9.155
  172    HA   VAL  24           HA       VAL  24  12.601   2.742   7.569
  173    HB   VAL  24           HB       VAL  24   9.641   2.433   6.972
  174   HG11  VAL  24          1HG1      VAL  24  10.667   2.183   4.905
  175   HG12  VAL  24          2HG1      VAL  24  10.787   0.534   5.516
  176   HG13  VAL  24          3HG1      VAL  24  12.179   1.611   5.609
  177   HG21  VAL  24          1HG2      VAL  24  10.027   1.086   8.872
  178   HG22  VAL  24          2HG2      VAL  24  11.660   0.669   8.355
  179   HG23  VAL  24          3HG2      VAL  24  10.268  -0.027   7.525
  180    H    ASP  25           H        ASP  25  13.245   3.912   5.777
  181    HA   ASP  25           HA       ASP  25  12.296   6.612   5.485
  182    HB2  ASP  25          2HB       ASP  25  14.021   4.895   3.677
  183    HB3  ASP  25          1HB       ASP  25  13.743   6.620   3.434
  184    H    VAL  26           H        VAL  26   9.998   6.354   5.122
  185    HA   VAL  26           HA       VAL  26   8.905   4.800   2.975
  186    HB   VAL  26           HB       VAL  26   6.884   6.134   3.282
  187   HG11  VAL  26          1HG1      VAL  26   8.048   6.000   6.046
  188   HG12  VAL  26          2HG1      VAL  26   7.860   4.511   5.119
  189   HG13  VAL  26          3HG1      VAL  26   6.451   5.507   5.484
  190   HG21  VAL  26          1HG2      VAL  26   7.626   8.370   3.370
  191   HG22  VAL  26          2HG2      VAL  26   8.820   8.020   4.620
  192   HG23  VAL  26          3HG2      VAL  26   7.104   8.056   5.025
  193    H    ASP  27           H        ASP  27  11.111   7.152   2.676
  194    HA   ASP  27           HA       ASP  27   9.882   8.500   0.334
  195    HB2  ASP  27          2HB       ASP  27  12.537   8.899   1.749
  196    HB3  ASP  27          1HB       ASP  27  12.016   9.824   0.341
  197    H    LEU  28           H        LEU  28  11.308   5.641   0.888
  198    HA   LEU  28           HA       LEU  28  13.045   5.642  -1.518
  199    HB2  LEU  28          2HB       LEU  28  13.872   4.591   0.578
  200    HB3  LEU  28          1HB       LEU  28  12.535   3.449   0.512
  201    HG   LEU  28           HG       LEU  28  14.127   3.674  -1.976
  202   HD11  LEU  28          1HD1      LEU  28  15.953   3.821  -0.385
  203   HD12  LEU  28          2HD1      LEU  28  15.911   2.178  -1.023
  204   HD13  LEU  28          3HD1      LEU  28  15.268   2.517   0.584
  205   HD21  LEU  28          1HD2      LEU  28  12.213   2.003  -1.200
  206   HD22  LEU  28          2HD2      LEU  28  13.561   1.152  -0.450
  207   HD23  LEU  28          3HD2      LEU  28  13.551   1.428  -2.191
  208    H    ASP  29           H        ASP  29  12.483   4.535  -3.381
  209    HA   ASP  29           HA       ASP  29   9.734   3.982  -3.868
  210    HB2  ASP  29          2HB       ASP  29  12.217   3.003  -5.312
  211    HB3  ASP  29          1HB       ASP  29  10.575   2.808  -5.925
  212    H    LEU  30           H        LEU  30   8.558   2.306  -3.105
  213    HA   LEU  30           HA       LEU  30   9.731   0.162  -1.626
  214    HB2  LEU  30          2HB       LEU  30   7.499  -0.712  -1.432
  215    HB3  LEU  30          1HB       LEU  30   7.364   1.045  -1.397
  216    HG   LEU  30           HG       LEU  30   7.238   0.441  -4.114
  217   HD11  LEU  30          1HD1      LEU  30   5.292  -1.407  -2.750
  218   HD12  LEU  30          2HD1      LEU  30   6.896  -1.989  -3.194
  219   HD13  LEU  30          3HD1      LEU  30   5.805  -1.387  -4.436
  220   HD21  LEU  30          1HD2      LEU  30   5.917   2.124  -2.874
  221   HD22  LEU  30          2HD2      LEU  30   4.967   0.831  -2.142
  222   HD23  LEU  30          3HD2      LEU  30   4.883   1.111  -3.881
  223    H    VAL  31           H        VAL  31  10.053   0.645  -4.815
  224    HA   VAL  31           HA       VAL  31   9.270  -1.688  -6.151
  225    HB   VAL  31           HB       VAL  31  10.528   0.367  -7.075
  226   HG11  VAL  31          1HG1      VAL  31  12.946  -1.349  -6.487
  227   HG12  VAL  31          2HG1      VAL  31  12.452  -0.035  -5.419
  228   HG13  VAL  31          3HG1      VAL  31  12.908   0.309  -7.088
  229   HG21  VAL  31          1HG2      VAL  31  11.402  -0.931  -8.948
  230   HG22  VAL  31          2HG2      VAL  31   9.902  -1.671  -8.389
  231   HG23  VAL  31          3HG2      VAL  31  11.454  -2.387  -7.953
  232    H    ASP  32           H        ASP  32  12.041  -1.186  -4.002
  233    HA   ASP  32           HA       ASP  32  13.337  -3.685  -4.420
  234    HB2  ASP  32          2HB       ASP  32  13.088  -2.003  -1.904
  235    HB3  ASP  32          1HB       ASP  32  14.177  -3.382  -2.066
  236    H    ASN  33           H        ASN  33  10.585  -2.746  -2.442
  237    HA   ASN  33           HA       ASN  33  10.252  -5.451  -1.347
  238    HB2  ASN  33          2HB       ASN  33   8.455  -3.025  -1.160
  239    HB3  ASN  33          1HB       ASN  33   8.295  -4.502  -0.214
  240   HD21  ASN  33          1HD2      ASN  33   9.844  -1.430  -0.339
  241   HD22  ASN  33          2HD2      ASN  33  10.904  -1.661   0.966
  242    H    GLY  34           H        GLY  34   9.969  -4.490  -4.309
  243    HA2  GLY  34          2HA       GLY  34   7.416  -4.628  -5.320
  244    HA3  GLY  34          1HA       GLY  34   8.777  -5.409  -6.124
  245    H    VAL  35           H        VAL  35   8.949  -7.077  -3.461
  246    HA   VAL  35           HA       VAL  35   7.775  -9.443  -4.428
  247    HB   VAL  35           HB       VAL  35   9.334  -9.090  -2.384
  248   HG11  VAL  35          1HG1      VAL  35   8.310  -8.737  -0.282
  249   HG12  VAL  35          2HG1      VAL  35   6.698  -9.053  -0.925
  250   HG13  VAL  35          3HG1      VAL  35   7.536  -7.561  -1.345
  251   HG21  VAL  35          1HG2      VAL  35   8.944 -11.327  -2.554
  252   HG22  VAL  35          2HG2      VAL  35   7.230 -11.092  -2.899
  253   HG23  VAL  35          3HG2      VAL  35   7.806 -11.071  -1.232
  254    H    ILE  36           H        ILE  36   6.364  -6.806  -2.584
  255    HA   ILE  36           HA       ILE  36   3.832  -8.095  -2.042
  256    HB   ILE  36           HB       ILE  36   4.905  -5.959  -0.974
  257   HG12  ILE  36          2HG1      ILE  36   1.990  -6.297  -1.705
  258   HG13  ILE  36          1HG1      ILE  36   2.793  -6.730  -0.198
  259   HG21  ILE  36          1HG2      ILE  36   3.238  -4.612  -3.098
  260   HG22  ILE  36          2HG2      ILE  36   4.958  -4.906  -3.352
  261   HG23  ILE  36          3HG2      ILE  36   4.426  -3.892  -2.011
  262   HD11  ILE  36          1HD1      ILE  36   1.820  -4.089  -1.125
  263   HD12  ILE  36          2HD1      ILE  36   3.376  -4.085  -0.294
  264   HD13  ILE  36          3HD1      ILE  36   1.947  -4.730   0.514
  265    H    ASP  37           H        ASP  37   5.180  -6.422  -4.765
  266    HA   ASP  37           HA       ASP  37   2.848  -5.509  -6.057
  267    HB2  ASP  37          2HB       ASP  37   5.398  -6.582  -7.287
  268    HB3  ASP  37          1HB       ASP  37   4.161  -5.684  -8.160
  269    H    SER  38           H        SER  38   4.187  -8.797  -5.975
  270    HA   SER  38           HA       SER  38   2.005  -9.632  -7.821
  271    HB2  SER  38          2HB       SER  38   4.550 -11.030  -6.996
  272    HB3  SER  38          1HB       SER  38   3.316 -11.752  -8.026
  273    H    LEU  39           H        LEU  39   3.628 -11.138  -4.996
  274    HA   LEU  39           HA       LEU  39   1.292 -12.732  -4.431
  275    HB2  LEU  39          2HB       LEU  39   3.764 -12.144  -2.809
  276    HB3  LEU  39          1HB       LEU  39   2.514 -13.265  -2.285
  277    HG   LEU  39           HG       LEU  39   2.933 -14.238  -4.754
  278   HD11  LEU  39          1HD1      LEU  39   5.383 -14.188  -5.206
  279   HD12  LEU  39          2HD1      LEU  39   5.571 -13.008  -3.909
  280   HD13  LEU  39          3HD1      LEU  39   4.638 -12.596  -5.347
  281   HD21  LEU  39          1HD2      LEU  39   3.085 -15.576  -2.740
  282   HD22  LEU  39          2HD2      LEU  39   4.579 -14.769  -2.265
  283   HD23  LEU  39          3HD2      LEU  39   4.559 -15.831  -3.673
  284    H    GLY  40           H        GLY  40   2.742  -9.977  -2.689
  285    HA2  GLY  40          2HA       GLY  40   0.625  -9.786  -0.766
  286    HA3  GLY  40          1HA       GLY  40   1.769  -8.502  -1.147
  287    H    LEU  41           H        LEU  41   1.122  -8.324  -3.937
  288    HA   LEU  41           HA       LEU  41  -0.974  -6.420  -3.876
  289    HB2  LEU  41          2HB       LEU  41   0.745  -6.572  -5.654
  290    HB3  LEU  41          1HB       LEU  41  -0.002  -8.059  -6.237
  291    HG   LEU  41           HG       LEU  41  -2.173  -6.450  -6.238
  292   HD11  LEU  41          1HD1      LEU  41  -1.460  -4.241  -7.143
  293   HD12  LEU  41          2HD1      LEU  41   0.208  -4.646  -6.742
  294   HD13  LEU  41          3HD1      LEU  41  -0.991  -4.474  -5.459
  295   HD21  LEU  41          1HD2      LEU  41  -1.332  -7.761  -8.143
  296   HD22  LEU  41          2HD2      LEU  41  -0.050  -6.579  -8.401
  297   HD23  LEU  41          3HD2      LEU  41  -1.734  -6.121  -8.654
  298    H    LEU  42           H        LEU  42  -1.018  -9.871  -4.720
  299    HA   LEU  42           HA       LEU  42  -3.779  -9.913  -5.513
  300    HB2  LEU  42          2HB       LEU  42  -2.131 -11.730  -6.024
  301    HB3  LEU  42          1HB       LEU  42  -2.152 -12.173  -4.324
  302    HG   LEU  42           HG       LEU  42  -4.642 -12.484  -4.496
  303   HD11  LEU  42          1HD1      LEU  42  -5.252 -12.933  -7.035
  304   HD12  LEU  42          2HD1      LEU  42  -3.972 -11.757  -7.319
  305   HD13  LEU  42          3HD1      LEU  42  -5.377 -11.314  -6.353
  306   HD21  LEU  42          1HD2      LEU  42  -2.963 -14.357  -4.679
  307   HD22  LEU  42          2HD2      LEU  42  -3.038 -14.182  -6.432
  308   HD23  LEU  42          3HD2      LEU  42  -4.474 -14.670  -5.533
  309    H    LYS  43           H        LYS  43  -2.155 -10.479  -2.399
  310    HA   LYS  43           HA       LYS  43  -4.554 -11.195  -0.984
  311    HB2  LYS  43          2HB       LYS  43  -1.899 -10.143  -0.010
  312    HB3  LYS  43          1HB       LYS  43  -3.163 -10.770   1.040
  313    HG2  LYS  43          2HG       LYS  43  -3.084 -12.926  -0.219
  314    HG3  LYS  43          1HG       LYS  43  -1.727 -12.292  -1.151
  315    HD2  LYS  43          2HD       LYS  43  -0.477 -11.947   0.986
  316    HD3  LYS  43          1HD       LYS  43  -1.807 -12.718   1.851
  317    HE2  LYS  43          2HE       LYS  43  -1.457 -14.800   0.704
  318    HE3  LYS  43          1HE       LYS  43  -0.325 -14.056  -0.425
  319    HZ1  LYS  43          1HZ       LYS  43   1.069 -15.041   1.097
  320    HZ2  LYS  43          2HZ       LYS  43   0.052 -14.715   2.419
  321    HZ3  LYS  43          3HZ       LYS  43   0.962 -13.465   1.716
  322    H    VAL  44           H        VAL  44  -2.780  -8.087  -1.236
  323    HA   VAL  44           HA       VAL  44  -4.593  -6.725   0.542
  324    HB   VAL  44           HB       VAL  44  -3.498  -4.656  -0.400
  325   HG11  VAL  44          1HG1      VAL  44  -1.562  -6.825   0.438
  326   HG12  VAL  44          2HG1      VAL  44  -2.649  -6.010   1.562
  327   HG13  VAL  44          3HG1      VAL  44  -1.406  -5.091   0.714
  328   HG21  VAL  44          1HG2      VAL  44  -1.290  -5.914  -1.656
  329   HG22  VAL  44          2HG2      VAL  44  -2.460  -4.817  -2.388
  330   HG23  VAL  44          3HG2      VAL  44  -2.743  -6.557  -2.418
  331    H    ILE  45           H        ILE  45  -4.398  -6.874  -3.023
  332    HA   ILE  45           HA       ILE  45  -6.402  -4.943  -3.557
  333    HB   ILE  45           HB       ILE  45  -5.229  -7.243  -5.035
  334   HG12  ILE  45          2HG1      ILE  45  -4.734  -5.536  -6.653
  335   HG13  ILE  45          1HG1      ILE  45  -5.888  -4.424  -5.921
  336   HG21  ILE  45          1HG2      ILE  45  -6.893  -6.749  -6.915
  337   HG22  ILE  45          2HG2      ILE  45  -7.906  -6.009  -5.677
  338   HG23  ILE  45          3HG2      ILE  45  -7.489  -7.719  -5.569
  339   HD11  ILE  45          1HD1      ILE  45  -4.479  -3.892  -4.176
  340   HD12  ILE  45          2HD1      ILE  45  -3.270  -4.275  -5.400
  341   HD13  ILE  45          3HD1      ILE  45  -3.703  -5.474  -4.185
  342    H    ALA  46           H        ALA  46  -6.746  -8.476  -3.121
  343    HA   ALA  46           HA       ALA  46  -9.568  -8.538  -3.505
  344    HB1  ALA  46          1HB       ALA  46  -9.165 -10.587  -1.762
  345    HB2  ALA  46          2HB       ALA  46  -7.520 -10.332  -2.344
  346    HB3  ALA  46          3HB       ALA  46  -8.814 -10.690  -3.487
  347    H    TRP  47           H        TRP  47  -7.632  -8.006  -0.562
  348    HA   TRP  47           HA       TRP  47  -9.987  -7.922   1.149
  349    HB2  TRP  47          2HB       TRP  47  -8.180  -8.470   2.446
  350    HB3  TRP  47          1HB       TRP  47  -7.060  -7.517   1.474
  351    HD1  TRP  47           HD       TRP  47  -9.677  -7.148   4.253
  352    HE1  TRP  47          1HE       TRP  47  -9.257  -4.916   5.476
  353    HE3  TRP  47          3HE       TRP  47  -6.034  -5.179   1.276
  354    HZ2  TRP  47          2HZ       TRP  47  -7.584  -2.604   5.225
  355    HZ3  TRP  47          3HZ       TRP  47  -5.039  -2.973   1.785
  356    HH2  TRP  47           HH       TRP  47  -5.809  -1.684   3.752
  357    H    LEU  48           H        LEU  48  -7.737  -5.436  -0.097
  358    HA   LEU  48           HA       LEU  48  -9.055  -3.211   1.062
  359    HB2  LEU  48          2HB       LEU  48  -6.793  -3.191  -0.030
  360    HB3  LEU  48          1HB       LEU  48  -7.596  -3.277  -1.588
  361    HG   LEU  48           HG       LEU  48  -8.918  -1.194  -0.724
  362   HD11  LEU  48          1HD1      LEU  48  -7.462  -1.671   1.522
  363   HD12  LEU  48          2HD1      LEU  48  -8.101  -0.086   1.092
  364   HD13  LEU  48          3HD1      LEU  48  -6.431  -0.498   0.707
  365   HD21  LEU  48          1HD2      LEU  48  -6.625   0.133  -1.331
  366   HD22  LEU  48          2HD2      LEU  48  -7.644  -0.645  -2.544
  367   HD23  LEU  48          3HD2      LEU  48  -6.221  -1.480  -1.920
  368    H    GLU  49           H        GLU  49  -9.512  -4.700  -2.159
  369    HA   GLU  49           HA       GLU  49 -11.553  -2.853  -2.969
  370    HB2  GLU  49          2HB       GLU  49 -10.782  -5.626  -3.883
  371    HB3  GLU  49          1HB       GLU  49 -12.134  -4.758  -4.592
  372    HG2  GLU  49          2HG       GLU  49  -9.659  -4.550  -5.579
  373    HG3  GLU  49          1HG       GLU  49 -10.789  -3.199  -5.606
  374    H    ASP  50           H        ASP  50 -11.635  -5.974  -1.288
  375    HA   ASP  50           HA       ASP  50 -14.470  -6.318  -1.321
  376    HB2  ASP  50          2HB       ASP  50 -12.828  -8.081  -0.661
  377    HB3  ASP  50          1HB       ASP  50 -12.537  -7.190   0.832
  378    H    ARG  51           H        ARG  51 -12.317  -4.589   0.889
  379    HA   ARG  51           HA       ARG  51 -14.206  -3.973   2.908
  380    HB2  ARG  51          2HB       ARG  51 -11.797  -2.438   1.901
  381    HB3  ARG  51          1HB       ARG  51 -12.695  -2.003   3.349
  382    HG2  ARG  51          2HG       ARG  51 -11.692  -4.813   3.031
  383    HG3  ARG  51          1HG       ARG  51 -10.575  -3.550   3.546
  384    HD2  ARG  51          2HD       ARG  51 -13.199  -4.244   4.907
  385    HD3  ARG  51          1HD       ARG  51 -11.592  -4.662   5.496
  386    HE   ARG  51           HE       ARG  51 -12.845  -2.028   5.660
  387   HH11  ARG  51          1HH1      ARG  51 -11.625  -0.454   6.730
  388   HH12  ARG  51          2HH1      ARG  51  -9.944  -0.742   7.038
  389   HH21  ARG  51          1HH2      ARG  51  -9.936  -3.875   5.553
  390   HH22  ARG  51          2HH2      ARG  51  -8.988  -2.678   6.371
  391    H    PHE  52           H        PHE  52 -13.485  -2.318  -0.155
  392    HA   PHE  52           HA       PHE  52 -15.586  -0.320   0.452
  393    HB2  PHE  52          2HB       PHE  52 -13.549  -0.567  -1.773
  394    HB3  PHE  52          1HB       PHE  52 -14.790   0.682  -1.734
  395    HD1  PHE  52          1HD       PHE  52 -14.863   2.307   0.188
  396    HD2  PHE  52          2HD       PHE  52 -11.607  -0.432  -0.392
  397    HE1  PHE  52          1HE       PHE  52 -13.455   3.659   1.716
  398    HE2  PHE  52          2HE       PHE  52 -10.198   0.919   1.138
  399    HZ   PHE  52           HZ       PHE  52 -11.122   2.965   2.193
  400    H    GLY  53           H        GLY  53 -15.535  -3.373  -0.792
  401    HA2  GLY  53          2HA       GLY  53 -17.185  -4.557  -1.989
  402    HA3  GLY  53          1HA       GLY  53 -18.147  -3.076  -2.009
  403    H    ILE  54           H        ILE  54 -14.853  -3.451  -3.238
  404    HA   ILE  54           HA       ILE  54 -15.854  -2.586  -5.911
  405    HB   ILE  54           HB       ILE  54 -13.024  -2.612  -4.818
  406   HG12  ILE  54          2HG1      ILE  54 -14.827  -0.213  -5.206
  407   HG13  ILE  54          1HG1      ILE  54 -14.720  -1.067  -3.666
  408   HG21  ILE  54          1HG2      ILE  54 -14.314  -1.618  -7.354
  409   HG22  ILE  54          2HG2      ILE  54 -12.862  -2.601  -7.167
  410   HG23  ILE  54          3HG2      ILE  54 -12.825  -0.887  -6.755
  411   HD11  ILE  54          1HD1      ILE  54 -13.147   0.785  -3.623
  412   HD12  ILE  54          2HD1      ILE  54 -12.443   0.271  -5.156
  413   HD13  ILE  54          3HD1      ILE  54 -12.233  -0.722  -3.713
  414    H    ALA  55           H        ALA  55 -15.218  -3.758  -7.794
  415    HA   ALA  55           HA       ALA  55 -14.519  -6.586  -7.258
  416    HB1  ALA  55          1HB       ALA  55 -14.790  -6.025 -10.057
  417    HB2  ALA  55          2HB       ALA  55 -16.111  -5.228  -9.202
  418    HB3  ALA  55          3HB       ALA  55 -15.867  -6.966  -9.026
  419    H    ALA  56           H        ALA  56 -12.412  -7.224  -7.420
  420    HA   ALA  56           HA       ALA  56 -10.324  -5.433  -8.193
  421    HB1  ALA  56          1HB       ALA  56  -9.709  -7.207  -6.742
  422    HB2  ALA  56          2HB       ALA  56  -8.940  -7.601  -8.279
  423    HB3  ALA  56          3HB       ALA  56 -10.423  -8.425  -7.799
  424    H    ASP  57           H        ASP  57 -12.012  -7.996  -9.965
  425    HA   ASP  57           HA       ASP  57 -10.364  -7.983 -12.290
  426    HB2  ASP  57          2HB       ASP  57 -13.301  -8.610 -11.960
  427    HB3  ASP  57          1HB       ASP  57 -12.388  -8.921 -13.435
  428    H    ASP  58           H        ASP  58 -13.135  -5.974 -11.371
  429    HA   ASP  58           HA       ASP  58 -13.591  -4.706 -13.852
  430    HB2  ASP  58          2HB       ASP  58 -13.866  -3.655 -11.038
  431    HB3  ASP  58          1HB       ASP  58 -14.446  -2.786 -12.458
  432    H    VAL  59           H        VAL  59 -11.186  -3.976 -11.353
  433    HA   VAL  59           HA       VAL  59  -9.995  -1.973 -13.234
  434    HB   VAL  59           HB       VAL  59  -9.763  -2.045 -10.224
  435   HG11  VAL  59          1HG1      VAL  59  -9.195   0.496 -11.365
  436   HG12  VAL  59          2HG1      VAL  59  -8.285  -0.703 -12.285
  437   HG13  VAL  59          3HG1      VAL  59  -8.078  -0.588 -10.537
  438   HG21  VAL  59          1HG2      VAL  59 -11.090   0.280 -11.239
  439   HG22  VAL  59          2HG2      VAL  59 -11.729  -0.949 -10.148
  440   HG23  VAL  59          3HG2      VAL  59 -11.895  -1.146 -11.892
  441    H    GLU  60           H        GLU  60  -7.901  -2.315 -13.848
  442    HA   GLU  60           HA       GLU  60  -6.477  -4.616 -12.578
  443    HB2  GLU  60          2HB       GLU  60  -6.958  -4.810 -15.020
  444    HB3  GLU  60          1HB       GLU  60  -5.997  -3.360 -15.294
  445    HG2  GLU  60          2HG       GLU  60  -4.052  -4.482 -14.256
  446    HG3  GLU  60          1HG       GLU  60  -5.015  -5.943 -14.073
  447    H    LEU  61           H        LEU  61  -4.470  -4.261 -11.668
  448    HA   LEU  61           HA       LEU  61  -3.517  -1.440 -11.651
  449    HB2  LEU  61          2HB       LEU  61  -2.766  -3.661  -9.736
  450    HB3  LEU  61          1HB       LEU  61  -2.479  -1.934  -9.540
  451    HG   LEU  61           HG       LEU  61  -5.149  -3.340  -9.555
  452   HD11  LEU  61          1HD1      LEU  61  -5.317  -2.417  -7.281
  453   HD12  LEU  61          2HD1      LEU  61  -3.732  -1.666  -7.462
  454   HD13  LEU  61          3HD1      LEU  61  -3.877  -3.424  -7.436
  455   HD21  LEU  61          1HD2      LEU  61  -5.602  -1.335 -10.699
  456   HD22  LEU  61          2HD2      LEU  61  -4.403  -0.430  -9.776
  457   HD23  LEU  61          3HD2      LEU  61  -5.922  -0.908  -9.018
  458    H    SER  62           H        SER  62  -1.315  -0.998 -12.088
  459    HA   SER  62           HA       SER  62   0.165  -3.242 -13.386
  460    HB2  SER  62          2HB       SER  62  -0.425  -0.560 -14.246
  461    HB3  SER  62          1HB       SER  62   1.320  -0.752 -14.097
  462    HG   SER  62           HG       SER  62   0.795  -1.485 -16.104
  463    HA   PRO  63           HA       PRO  63   3.424  -2.956 -10.456
  464    HB2  PRO  63          2HB       PRO  63   5.661  -2.945 -12.099
  465    HB3  PRO  63          1HB       PRO  63   4.751  -4.395 -11.637
  466    HG2  PRO  63          2HG       PRO  63   4.674  -2.831 -14.154
  467    HG3  PRO  63          1HG       PRO  63   4.491  -4.573 -13.895
  468    HD2  PRO  63          2HD       PRO  63   2.374  -2.925 -14.400
  469    HD3  PRO  63          1HD       PRO  63   2.233  -4.403 -13.427
  470    H    GLU  64           H        GLU  64   3.586  -0.665 -13.132
  471    HA   GLU  64           HA       GLU  64   5.542   1.098 -12.031
  472    HB2  GLU  64          2HB       GLU  64   4.716   1.174 -14.388
  473    HB3  GLU  64          1HB       GLU  64   3.200   1.831 -13.792
  474    HG2  GLU  64          2HG       GLU  64   4.454   3.712 -12.770
  475    HG3  GLU  64          1HG       GLU  64   5.931   3.078 -13.485
  476    H    HIS  65           H        HIS  65   2.126   0.679 -11.403
  477    HA   HIS  65           HA       HIS  65   1.698   3.196 -10.075
  478    HB2  HIS  65          2HB       HIS  65  -0.185   1.858 -10.856
  479    HB3  HIS  65          1HB       HIS  65   0.271   0.538  -9.779
  480    HD1  HIS  65          1HD       HIS  65  -0.934   0.537  -7.604
  481    HD2  HIS  65          2HD       HIS  65  -0.670   4.383  -9.199
  482    HE1  HIS  65          1HE       HIS  65  -2.173   2.063  -6.006
  483    HE2  HIS  65          2HE       HIS  65  -2.011   4.406  -6.962
  484    H    PHE  66           H        PHE  66   3.115   0.166  -9.046
  485    HA   PHE  66           HA       PHE  66   3.050   1.057  -6.215
  486    HB2  PHE  66          2HB       PHE  66   3.895  -1.556  -7.500
  487    HB3  PHE  66          1HB       PHE  66   3.973  -1.231  -5.769
  488    HD1  PHE  66          1HD       PHE  66   1.902  -0.799  -4.471
  489    HD2  PHE  66          2HD       PHE  66   1.789  -1.958  -8.603
  490    HE1  PHE  66          1HE       PHE  66  -0.505  -1.345  -4.248
  491    HE2  PHE  66          2HE       PHE  66  -0.616  -2.510  -8.380
  492    HZ   PHE  66           HZ       PHE  66  -1.766  -2.199  -6.205
  493    H    ARG  67           H        ARG  67   4.919   1.815  -8.717
  494    HA   ARG  67           HA       ARG  67   7.575   1.150  -8.019
  495    HB2  ARG  67          2HB       ARG  67   6.886   2.321 -10.122
  496    HB3  ARG  67          1HB       ARG  67   6.608   3.783  -9.182
  497    HG2  ARG  67          2HG       ARG  67   8.781   4.110  -9.987
  498    HG3  ARG  67          1HG       ARG  67   9.073   3.432  -8.390
  499    HD2  ARG  67          2HD       ARG  67   9.344   1.186  -9.387
  500    HD3  ARG  67          1HD       ARG  67   9.050   1.867 -10.986
  501    HE   ARG  67           HE       ARG  67  11.537   2.041  -9.489
  502   HH11  ARG  67          1HH1      ARG  67  13.207   3.188 -10.491
  503   HH12  ARG  67          2HH1      ARG  67  12.845   4.227 -11.829
  504   HH21  ARG  67          1HH2      ARG  67   9.447   3.543 -11.782
  505   HH22  ARG  67          2HH2      ARG  67  10.717   4.428 -12.560
  506    H    SER  68           H        SER  68   5.507   3.802  -6.847
  507    HA   SER  68           HA       SER  68   7.470   4.190  -4.620
  508    HB2  SER  68          2HB       SER  68   5.881   6.352  -6.030
  509    HB3  SER  68          1HB       SER  68   6.954   6.597  -4.656
  510    HG   SER  68           HG       SER  68   8.307   5.241  -6.461
  511    H    ILE  69           H        ILE  69   6.535   4.555  -2.569
  512    HA   ILE  69           HA       ILE  69   3.955   3.440  -2.097
  513    HB   ILE  69           HB       ILE  69   5.583   5.287  -0.330
  514   HG12  ILE  69          2HG1      ILE  69   5.508   2.267  -0.445
  515   HG13  ILE  69          1HG1      ILE  69   6.800   3.257  -1.105
  516   HG21  ILE  69          1HG2      ILE  69   3.000   4.155  -0.038
  517   HG22  ILE  69          2HG2      ILE  69   3.940   5.035   1.167
  518   HG23  ILE  69          3HG2      ILE  69   4.086   3.282   1.040
  519   HD11  ILE  69          1HD1      ILE  69   7.408   2.462   1.138
  520   HD12  ILE  69          2HD1      ILE  69   5.940   3.183   1.797
  521   HD13  ILE  69          3HD1      ILE  69   7.211   4.214   1.139
  522    H    ARG  70           H        ARG  70   5.073   6.798  -2.376
  523    HA   ARG  70           HA       ARG  70   2.650   8.068  -1.588
  524    HB2  ARG  70          2HB       ARG  70   4.775   8.990  -3.547
  525    HB3  ARG  70          1HB       ARG  70   3.519  10.022  -2.864
  526    HG2  ARG  70          2HG       ARG  70   4.358   9.450  -0.577
  527    HG3  ARG  70          1HG       ARG  70   5.682   8.556  -1.327
  528    HD2  ARG  70          2HD       ARG  70   5.104  11.515  -1.666
  529    HD3  ARG  70          1HD       ARG  70   6.438  10.812  -0.751
  530    HE   ARG  70           HE       ARG  70   6.536   9.839  -3.441
  531   HH11  ARG  70          1HH1      ARG  70   8.064  10.745  -4.840
  532   HH12  ARG  70          2HH1      ARG  70   8.758  12.286  -4.463
  533   HH21  ARG  70          1HH2      ARG  70   6.963  12.671  -1.521
  534   HH22  ARG  70          2HH2      ARG  70   8.135  13.377  -2.585
  535    H    SER  71           H        SER  71   3.710   6.812  -4.737
  536    HA   SER  71           HA       SER  71   1.661   7.934  -6.335
  537    HB2  SER  71          2HB       SER  71   2.905   5.186  -6.635
  538    HB3  SER  71          1HB       SER  71   2.129   6.132  -7.900
  539    HG   SER  71           HG       SER  71   3.832   7.774  -7.067
  540    H    ILE  72           H        ILE  72   1.677   5.004  -4.327
  541    HA   ILE  72           HA       ILE  72  -0.860   3.999  -5.152
  542    HB   ILE  72           HB       ILE  72   0.489   3.749  -2.447
  543   HG12  ILE  72          2HG1      ILE  72   0.685   1.937  -4.872
  544   HG13  ILE  72          1HG1      ILE  72   1.926   3.101  -4.406
  545   HG21  ILE  72          1HG2      ILE  72  -1.926   3.049  -2.621
  546   HG22  ILE  72          2HG2      ILE  72  -0.823   1.738  -2.206
  547   HG23  ILE  72          3HG2      ILE  72  -1.438   1.887  -3.851
  548   HD11  ILE  72          1HD1      ILE  72   1.866   1.939  -2.094
  549   HD12  ILE  72          2HD1      ILE  72   2.651   1.081  -3.418
  550   HD13  ILE  72          3HD1      ILE  72   1.018   0.635  -2.925
  551    H    ASP  73           H        ASP  73   0.079   6.234  -2.541
  552    HA   ASP  73           HA       ASP  73  -2.483   6.499  -1.346
  553    HB2  ASP  73          2HB       ASP  73  -0.286   7.391  -0.451
  554    HB3  ASP  73          1HB       ASP  73  -0.439   8.717  -1.605
  555    H    ALA  74           H        ALA  74  -1.050   8.200  -4.122
  556    HA   ALA  74           HA       ALA  74  -3.164  10.113  -4.412
  557    HB1  ALA  74          1HB       ALA  74  -1.173   8.973  -6.383
  558    HB2  ALA  74          2HB       ALA  74  -1.104  10.533  -5.561
  559    HB3  ALA  74          3HB       ALA  74  -2.317  10.247  -6.809
  560    H    PHE  75           H        PHE  75  -2.645   6.933  -5.951
  561    HA   PHE  75           HA       PHE  75  -5.016   7.018  -7.549
  562    HB2  PHE  75          2HB       PHE  75  -3.162   5.380  -7.868
  563    HB3  PHE  75          1HB       PHE  75  -3.666   4.577  -6.385
  564    HD1  PHE  75          1HD       PHE  75  -4.686   5.437  -9.841
  565    HD2  PHE  75          2HD       PHE  75  -5.619   3.176  -6.310
  566    HE1  PHE  75          1HE       PHE  75  -6.400   4.167 -11.106
  567    HE2  PHE  75          2HE       PHE  75  -7.333   1.908  -7.575
  568    HZ   PHE  75           HZ       PHE  75  -7.724   2.403  -9.974
  569    H    VAL  76           H        VAL  76  -4.411   5.626  -4.319
  570    HA   VAL  76           HA       VAL  76  -7.078   4.693  -3.910
  571    HB   VAL  76           HB       VAL  76  -4.883   5.489  -1.983
  572   HG11  VAL  76          1HG1      VAL  76  -6.291   4.104  -0.362
  573   HG12  VAL  76          2HG1      VAL  76  -7.612   4.284  -1.515
  574   HG13  VAL  76          3HG1      VAL  76  -6.907   5.708  -0.751
  575   HG21  VAL  76          1HG2      VAL  76  -4.775   2.983  -1.712
  576   HG22  VAL  76          2HG2      VAL  76  -4.332   3.544  -3.324
  577   HG23  VAL  76          3HG2      VAL  76  -5.926   2.843  -3.040
  578    H    VAL  77           H        VAL  77  -5.472   7.771  -3.061
  579    HA   VAL  77           HA       VAL  77  -7.624   8.918  -1.618
  580    HB   VAL  77           HB       VAL  77  -5.455  10.160  -3.322
  581   HG11  VAL  77          1HG1      VAL  77  -7.715  11.362  -1.782
  582   HG12  VAL  77          2HG1      VAL  77  -6.969  11.903  -3.285
  583   HG13  VAL  77          3HG1      VAL  77  -6.151  12.176  -1.746
  584   HG21  VAL  77          1HG2      VAL  77  -5.631  10.430  -0.358
  585   HG22  VAL  77          2HG2      VAL  77  -4.209  10.257  -1.387
  586   HG23  VAL  77          3HG2      VAL  77  -5.186   8.844  -0.990
  587    H    GLY  78           H        GLY  78  -6.901   8.929  -5.095
  588    HA2  GLY  78          2HA       GLY  78  -8.974  10.695  -5.900
  589    HA3  GLY  78          1HA       GLY  78  -8.252   9.461  -6.930
  590    H    ALA  79           H        ALA  79  -9.078   7.243  -5.118
  591    HA   ALA  79           HA       ALA  79 -11.934   7.191  -5.961
  592    HB1  ALA  79          1HB       ALA  79 -10.779   4.675  -5.010
  593    HB2  ALA  79          2HB       ALA  79  -9.906   5.368  -6.378
  594    HB3  ALA  79          3HB       ALA  79 -11.630   5.023  -6.515
  595    H    THR  80           H        THR  80  -9.879   6.217  -3.209
  596    HA   THR  80           HA       THR  80 -12.267   6.625  -1.454
  597    HB   THR  80           HB       THR  80 -11.742   4.678  -0.189
  598    HG1  THR  80          1HG       THR  80  -9.799   3.847  -0.141
  599   HG21  THR  80          1HG2      THR  80 -12.305   3.075  -1.726
  600   HG22  THR  80          2HG2      THR  80 -11.031   3.554  -2.847
  601   HG23  THR  80          3HG2      THR  80 -12.525   4.487  -2.759
  602    H    THR  81           H        THR  81 -11.714   7.266   0.752
  603    HA   THR  81           HA       THR  81  -8.914   8.185   1.118
  604    HB   THR  81           HB       THR  81 -10.238  10.073   0.194
  605    HG1  THR  81          1HG       THR  81  -9.837  11.463   2.094
  606   HG21  THR  81          1HG2      THR  81 -12.289   9.050   1.700
  607   HG22  THR  81          2HG2      THR  81 -12.270  10.675   1.012
  608   HG23  THR  81          3HG2      THR  81 -11.776  10.421   2.686
  609    HA   PRO  82           HA       PRO  82 -10.521   6.009   4.866
  610    HB2  PRO  82          2HB       PRO  82  -7.669   5.496   5.343
  611    HB3  PRO  82          1HB       PRO  82  -9.001   4.343   5.179
  612    HG2  PRO  82          2HG       PRO  82  -7.068   4.665   3.314
  613    HG3  PRO  82          1HG       PRO  82  -8.714   4.127   2.940
  614    HD2  PRO  82          2HD       PRO  82  -7.460   6.800   2.495
  615    HD3  PRO  82          1HD       PRO  82  -8.713   5.964   1.550
  616    HA   PRO  83           HA       PRO  83  -9.758   9.173   7.854
  617    HB2  PRO  83          2HB       PRO  83  -9.351   7.625  10.142
  618    HB3  PRO  83          1HB       PRO  83 -10.929   8.114   9.501
  619    HG2  PRO  83          2HG       PRO  83  -9.498   5.531   9.242
  620    HG3  PRO  83          1HG       PRO  83 -11.234   5.858   9.367
  621    HD2  PRO  83          2HD       PRO  83 -10.050   5.198   7.011
  622    HD3  PRO  83          1HD       PRO  83 -11.460   6.278   7.096
  623    H    VAL  84           H        VAL  84  -8.012  10.220   8.964
  624    HA   VAL  84           HA       VAL  84  -5.367   8.997   8.400
  625    HB   VAL  84           HB       VAL  84  -6.049  11.795   9.352
  626   HG11  VAL  84          1HG1      VAL  84  -3.580  10.338   9.121
  627   HG12  VAL  84          2HG1      VAL  84  -3.828  12.005   9.641
  628   HG13  VAL  84          3HG1      VAL  84  -3.594  11.640   7.931
  629   HG21  VAL  84          1HG2      VAL  84  -6.667  10.720   6.909
  630   HG22  VAL  84          2HG2      VAL  84  -5.046  11.345   6.609
  631   HG23  VAL  84          3HG2      VAL  84  -6.318  12.426   7.178
  632    H    GLU  85           H        GLU  85  -4.142   8.158   9.999
  633    HA   GLU  85           HA       GLU  85  -4.686   8.970  12.808
  634    HB2  GLU  85          2HB       GLU  85  -4.333   6.119  11.828
  635    HB3  GLU  85          1HB       GLU  85  -4.481   6.609  13.517
  636    HG2  GLU  85          2HG       GLU  85  -6.717   7.579  13.012
  637    HG3  GLU  85          1HG       GLU  85  -6.573   6.993  11.354
  638    H    ALA  86           H        ALA  86  -2.795   8.263  14.251
  639    HA   ALA  86           HA       ALA  86  -0.351   9.259  13.255
  640    HB1  ALA  86          1HB       ALA  86  -1.046   8.768  15.701
  641    HB2  ALA  86          2HB       ALA  86   0.641   8.492  15.265
  642    HB3  ALA  86          3HB       ALA  86  -0.471   7.130  15.393
  643    H    LYS  87           H        LYS  87   1.384   8.303  12.197
  644    HA   LYS  87           HA       LYS  87   0.944   5.992  10.608
  645    HB2  LYS  87          2HB       LYS  87   2.668   7.761  10.159
  646    HB3  LYS  87          1HB       LYS  87   3.631   7.092  11.477
  647    HG2  LYS  87          2HG       LYS  87   3.690   4.907  10.322
  648    HG3  LYS  87          1HG       LYS  87   2.748   5.588   8.996
  649    HD2  LYS  87          2HD       LYS  87   4.548   7.278   8.633
  650    HD3  LYS  87          1HD       LYS  87   5.504   6.484   9.884
  651    HE2  LYS  87          2HE       LYS  87   4.591   5.297   7.250
  652    HE3  LYS  87          1HE       LYS  87   6.249   5.617   7.759
  653    HZ1  LYS  87          1HZ       LYS  87   6.192   3.486   8.397
  654    HZ2  LYS  87          2HZ       LYS  87   4.496   3.422   8.442
  655    HZ3  LYS  87          3HZ       LYS  87   5.360   4.071   9.754
  656    H    LEU  88           H        LEU  88   2.429   6.364  13.797
  657    HA   LEU  88           HA       LEU  88   3.552   3.767  14.044
  658    HB2  LEU  88          2HB       LEU  88   2.254   5.434  16.224
  659    HB3  LEU  88          1HB       LEU  88   3.412   4.125  16.465
  660    HG   LEU  88           HG       LEU  88   3.938   6.733  15.009
  661   HD11  LEU  88          1HD1      LEU  88   4.508   5.679  17.745
  662   HD12  LEU  88          2HD1      LEU  88   4.140   7.326  17.230
  663   HD13  LEU  88          3HD1      LEU  88   5.754   6.660  16.972
  664   HD21  LEU  88          1HD2      LEU  88   5.312   5.219  13.883
  665   HD22  LEU  88          2HD2      LEU  88   5.485   4.174  15.293
  666   HD23  LEU  88          3HD2      LEU  88   6.359   5.703  15.216
  667    H    GLN  89           H        GLN  89   0.235   4.915  14.489
  668    HA   GLN  89           HA       GLN  89  -0.601   2.150  15.209
  669    HB2  GLN  89          2HB       GLN  89  -2.111   4.781  15.274
  670    HB3  GLN  89          1HB       GLN  89  -2.795   3.221  15.735
  671    HG2  GLN  89          2HG       GLN  89  -1.099   2.975  17.494
  672    HG3  GLN  89          1HG       GLN  89  -0.368   4.508  17.019
  673   HE21  GLN  89          1HE2      GLN  89  -1.389   4.147  19.660
  674   HE22  GLN  89          2HE2      GLN  89  -2.754   5.137  19.854
  675    H1   PN7 101          3HO       SAT 101   2.134  -9.318 -12.602
  676    H2   PN7 101          1H1       SAT 101   4.356  -7.718 -10.204
  677    H3   PN7 101          2H1       SAT 101   2.894  -8.460  -9.559
  678    H5   PN7 101          1HE1      SAT 101   2.582  -6.664 -13.389
  679    H6   PN7 101          2HE1      SAT 101   3.654  -8.023 -13.049
  680    H7   PN7 101          3HE1      SAT 101   4.107  -6.394 -12.546
  681    H8   PN7 101          2HE2      SAT 101   1.995  -5.226 -11.327
  682    H9   PN7 101          3HE2      SAT 101   3.354  -5.599 -10.275
  683    H10  PN7 101          1HE2      SAT 101   1.721  -6.063  -9.800
  684    H11  PN7 101          3H        SAT 101   0.913  -8.486 -10.688
  685    H12  PN7 101          5H        SAT 101   0.713  -5.295 -12.966
  686    H13  PN7 101          1H6       SAT 101  -0.429  -7.759 -14.199
  687    H14  PN7 101          2H6       SAT 101  -1.280  -6.225 -14.379
  688    H15  PN7 101          1H7       SAT 101   1.265  -5.545 -15.157
  689    H16  PN7 101          2H7       SAT 101  -0.032  -5.992 -16.265
  690    H17  PN7 101          9H        SAT 101   0.332  -7.849 -17.536
  691    H18  PN7 101          1H10      SAT 101   1.421 -10.124 -15.989
  692    H19  PN7 101          2H10      SAT 101   0.432 -10.245 -17.444
  693    H20  PN7 101          1H11      SAT 101   2.264 -10.361 -18.753
  694    H21  PN7 101          2H11      SAT 101   3.232 -10.474 -17.284
  695    H22  PN7 101          2HS1      SAT 101   3.049  -8.033 -19.081
  Start of MODEL    4
    1    H1   MET   1          1HT       MET   1   2.501  11.442   2.729
    2    H2   MET   1          2HT       MET   1   2.089  10.497   1.379
    3    H3   MET   1          3HT       MET   1   1.173  10.390   2.805
    4    HA   MET   1           HA       MET   1   1.355  13.058   1.729
    5    HB2  MET   1          2HB       MET   1  -0.103  10.863   0.225
    6    HB3  MET   1          1HB       MET   1  -0.276  12.590  -0.084
    7    HG2  MET   1          2HG       MET   1   2.198  12.696  -0.511
    8    HG3  MET   1          1HG       MET   1   2.246  10.939  -0.377
    9    HE1  MET   1          1HE       MET   1  -0.550  13.357  -2.219
   10    HE2  MET   1          2HE       MET   1   0.501  13.594  -3.613
   11    HE3  MET   1          3HE       MET   1   1.080  14.008  -2.002
   12    H    GLN   2           H        GLN   2  -1.613  12.549   1.049
   13    HA   GLN   2           HA       GLN   2  -2.695  13.342   3.558
   14    HB2  GLN   2          2HB       GLN   2  -4.066  12.042   1.185
   15    HB3  GLN   2          1HB       GLN   2  -4.904  12.825   2.525
   16    HG2  GLN   2          2HG       GLN   2  -3.767  14.947   2.008
   17    HG3  GLN   2          1HG       GLN   2  -2.911  14.168   0.676
   18   HE21  GLN   2          1HE2      GLN   2  -4.608  16.375   0.140
   19   HE22  GLN   2          2HE2      GLN   2  -5.972  15.830  -0.710
   20    H    HIS   3           H        HIS   3  -2.415  10.137   2.051
   21    HA   HIS   3           HA       HIS   3  -2.978   8.948   4.719
   22    HB2  HIS   3          2HB       HIS   3  -4.233   7.897   2.170
   23    HB3  HIS   3          1HB       HIS   3  -4.544   7.353   3.818
   24    HD1  HIS   3          1HD       HIS   3  -5.736   9.153   5.431
   25    HD2  HIS   3          2HD       HIS   3  -5.799  10.062   1.360
   26    HE1  HIS   3          1HE       HIS   3  -7.491  10.955   5.124
   27    HE2  HIS   3          2HE       HIS   3  -7.538  11.514   2.651
   28    H    ALA   4           H        ALA   4  -0.716   9.309   2.550
   29    HA   ALA   4           HA       ALA   4   0.005   6.723   1.616
   30    HB1  ALA   4          1HB       ALA   4   1.026   9.074   1.085
   31    HB2  ALA   4          2HB       ALA   4   2.075   7.656   1.054
   32    HB3  ALA   4          3HB       ALA   4   2.081   8.727   2.455
   33    H    SER   5           H        SER   5   0.534   8.283   4.748
   34    HA   SER   5           HA       SER   5   2.469   6.448   5.749
   35    HB2  SER   5          2HB       SER   5   1.853   7.245   7.952
   36    HB3  SER   5          1HB       SER   5   1.799   8.613   6.844
   37    HG   SER   5           HG       SER   5  -0.546   7.221   6.953
   38    H    VAL   6           H        VAL   6  -1.066   6.281   5.623
   39    HA   VAL   6           HA       VAL   6  -1.302   3.907   7.242
   40    HB   VAL   6           HB       VAL   6  -3.091   5.024   5.071
   41   HG11  VAL   6          1HG1      VAL   6  -4.804   3.531   6.330
   42   HG12  VAL   6          2HG1      VAL   6  -3.385   2.670   6.928
   43   HG13  VAL   6          3HG1      VAL   6  -3.703   2.751   5.194
   44   HG21  VAL   6          1HG2      VAL   6  -3.576   6.523   6.691
   45   HG22  VAL   6          2HG2      VAL   6  -2.649   5.622   7.891
   46   HG23  VAL   6          3HG2      VAL   6  -4.328   5.189   7.567
   47    H    ILE   7           H        ILE   7  -0.880   4.475   3.773
   48    HA   ILE   7           HA       ILE   7  -1.150   1.762   2.934
   49    HB   ILE   7           HB       ILE   7   0.560   3.980   1.767
   50   HG12  ILE   7          2HG1      ILE   7  -2.231   3.045   1.022
   51   HG13  ILE   7          1HG1      ILE   7  -1.894   4.468   2.010
   52   HG21  ILE   7          1HG2      ILE   7  -0.393   1.322   0.662
   53   HG22  ILE   7          2HG2      ILE   7   1.273   1.865   0.855
   54   HG23  ILE   7          3HG2      ILE   7   0.233   2.623  -0.351
   55   HD11  ILE   7          1HD1      ILE   7  -1.987   4.345  -0.802
   56   HD12  ILE   7          2HD1      ILE   7  -0.281   4.515  -0.389
   57   HD13  ILE   7          3HD1      ILE   7  -1.450   5.702   0.187
   58    H    ALA   8           H        ALA   8   1.762   3.651   3.770
   59    HA   ALA   8           HA       ALA   8   3.589   1.454   3.525
   60    HB1  ALA   8          1HB       ALA   8   4.127   3.584   5.537
   61    HB2  ALA   8          2HB       ALA   8   3.937   4.096   3.861
   62    HB3  ALA   8          3HB       ALA   8   5.186   2.927   4.290
   63    H    GLN   9           H        GLN   9   1.960   2.873   6.352
   64    HA   GLN   9           HA       GLN   9   2.981   1.018   8.271
   65    HB2  GLN   9          2HB       GLN   9   1.852   3.168   8.840
   66    HB3  GLN   9          1HB       GLN   9   0.324   2.481   8.292
   67    HG2  GLN   9          2HG       GLN   9   1.329   0.565  10.048
   68    HG3  GLN   9          1HG       GLN   9   1.713   2.100  10.824
   69   HE21  GLN   9          1HE2      GLN   9  -1.034   0.393   9.241
   70   HE22  GLN   9          2HE2      GLN   9  -2.234   1.125  10.197
   71    H    PHE  10           H        PHE  10  -0.006   1.027   6.362
   72    HA   PHE  10           HA       PHE  10  -1.015  -1.451   7.430
   73    HB2  PHE  10          2HB       PHE  10  -2.408   0.284   6.276
   74    HB3  PHE  10          1HB       PHE  10  -1.628  -0.156   4.758
   75    HD1  PHE  10          1HD       PHE  10  -2.180  -2.195   3.605
   76    HD2  PHE  10          2HD       PHE  10  -3.848  -1.349   7.470
   77    HE1  PHE  10          1HE       PHE  10  -3.793  -4.056   3.315
   78    HE2  PHE  10          2HE       PHE  10  -5.461  -3.211   7.183
   79    HZ   PHE  10           HZ       PHE  10  -5.434  -4.563   5.105
   80    H    VAL  11           H        VAL  11   0.661  -0.630   4.406
   81    HA   VAL  11           HA       VAL  11   0.800  -3.327   3.431
   82    HB   VAL  11           HB       VAL  11   2.551  -0.924   2.832
   83   HG11  VAL  11          1HG1      VAL  11   3.825  -2.375   1.676
   84   HG12  VAL  11          2HG1      VAL  11   2.432  -2.674   0.636
   85   HG13  VAL  11          3HG1      VAL  11   2.723  -3.704   2.038
   86   HG21  VAL  11          1HG2      VAL  11   0.415  -2.041   1.039
   87   HG22  VAL  11          2HG2      VAL  11   1.044  -0.395   1.133
   88   HG23  VAL  11          3HG2      VAL  11  -0.050  -0.994   2.380
   89    H    VAL  12           H        VAL  12   3.138  -1.309   5.216
   90    HA   VAL  12           HA       VAL  12   5.217  -3.272   5.296
   91    HB   VAL  12           HB       VAL  12   4.598  -1.029   7.225
   92   HG11  VAL  12          1HG1      VAL  12   6.136  -2.217   8.442
   93   HG12  VAL  12          2HG1      VAL  12   7.258  -1.359   7.389
   94   HG13  VAL  12          3HG1      VAL  12   6.797  -3.021   7.021
   95   HG21  VAL  12          1HG2      VAL  12   5.713   0.381   5.807
   96   HG22  VAL  12          2HG2      VAL  12   5.213  -0.793   4.589
   97   HG23  VAL  12          3HG2      VAL  12   6.833  -0.876   5.282
   98    H    GLU  13           H        GLU  13   2.461  -2.632   7.413
   99    HA   GLU  13           HA       GLU  13   3.144  -4.297   9.580
  100    HB2  GLU  13          2HB       GLU  13   1.165  -2.791   9.517
  101    HB3  GLU  13          1HB       GLU  13   0.388  -3.912   8.408
  102    HG2  GLU  13          2HG       GLU  13   0.608  -5.710  10.116
  103    HG3  GLU  13          1HG       GLU  13   1.280  -4.522  11.229
  104    H    GLU  14           H        GLU  14   1.936  -5.147   6.389
  105    HA   GLU  14           HA       GLU  14   1.189  -7.848   7.009
  106    HB2  GLU  14          2HB       GLU  14   2.126  -6.600   4.410
  107    HB3  GLU  14          1HB       GLU  14   1.451  -8.222   4.544
  108    HG2  GLU  14          2HG       GLU  14  -0.624  -7.254   5.511
  109    HG3  GLU  14          1HG       GLU  14   0.050  -5.639   5.293
  110    H    PHE  15           H        PHE  15   4.266  -6.305   6.319
  111    HA   PHE  15           HA       PHE  15   5.633  -8.802   7.113
  112    HB2  PHE  15          2HB       PHE  15   7.079  -8.855   5.166
  113    HB3  PHE  15          1HB       PHE  15   5.407  -8.874   4.609
  114    HD1  PHE  15          1HD       PHE  15   4.337  -6.674   3.891
  115    HD2  PHE  15          2HD       PHE  15   8.560  -7.116   4.519
  116    HE1  PHE  15          1HE       PHE  15   4.747  -4.623   2.560
  117    HE2  PHE  15          2HE       PHE  15   8.973  -5.064   3.191
  118    HZ   PHE  15           HZ       PHE  15   7.066  -3.817   2.210
  119    H    LEU  16           H        LEU  16   5.465  -6.548   8.674
  120    HA   LEU  16           HA       LEU  16   7.709  -4.785   8.145
  121    HB2  LEU  16          2HB       LEU  16   7.037  -3.563  10.025
  122    HB3  LEU  16          1HB       LEU  16   5.531  -4.189   9.390
  123    HG   LEU  16           HG       LEU  16   7.102  -5.440  11.662
  124   HD11  LEU  16          1HD1      LEU  16   5.198  -3.254  11.554
  125   HD12  LEU  16          2HD1      LEU  16   6.137  -3.850  12.923
  126   HD13  LEU  16          3HD1      LEU  16   4.583  -4.587  12.532
  127   HD21  LEU  16          1HD2      LEU  16   4.605  -6.154  10.153
  128   HD22  LEU  16          2HD2      LEU  16   4.674  -6.508  11.877
  129   HD23  LEU  16          3HD2      LEU  16   5.859  -7.218  10.786
  130    HA   PRO  17           HA       PRO  17  10.691  -7.403  10.174
  131    HB2  PRO  17          2HB       PRO  17  12.734  -5.602  10.409
  132    HB3  PRO  17          1HB       PRO  17  12.294  -6.351   8.865
  133    HG2  PRO  17          2HG       PRO  17  11.624  -3.647   9.910
  134    HG3  PRO  17          1HG       PRO  17  12.084  -4.142   8.275
  135    HD2  PRO  17          2HD       PRO  17   9.496  -3.657   9.028
  136    HD3  PRO  17          1HD       PRO  17   9.944  -4.779   7.726
  137    H    ASP  18           H        ASP  18  12.582  -6.218  12.054
  138    HA   ASP  18           HA       ASP  18  10.846  -6.088  14.402
  139    HB2  ASP  18          2HB       ASP  18  13.842  -5.881  14.058
  140    HB3  ASP  18          1HB       ASP  18  13.031  -5.863  15.618
  141    H    VAL  19           H        VAL  19  11.233  -3.907  12.164
  142    HA   VAL  19           HA       VAL  19  11.727  -1.612  14.022
  143    HB   VAL  19           HB       VAL  19  11.862  -1.661  10.996
  144   HG11  VAL  19          1HG1      VAL  19  13.260   0.472  11.594
  145   HG12  VAL  19          2HG1      VAL  19  12.396   0.394  13.129
  146   HG13  VAL  19          3HG1      VAL  19  11.499   0.568  11.620
  147   HG21  VAL  19          1HG2      VAL  19  13.876  -2.649  11.251
  148   HG22  VAL  19          2HG2      VAL  19  13.735  -2.581  13.008
  149   HG23  VAL  19          3HG2      VAL  19  14.411  -1.212  12.124
  150    H    ALA  20           H        ALA  20  10.097  -0.106  14.275
  151    HA   ALA  20           HA       ALA  20   7.449  -0.771  13.300
  152    HB1  ALA  20          1HB       ALA  20   6.785   0.598  14.966
  153    HB2  ALA  20          2HB       ALA  20   7.715   1.944  14.309
  154    HB3  ALA  20          3HB       ALA  20   8.489   0.777  15.381
  155    HA   PRO  21           HA       PRO  21   7.599   1.278   9.316
  156    HB2  PRO  21          2HB       PRO  21   4.931   2.389  10.052
  157    HB3  PRO  21          1HB       PRO  21   5.420   1.498   8.599
  158    HG2  PRO  21          2HG       PRO  21   3.976   0.379  10.568
  159    HG3  PRO  21          1HG       PRO  21   5.126  -0.532   9.580
  160    HD2  PRO  21          2HD       PRO  21   5.342   0.279  12.417
  161    HD3  PRO  21          1HD       PRO  21   6.160  -1.036  11.541
  162    H    ALA  22           H        ALA  22   6.612   3.043  12.206
  163    HA   ALA  22           HA       ALA  22   6.883   5.693  11.125
  164    HB1  ALA  22          1HB       ALA  22   6.131   6.253  13.174
  165    HB2  ALA  22          2HB       ALA  22   7.563   5.558  13.936
  166    HB3  ALA  22          3HB       ALA  22   6.163   4.540  13.596
  167    H    ASP  23           H        ASP  23   9.165   3.325  12.219
  168    HA   ASP  23           HA       ASP  23  11.340   5.337  12.366
  169    HB2  ASP  23          2HB       ASP  23  11.263   2.374  12.999
  170    HB3  ASP  23          1HB       ASP  23  12.717   3.366  13.112
  171    H    VAL  24           H        VAL  24   9.806   3.715  10.007
  172    HA   VAL  24           HA       VAL  24  12.288   3.119   8.462
  173    HB   VAL  24           HB       VAL  24   9.414   2.356   7.848
  174   HG11  VAL  24          1HG1      VAL  24  12.050   1.425   6.666
  175   HG12  VAL  24          2HG1      VAL  24  10.911   2.519   5.879
  176   HG13  VAL  24          3HG1      VAL  24  10.448   0.848   6.203
  177   HG21  VAL  24          1HG2      VAL  24  10.535   0.017   8.407
  178   HG22  VAL  24          2HG2      VAL  24   9.882   1.027   9.697
  179   HG23  VAL  24          3HG2      VAL  24  11.617   1.014   9.379
  180    H    ASP  25           H        ASP  25  12.736   4.350   6.644
  181    HA   ASP  25           HA       ASP  25  11.338   6.861   6.345
  182    HB2  ASP  25          2HB       ASP  25  13.771   6.510   5.824
  183    HB3  ASP  25          1HB       ASP  25  13.285   5.570   4.413
  184    H    VAL  26           H        VAL  26   9.180   6.494   5.776
  185    HA   VAL  26           HA       VAL  26   8.292   4.619   3.810
  186    HB   VAL  26           HB       VAL  26   6.201   5.854   3.822
  187   HG11  VAL  26          1HG1      VAL  26   6.705   6.436   6.596
  188   HG12  VAL  26          2HG1      VAL  26   7.555   4.956   6.148
  189   HG13  VAL  26          3HG1      VAL  26   5.814   5.082   5.899
  190   HG21  VAL  26          1HG2      VAL  26   6.431   8.112   3.715
  191   HG22  VAL  26          2HG2      VAL  26   8.018   8.071   4.485
  192   HG23  VAL  26          3HG2      VAL  26   6.557   8.042   5.472
  193    H    ASP  27           H        ASP  27  10.414   7.011   3.273
  194    HA   ASP  27           HA       ASP  27   9.257   7.951   0.710
  195    HB2  ASP  27          2HB       ASP  27  11.833   8.654   2.153
  196    HB3  ASP  27          1HB       ASP  27  11.332   9.354   0.612
  197    H    LEU  28           H        LEU  28  10.646   5.214   1.653
  198    HA   LEU  28           HA       LEU  28  12.636   4.975  -0.524
  199    HB2  LEU  28          2HB       LEU  28  13.096   4.019   1.737
  200    HB3  LEU  28          1HB       LEU  28  11.743   2.916   1.513
  201    HG   LEU  28           HG       LEU  28  13.698   2.964  -0.709
  202   HD11  LEU  28          1HD1      LEU  28  14.424   2.172   2.103
  203   HD12  LEU  28          2HD1      LEU  28  15.390   3.046   0.913
  204   HD13  LEU  28          3HD1      LEU  28  15.125   1.311   0.733
  205   HD21  LEU  28          1HD2      LEU  28  13.103   0.710  -0.877
  206   HD22  LEU  28          2HD2      LEU  28  11.636   1.397  -0.186
  207   HD23  LEU  28          3HD2      LEU  28  12.790   0.560   0.851
  208    H    ASP  29           H        ASP  29  12.233   3.886  -2.409
  209    HA   ASP  29           HA       ASP  29   9.544   3.311  -3.172
  210    HB2  ASP  29          2HB       ASP  29  12.183   2.384  -4.350
  211    HB3  ASP  29          1HB       ASP  29  10.618   2.135  -5.124
  212    H    LEU  30           H        LEU  30   8.324   1.603  -2.529
  213    HA   LEU  30           HA       LEU  30   9.464  -0.549  -0.985
  214    HB2  LEU  30          2HB       LEU  30   7.213  -1.446  -0.905
  215    HB3  LEU  30          1HB       LEU  30   7.110   0.306  -0.735
  216    HG   LEU  30           HG       LEU  30   7.030  -0.137  -3.501
  217   HD11  LEU  30          1HD1      LEU  30   5.095  -1.726  -3.686
  218   HD12  LEU  30          2HD1      LEU  30   5.334  -2.151  -1.993
  219   HD13  LEU  30          3HD1      LEU  30   6.591  -2.507  -3.178
  220   HD21  LEU  30          1HD2      LEU  30   4.824   0.352  -1.477
  221   HD22  LEU  30          2HD2      LEU  30   4.640   0.568  -3.218
  222   HD23  LEU  30          3HD2      LEU  30   5.771   1.578  -2.317
  223    H    VAL  31           H        VAL  31   9.967  -0.017  -4.095
  224    HA   VAL  31           HA       VAL  31   9.160  -2.269  -5.561
  225    HB   VAL  31           HB       VAL  31  10.509  -0.228  -6.357
  226   HG11  VAL  31          1HG1      VAL  31  12.891  -0.349  -6.257
  227   HG12  VAL  31          2HG1      VAL  31  12.852  -2.010  -5.663
  228   HG13  VAL  31          3HG1      VAL  31  12.330  -0.687  -4.619
  229   HG21  VAL  31          1HG2      VAL  31  10.016  -1.868  -7.986
  230   HG22  VAL  31          2HG2      VAL  31  11.034  -3.076  -7.202
  231   HG23  VAL  31          3HG2      VAL  31  11.773  -1.724  -8.059
  232    H    ASP  32           H        ASP  32  11.844  -1.947  -3.272
  233    HA   ASP  32           HA       ASP  32  13.088  -4.458  -3.742
  234    HB2  ASP  32          2HB       ASP  32  12.750  -2.899  -1.158
  235    HB3  ASP  32          1HB       ASP  32  13.811  -4.297  -1.336
  236    H    ASN  33           H        ASN  33  10.256  -3.546  -1.870
  237    HA   ASN  33           HA       ASN  33   9.801  -6.293  -0.933
  238    HB2  ASN  33          2HB       ASN  33   8.044  -3.843  -0.711
  239    HB3  ASN  33          1HB       ASN  33   7.839  -5.353   0.173
  240   HD21  ASN  33          1HD2      ASN  33   8.859  -2.326   0.716
  241   HD22  ASN  33          2HD2      ASN  33  10.105  -2.601   1.834
  242    H    GLY  34           H        GLY  34   9.683  -5.176  -3.853
  243    HA2  GLY  34          2HA       GLY  34   7.172  -5.187  -4.975
  244    HA3  GLY  34          1HA       GLY  34   8.543  -5.970  -5.760
  245    H    VAL  35           H        VAL  35   8.567  -7.748  -3.167
  246    HA   VAL  35           HA       VAL  35   7.352 -10.038  -4.284
  247    HB   VAL  35           HB       VAL  35   8.888  -9.840  -2.205
  248   HG11  VAL  35          1HG1      VAL  35   7.129  -8.298  -1.118
  249   HG12  VAL  35          2HG1      VAL  35   7.849  -9.547  -0.102
  250   HG13  VAL  35          3HG1      VAL  35   6.236  -9.779  -0.778
  251   HG21  VAL  35          1HG2      VAL  35   6.513 -11.692  -2.457
  252   HG22  VAL  35          2HG2      VAL  35   7.707 -11.898  -1.176
  253   HG23  VAL  35          3HG2      VAL  35   8.198 -12.016  -2.866
  254    H    ILE  36           H        ILE  36   6.002  -7.454  -2.337
  255    HA   ILE  36           HA       ILE  36   3.425  -8.676  -1.874
  256    HB   ILE  36           HB       ILE  36   4.550  -6.651  -0.688
  257   HG12  ILE  36          2HG1      ILE  36   1.641  -6.725  -1.523
  258   HG13  ILE  36          1HG1      ILE  36   2.355  -7.355  -0.040
  259   HG21  ILE  36          1HG2      ILE  36   4.754  -5.489  -2.996
  260   HG22  ILE  36          2HG2      ILE  36   4.215  -4.511  -1.630
  261   HG23  ILE  36          3HG2      ILE  36   3.041  -5.116  -2.799
  262   HD11  ILE  36          1HD1      ILE  36   1.602  -4.587  -0.731
  263   HD12  ILE  36          2HD1      ILE  36   3.165  -4.758   0.070
  264   HD13  ILE  36          3HD1      ILE  36   1.704  -5.366   0.849
  265    H    ASP  37           H        ASP  37   4.843  -6.924  -4.516
  266    HA   ASP  37           HA       ASP  37   2.546  -5.876  -5.770
  267    HB2  ASP  37          2HB       ASP  37   5.076  -6.960  -7.029
  268    HB3  ASP  37          1HB       ASP  37   3.865  -6.006  -7.882
  269    H    SER  38           H        SER  38   3.799  -9.202  -5.874
  270    HA   SER  38           HA       SER  38   1.595  -9.875  -7.761
  271    HB2  SER  38          2HB       SER  38   4.311 -10.824  -7.414
  272    HB3  SER  38          1HB       SER  38   3.164 -12.156  -7.354
  273    H    LEU  39           H        LEU  39   3.172 -11.575  -5.035
  274    HA   LEU  39           HA       LEU  39   0.830 -13.144  -4.517
  275    HB2  LEU  39          2HB       LEU  39   3.172 -13.805  -3.912
  276    HB3  LEU  39          1HB       LEU  39   3.120 -12.598  -2.633
  277    HG   LEU  39           HG       LEU  39   0.828 -14.466  -2.680
  278   HD11  LEU  39          1HD1      LEU  39   2.372 -16.124  -1.372
  279   HD12  LEU  39          2HD1      LEU  39   3.674 -15.358  -2.282
  280   HD13  LEU  39          3HD1      LEU  39   2.365 -16.177  -3.135
  281   HD21  LEU  39          1HD2      LEU  39   1.115 -12.815  -0.894
  282   HD22  LEU  39          2HD2      LEU  39   2.728 -13.437  -0.547
  283   HD23  LEU  39          3HD2      LEU  39   1.310 -14.436  -0.228
  284    H    GLY  40           H        GLY  40   2.226 -10.344  -2.819
  285    HA2  GLY  40          2HA       GLY  40   0.124 -10.235  -0.849
  286    HA3  GLY  40          1HA       GLY  40   1.269  -8.948  -1.194
  287    H    LEU  41           H        LEU  41   0.643  -8.580  -3.945
  288    HA   LEU  41           HA       LEU  41  -1.517  -6.750  -3.766
  289    HB2  LEU  41          2HB       LEU  41   0.253  -6.753  -5.548
  290    HB3  LEU  41          1HB       LEU  41  -0.539  -8.151  -6.273
  291    HG   LEU  41           HG       LEU  41  -2.297  -5.828  -5.696
  292   HD11  LEU  41          1HD1      LEU  41  -0.213  -5.788  -7.902
  293   HD12  LEU  41          2HD1      LEU  41  -0.285  -4.687  -6.525
  294   HD13  LEU  41          3HD1      LEU  41  -1.553  -4.651  -7.751
  295   HD21  LEU  41          1HD2      LEU  41  -2.699  -8.126  -6.985
  296   HD22  LEU  41          2HD2      LEU  41  -2.022  -7.221  -8.336
  297   HD23  LEU  41          3HD2      LEU  41  -3.476  -6.640  -7.526
  298    H    LEU  42           H        LEU  42  -1.414 -10.130  -4.825
  299    HA   LEU  42           HA       LEU  42  -4.127 -10.274  -5.725
  300    HB2  LEU  42          2HB       LEU  42  -2.373 -12.034  -6.128
  301    HB3  LEU  42          1HB       LEU  42  -2.505 -12.486  -4.435
  302    HG   LEU  42           HG       LEU  42  -5.056 -12.708  -4.938
  303   HD11  LEU  42          1HD1      LEU  42  -4.235 -11.805  -7.402
  304   HD12  LEU  42          2HD1      LEU  42  -5.738 -12.675  -7.099
  305   HD13  LEU  42          3HD1      LEU  42  -4.309 -13.547  -7.653
  306   HD21  LEU  42          1HD2      LEU  42  -4.415 -15.038  -6.096
  307   HD22  LEU  42          2HD2      LEU  42  -4.080 -14.728  -4.392
  308   HD23  LEU  42          3HD2      LEU  42  -2.797 -14.550  -5.589
  309    H    LYS  43           H        LYS  43  -2.639 -10.874  -2.545
  310    HA   LYS  43           HA       LYS  43  -5.118 -11.543  -1.235
  311    HB2  LYS  43          2HB       LYS  43  -2.487 -10.539  -0.140
  312    HB3  LYS  43          1HB       LYS  43  -3.810 -11.146   0.849
  313    HG2  LYS  43          2HG       LYS  43  -3.700 -13.305  -0.399
  314    HG3  LYS  43          1HG       LYS  43  -2.293 -12.693  -1.269
  315    HD2  LYS  43          2HD       LYS  43  -1.136 -12.361   0.921
  316    HD3  LYS  43          1HD       LYS  43  -2.518 -13.107   1.726
  317    HE2  LYS  43          2HE       LYS  43  -2.145 -15.201   0.621
  318    HE3  LYS  43          1HE       LYS  43  -0.970 -14.483  -0.480
  319    HZ1  LYS  43          1HZ       LYS  43   0.223 -15.621   1.204
  320    HZ2  LYS  43          2HZ       LYS  43  -0.682 -14.890   2.443
  321    HZ3  LYS  43          3HZ       LYS  43   0.397 -13.962   1.515
  322    H    VAL  44           H        VAL  44  -3.275  -8.533  -1.613
  323    HA   VAL  44           HA       VAL  44  -4.897  -6.930   0.115
  324    HB   VAL  44           HB       VAL  44  -3.199  -6.194  -2.280
  325   HG11  VAL  44          1HG1      VAL  44  -4.605  -4.479  -0.220
  326   HG12  VAL  44          2HG1      VAL  44  -4.797  -4.421  -1.971
  327   HG13  VAL  44          3HG1      VAL  44  -3.287  -3.888  -1.230
  328   HG21  VAL  44          1HG2      VAL  44  -2.455  -7.158   0.182
  329   HG22  VAL  44          2HG2      VAL  44  -2.431  -5.417   0.461
  330   HG23  VAL  44          3HG2      VAL  44  -1.448  -6.116  -0.826
  331    H    ILE  45           H        ILE  45  -5.044  -7.456  -3.409
  332    HA   ILE  45           HA       ILE  45  -7.240  -5.709  -3.893
  333    HB   ILE  45           HB       ILE  45  -5.915  -7.956  -5.313
  334   HG12  ILE  45          2HG1      ILE  45  -5.760  -6.319  -7.073
  335   HG13  ILE  45          1HG1      ILE  45  -6.978  -5.300  -6.308
  336   HG21  ILE  45          1HG2      ILE  45  -8.139  -8.735  -5.637
  337   HG22  ILE  45          2HG2      ILE  45  -7.753  -7.813  -7.088
  338   HG23  ILE  45          3HG2      ILE  45  -8.764  -7.098  -5.834
  339   HD11  ILE  45          1HD1      ILE  45  -5.509  -4.485  -4.737
  340   HD12  ILE  45          2HD1      ILE  45  -4.350  -4.841  -6.015
  341   HD13  ILE  45          3HD1      ILE  45  -4.572  -5.977  -4.687
  342    H    ALA  46           H        ALA  46  -7.156  -9.203  -3.187
  343    HA   ALA  46           HA       ALA  46  -9.986  -9.599  -3.316
  344    HB1  ALA  46          1HB       ALA  46  -7.696 -11.062  -2.035
  345    HB2  ALA  46          2HB       ALA  46  -8.750 -11.584  -3.350
  346    HB3  ALA  46          3HB       ALA  46  -9.353 -11.562  -1.692
  347    H    TRP  47           H        TRP  47  -7.828  -8.758  -0.615
  348    HA   TRP  47           HA       TRP  47  -9.973  -8.775   1.344
  349    HB2  TRP  47          2HB       TRP  47  -7.953  -9.078   2.410
  350    HB3  TRP  47          1HB       TRP  47  -7.088  -8.017   1.299
  351    HD1  TRP  47           HD       TRP  47  -9.313  -7.936   4.408
  352    HE1  TRP  47          1HE       TRP  47  -9.082  -5.621   5.522
  353    HE3  TRP  47          3HE       TRP  47  -6.514  -5.537   0.882
  354    HZ2  TRP  47          2HZ       TRP  47  -7.864  -3.086   4.982
  355    HZ3  TRP  47          3HZ       TRP  47  -5.829  -3.180   1.203
  356    HH2  TRP  47           HH       TRP  47  -6.499  -1.955   3.244
  357    H    LEU  48           H        LEU  48  -8.307  -6.256  -0.533
  358    HA   LEU  48           HA       LEU  48  -9.491  -4.002   0.693
  359    HB2  LEU  48          2HB       LEU  48  -7.640  -3.967  -1.012
  360    HB3  LEU  48          1HB       LEU  48  -8.837  -4.315  -2.248
  361    HG   LEU  48           HG       LEU  48 -10.079  -2.240  -1.268
  362   HD11  LEU  48          1HD1      LEU  48  -7.409  -1.144  -0.688
  363   HD12  LEU  48          2HD1      LEU  48  -7.992  -2.313   0.494
  364   HD13  LEU  48          3HD1      LEU  48  -8.940  -0.869   0.141
  365   HD21  LEU  48          1HD2      LEU  48  -7.810  -2.482  -3.154
  366   HD22  LEU  48          2HD2      LEU  48  -8.179  -0.839  -2.630
  367   HD23  LEU  48          3HD2      LEU  48  -9.421  -1.815  -3.416
  368    H    GLU  49           H        GLU  49 -10.670  -6.000  -2.016
  369    HA   GLU  49           HA       GLU  49 -13.038  -4.458  -2.485
  370    HB2  GLU  49          2HB       GLU  49 -12.379  -5.987  -4.190
  371    HB3  GLU  49          1HB       GLU  49 -12.303  -7.332  -3.067
  372    HG2  GLU  49          2HG       GLU  49 -14.735  -7.262  -2.786
  373    HG3  GLU  49          1HG       GLU  49 -14.833  -5.872  -3.855
  374    H    ASP  50           H        ASP  50 -12.356  -7.202  -0.348
  375    HA   ASP  50           HA       ASP  50 -15.062  -7.567   0.530
  376    HB2  ASP  50          2HB       ASP  50 -13.188  -9.214   0.811
  377    HB3  ASP  50          1HB       ASP  50 -12.540  -8.166   2.070
  378    H    ARG  51           H        ARG  51 -12.349  -5.732   1.929
  379    HA   ARG  51           HA       ARG  51 -13.836  -4.854   4.227
  380    HB2  ARG  51          2HB       ARG  51 -11.358  -4.913   4.126
  381    HB3  ARG  51          1HB       ARG  51 -11.395  -3.575   2.975
  382    HG2  ARG  51          2HG       ARG  51 -12.540  -2.162   4.632
  383    HG3  ARG  51          1HG       ARG  51 -12.536  -3.496   5.784
  384    HD2  ARG  51          2HD       ARG  51 -10.050  -3.530   5.693
  385    HD3  ARG  51          1HD       ARG  51 -10.091  -2.133   4.617
  386    HE   ARG  51           HE       ARG  51 -11.495  -1.167   6.708
  387   HH11  ARG  51          1HH1      ARG  51 -10.656  -0.325   8.625
  388   HH12  ARG  51          2HH1      ARG  51  -9.119  -0.877   9.201
  389   HH21  ARG  51          1HH2      ARG  51  -8.617  -3.070   6.567
  390   HH22  ARG  51          2HH2      ARG  51  -7.967  -2.428   8.037
  391    H    PHE  52           H        PHE  52 -13.096  -3.168   1.132
  392    HA   PHE  52           HA       PHE  52 -14.919  -0.995   2.026
  393    HB2  PHE  52          2HB       PHE  52 -12.930  -1.134  -0.251
  394    HB3  PHE  52          1HB       PHE  52 -13.930   0.263   0.128
  395    HD1  PHE  52          1HD       PHE  52 -13.637   1.479   2.283
  396    HD2  PHE  52          2HD       PHE  52 -11.009  -1.700   1.085
  397    HE1  PHE  52          1HE       PHE  52 -11.984   2.205   3.983
  398    HE2  PHE  52          2HE       PHE  52  -9.355  -0.974   2.784
  399    HZ   PHE  52           HZ       PHE  52  -9.843   0.978   4.234
  400    H    GLY  53           H        GLY  53 -15.085  -3.783   0.132
  401    HA2  GLY  53          2HA       GLY  53 -16.808  -4.508  -1.317
  402    HA3  GLY  53          1HA       GLY  53 -17.678  -3.031  -0.903
  403    H    ILE  54           H        ILE  54 -14.414  -2.890  -2.142
  404    HA   ILE  54           HA       ILE  54 -15.459  -1.476  -4.540
  405    HB   ILE  54           HB       ILE  54 -12.628  -1.679  -3.466
  406   HG12  ILE  54          2HG1      ILE  54 -14.567   0.644  -3.290
  407   HG13  ILE  54          1HG1      ILE  54 -14.329  -0.514  -1.982
  408   HG21  ILE  54          1HG2      ILE  54 -13.932  -0.184  -5.732
  409   HG22  ILE  54          2HG2      ILE  54 -12.426  -1.102  -5.733
  410   HG23  ILE  54          3HG2      ILE  54 -12.498   0.473  -4.943
  411   HD11  ILE  54          1HD1      ILE  54 -12.909   1.466  -1.643
  412   HD12  ILE  54          2HD1      ILE  54 -12.173   1.215  -3.225
  413   HD13  ILE  54          3HD1      ILE  54 -11.919   0.037  -1.938
  414    H    ALA  55           H        ALA  55 -14.951  -2.179  -6.637
  415    HA   ALA  55           HA       ALA  55 -14.598  -4.970  -7.049
  416    HB1  ALA  55          1HB       ALA  55 -15.536  -4.014  -8.919
  417    HB2  ALA  55          2HB       ALA  55 -13.851  -4.001  -9.443
  418    HB3  ALA  55          3HB       ALA  55 -14.578  -2.539  -8.773
  419    H    ALA  56           H        ALA  56 -12.774  -6.152  -7.784
  420    HA   ALA  56           HA       ALA  56 -10.305  -5.572  -6.553
  421    HB1  ALA  56          1HB       ALA  56 -10.472  -7.800  -7.176
  422    HB2  ALA  56          2HB       ALA  56  -9.452  -7.194  -8.481
  423    HB3  ALA  56          3HB       ALA  56 -11.181  -7.415  -8.743
  424    H    ASP  57           H        ASP  57 -11.538  -4.656  -9.720
  425    HA   ASP  57           HA       ASP  57 -10.646  -3.248 -11.369
  426    HB2  ASP  57          2HB       ASP  57  -9.203  -2.173  -8.938
  427    HB3  ASP  57          1HB       ASP  57  -9.244  -1.371 -10.506
  428    H    ASP  58           H        ASP  58  -9.415  -5.758 -11.230
  429    HA   ASP  58           HA       ASP  58  -6.499  -5.257 -11.363
  430    HB2  ASP  58          2HB       ASP  58  -6.294  -7.687 -11.566
  431    HB3  ASP  58          1HB       ASP  58  -7.350  -7.295 -10.209
  432    H    VAL  59           H        VAL  59  -8.847  -4.567 -13.391
  433    HA   VAL  59           HA       VAL  59  -8.321  -5.968 -15.802
  434    HB   VAL  59           HB       VAL  59  -9.267  -3.139 -15.336
  435   HG11  VAL  59          1HG1      VAL  59  -9.101  -4.789 -17.870
  436   HG12  VAL  59          2HG1      VAL  59  -8.363  -3.216 -17.567
  437   HG13  VAL  59          3HG1      VAL  59 -10.115  -3.354 -17.714
  438   HG21  VAL  59          1HG2      VAL  59 -11.104  -5.125 -16.455
  439   HG22  VAL  59          2HG2      VAL  59 -11.328  -4.044 -15.080
  440   HG23  VAL  59          3HG2      VAL  59 -10.497  -5.584 -14.864
  441    H    GLU  60           H        GLU  60  -6.797  -3.055 -14.449
  442    HA   GLU  60           HA       GLU  60  -4.716  -3.279 -16.593
  443    HB2  GLU  60          2HB       GLU  60  -5.533  -0.834 -15.003
  444    HB3  GLU  60          1HB       GLU  60  -4.330  -0.881 -16.290
  445    HG2  GLU  60          2HG       GLU  60  -6.097  -1.720 -17.830
  446    HG3  GLU  60          1HG       GLU  60  -7.274  -1.479 -16.547
  447    H    LEU  61           H        LEU  61  -2.686  -3.726 -15.917
  448    HA   LEU  61           HA       LEU  61  -2.082  -3.420 -13.008
  449    HB2  LEU  61          2HB       LEU  61  -0.728  -5.466 -14.741
  450    HB3  LEU  61          1HB       LEU  61  -0.992  -5.491 -13.001
  451    HG   LEU  61           HG       LEU  61  -3.129  -5.825 -15.116
  452   HD11  LEU  61          1HD1      LEU  61  -1.807  -7.766 -13.209
  453   HD12  LEU  61          2HD1      LEU  61  -1.766  -7.808 -14.972
  454   HD13  LEU  61          3HD1      LEU  61  -3.275  -8.130 -14.118
  455   HD21  LEU  61          1HD2      LEU  61  -3.252  -5.184 -12.267
  456   HD22  LEU  61          2HD2      LEU  61  -4.110  -6.673 -12.649
  457   HD23  LEU  61          3HD2      LEU  61  -4.542  -5.175 -13.471
  458    H    SER  62           H        SER  62  -0.071  -2.488 -12.511
  459    HA   SER  62           HA       SER  62   1.913  -2.072 -14.629
  460    HB2  SER  62          2HB       SER  62  -0.087  -0.130 -14.240
  461    HB3  SER  62          1HB       SER  62   1.361   0.518 -13.474
  462    HG   SER  62           HG       SER  62   2.461  -0.060 -15.467
  463    HA   PRO  63           HA       PRO  63   3.960  -2.648 -10.557
  464    HB2  PRO  63          2HB       PRO  63   6.386  -2.446 -12.242
  465    HB3  PRO  63          1HB       PRO  63   5.916  -3.710 -11.097
  466    HG2  PRO  63          2HG       PRO  63   5.842  -4.047 -13.767
  467    HG3  PRO  63          1HG       PRO  63   4.742  -4.872 -12.654
  468    HD2  PRO  63          2HD       PRO  63   4.187  -2.625 -14.514
  469    HD3  PRO  63          1HD       PRO  63   3.088  -3.863 -13.875
  470    H    GLU  64           H        GLU  64   4.391  -0.210 -12.990
  471    HA   GLU  64           HA       GLU  64   6.235   1.502 -11.658
  472    HB2  GLU  64          2HB       GLU  64   3.988   2.163 -13.560
  473    HB3  GLU  64          1HB       GLU  64   5.250   3.289 -13.085
  474    HG2  GLU  64          2HG       GLU  64   6.947   1.716 -13.965
  475    HG3  GLU  64          1HG       GLU  64   5.652   0.654 -14.505
  476    H    HIS  65           H        HIS  65   2.786   1.002 -11.294
  477    HA   HIS  65           HA       HIS  65   2.251   3.378  -9.756
  478    HB2  HIS  65          2HB       HIS  65   0.478   2.086 -10.877
  479    HB3  HIS  65          1HB       HIS  65   0.784   0.728  -9.795
  480    HD1  HIS  65          1HD       HIS  65  -0.180   0.845  -7.437
  481    HD2  HIS  65          2HD       HIS  65  -0.679   4.402  -9.560
  482    HE1  HIS  65          1HE       HIS  65  -1.730   2.297  -6.052
  483    HE2  HIS  65          2HE       HIS  65  -2.039   4.463  -7.335
  484    H    PHE  66           H        PHE  66   3.555   0.238  -8.889
  485    HA   PHE  66           HA       PHE  66   3.159   0.833  -6.009
  486    HB2  PHE  66          2HB       PHE  66   4.208  -1.628  -7.428
  487    HB3  PHE  66          1HB       PHE  66   4.014  -1.486  -5.681
  488    HD1  PHE  66          1HD       PHE  66   1.752  -1.202  -4.683
  489    HD2  PHE  66          2HD       PHE  66   2.308  -1.918  -8.882
  490    HE1  PHE  66          1HE       PHE  66  -0.645  -1.801  -4.898
  491    HE2  PHE  66          2HE       PHE  66  -0.089  -2.517  -9.097
  492    HZ   PHE  66           HZ       PHE  66  -1.566  -2.457  -7.105
  493    H    ARG  67           H        ARG  67   5.420   1.765  -8.176
  494    HA   ARG  67           HA       ARG  67   7.899   0.978  -7.019
  495    HB2  ARG  67          2HB       ARG  67   7.150   3.532  -8.466
  496    HB3  ARG  67          1HB       ARG  67   8.802   3.068  -8.067
  497    HG2  ARG  67          2HG       ARG  67   7.022   1.182  -9.573
  498    HG3  ARG  67          1HG       ARG  67   7.878   2.465 -10.425
  499    HD2  ARG  67          2HD       ARG  67  10.010   1.615  -9.348
  500    HD3  ARG  67          1HD       ARG  67   9.085   0.228  -8.775
  501    HE   ARG  67           HE       ARG  67   8.537   0.160 -11.434
  502   HH11  ARG  67          1HH1      ARG  67   9.849  -0.778 -13.017
  503   HH12  ARG  67          2HH1      ARG  67  11.558  -0.886 -12.753
  504   HH21  ARG  67          1HH2      ARG  67  11.441   0.622  -9.634
  505   HH22  ARG  67          2HH2      ARG  67  12.459  -0.094 -10.838
  506    H    SER  68           H        SER  68   5.702   3.642  -6.172
  507    HA   SER  68           HA       SER  68   7.321   4.000  -3.682
  508    HB2  SER  68          2HB       SER  68   7.759   5.859  -5.278
  509    HB3  SER  68          1HB       SER  68   6.037   6.223  -5.293
  510    HG   SER  68           HG       SER  68   7.026   5.992  -2.771
  511    H    ILE  69           H        ILE  69   6.125   4.285  -1.810
  512    HA   ILE  69           HA       ILE  69   3.428   3.372  -1.749
  513    HB   ILE  69           HB       ILE  69   4.957   4.995   0.306
  514   HG12  ILE  69          2HG1      ILE  69   4.607   2.004   0.085
  515   HG13  ILE  69          1HG1      ILE  69   6.045   2.862  -0.448
  516   HG21  ILE  69          1HG2      ILE  69   3.126   3.100   1.386
  517   HG22  ILE  69          2HG2      ILE  69   2.265   4.092   0.211
  518   HG23  ILE  69          3HG2      ILE  69   3.108   4.853   1.560
  519   HD11  ILE  69          1HD1      ILE  69   5.371   2.009   2.201
  520   HD12  ILE  69          2HD1      ILE  69   5.451   3.770   2.178
  521   HD13  ILE  69          3HD1      ILE  69   6.839   2.818   1.653
  522    H    ARG  70           H        ARG  70   4.833   6.632  -1.757
  523    HA   ARG  70           HA       ARG  70   2.445   8.076  -1.196
  524    HB2  ARG  70          2HB       ARG  70   4.850   8.865  -2.864
  525    HB3  ARG  70          1HB       ARG  70   3.601   9.984  -2.316
  526    HG2  ARG  70          2HG       ARG  70   4.102   9.317   0.041
  527    HG3  ARG  70          1HG       ARG  70   5.430   8.324  -0.558
  528    HD2  ARG  70          2HD       ARG  70   5.146  11.324  -0.898
  529    HD3  ARG  70          1HD       ARG  70   6.293  10.498   0.157
  530    HE   ARG  70           HE       ARG  70   6.633   9.565  -2.531
  531   HH11  ARG  70          1HH1      ARG  70   8.405  10.345  -3.700
  532   HH12  ARG  70          2HH1      ARG  70   9.192  11.799  -3.186
  533   HH21  ARG  70          1HH2      ARG  70   7.089  12.292  -0.473
  534   HH22  ARG  70          2HH2      ARG  70   8.447  12.902  -1.359
  535    H    SER  71           H        SER  71   3.741   6.829  -4.259
  536    HA   SER  71           HA       SER  71   1.964   8.161  -6.018
  537    HB2  SER  71          2HB       SER  71   3.039   5.342  -6.304
  538    HB3  SER  71          1HB       SER  71   2.471   6.386  -7.601
  539    HG   SER  71           HG       SER  71   4.876   6.223  -6.917
  540    H    ILE  72           H        ILE  72   1.569   5.141  -4.183
  541    HA   ILE  72           HA       ILE  72  -0.958   4.414  -5.298
  542    HB   ILE  72           HB       ILE  72   0.148   3.836  -2.531
  543   HG12  ILE  72          2HG1      ILE  72   0.360   2.217  -5.090
  544   HG13  ILE  72          1HG1      ILE  72   1.667   3.195  -4.421
  545   HG21  ILE  72          1HG2      ILE  72  -1.453   1.773  -3.768
  546   HG22  ILE  72          2HG2      ILE  72  -2.358   3.283  -3.687
  547   HG23  ILE  72          3HG2      ILE  72  -1.687   2.577  -2.218
  548   HD11  ILE  72          1HD1      ILE  72   0.391   0.722  -3.253
  549   HD12  ILE  72          2HD1      ILE  72   1.309   1.844  -2.248
  550   HD13  ILE  72          3HD1      ILE  72   2.096   1.019  -3.594
  551    H    ASP  73           H        ASP  73  -0.032   6.446  -2.541
  552    HA   ASP  73           HA       ASP  73  -2.599   6.840  -1.416
  553    HB2  ASP  73          2HB       ASP  73  -0.395   7.620  -0.451
  554    HB3  ASP  73          1HB       ASP  73  -0.428   8.942  -1.616
  555    H    ALA  74           H        ALA  74  -1.012   8.502  -4.133
  556    HA   ALA  74           HA       ALA  74  -3.028  10.506  -4.468
  557    HB1  ALA  74          1HB       ALA  74  -2.067  10.046  -7.018
  558    HB2  ALA  74          2HB       ALA  74  -0.743   9.481  -5.999
  559    HB3  ALA  74          3HB       ALA  74  -1.335  11.135  -5.841
  560    H    PHE  75           H        PHE  75  -2.639   7.278  -5.916
  561    HA   PHE  75           HA       PHE  75  -4.981   7.430  -7.564
  562    HB2  PHE  75          2HB       PHE  75  -3.177   5.721  -7.824
  563    HB3  PHE  75          1HB       PHE  75  -3.737   4.963  -6.336
  564    HD1  PHE  75          1HD       PHE  75  -5.754   3.649  -6.271
  565    HD2  PHE  75          2HD       PHE  75  -4.652   5.787  -9.830
  566    HE1  PHE  75          1HE       PHE  75  -7.491   2.420  -7.546
  567    HE2  PHE  75          2HE       PHE  75  -6.388   4.558 -11.105
  568    HZ   PHE  75           HZ       PHE  75  -7.807   2.876  -9.964
  569    H    VAL  76           H        VAL  76  -4.452   6.107  -4.295
  570    HA   VAL  76           HA       VAL  76  -7.138   5.247  -3.880
  571    HB   VAL  76           HB       VAL  76  -4.948   6.077  -1.962
  572   HG11  VAL  76          1HG1      VAL  76  -7.706   4.952  -1.469
  573   HG12  VAL  76          2HG1      VAL  76  -6.980   6.394  -0.762
  574   HG13  VAL  76          3HG1      VAL  76  -6.398   4.795  -0.297
  575   HG21  VAL  76          1HG2      VAL  76  -5.238   3.834  -3.573
  576   HG22  VAL  76          2HG2      VAL  76  -5.887   3.299  -2.022
  577   HG23  VAL  76          3HG2      VAL  76  -4.242   3.928  -2.121
  578    H    VAL  77           H        VAL  77  -5.490   8.325  -3.106
  579    HA   VAL  77           HA       VAL  77  -7.676   9.548  -1.763
  580    HB   VAL  77           HB       VAL  77  -5.408  10.706  -3.402
  581   HG11  VAL  77          1HG1      VAL  77  -7.545  12.052  -1.743
  582   HG12  VAL  77          2HG1      VAL  77  -7.142  12.352  -3.433
  583   HG13  VAL  77          3HG1      VAL  77  -6.021  12.835  -2.160
  584   HG21  VAL  77          1HG2      VAL  77  -4.203  10.491  -1.507
  585   HG22  VAL  77          2HG2      VAL  77  -5.527   9.531  -0.848
  586   HG23  VAL  77          3HG2      VAL  77  -5.466  11.270  -0.555
  587    H    GLY  78           H        GLY  78  -6.805   9.419  -5.199
  588    HA2  GLY  78          2HA       GLY  78  -8.752  11.221  -6.183
  589    HA3  GLY  78          1HA       GLY  78  -8.079   9.881  -7.108
  590    H    ALA  79           H        ALA  79  -9.072   7.831  -5.208
  591    HA   ALA  79           HA       ALA  79 -11.912   7.899  -6.099
  592    HB1  ALA  79          1HB       ALA  79 -10.378   5.992  -6.784
  593    HB2  ALA  79          2HB       ALA  79 -11.887   5.512  -6.009
  594    HB3  ALA  79          3HB       ALA  79 -10.382   5.500  -5.089
  595    H    THR  80           H        THR  80  -9.965   6.958  -3.249
  596    HA   THR  80           HA       THR  80 -12.320   7.700  -1.570
  597    HB   THR  80           HB       THR  80 -12.117   5.737  -0.236
  598    HG1  THR  80          1HG       THR  80 -10.390   4.327  -0.480
  599   HG21  THR  80          1HG2      THR  80 -13.231   5.375  -2.414
  600   HG22  THR  80          2HG2      THR  80 -12.403   3.918  -1.863
  601   HG23  THR  80          3HG2      THR  80 -11.681   4.920  -3.121
  602    H    THR  81           H        THR  81 -11.752   8.363   0.599
  603    HA   THR  81           HA       THR  81  -8.861   8.806   1.097
  604    HB   THR  81           HB       THR  81  -9.772  10.860   0.028
  605    HG1  THR  81          1HG       THR  81  -9.494  11.731   2.607
  606   HG21  THR  81          1HG2      THR  81 -12.058  10.279   1.419
  607   HG22  THR  81          2HG2      THR  81 -11.706  11.849   0.695
  608   HG23  THR  81          3HG2      THR  81 -11.371  11.570   2.404
  609    HA   PRO  82           HA       PRO  82 -11.043   7.428   4.895
  610    HB2  PRO  82          2HB       PRO  82  -9.332   5.455   5.588
  611    HB3  PRO  82          1HB       PRO  82 -10.564   5.235   4.329
  612    HG2  PRO  82          2HG       PRO  82  -7.643   5.655   4.064
  613    HG3  PRO  82          1HG       PRO  82  -8.751   4.720   3.048
  614    HD2  PRO  82          2HD       PRO  82  -7.790   7.317   2.495
  615    HD3  PRO  82          1HD       PRO  82  -9.135   6.500   1.672
  616    HA   PRO  83           HA       PRO  83  -8.704   9.641   7.933
  617    HB2  PRO  83          2HB       PRO  83  -9.071   8.002  10.151
  618    HB3  PRO  83          1HB       PRO  83 -10.234   9.210   9.575
  619    HG2  PRO  83          2HG       PRO  83 -10.210   6.268   9.187
  620    HG3  PRO  83          1HG       PRO  83 -11.578   7.372   9.406
  621    HD2  PRO  83          2HD       PRO  83 -10.917   6.349   6.974
  622    HD3  PRO  83          1HD       PRO  83 -11.642   7.961   7.164
  623    H    VAL  84           H        VAL  84  -6.645   9.617   9.009
  624    HA   VAL  84           HA       VAL  84  -4.997   7.235   8.331
  625    HB   VAL  84           HB       VAL  84  -4.127   9.995   9.234
  626   HG11  VAL  84          1HG1      VAL  84  -2.230   8.451   7.686
  627   HG12  VAL  84          2HG1      VAL  84  -2.732   7.550   9.116
  628   HG13  VAL  84          3HG1      VAL  84  -2.035   9.161   9.288
  629   HG21  VAL  84          1HG2      VAL  84  -4.402   8.738   6.491
  630   HG22  VAL  84          2HG2      VAL  84  -3.470  10.204   6.795
  631   HG23  VAL  84          3HG2      VAL  84  -5.210  10.188   7.087
  632    H    GLU  85           H        GLU  85  -4.341   5.877   9.910
  633    HA   GLU  85           HA       GLU  85  -5.153   6.236  12.650
  634    HB2  GLU  85          2HB       GLU  85  -3.164   4.315  11.402
  635    HB3  GLU  85          1HB       GLU  85  -3.752   4.208  13.062
  636    HG2  GLU  85          2HG       GLU  85  -6.077   4.024  12.207
  637    HG3  GLU  85          1HG       GLU  85  -5.454   4.058  10.557
  638    H    ALA  86           H        ALA  86  -2.217   6.931  10.862
  639    HA   ALA  86           HA       ALA  86  -0.469   8.398  11.490
  640    HB1  ALA  86          1HB       ALA  86  -0.670   9.711  13.371
  641    HB2  ALA  86          2HB       ALA  86  -1.227   8.371  14.373
  642    HB3  ALA  86          3HB       ALA  86  -2.343   9.163  13.259
  643    H    LYS  87           H        LYS  87   1.428   7.304  11.484
  644    HA   LYS  87           HA       LYS  87   1.850   4.769  12.681
  645    HB2  LYS  87          2HB       LYS  87   3.872   6.902  11.927
  646    HB3  LYS  87          1HB       LYS  87   4.277   5.230  12.317
  647    HG2  LYS  87          2HG       LYS  87   2.765   4.484  10.466
  648    HG3  LYS  87          1HG       LYS  87   2.526   6.175  10.029
  649    HD2  LYS  87          2HD       LYS  87   5.005   6.400   9.744
  650    HD3  LYS  87          1HD       LYS  87   5.155   4.667  10.034
  651    HE2  LYS  87          2HE       LYS  87   4.816   4.364   7.824
  652    HE3  LYS  87          1HE       LYS  87   3.153   4.886   8.086
  653    HZ1  LYS  87          1HZ       LYS  87   4.488   6.150   6.373
  654    HZ2  LYS  87          2HZ       LYS  87   5.354   6.817   7.673
  655    HZ3  LYS  87          3HZ       LYS  87   3.681   7.081   7.538
  656    H    LEU  88           H        LEU  88   2.306   8.026  13.956
  657    HA   LEU  88           HA       LEU  88   3.570   6.988  16.413
  658    HB2  LEU  88          2HB       LEU  88   2.668   9.806  15.736
  659    HB3  LEU  88          1HB       LEU  88   3.709   9.336  17.080
  660    HG   LEU  88           HG       LEU  88   4.347   9.010  14.133
  661   HD11  LEU  88          1HD1      LEU  88   5.799  10.678  16.192
  662   HD12  LEU  88          2HD1      LEU  88   4.469  11.334  15.239
  663   HD13  LEU  88          3HD1      LEU  88   5.929  10.757  14.435
  664   HD21  LEU  88          1HD2      LEU  88   5.446   7.205  15.131
  665   HD22  LEU  88          2HD2      LEU  88   5.662   8.053  16.661
  666   HD23  LEU  88          3HD2      LEU  88   6.663   8.473  15.271
  667    H    GLN  89           H        GLN  89   2.531   6.878  18.414
  668    HA   GLN  89           HA       GLN  89  -0.427   6.956  18.307
  669    HB2  GLN  89          2HB       GLN  89   1.490   5.973  20.444
  670    HB3  GLN  89          1HB       GLN  89  -0.267   5.862  20.544
  671    HG2  GLN  89          2HG       GLN  89  -0.317   4.483  18.513
  672    HG3  GLN  89          1HG       GLN  89   1.434   4.623  18.360
  673   HE21  GLN  89          1HE2      GLN  89   0.227   2.060  18.641
  674   HE22  GLN  89          2HE2      GLN  89   0.645   1.422  20.158
  675    H1   PN7 101          3HO       SAT 101   3.465  -5.916 -13.341
  676    H2   PN7 101          1H1       SAT 101   3.752  -7.261 -10.414
  677    H3   PN7 101          2H1       SAT 101   2.382  -7.459  -9.323
  678    H5   PN7 101          1HE1      SAT 101   2.982  -5.132 -11.224
  679    H6   PN7 101          2HE1      SAT 101   1.554  -5.150 -10.190
  680    H7   PN7 101          3HE1      SAT 101   1.380  -4.935 -11.932
  681    H8   PN7 101          2HE2      SAT 101   0.312  -7.915 -10.173
  682    H9   PN7 101          3HE2      SAT 101   0.076  -8.028 -11.916
  683    H10  PN7 101          1HE2      SAT 101  -0.249  -6.510 -11.079
  684    H11  PN7 101          3H        SAT 101   2.279  -8.409 -12.840
  685    H12  PN7 101          5H        SAT 101   1.600  -4.789 -13.668
  686    H13  PN7 101          1H6       SAT 101   0.963  -5.623 -16.282
  687    H14  PN7 101          2H6       SAT 101   2.204  -4.427 -15.907
  688    H15  PN7 101          1H7       SAT 101   2.570  -7.439 -15.970
  689    H16  PN7 101          2H7       SAT 101   3.814  -6.286 -15.484
  690    H17  PN7 101          9H        SAT 101   2.345  -4.497 -17.657
  691    H18  PN7 101          1H10      SAT 101   4.125  -5.488 -19.843
  692    H19  PN7 101          2H10      SAT 101   2.483  -4.946 -20.192
  693    H20  PN7 101          1H11      SAT 101   3.836  -3.060 -20.673
  694    H21  PN7 101          2H11      SAT 101   4.835  -3.307 -19.241
  695    H22  PN7 101          2HS1      SAT 101   2.320  -2.819 -18.002
  Start of MODEL    5
    1    H1   MET   1          1HT       MET   1   0.485  11.835   2.285
    2    H2   MET   1          2HT       MET   1   0.073  13.415   2.761
    3    H3   MET   1          3HT       MET   1   0.772  13.137   1.236
    4    HA   MET   1           HA       MET   1  -1.498  13.461   0.806
    5    HB2  MET   1          2HB       MET   1  -1.063  10.466   1.026
    6    HB3  MET   1          1HB       MET   1  -2.183  11.289  -0.060
    7    HG2  MET   1          2HG       MET   1   0.841  11.513  -0.101
    8    HG3  MET   1          1HG       MET   1  -0.158  10.674  -1.287
    9    HE1  MET   1          1HE       MET   1  -2.063  13.211  -3.164
   10    HE2  MET   1          2HE       MET   1  -2.730  12.943  -1.556
   11    HE3  MET   1          3HE       MET   1  -2.001  11.601  -2.435
   12    H    GLN   2           H        GLN   2  -3.263  11.037   1.417
   13    HA   GLN   2           HA       GLN   2  -4.168  12.017   4.090
   14    HB2  GLN   2          2HB       GLN   2  -5.681  10.487   1.947
   15    HB3  GLN   2          1HB       GLN   2  -6.362  11.065   3.468
   16    HG2  GLN   2          2HG       GLN   2  -5.835  13.388   2.829
   17    HG3  GLN   2          1HG       GLN   2  -5.153  12.813   1.307
   18   HE21  GLN   2          1HE2      GLN   2  -7.358  14.603   1.273
   19   HE22  GLN   2          2HE2      GLN   2  -8.728  13.777   0.707
   20    H    HIS   3           H        HIS   3  -4.087  10.616   5.805
   21    HA   HIS   3           HA       HIS   3  -3.371   8.676   6.956
   22    HB2  HIS   3          2HB       HIS   3  -5.607   7.996   5.121
   23    HB3  HIS   3          1HB       HIS   3  -4.741   6.631   5.826
   24    HD1  HIS   3          1HD       HIS   3  -6.074   9.972   7.140
   25    HD2  HIS   3          2HD       HIS   3  -5.847   5.959   8.254
   26    HE1  HIS   3          1HE       HIS   3  -7.216   9.786   9.395
   27    HE2  HIS   3          2HE       HIS   3  -7.083   7.349  10.081
   28    H    ALA   4           H        ALA   4  -1.697   9.436   4.644
   29    HA   ALA   4           HA       ALA   4  -0.997   7.192   3.043
   30    HB1  ALA   4          1HB       ALA   4   1.134   9.079   3.964
   31    HB2  ALA   4          2HB       ALA   4  -0.203   9.730   3.017
   32    HB3  ALA   4          3HB       ALA   4   0.813   8.454   2.345
   33    H    SER   5           H        SER   5   0.124   8.192   6.266
   34    HA   SER   5           HA       SER   5   2.167   6.196   6.505
   35    HB2  SER   5          2HB       SER   5   2.133   6.697   8.876
   36    HB3  SER   5          1HB       SER   5   1.916   8.207   7.994
   37    HG   SER   5           HG       SER   5  -0.442   6.944   8.445
   38    H    VAL   6           H        VAL   6  -1.307   6.147   7.098
   39    HA   VAL   6           HA       VAL   6  -1.363   3.640   8.509
   40    HB   VAL   6           HB       VAL   6  -3.462   5.031   6.836
   41   HG11  VAL   6          1HG1      VAL   6  -4.883   3.441   8.472
   42   HG12  VAL   6          2HG1      VAL   6  -3.445   2.435   8.296
   43   HG13  VAL   6          3HG1      VAL   6  -4.365   2.916   6.870
   44   HG21  VAL   6          1HG2      VAL   6  -4.122   4.944   9.581
   45   HG22  VAL   6          2HG2      VAL   6  -3.629   6.359   8.652
   46   HG23  VAL   6          3HG2      VAL   6  -2.420   5.403   9.508
   47    H    ILE   7           H        ILE   7  -1.533   4.496   5.076
   48    HA   ILE   7           HA       ILE   7  -2.155   1.897   4.094
   49    HB   ILE   7           HB       ILE   7  -0.513   4.094   2.804
   50   HG12  ILE   7          2HG1      ILE   7  -3.451   3.387   2.511
   51   HG13  ILE   7          1HG1      ILE   7  -2.846   4.697   3.523
   52   HG21  ILE   7          1HG2      ILE   7  -1.744   1.538   1.761
   53   HG22  ILE   7          2HG2      ILE   7  -0.091   2.118   1.558
   54   HG23  ILE   7          3HG2      ILE   7  -1.412   2.903   0.695
   55   HD11  ILE   7          1HD1      ILE   7  -1.770   4.752   0.795
   56   HD12  ILE   7          2HD1      ILE   7  -2.489   6.051   1.745
   57   HD13  ILE   7          3HD1      ILE   7  -3.522   4.933   0.856
   58    H    ALA   8           H        ALA   8   1.018   3.479   4.551
   59    HA   ALA   8           HA       ALA   8   2.568   1.186   3.789
   60    HB1  ALA   8          1HB       ALA   8   4.232   2.444   5.501
   61    HB2  ALA   8          2HB       ALA   8   3.079   3.747   5.215
   62    HB3  ALA   8          3HB       ALA   8   3.946   3.024   3.860
   63    H    GLN   9           H        GLN   9   1.525   2.399   6.962
   64    HA   GLN   9           HA       GLN   9   2.673   0.285   8.507
   65    HB2  GLN   9          2HB       GLN   9   1.824   2.428   9.458
   66    HB3  GLN   9          1HB       GLN   9   0.179   1.909   9.093
   67    HG2  GLN   9          2HG       GLN   9   1.272  -0.254  10.466
   68    HG3  GLN   9          1HG       GLN   9   1.899   1.153  11.322
   69   HE21  GLN   9          1HE2      GLN   9  -1.209  -0.078   9.968
   70   HE22  GLN   9          2HE2      GLN   9  -2.176   0.584  11.197
   71    H    PHE  10           H        PHE  10  -0.536   0.700   7.077
   72    HA   PHE  10           HA       PHE  10  -1.618  -1.780   8.042
   73    HB2  PHE  10          2HB       PHE  10  -2.957   0.178   7.210
   74    HB3  PHE  10          1HB       PHE  10  -2.429  -0.217   5.577
   75    HD1  PHE  10          1HD       PHE  10  -4.365  -1.429   8.495
   76    HD2  PHE  10          2HD       PHE  10  -3.362  -2.069   4.368
   77    HE1  PHE  10          1HE       PHE  10  -6.192  -3.094   8.310
   78    HE2  PHE  10          2HE       PHE  10  -5.188  -3.737   4.183
   79    HZ   PHE  10           HZ       PHE  10  -6.603  -4.248   6.154
   80    H    VAL  11           H        VAL  11  -0.269  -0.830   4.889
   81    HA   VAL  11           HA       VAL  11  -0.481  -3.451   3.723
   82    HB   VAL  11           HB       VAL  11   1.359  -1.145   3.021
   83   HG11  VAL  11          1HG1      VAL  11   1.186  -3.847   2.037
   84   HG12  VAL  11          2HG1      VAL  11   2.268  -2.554   1.522
   85   HG13  VAL  11          3HG1      VAL  11   0.682  -2.728   0.770
   86   HG21  VAL  11          1HG2      VAL  11  -1.260  -0.922   3.004
   87   HG22  VAL  11          2HG2      VAL  11  -1.150  -1.922   1.555
   88   HG23  VAL  11          3HG2      VAL  11  -0.335  -0.359   1.612
   89    H    VAL  12           H        VAL  12   2.218  -1.724   5.283
   90    HA   VAL  12           HA       VAL  12   4.149  -3.801   4.922
   91    HB   VAL  12           HB       VAL  12   3.971  -1.685   7.075
   92   HG11  VAL  12          1HG1      VAL  12   6.376  -2.065   7.363
   93   HG12  VAL  12          2HG1      VAL  12   6.341  -3.319   6.123
   94   HG13  VAL  12          3HG1      VAL  12   5.494  -3.564   7.647
   95   HG21  VAL  12          1HG2      VAL  12   5.888  -1.491   4.820
   96   HG22  VAL  12          2HG2      VAL  12   4.944  -0.225   5.605
   97   HG23  VAL  12          3HG2      VAL  12   4.189  -1.269   4.401
   98    H    GLU  13           H        GLU  13   1.715  -3.219   7.411
   99    HA   GLU  13           HA       GLU  13   2.589  -5.066   9.359
  100    HB2  GLU  13          2HB       GLU  13   0.681  -3.493   9.653
  101    HB3  GLU  13          1HB       GLU  13  -0.271  -4.499   8.569
  102    HG2  GLU  13          2HG       GLU  13   0.081  -6.432  10.097
  103    HG3  GLU  13          1HG       GLU  13   0.930  -5.357  11.204
  104    H    GLU  14           H        GLU  14   0.932  -5.585   6.306
  105    HA   GLU  14           HA       GLU  14   0.168  -8.310   6.769
  106    HB2  GLU  14          2HB       GLU  14  -0.712  -6.881   4.915
  107    HB3  GLU  14          1HB       GLU  14   0.861  -6.996   4.127
  108    HG2  GLU  14          2HG       GLU  14   0.636  -9.479   4.121
  109    HG3  GLU  14          1HG       GLU  14  -0.984  -9.303   4.797
  110    H    PHE  15           H        PHE  15   3.170  -6.812   5.678
  111    HA   PHE  15           HA       PHE  15   4.481  -9.471   5.946
  112    HB2  PHE  15          2HB       PHE  15   5.697  -9.204   3.870
  113    HB3  PHE  15          1HB       PHE  15   3.978  -9.033   3.520
  114    HD1  PHE  15          1HD       PHE  15   7.218  -7.437   3.413
  115    HD2  PHE  15          2HD       PHE  15   2.990  -6.688   3.364
  116    HE1  PHE  15          1HE       PHE  15   7.630  -5.176   2.482
  117    HE2  PHE  15          2HE       PHE  15   3.400  -4.428   2.431
  118    HZ   PHE  15           HZ       PHE  15   5.720  -3.673   1.990
  119    H    LEU  16           H        LEU  16   4.581  -7.477   7.878
  120    HA   LEU  16           HA       LEU  16   6.924  -5.813   7.445
  121    HB2  LEU  16          2HB       LEU  16   6.338  -4.732   9.364
  122    HB3  LEU  16          1HB       LEU  16   4.797  -5.501   9.046
  123    HG   LEU  16           HG       LEU  16   6.953  -6.558  10.909
  124   HD11  LEU  16          1HD1      LEU  16   4.765  -6.151  12.435
  125   HD12  LEU  16          2HD1      LEU  16   4.541  -4.868  11.246
  126   HD13  LEU  16          3HD1      LEU  16   6.019  -4.933  12.206
  127   HD21  LEU  16          1HD2      LEU  16   4.240  -7.656  11.108
  128   HD22  LEU  16          2HD2      LEU  16   5.784  -8.503  11.060
  129   HD23  LEU  16          3HD2      LEU  16   5.000  -8.016   9.561
  130    HA   PRO  17           HA       PRO  17   9.781  -8.958   8.841
  131    HB2  PRO  17          2HB       PRO  17  12.024  -7.429   9.016
  132    HB3  PRO  17          1HB       PRO  17  11.320  -7.885   7.455
  133    HG2  PRO  17          2HG       PRO  17  11.092  -5.319   8.952
  134    HG3  PRO  17          1HG       PRO  17  11.330  -5.597   7.218
  135    HD2  PRO  17          2HD       PRO  17   8.895  -4.989   8.325
  136    HD3  PRO  17          1HD       PRO  17   9.091  -5.927   6.829
  137    H    ASP  18           H        ASP  18  11.979  -8.123  10.619
  138    HA   ASP  18           HA       ASP  18  10.534  -8.195  13.143
  139    HB2  ASP  18          2HB       ASP  18  13.474  -7.949  12.480
  140    HB3  ASP  18          1HB       ASP  18  12.848  -8.101  14.116
  141    H    VAL  19           H        VAL  19  10.814  -5.774  11.083
  142    HA   VAL  19           HA       VAL  19  11.425  -3.704  13.158
  143    HB   VAL  19           HB       VAL  19  11.422  -3.392  10.143
  144   HG11  VAL  19          1HG1      VAL  19  11.119  -1.257  11.083
  145   HG12  VAL  19          2HG1      VAL  19  12.871  -1.364  10.903
  146   HG13  VAL  19          3HG1      VAL  19  12.129  -1.627  12.481
  147   HG21  VAL  19          1HG2      VAL  19  13.858  -3.486  10.283
  148   HG22  VAL  19          2HG2      VAL  19  13.189  -4.964  10.975
  149   HG23  VAL  19          3HG2      VAL  19  13.780  -3.685  12.034
  150    H    ALA  20           H        ALA  20   9.807  -2.260  13.679
  151    HA   ALA  20           HA       ALA  20   7.119  -2.790  12.755
  152    HB1  ALA  20          1HB       ALA  20   7.652  -1.920  15.035
  153    HB2  ALA  20          2HB       ALA  20   6.474  -0.919  14.184
  154    HB3  ALA  20          3HB       ALA  20   8.155  -0.398  14.300
  155    HA   PRO  21           HA       PRO  21   7.114  -0.362   8.990
  156    HB2  PRO  21          2HB       PRO  21   4.499   0.703   9.931
  157    HB3  PRO  21          1HB       PRO  21   4.916  -0.073   8.393
  158    HG2  PRO  21          2HG       PRO  21   3.534  -1.319  10.345
  159    HG3  PRO  21          1HG       PRO  21   4.593  -2.167   9.208
  160    HD2  PRO  21          2HD       PRO  21   4.995  -1.651  12.088
  161    HD3  PRO  21          1HD       PRO  21   5.744  -2.871  11.033
  162    H    ALA  22           H        ALA  22   6.206   1.125  12.061
  163    HA   ALA  22           HA       ALA  22   6.581   3.859  11.212
  164    HB1  ALA  22          1HB       ALA  22   6.223   2.415  13.790
  165    HB2  ALA  22          2HB       ALA  22   5.391   3.846  13.178
  166    HB3  ALA  22          3HB       ALA  22   7.005   3.994  13.874
  167    H    ASP  23           H        ASP  23   8.717   1.298  12.073
  168    HA   ASP  23           HA       ASP  23  10.970   3.175  12.542
  169    HB2  ASP  23          2HB       ASP  23  10.745   0.165  12.834
  170    HB3  ASP  23          1HB       ASP  23  12.227   1.077  13.119
  171    H    VAL  24           H        VAL  24   9.473   1.920   9.949
  172    HA   VAL  24           HA       VAL  24  11.989   1.324   8.462
  173    HB   VAL  24           HB       VAL  24   9.100   0.885   7.638
  174   HG11  VAL  24          1HG1      VAL  24   9.997   0.657   5.581
  175   HG12  VAL  24          2HG1      VAL  24  10.845  -0.765   6.188
  176   HG13  VAL  24          3HG1      VAL  24  11.635   0.811   6.217
  177   HG21  VAL  24          1HG2      VAL  24   9.803  -1.558   7.945
  178   HG22  VAL  24          2HG2      VAL  24   9.582  -0.629   9.427
  179   HG23  VAL  24          3HG2      VAL  24  11.206  -0.942   8.819
  180    H    ASP  25           H        ASP  25  12.662   2.728   6.864
  181    HA   ASP  25           HA       ASP  25  11.539   5.374   6.799
  182    HB2  ASP  25          2HB       ASP  25  13.491   3.986   4.938
  183    HB3  ASP  25          1HB       ASP  25  13.105   5.705   4.863
  184    H    VAL  26           H        VAL  26   9.363   5.296   6.165
  185    HA   VAL  26           HA       VAL  26   8.331   3.778   3.982
  186    HB   VAL  26           HB       VAL  26   6.406   5.280   4.077
  187   HG11  VAL  26          1HG1      VAL  26   6.959   3.617   5.969
  188   HG12  VAL  26          2HG1      VAL  26   5.781   4.880   6.330
  189   HG13  VAL  26          3HG1      VAL  26   7.443   5.032   6.903
  190   HG21  VAL  26          1HG2      VAL  26   6.832   7.167   5.971
  191   HG22  VAL  26          2HG2      VAL  26   7.059   7.473   4.249
  192   HG23  VAL  26          3HG2      VAL  26   8.447   7.086   5.267
  193    H    ASP  27           H        ASP  27  10.730   5.947   3.752
  194    HA   ASP  27           HA       ASP  27   9.780   7.292   1.291
  195    HB2  ASP  27          2HB       ASP  27  12.383   7.482   2.841
  196    HB3  ASP  27          1HB       ASP  27  12.030   8.402   1.378
  197    H    LEU  28           H        LEU  28  10.805   4.315   1.977
  198    HA   LEU  28           HA       LEU  28  12.782   4.032  -0.205
  199    HB2  LEU  28          2HB       LEU  28  13.067   2.803   1.955
  200    HB3  LEU  28          1HB       LEU  28  11.584   1.919   1.608
  201    HG   LEU  28           HG       LEU  28  12.649   1.186  -0.574
  202   HD11  LEU  28          1HD1      LEU  28  14.421   2.649  -0.988
  203   HD12  LEU  28          2HD1      LEU  28  15.266   1.253  -0.322
  204   HD13  LEU  28          3HD1      LEU  28  14.944   2.655   0.697
  205   HD21  LEU  28          1HD2      LEU  28  14.265  -0.418   0.648
  206   HD22  LEU  28          2HD2      LEU  28  12.573  -0.442   1.143
  207   HD23  LEU  28          3HD2      LEU  28  13.766   0.413   2.122
  208    H    ASP  29           H        ASP  29  12.287   3.143  -2.184
  209    HA   ASP  29           HA       ASP  29   9.558   3.048  -3.016
  210    HB2  ASP  29          2HB       ASP  29  12.044   1.843  -4.271
  211    HB3  ASP  29          1HB       ASP  29  10.474   1.930  -5.069
  212    H    LEU  30           H        LEU  30   8.090   1.494  -2.562
  213    HA   LEU  30           HA       LEU  30   8.831  -0.923  -1.193
  214    HB2  LEU  30          2HB       LEU  30   6.220  -0.245  -2.588
  215    HB3  LEU  30          1HB       LEU  30   6.457  -1.529  -1.402
  216    HG   LEU  30           HG       LEU  30   6.849   1.435  -0.904
  217   HD11  LEU  30          1HD1      LEU  30   4.624  -0.497  -0.436
  218   HD12  LEU  30          2HD1      LEU  30   4.555   1.226  -0.803
  219   HD13  LEU  30          3HD1      LEU  30   4.946   0.686   0.830
  220   HD21  LEU  30          1HD2      LEU  30   7.479  -1.038   0.650
  221   HD22  LEU  30          2HD2      LEU  30   6.843   0.345   1.540
  222   HD23  LEU  30          3HD2      LEU  30   8.331   0.506   0.607
  223    H    VAL  31           H        VAL  31   9.153  -0.095  -4.408
  224    HA   VAL  31           HA       VAL  31   8.278  -2.332  -5.861
  225    HB   VAL  31           HB       VAL  31  10.783  -0.658  -6.180
  226   HG11  VAL  31          1HG1      VAL  31  10.579  -1.660  -8.596
  227   HG12  VAL  31          2HG1      VAL  31   9.719  -2.969  -7.785
  228   HG13  VAL  31          3HG1      VAL  31  11.386  -2.599  -7.340
  229   HG21  VAL  31          1HG2      VAL  31   8.303   0.189  -6.497
  230   HG22  VAL  31          2HG2      VAL  31   8.405  -0.704  -8.015
  231   HG23  VAL  31          3HG2      VAL  31   9.533   0.612  -7.688
  232    H    ASP  32           H        ASP  32  11.239  -1.941  -3.938
  233    HA   ASP  32           HA       ASP  32  12.442  -4.441  -4.539
  234    HB2  ASP  32          2HB       ASP  32  12.418  -2.858  -1.948
  235    HB3  ASP  32          1HB       ASP  32  13.462  -4.248  -2.243
  236    H    ASN  33           H        ASN  33   9.838  -3.526  -2.377
  237    HA   ASN  33           HA       ASN  33   9.532  -6.232  -1.292
  238    HB2  ASN  33          2HB       ASN  33   7.737  -3.805  -1.066
  239    HB3  ASN  33          1HB       ASN  33   7.588  -5.283  -0.121
  240   HD21  ASN  33          1HD2      ASN  33  10.869  -4.685  -0.656
  241   HD22  ASN  33          2HD2      ASN  33  11.223  -3.885   0.799
  242    H    GLY  34           H        GLY  34   9.180  -5.279  -4.246
  243    HA2  GLY  34          2HA       GLY  34   6.610  -5.417  -5.211
  244    HA3  GLY  34          1HA       GLY  34   7.956  -6.202  -6.038
  245    H    VAL  35           H        VAL  35   8.176  -7.862  -3.382
  246    HA   VAL  35           HA       VAL  35   6.972 -10.229  -4.316
  247    HB   VAL  35           HB       VAL  35   7.539  -9.307  -1.483
  248   HG11  VAL  35          1HG1      VAL  35   6.124 -11.681  -2.491
  249   HG12  VAL  35          2HG1      VAL  35   6.183 -11.016  -0.858
  250   HG13  VAL  35          3HG1      VAL  35   7.481 -12.062  -1.432
  251   HG21  VAL  35          1HG2      VAL  35   9.204 -10.121  -3.583
  252   HG22  VAL  35          2HG2      VAL  35   9.056 -11.548  -2.558
  253   HG23  VAL  35          3HG2      VAL  35   9.643 -10.031  -1.877
  254    H    ILE  36           H        ILE  36   5.650  -7.644  -2.293
  255    HA   ILE  36           HA       ILE  36   3.101  -8.924  -1.812
  256    HB   ILE  36           HB       ILE  36   4.255  -6.880  -0.620
  257   HG12  ILE  36          2HG1      ILE  36   1.291  -7.021  -1.245
  258   HG13  ILE  36          1HG1      ILE  36   2.126  -7.819   0.086
  259   HG21  ILE  36          1HG2      ILE  36   3.722  -4.742  -1.463
  260   HG22  ILE  36          2HG2      ILE  36   2.483  -5.381  -2.545
  261   HG23  ILE  36          3HG2      ILE  36   4.190  -5.643  -2.905
  262   HD11  ILE  36          1HD1      ILE  36   1.145  -5.088  -0.087
  263   HD12  ILE  36          2HD1      ILE  36   2.860  -5.132   0.321
  264   HD13  ILE  36          3HD1      ILE  36   1.691  -5.989   1.328
  265    H    ASP  37           H        ASP  37   4.429  -7.035  -4.421
  266    HA   ASP  37           HA       ASP  37   1.999  -6.091  -5.567
  267    HB2  ASP  37          2HB       ASP  37   4.633  -6.777  -6.888
  268    HB3  ASP  37          1HB       ASP  37   3.311  -5.936  -7.690
  269    H    SER  38           H        SER  38   3.561  -9.252  -5.774
  270    HA   SER  38           HA       SER  38   1.504 -10.071  -7.769
  271    HB2  SER  38          2HB       SER  38   4.135 -11.298  -6.942
  272    HB3  SER  38          1HB       SER  38   2.970 -12.140  -7.959
  273    H    LEU  39           H        LEU  39   3.133 -11.689  -5.018
  274    HA   LEU  39           HA       LEU  39   0.894 -13.457  -4.632
  275    HB2  LEU  39          2HB       LEU  39   3.270 -13.996  -4.033
  276    HB3  LEU  39          1HB       LEU  39   3.123 -12.868  -2.690
  277    HG   LEU  39           HG       LEU  39   0.960 -14.874  -2.871
  278   HD11  LEU  39          1HD1      LEU  39   2.432 -16.611  -1.793
  279   HD12  LEU  39          2HD1      LEU  39   3.826 -15.626  -2.236
  280   HD13  LEU  39          3HD1      LEU  39   2.801 -16.319  -3.493
  281   HD21  LEU  39          1HD2      LEU  39   1.125 -13.307  -0.996
  282   HD22  LEU  39          2HD2      LEU  39   2.769 -13.850  -0.660
  283   HD23  LEU  39          3HD2      LEU  39   1.411 -14.947  -0.417
  284    H    GLY  40           H        GLY  40   2.139 -10.770  -2.640
  285    HA2  GLY  40          2HA       GLY  40  -0.029 -10.872  -0.762
  286    HA3  GLY  40          1HA       GLY  40   1.056  -9.505  -0.985
  287    H    LEU  41           H        LEU  41   0.458  -9.084  -3.767
  288    HA   LEU  41           HA       LEU  41  -1.736  -7.301  -3.567
  289    HB2  LEU  41          2HB       LEU  41   0.043  -7.236  -5.323
  290    HB3  LEU  41          1HB       LEU  41  -0.696  -8.648  -6.076
  291    HG   LEU  41           HG       LEU  41  -2.872  -7.051  -5.869
  292   HD11  LEU  41          1HD1      LEU  41  -2.399  -4.786  -6.034
  293   HD12  LEU  41          2HD1      LEU  41  -0.778  -5.068  -6.668
  294   HD13  LEU  41          3HD1      LEU  41  -1.107  -5.301  -4.950
  295   HD21  LEU  41          1HD2      LEU  41  -1.982  -8.174  -7.909
  296   HD22  LEU  41          2HD2      LEU  41  -0.797  -6.877  -8.078
  297   HD23  LEU  41          3HD2      LEU  41  -2.519  -6.525  -8.237
  298    H    LEU  42           H        LEU  42  -1.572 -10.643  -4.750
  299    HA   LEU  42           HA       LEU  42  -4.316 -10.773  -5.603
  300    HB2  LEU  42          2HB       LEU  42  -2.532 -12.432  -6.229
  301    HB3  LEU  42          1HB       LEU  42  -2.587 -13.046  -4.583
  302    HG   LEU  42           HG       LEU  42  -5.170 -13.256  -5.052
  303   HD11  LEU  42          1HD1      LEU  42  -3.932 -13.275  -7.814
  304   HD12  LEU  42          2HD1      LEU  42  -5.147 -12.147  -7.219
  305   HD13  LEU  42          3HD1      LEU  42  -5.559 -13.846  -7.449
  306   HD21  LEU  42          1HD2      LEU  42  -2.878 -15.021  -5.782
  307   HD22  LEU  42          2HD2      LEU  42  -4.477 -15.508  -6.347
  308   HD23  LEU  42          3HD2      LEU  42  -4.179 -15.292  -4.622
  309    H    LYS  43           H        LYS  43  -2.692 -11.616  -2.554
  310    HA   LYS  43           HA       LYS  43  -5.078 -12.504  -1.211
  311    HB2  LYS  43          2HB       LYS  43  -2.728 -13.035  -0.506
  312    HB3  LYS  43          1HB       LYS  43  -2.570 -11.365   0.029
  313    HG2  LYS  43          2HG       LYS  43  -4.652 -11.759   1.452
  314    HG3  LYS  43          1HG       LYS  43  -4.450 -13.476   1.099
  315    HD2  LYS  43          2HD       LYS  43  -2.261 -11.744   2.282
  316    HD3  LYS  43          1HD       LYS  43  -3.366 -12.713   3.257
  317    HE2  LYS  43          2HE       LYS  43  -1.980 -14.464   2.966
  318    HE3  LYS  43          1HE       LYS  43  -2.409 -14.453   1.255
  319    HZ1  LYS  43          1HZ       LYS  43  -0.027 -14.272   1.553
  320    HZ2  LYS  43          2HZ       LYS  43  -0.223 -12.882   2.510
  321    HZ3  LYS  43          3HZ       LYS  43  -0.642 -12.849   0.864
  322    H    VAL  44           H        VAL  44  -3.356  -9.389  -1.274
  323    HA   VAL  44           HA       VAL  44  -5.043  -8.060   0.609
  324    HB   VAL  44           HB       VAL  44  -3.401  -6.950  -1.681
  325   HG11  VAL  44          1HG1      VAL  44  -4.703  -5.596   0.699
  326   HG12  VAL  44          2HG1      VAL  44  -5.071  -5.317  -1.003
  327   HG13  VAL  44          3HG1      VAL  44  -3.508  -4.830  -0.347
  328   HG21  VAL  44          1HG2      VAL  44  -2.556  -8.277   0.568
  329   HG22  VAL  44          2HG2      VAL  44  -2.561  -6.604   1.127
  330   HG23  VAL  44          3HG2      VAL  44  -1.606  -7.060  -0.283
  331    H    ILE  45           H        ILE  45  -5.183  -8.180  -2.958
  332    HA   ILE  45           HA       ILE  45  -7.414  -6.439  -3.235
  333    HB   ILE  45           HB       ILE  45  -6.078  -8.507  -4.898
  334   HG12  ILE  45          2HG1      ILE  45  -5.970  -6.699  -6.479
  335   HG13  ILE  45          1HG1      ILE  45  -7.209  -5.790  -5.618
  336   HG21  ILE  45          1HG2      ILE  45  -8.296  -9.290  -5.264
  337   HG22  ILE  45          2HG2      ILE  45  -7.948  -8.221  -6.622
  338   HG23  ILE  45          3HG2      ILE  45  -8.951  -7.651  -5.289
  339   HD11  ILE  45          1HD1      ILE  45  -4.586  -5.301  -5.296
  340   HD12  ILE  45          2HD1      ILE  45  -4.782  -6.550  -4.069
  341   HD13  ILE  45          3HD1      ILE  45  -5.750  -5.080  -3.990
  342    H    ALA  46           H        ALA  46  -7.282  -9.990  -2.916
  343    HA   ALA  46           HA       ALA  46 -10.129 -10.364  -3.003
  344    HB1  ALA  46          1HB       ALA  46  -7.791 -12.002  -2.065
  345    HB2  ALA  46          2HB       ALA  46  -8.905 -12.317  -3.397
  346    HB3  ALA  46          3HB       ALA  46  -9.434 -12.549  -1.730
  347    H    TRP  47           H        TRP  47  -7.848 -10.038  -0.274
  348    HA   TRP  47           HA       TRP  47  -9.982 -10.261   1.695
  349    HB2  TRP  47          2HB       TRP  47  -7.968 -10.985   2.572
  350    HB3  TRP  47          1HB       TRP  47  -7.044  -9.716   1.769
  351    HD1  TRP  47           HD       TRP  47 -10.074  -9.472   4.180
  352    HE1  TRP  47          1HE       TRP  47  -9.424  -7.856   6.085
  353    HE3  TRP  47          3HE       TRP  47  -5.279  -8.455   2.845
  354    HZ2  TRP  47          2HZ       TRP  47  -7.144  -6.330   6.928
  355    HZ3  TRP  47          3HZ       TRP  47  -3.875  -6.922   4.202
  356    HH2  TRP  47           HH       TRP  47  -4.803  -5.860   6.240
  357    H    LEU  48           H        LEU  48  -7.927  -7.586   0.541
  358    HA   LEU  48           HA       LEU  48  -9.097  -5.553   2.134
  359    HB2  LEU  48          2HB       LEU  48  -6.978  -5.413   0.730
  360    HB3  LEU  48          1HB       LEU  48  -8.021  -5.157  -0.661
  361    HG   LEU  48           HG       LEU  48  -9.097  -3.312   0.877
  362   HD11  LEU  48          1HD1      LEU  48  -6.304  -3.020   1.855
  363   HD12  LEU  48          2HD1      LEU  48  -7.311  -4.228   2.653
  364   HD13  LEU  48          3HD1      LEU  48  -7.817  -2.538   2.621
  365   HD21  LEU  48          1HD2      LEU  48  -6.687  -3.310  -0.870
  366   HD22  LEU  48          2HD2      LEU  48  -6.972  -1.849   0.077
  367   HD23  LEU  48          3HD2      LEU  48  -8.203  -2.426  -1.049
  368    H    GLU  49           H        GLU  49  -9.993  -6.691  -1.135
  369    HA   GLU  49           HA       GLU  49 -12.036  -4.720  -1.530
  370    HB2  GLU  49          2HB       GLU  49 -12.747  -6.082  -3.376
  371    HB3  GLU  49          1HB       GLU  49 -10.994  -6.206  -3.309
  372    HG2  GLU  49          2HG       GLU  49 -11.547  -8.441  -3.485
  373    HG3  GLU  49          1HG       GLU  49 -11.554  -8.253  -1.734
  374    H    ASP  50           H        ASP  50 -12.029  -7.940  -0.072
  375    HA   ASP  50           HA       ASP  50 -14.880  -8.098   0.315
  376    HB2  ASP  50          2HB       ASP  50 -13.241 -10.032   0.395
  377    HB3  ASP  50          1HB       ASP  50 -12.742  -9.433   1.975
  378    H    ARG  51           H        ARG  51 -12.190  -6.925   2.285
  379    HA   ARG  51           HA       ARG  51 -13.586  -6.515   4.712
  380    HB2  ARG  51          2HB       ARG  51 -11.112  -6.344   4.422
  381    HB3  ARG  51          1HB       ARG  51 -11.350  -4.803   3.597
  382    HG2  ARG  51          2HG       ARG  51 -12.469  -3.902   5.609
  383    HG3  ARG  51          1HG       ARG  51 -12.208  -5.438   6.436
  384    HD2  ARG  51          2HD       ARG  51  -9.749  -5.154   6.094
  385    HD3  ARG  51          1HD       ARG  51 -10.062  -3.563   5.401
  386    HE   ARG  51           HE       ARG  51 -11.297  -3.317   7.798
  387   HH11  ARG  51          1HH1      ARG  51 -10.303  -2.823   9.765
  388   HH12  ARG  51          2HH1      ARG  51  -8.643  -3.249  10.012
  389   HH21  ARG  51          1HH2      ARG  51  -8.257  -4.663   6.871
  390   HH22  ARG  51          2HH2      ARG  51  -7.486  -4.291   8.376
  391    H    PHE  52           H        PHE  52 -13.261  -4.338   1.887
  392    HA   PHE  52           HA       PHE  52 -15.128  -2.459   3.243
  393    HB2  PHE  52          2HB       PHE  52 -13.317  -2.150   0.835
  394    HB3  PHE  52          1HB       PHE  52 -14.449  -0.916   1.375
  395    HD1  PHE  52          1HD       PHE  52 -11.309  -2.658   2.100
  396    HD2  PHE  52          2HD       PHE  52 -14.152   0.223   3.542
  397    HE1  PHE  52          1HE       PHE  52  -9.666  -1.877   3.786
  398    HE2  PHE  52          2HE       PHE  52 -12.507   1.003   5.226
  399    HZ   PHE  52           HZ       PHE  52 -10.264  -0.047   5.348
  400    H    GLY  53           H        GLY  53 -15.177  -4.998   1.049
  401    HA2  GLY  53          2HA       GLY  53 -16.886  -5.793  -0.350
  402    HA3  GLY  53          1HA       GLY  53 -17.939  -4.589   0.394
  403    H    ILE  54           H        ILE  54 -14.941  -3.736  -1.236
  404    HA   ILE  54           HA       ILE  54 -16.589  -2.364  -3.331
  405    HB   ILE  54           HB       ILE  54 -14.762  -0.746  -3.487
  406   HG12  ILE  54          2HG1      ILE  54 -13.444  -2.530  -1.412
  407   HG13  ILE  54          1HG1      ILE  54 -12.885  -2.255  -3.060
  408   HG21  ILE  54          1HG2      ILE  54 -15.508  -1.309  -0.600
  409   HG22  ILE  54          2HG2      ILE  54 -16.504  -0.418  -1.748
  410   HG23  ILE  54          3HG2      ILE  54 -14.950   0.237  -1.239
  411   HD11  ILE  54          1HD1      ILE  54 -11.585  -0.866  -1.548
  412   HD12  ILE  54          2HD1      ILE  54 -13.059  -0.192  -0.852
  413   HD13  ILE  54          3HD1      ILE  54 -12.628   0.170  -2.524
  414    H    ALA  55           H        ALA  55 -15.864  -2.491  -5.512
  415    HA   ALA  55           HA       ALA  55 -14.541  -4.956  -6.229
  416    HB1  ALA  55          1HB       ALA  55 -15.491  -2.542  -7.759
  417    HB2  ALA  55          2HB       ALA  55 -16.084  -4.202  -7.836
  418    HB3  ALA  55          3HB       ALA  55 -14.530  -3.785  -8.559
  419    H    ALA  56           H        ALA  56 -12.420  -5.250  -7.015
  420    HA   ALA  56           HA       ALA  56 -10.387  -3.556  -5.956
  421    HB1  ALA  56          1HB       ALA  56 -10.165  -5.506  -8.270
  422    HB2  ALA  56          2HB       ALA  56 -10.037  -5.945  -6.567
  423    HB3  ALA  56          3HB       ALA  56  -8.829  -4.888  -7.298
  424    H    ASP  57           H        ASP  57 -11.948  -3.671  -9.121
  425    HA   ASP  57           HA       ASP  57 -11.810  -2.207 -10.950
  426    HB2  ASP  57          2HB       ASP  57 -11.142  -0.313  -8.690
  427    HB3  ASP  57          1HB       ASP  57 -11.528   0.198 -10.331
  428    H    ASP  58           H        ASP  58  -9.492  -3.755 -10.560
  429    HA   ASP  58           HA       ASP  58  -7.160  -1.985 -10.692
  430    HB2  ASP  58          2HB       ASP  58  -7.485  -4.959 -11.122
  431    HB3  ASP  58          1HB       ASP  58  -5.935  -4.122 -11.177
  432    H    VAL  59           H        VAL  59  -7.458  -0.690 -12.553
  433    HA   VAL  59           HA       VAL  59  -8.286  -1.699 -15.097
  434    HB   VAL  59           HB       VAL  59  -6.618   0.715 -14.377
  435   HG11  VAL  59          1HG1      VAL  59  -7.648   1.395 -16.733
  436   HG12  VAL  59          2HG1      VAL  59  -7.620  -0.351 -16.986
  437   HG13  VAL  59          3HG1      VAL  59  -6.123   0.513 -16.631
  438   HG21  VAL  59          1HG2      VAL  59  -9.293   0.163 -13.901
  439   HG22  VAL  59          2HG2      VAL  59  -9.337   1.070 -15.413
  440   HG23  VAL  59          3HG2      VAL  59  -8.584   1.776 -13.984
  441    H    GLU  60           H        GLU  60  -5.062  -1.178 -13.695
  442    HA   GLU  60           HA       GLU  60  -3.978  -3.302 -15.393
  443    HB2  GLU  60          2HB       GLU  60  -3.889  -1.313 -16.886
  444    HB3  GLU  60          1HB       GLU  60  -2.906  -0.484 -15.685
  445    HG2  GLU  60          2HG       GLU  60  -1.226  -2.289 -15.839
  446    HG3  GLU  60          1HG       GLU  60  -2.193  -3.060 -17.089
  447    H    LEU  61           H        LEU  61  -2.154  -4.208 -14.446
  448    HA   LEU  61           HA       LEU  61  -1.307  -2.988 -11.868
  449    HB2  LEU  61          2HB       LEU  61  -0.800  -5.797 -12.888
  450    HB3  LEU  61          1HB       LEU  61  -0.546  -5.203 -11.249
  451    HG   LEU  61           HG       LEU  61  -3.192  -5.463 -12.682
  452   HD11  LEU  61          1HD1      LEU  61  -3.584  -6.914 -10.558
  453   HD12  LEU  61          2HD1      LEU  61  -1.825  -6.931 -10.437
  454   HD13  LEU  61          3HD1      LEU  61  -2.618  -7.592 -11.867
  455   HD21  LEU  61          1HD2      LEU  61  -2.370  -4.064 -10.155
  456   HD22  LEU  61          2HD2      LEU  61  -3.965  -4.812 -10.249
  457   HD23  LEU  61          3HD2      LEU  61  -3.516  -3.545 -11.393
  458    H    SER  62           H        SER  62   0.819  -2.348 -11.580
  459    HA   SER  62           HA       SER  62   2.917  -3.287 -13.382
  460    HB2  SER  62          2HB       SER  62   1.472  -1.010 -14.157
  461    HB3  SER  62          1HB       SER  62   2.966  -0.384 -13.468
  462    HG   SER  62           HG       SER  62   3.187  -0.889 -15.688
  463    HA   PRO  63           HA       PRO  63   5.261  -2.481  -9.708
  464    HB2  PRO  63          2HB       PRO  63   7.743  -1.992 -10.840
  465    HB3  PRO  63          1HB       PRO  63   7.069  -3.604 -10.547
  466    HG2  PRO  63          2HG       PRO  63   7.211  -2.037 -13.060
  467    HG3  PRO  63          1HG       PRO  63   7.346  -3.785 -12.804
  468    HD2  PRO  63          2HD       PRO  63   5.088  -2.606 -13.786
  469    HD3  PRO  63          1HD       PRO  63   5.057  -4.102 -12.830
  470    H    GLU  64           H        GLU  64   5.135  -0.157 -12.287
  471    HA   GLU  64           HA       GLU  64   6.624   1.973 -11.151
  472    HB2  GLU  64          2HB       GLU  64   4.187   2.048 -12.927
  473    HB3  GLU  64          1HB       GLU  64   5.209   3.436 -12.587
  474    HG2  GLU  64          2HG       GLU  64   7.148   2.196 -13.502
  475    HG3  GLU  64          1HG       GLU  64   6.076   0.860 -13.908
  476    H    HIS  65           H        HIS  65   3.362   0.838 -10.523
  477    HA   HIS  65           HA       HIS  65   2.456   3.155  -9.083
  478    HB2  HIS  65          2HB       HIS  65   0.988   1.340 -10.027
  479    HB3  HIS  65          1HB       HIS  65   1.538   0.293  -8.719
  480    HD1  HIS  65          1HD       HIS  65   0.072   3.813  -9.026
  481    HD2  HIS  65          2HD       HIS  65  -0.116   0.483  -6.522
  482    HE1  HIS  65          1HE       HIS  65  -1.616   4.368  -7.220
  483    HE2  HIS  65          2HE       HIS  65  -1.738   2.348  -5.690
  484    H    PHE  66           H        PHE  66   4.424   0.406  -8.147
  485    HA   PHE  66           HA       PHE  66   4.105   1.065  -5.278
  486    HB2  PHE  66          2HB       PHE  66   5.633  -1.128  -6.702
  487    HB3  PHE  66          1HB       PHE  66   5.593  -0.929  -4.949
  488    HD1  PHE  66          1HD       PHE  66   3.453  -1.155  -3.705
  489    HD2  PHE  66          2HD       PHE  66   3.734  -1.987  -7.909
  490    HE1  PHE  66          1HE       PHE  66   1.282  -2.347  -3.613
  491    HE2  PHE  66          2HE       PHE  66   1.562  -3.180  -7.816
  492    HZ   PHE  66           HZ       PHE  66   0.337  -3.358  -5.668
  493    H    ARG  67           H        ARG  67   5.807   2.487  -7.608
  494    HA   ARG  67           HA       ARG  67   8.518   2.447  -6.780
  495    HB2  ARG  67          2HB       ARG  67   6.875   4.660  -8.032
  496    HB3  ARG  67          1HB       ARG  67   8.626   4.731  -7.835
  497    HG2  ARG  67          2HG       ARG  67   7.467   2.301  -9.102
  498    HG3  ARG  67          1HG       ARG  67   7.535   3.777 -10.068
  499    HD2  ARG  67          2HD       ARG  67   9.919   2.696  -8.553
  500    HD3  ARG  67          1HD       ARG  67   9.580   2.259 -10.227
  501    HE   ARG  67           HE       ARG  67   9.526   5.014 -10.279
  502   HH11  ARG  67          1HH1      ARG  67  11.361   6.287 -10.623
  503   HH12  ARG  67          2HH1      ARG  67  12.923   5.659 -10.215
  504   HH21  ARG  67          1HH2      ARG  67  11.699   2.616  -9.090
  505   HH22  ARG  67          2HH2      ARG  67  13.114   3.580  -9.348
  506    H    SER  68           H        SER  68   5.772   4.275  -5.513
  507    HA   SER  68           HA       SER  68   7.395   4.892  -3.119
  508    HB2  SER  68          2HB       SER  68   7.000   7.272  -3.206
  509    HB3  SER  68          1HB       SER  68   7.718   6.792  -4.741
  510    HG   SER  68           HG       SER  68   4.940   7.099  -4.221
  511    H    ILE  69           H        ILE  69   6.065   5.652  -1.315
  512    HA   ILE  69           HA       ILE  69   3.581   4.273  -1.068
  513    HB   ILE  69           HB       ILE  69   4.510   6.645   0.575
  514   HG12  ILE  69          2HG1      ILE  69   6.380   5.189   0.577
  515   HG13  ILE  69          1HG1      ILE  69   5.500   4.779   2.043
  516   HG21  ILE  69          1HG2      ILE  69   2.677   4.302   1.027
  517   HG22  ILE  69          2HG2      ILE  69   2.319   6.019   1.203
  518   HG23  ILE  69          3HG2      ILE  69   3.372   5.212   2.365
  519   HD11  ILE  69          1HD1      ILE  69   6.029   2.694   1.024
  520   HD12  ILE  69          2HD1      ILE  69   5.556   3.272  -0.573
  521   HD13  ILE  69          3HD1      ILE  69   4.327   2.975   0.657
  522    H    ARG  70           H        ARG  70   4.366   7.623  -1.910
  523    HA   ARG  70           HA       ARG  70   1.753   8.715  -1.685
  524    HB2  ARG  70          2HB       ARG  70   3.992   9.425  -3.604
  525    HB3  ARG  70          1HB       ARG  70   2.556  10.414  -3.330
  526    HG2  ARG  70          2HG       ARG  70   3.146  10.525  -0.904
  527    HG3  ARG  70          1HG       ARG  70   4.635   9.649  -1.260
  528    HD2  ARG  70          2HD       ARG  70   3.829  12.339  -2.404
  529    HD3  ARG  70          1HD       ARG  70   5.088  12.054  -1.202
  530    HE   ARG  70           HE       ARG  70   5.506  10.547  -3.662
  531   HH11  ARG  70          1HH1      ARG  70   7.296  11.178  -4.892
  532   HH12  ARG  70          2HH1      ARG  70   8.058  12.700  -4.569
  533   HH21  ARG  70          1HH2      ARG  70   5.891  13.540  -1.995
  534   HH22  ARG  70          2HH2      ARG  70   7.263  14.037  -2.929
  535    H    SER  71           H        SER  71   3.279   6.901  -4.334
  536    HA   SER  71           HA       SER  71   1.267   7.357  -6.298
  537    HB2  SER  71          2HB       SER  71   3.477   6.214  -6.701
  538    HB3  SER  71          1HB       SER  71   2.835   4.793  -5.882
  539    HG   SER  71           HG       SER  71   1.821   6.053  -8.220
  540    H    ILE  72           H        ILE  72   1.521   4.891  -3.744
  541    HA   ILE  72           HA       ILE  72  -0.845   3.456  -4.403
  542    HB   ILE  72           HB       ILE  72   0.442   3.895  -1.691
  543   HG12  ILE  72          2HG1      ILE  72   0.814   1.642  -3.691
  544   HG13  ILE  72          1HG1      ILE  72   1.952   2.973  -3.479
  545   HG21  ILE  72          1HG2      ILE  72  -1.837   3.003  -1.546
  546   HG22  ILE  72          2HG2      ILE  72  -0.664   1.752  -1.138
  547   HG23  ILE  72          3HG2      ILE  72  -1.436   1.755  -2.723
  548   HD11  ILE  72          1HD1      ILE  72   2.156   2.342  -1.063
  549   HD12  ILE  72          2HD1      ILE  72   2.720   1.081  -2.160
  550   HD13  ILE  72          3HD1      ILE  72   1.142   0.935  -1.386
  551    H    ASP  73           H        ASP  73  -0.279   6.323  -2.397
  552    HA   ASP  73           HA       ASP  73  -2.831   6.556  -1.213
  553    HB2  ASP  73          2HB       ASP  73  -0.953   8.730  -2.190
  554    HB3  ASP  73          1HB       ASP  73  -2.321   8.994  -1.114
  555    H    ALA  74           H        ALA  74  -1.689   7.514  -4.430
  556    HA   ALA  74           HA       ALA  74  -4.031   8.949  -5.216
  557    HB1  ALA  74          1HB       ALA  74  -2.407   7.334  -7.165
  558    HB2  ALA  74          2HB       ALA  74  -1.697   8.745  -6.380
  559    HB3  ALA  74          3HB       ALA  74  -3.138   8.925  -7.382
  560    H    PHE  75           H        PHE  75  -3.176   5.502  -5.453
  561    HA   PHE  75           HA       PHE  75  -5.454   4.709  -6.986
  562    HB2  PHE  75          2HB       PHE  75  -3.477   3.254  -6.551
  563    HB3  PHE  75          1HB       PHE  75  -4.010   3.092  -4.880
  564    HD1  PHE  75          1HD       PHE  75  -5.868   1.685  -4.282
  565    HD2  PHE  75          2HD       PHE  75  -4.873   2.354  -8.406
  566    HE1  PHE  75          1HE       PHE  75  -7.407  -0.141  -4.949
  567    HE2  PHE  75          2HE       PHE  75  -6.414   0.528  -9.073
  568    HZ   PHE  75           HZ       PHE  75  -7.681  -0.719  -7.345
  569    H    VAL  76           H        VAL  76  -4.952   4.653  -3.443
  570    HA   VAL  76           HA       VAL  76  -7.627   3.842  -2.836
  571    HB   VAL  76           HB       VAL  76  -5.532   5.306  -1.212
  572   HG11  VAL  76          1HG1      VAL  76  -8.302   4.348  -0.524
  573   HG12  VAL  76          2HG1      VAL  76  -7.551   5.900  -0.157
  574   HG13  VAL  76          3HG1      VAL  76  -7.047   4.449   0.710
  575   HG21  VAL  76          1HG2      VAL  76  -4.913   3.213  -0.423
  576   HG22  VAL  76          2HG2      VAL  76  -5.412   2.783  -2.059
  577   HG23  VAL  76          3HG2      VAL  76  -6.510   2.520  -0.705
  578    H    VAL  77           H        VAL  77  -6.089   7.041  -3.108
  579    HA   VAL  77           HA       VAL  77  -8.269   8.611  -2.222
  580    HB   VAL  77           HB       VAL  77  -6.101   9.146  -4.260
  581   HG11  VAL  77          1HG1      VAL  77  -7.450  10.853  -4.908
  582   HG12  VAL  77          2HG1      VAL  77  -6.950  11.595  -3.389
  583   HG13  VAL  77          3HG1      VAL  77  -8.473  10.711  -3.481
  584   HG21  VAL  77          1HG2      VAL  77  -4.843   9.820  -2.488
  585   HG22  VAL  77          2HG2      VAL  77  -5.985   8.888  -1.517
  586   HG23  VAL  77          3HG2      VAL  77  -6.209  10.627  -1.715
  587    H    GLY  78           H        GLY  78  -7.520   7.289  -5.428
  588    HA2  GLY  78          2HA       GLY  78  -9.608   8.577  -6.863
  589    HA3  GLY  78          1HA       GLY  78  -8.856   7.056  -7.334
  590    H    ALA  79           H        ALA  79  -9.653   5.651  -4.852
  591    HA   ALA  79           HA       ALA  79 -12.496   5.228  -5.614
  592    HB1  ALA  79          1HB       ALA  79 -10.760   3.331  -5.581
  593    HB2  ALA  79          2HB       ALA  79 -12.293   3.027  -4.762
  594    HB3  ALA  79          3HB       ALA  79 -10.857   3.440  -3.824
  595    H    THR  80           H        THR  80 -10.493   5.491  -2.674
  596    HA   THR  80           HA       THR  80 -12.914   6.551  -1.271
  597    HB   THR  80           HB       THR  80 -12.392   5.302   0.693
  598    HG1  THR  80          1HG       THR  80 -10.029   5.647   0.216
  599   HG21  THR  80          1HG2      THR  80 -13.324   4.040  -1.365
  600   HG22  THR  80          2HG2      THR  80 -12.682   3.076  -0.034
  601   HG23  THR  80          3HG2      THR  80 -11.713   3.332  -1.485
  602    H    THR  81           H        THR  81 -12.402   8.121   0.413
  603    HA   THR  81           HA       THR  81  -9.590   9.093   0.383
  604    HB   THR  81           HB       THR  81 -10.907  10.410  -1.255
  605    HG1  THR  81          1HG       THR  81  -9.234  11.350   0.080
  606   HG21  THR  81          1HG2      THR  81 -12.464  11.772   0.845
  607   HG22  THR  81          2HG2      THR  81 -12.966  10.111   0.528
  608   HG23  THR  81          3HG2      THR  81 -12.945  11.290  -0.783
  609    HA   PRO  82           HA       PRO  82 -11.169   8.794   4.716
  610    HB2  PRO  82          2HB       PRO  82  -8.315   8.436   5.322
  611    HB3  PRO  82          1HB       PRO  82  -9.682   7.377   5.706
  612    HG2  PRO  82          2HG       PRO  82  -7.812   6.759   3.863
  613    HG3  PRO  82          1HG       PRO  82  -9.493   6.208   3.765
  614    HD2  PRO  82          2HD       PRO  82  -8.133   8.388   2.230
  615    HD3  PRO  82          1HD       PRO  82  -9.414   7.266   1.714
  616    HA   PRO  83           HA       PRO  83 -10.015  12.720   6.414
  617    HB2  PRO  83          2HB       PRO  83  -8.382  11.591   8.617
  618    HB3  PRO  83          1HB       PRO  83  -9.836  12.602   8.696
  619    HG2  PRO  83          2HG       PRO  83  -9.872   9.992   9.305
  620    HG3  PRO  83          1HG       PRO  83 -11.253  10.815   8.560
  621    HD2  PRO  83          2HD       PRO  83  -9.280   8.945   7.318
  622    HD3  PRO  83          1HD       PRO  83 -11.001   9.182   6.946
  623    H    VAL  84           H        VAL  84  -8.301  14.285   6.372
  624    HA   VAL  84           HA       VAL  84  -5.821  13.271   5.116
  625    HB   VAL  84           HB       VAL  84  -6.669  16.135   5.632
  626   HG11  VAL  84          1HG1      VAL  84  -5.065  15.800   3.309
  627   HG12  VAL  84          2HG1      VAL  84  -4.278  14.911   4.614
  628   HG13  VAL  84          3HG1      VAL  84  -4.636  16.627   4.808
  629   HG21  VAL  84          1HG2      VAL  84  -7.737  14.176   3.819
  630   HG22  VAL  84          2HG2      VAL  84  -6.891  15.414   2.889
  631   HG23  VAL  84          3HG2      VAL  84  -8.189  15.872   3.991
  632    H    GLU  85           H        GLU  85  -3.947  13.072   6.233
  633    HA   GLU  85           HA       GLU  85  -3.558  14.681   8.698
  634    HB2  GLU  85          2HB       GLU  85  -3.142  11.682   8.508
  635    HB3  GLU  85          1HB       GLU  85  -2.726  12.685   9.898
  636    HG2  GLU  85          2HG       GLU  85  -5.111  13.366  10.088
  637    HG3  GLU  85          1HG       GLU  85  -5.505  12.281   8.754
  638    H    ALA  86           H        ALA  86  -1.289  14.957   9.234
  639    HA   ALA  86           HA       ALA  86   0.427  15.139   6.930
  640    HB1  ALA  86          1HB       ALA  86   2.212  15.454   8.841
  641    HB2  ALA  86          2HB       ALA  86   0.795  15.507   9.889
  642    HB3  ALA  86          3HB       ALA  86   0.975  16.686   8.592
  643    H    LYS  87           H        LYS  87   2.087  13.769   6.253
  644    HA   LYS  87           HA       LYS  87   1.956  11.006   7.244
  645    HB2  LYS  87          2HB       LYS  87   2.187  11.611   4.796
  646    HB3  LYS  87          1HB       LYS  87   3.826  12.155   5.154
  647    HG2  LYS  87          2HG       LYS  87   4.366   9.898   6.035
  648    HG3  LYS  87          1HG       LYS  87   2.741   9.360   5.610
  649    HD2  LYS  87          2HD       LYS  87   3.215  10.008   3.229
  650    HD3  LYS  87          1HD       LYS  87   4.881  10.344   3.703
  651    HE2  LYS  87          2HE       LYS  87   3.491   7.736   3.389
  652    HE3  LYS  87          1HE       LYS  87   5.182   8.152   3.106
  653    HZ1  LYS  87          1HZ       LYS  87   3.860   7.678   5.718
  654    HZ2  LYS  87          2HZ       LYS  87   5.426   8.318   5.562
  655    HZ3  LYS  87          3HZ       LYS  87   5.085   6.750   5.002
  656    H    LEU  88           H        LEU  88   3.483  10.036   8.547
  657    HA   LEU  88           HA       LEU  88   5.511  11.805   9.757
  658    HB2  LEU  88          2HB       LEU  88   4.871   8.905  10.373
  659    HB3  LEU  88          1HB       LEU  88   5.828  10.003  11.366
  660    HG   LEU  88           HG       LEU  88   2.884  10.289  10.700
  661   HD11  LEU  88          1HD1      LEU  88   3.639   8.581  12.453
  662   HD12  LEU  88          2HD1      LEU  88   2.492   9.802  13.003
  663   HD13  LEU  88          3HD1      LEU  88   4.202   9.957  13.402
  664   HD21  LEU  88          1HD2      LEU  88   4.898  12.120  11.979
  665   HD22  LEU  88          2HD2      LEU  88   3.222  12.160  12.528
  666   HD23  LEU  88          3HD2      LEU  88   3.606  12.508  10.842
  667    H    GLN  89           H        GLN  89   7.735  11.515   9.535
  668    HA   GLN  89           HA       GLN  89   9.682  10.938   8.346
  669    HB2  GLN  89          2HB       GLN  89   8.398   8.209   8.671
  670    HB3  GLN  89          1HB       GLN  89  10.082   8.486   8.225
  671    HG2  GLN  89          2HG       GLN  89  10.394   9.760  10.350
  672    HG3  GLN  89          1HG       GLN  89   8.741   9.342  10.807
  673   HE21  GLN  89          1HE2      GLN  89   9.783   6.721   9.074
  674   HE22  GLN  89          2HE2      GLN  89  10.404   5.769  10.334
  675    H1   PN7 101          3HO       SAT 101   5.709  -8.846 -11.631
  676    H2   PN7 101          1H1       SAT 101   6.034  -7.485  -8.546
  677    H3   PN7 101          2H1       SAT 101   4.350  -7.924  -8.835
  678    H5   PN7 101          1HE1      SAT 101   7.025  -7.625 -11.465
  679    H6   PN7 101          2HE1      SAT 101   7.361  -6.406 -10.237
  680    H7   PN7 101          3HE1      SAT 101   6.675  -5.927 -11.789
  681    H8   PN7 101          2HE2      SAT 101   3.662  -5.544  -9.990
  682    H9   PN7 101          3HE2      SAT 101   5.088  -4.746 -10.649
  683    H10  PN7 101          1HE2      SAT 101   5.095  -5.329  -8.986
  684    H11  PN7 101          3H        SAT 101   3.343  -7.470 -11.175
  685    H12  PN7 101          5H        SAT 101   3.220  -4.989 -12.742
  686    H13  PN7 101          1H6       SAT 101   2.245  -7.545 -13.805
  687    H14  PN7 101          2H6       SAT 101   1.377  -6.010 -13.839
  688    H15  PN7 101          1H7       SAT 101   1.875  -6.225 -16.090
  689    H16  PN7 101          2H7       SAT 101   3.367  -7.113 -15.783
  690    H17  PN7 101          9H        SAT 101   5.359  -4.837 -14.784
  691    H18  PN7 101          1H10      SAT 101   6.591  -5.764 -16.565
  692    H19  PN7 101          2H10      SAT 101   5.080  -6.407 -17.208
  693    H20  PN7 101          1H11      SAT 101   4.775  -3.699 -17.610
  694    H21  PN7 101          2H11      SAT 101   5.327  -4.842 -18.834
  695    H22  PN7 101          2HS1      SAT 101   7.259  -3.107 -17.088
  Start of MODEL    6
    1    H1   MET   1          1HT       MET   1  -0.241  13.991   0.012
    2    H2   MET   1          2HT       MET   1  -1.472  14.491   1.071
    3    H3   MET   1          3HT       MET   1  -1.866  13.705  -0.383
    4    HA   MET   1           HA       MET   1  -1.263  11.649   0.369
    5    HB2  MET   1          2HB       MET   1   0.540  13.196   2.228
    6    HB3  MET   1          1HB       MET   1   0.209  11.480   2.481
    7    HG2  MET   1          2HG       MET   1   0.975  11.006   0.177
    8    HG3  MET   1          1HG       MET   1   1.353  12.715  -0.040
    9    HE1  MET   1          1HE       MET   1   2.606  14.029   1.490
   10    HE2  MET   1          2HE       MET   1   4.139  13.555   2.215
   11    HE3  MET   1          3HE       MET   1   2.644  13.351   3.124
   12    H    GLN   2           H        GLN   2  -3.467  11.514   0.881
   13    HA   GLN   2           HA       GLN   2  -4.244  12.320   3.649
   14    HB2  GLN   2          2HB       GLN   2  -5.957  11.536   1.265
   15    HB3  GLN   2          1HB       GLN   2  -6.574  12.020   2.845
   16    HG2  GLN   2          2HG       GLN   2  -5.505  14.221   2.608
   17    HG3  GLN   2          1HG       GLN   2  -4.847  13.742   1.043
   18   HE21  GLN   2          1HE2      GLN   2  -6.588  15.982   1.216
   19   HE22  GLN   2          2HE2      GLN   2  -8.058  15.595   0.461
   20    H    HIS   3           H        HIS   3  -4.919  10.706   5.108
   21    HA   HIS   3           HA       HIS   3  -4.916   8.511   5.983
   22    HB2  HIS   3          2HB       HIS   3  -7.026   8.505   4.671
   23    HB3  HIS   3          1HB       HIS   3  -6.129   7.975   3.250
   24    HD1  HIS   3          1HD       HIS   3  -5.715   5.504   3.008
   25    HD2  HIS   3          2HD       HIS   3  -6.993   6.511   6.849
   26    HE1  HIS   3          1HE       HIS   3  -6.134   3.317   4.220
   27    HE2  HIS   3          2HE       HIS   3  -6.914   3.919   6.559
   28    H    ALA   4           H        ALA   4  -2.782   9.501   3.850
   29    HA   ALA   4           HA       ALA   4  -1.748   7.189   2.543
   30    HB1  ALA   4          1HB       ALA   4  -0.082   9.491   3.573
   31    HB2  ALA   4          2HB       ALA   4  -1.114   9.630   2.150
   32    HB3  ALA   4          3HB       ALA   4   0.222   8.480   2.160
   33    H    SER   5           H        SER   5  -1.208   8.477   5.808
   34    HA   SER   5           HA       SER   5   1.009   6.853   6.512
   35    HB2  SER   5          2HB       SER   5  -1.262   7.743   8.311
   36    HB3  SER   5          1HB       SER   5   0.340   7.235   8.838
   37    HG   SER   5           HG       SER   5   1.124   9.110   8.245
   38    H    VAL   6           H        VAL   6  -2.470   6.193   6.691
   39    HA   VAL   6           HA       VAL   6  -2.195   3.597   7.907
   40    HB   VAL   6           HB       VAL   6  -4.386   4.837   6.242
   41   HG11  VAL   6          1HG1      VAL   6  -5.709   2.888   7.410
   42   HG12  VAL   6          2HG1      VAL   6  -4.125   2.119   7.494
   43   HG13  VAL   6          3HG1      VAL   6  -4.810   2.557   5.929
   44   HG21  VAL   6          1HG2      VAL   6  -4.189   5.930   8.356
   45   HG22  VAL   6          2HG2      VAL   6  -3.924   4.403   9.198
   46   HG23  VAL   6          3HG2      VAL   6  -5.516   4.783   8.539
   47    H    ILE   7           H        ILE   7  -2.244   4.736   4.562
   48    HA   ILE   7           HA       ILE   7  -2.454   2.209   3.284
   49    HB   ILE   7           HB       ILE   7  -0.996   4.713   2.401
   50   HG12  ILE   7          2HG1      ILE   7  -3.748   3.659   1.678
   51   HG13  ILE   7          1HG1      ILE   7  -3.461   4.898   2.897
   52   HG21  ILE   7          1HG2      ILE   7  -1.748   2.163   0.959
   53   HG22  ILE   7          2HG2      ILE   7  -0.168   2.942   1.039
   54   HG23  ILE   7          3HG2      ILE   7  -1.465   3.675   0.095
   55   HD11  ILE   7          1HD1      ILE   7  -3.469   5.127  -0.021
   56   HD12  ILE   7          2HD1      ILE   7  -2.032   5.833   0.717
   57   HD13  ILE   7          3HD1      ILE   7  -3.635   6.384   1.203
   58    H    ALA   8           H        ALA   8   0.483   4.036   4.210
   59    HA   ALA   8           HA       ALA   8   2.328   2.011   3.354
   60    HB1  ALA   8          1HB       ALA   8   2.429   4.463   4.985
   61    HB2  ALA   8          2HB       ALA   8   3.587   3.853   3.804
   62    HB3  ALA   8          3HB       ALA   8   3.607   3.238   5.457
   63    H    GLN   9           H        GLN   9   0.831   2.689   6.496
   64    HA   GLN   9           HA       GLN   9   2.072   0.522   7.906
   65    HB2  GLN   9          2HB       GLN   9   0.936   2.443   9.011
   66    HB3  GLN   9          1HB       GLN   9  -0.612   1.847   8.412
   67    HG2  GLN   9          2HG       GLN   9   0.514  -0.382   9.630
   68    HG3  GLN   9          1HG       GLN   9   0.957   0.943  10.703
   69   HE21  GLN   9          1HE2      GLN   9  -1.944  -0.143   8.841
   70   HE22  GLN   9          2HE2      GLN   9  -3.052   0.232  10.074
   71    H    PHE  10           H        PHE  10  -1.004   0.830   6.191
   72    HA   PHE  10           HA       PHE  10  -1.978  -1.802   6.753
   73    HB2  PHE  10          2HB       PHE  10  -3.367   0.108   5.924
   74    HB3  PHE  10          1HB       PHE  10  -2.576  -0.045   4.357
   75    HD1  PHE  10          1HD       PHE  10  -3.110  -1.846   2.846
   76    HD2  PHE  10          2HD       PHE  10  -4.827  -1.704   6.780
   77    HE1  PHE  10          1HE       PHE  10  -4.725  -3.614   2.204
   78    HE2  PHE  10          2HE       PHE  10  -6.442  -3.473   6.138
   79    HZ   PHE  10           HZ       PHE  10  -6.391  -4.427   3.853
   80    H    VAL  11           H        VAL  11  -0.331  -0.463   3.891
   81    HA   VAL  11           HA       VAL  11  -0.171  -2.974   2.499
   82    HB   VAL  11           HB       VAL  11   1.553  -0.491   2.253
   83   HG11  VAL  11          1HG1      VAL  11   1.733  -3.097   1.036
   84   HG12  VAL  11          2HG1      VAL  11   2.769  -1.690   0.790
   85   HG13  VAL  11          3HG1      VAL  11   1.320  -1.901  -0.192
   86   HG21  VAL  11          1HG2      VAL  11  -0.721  -1.340   0.459
   87   HG22  VAL  11          2HG2      VAL  11   0.023   0.251   0.608
   88   HG23  VAL  11          3HG2      VAL  11  -1.009  -0.364   1.899
   89    H    VAL  12           H        VAL  12   2.144  -1.209   4.545
   90    HA   VAL  12           HA       VAL  12   4.270  -3.105   4.304
   91    HB   VAL  12           HB       VAL  12   3.626  -1.179   6.543
   92   HG11  VAL  12          1HG1      VAL  12   5.199  -2.970   7.226
   93   HG12  VAL  12          2HG1      VAL  12   6.001  -1.406   7.139
   94   HG13  VAL  12          3HG1      VAL  12   6.222  -2.585   5.846
   95   HG21  VAL  12          1HG2      VAL  12   4.729   0.444   5.345
   96   HG22  VAL  12          2HG2      VAL  12   4.146  -0.517   3.987
   97   HG23  VAL  12          3HG2      VAL  12   5.800  -0.718   4.563
   98    H    GLU  13           H        GLU  13   1.497  -2.900   6.481
   99    HA   GLU  13           HA       GLU  13   2.255  -4.836   8.392
  100    HB2  GLU  13          2HB       GLU  13   0.216  -3.422   8.551
  101    HB3  GLU  13          1HB       GLU  13  -0.515  -4.389   7.276
  102    HG2  GLU  13          2HG       GLU  13  -0.220  -6.420   8.686
  103    HG3  GLU  13          1HG       GLU  13   0.402  -5.391   9.974
  104    H    GLU  14           H        GLU  14   1.064  -5.222   5.113
  105    HA   GLU  14           HA       GLU  14   0.422  -8.009   5.284
  106    HB2  GLU  14          2HB       GLU  14  -0.271  -6.494   3.418
  107    HB3  GLU  14          1HB       GLU  14   1.401  -6.477   2.862
  108    HG2  GLU  14          2HG       GLU  14   1.325  -8.959   2.663
  109    HG3  GLU  14          1HG       GLU  14  -0.380  -8.914   3.112
  110    H    PHE  15           H        PHE  15   3.451  -6.282   4.762
  111    HA   PHE  15           HA       PHE  15   4.869  -8.880   5.054
  112    HB2  PHE  15          2HB       PHE  15   6.342  -8.426   3.187
  113    HB3  PHE  15          1HB       PHE  15   4.681  -8.315   2.607
  114    HD1  PHE  15          1HD       PHE  15   3.595  -6.021   2.427
  115    HD2  PHE  15          2HD       PHE  15   7.810  -6.561   3.059
  116    HE1  PHE  15          1HE       PHE  15   4.006  -3.695   1.673
  117    HE2  PHE  15          2HE       PHE  15   8.220  -4.233   2.310
  118    HZ   PHE  15           HZ       PHE  15   6.319  -2.800   1.617
  119    H    LEU  16           H        LEU  16   4.566  -6.966   7.071
  120    HA   LEU  16           HA       LEU  16   6.867  -5.191   7.057
  121    HB2  LEU  16          2HB       LEU  16   5.966  -4.223   8.913
  122    HB3  LEU  16          1HB       LEU  16   4.521  -5.023   8.335
  123    HG   LEU  16           HG       LEU  16   6.414  -6.094  10.458
  124   HD11  LEU  16          1HD1      LEU  16   3.971  -4.449  10.496
  125   HD12  LEU  16          2HD1      LEU  16   5.230  -4.631  11.717
  126   HD13  LEU  16          3HD1      LEU  16   3.944  -5.832  11.591
  127   HD21  LEU  16          1HD2      LEU  16   4.751  -7.559   8.773
  128   HD22  LEU  16          2HD2      LEU  16   3.748  -7.293  10.193
  129   HD23  LEU  16          3HD2      LEU  16   5.316  -8.084  10.355
  130    HA   PRO  17           HA       PRO  17   9.615  -8.279   8.782
  131    HB2  PRO  17          2HB       PRO  17  11.763  -6.694   9.262
  132    HB3  PRO  17          1HB       PRO  17  11.271  -7.113   7.612
  133    HG2  PRO  17          2HG       PRO  17  10.764  -4.613   9.154
  134    HG3  PRO  17          1HG       PRO  17  11.246  -4.814   7.462
  135    HD2  PRO  17          2HD       PRO  17   8.662  -4.328   8.242
  136    HD3  PRO  17          1HD       PRO  17   9.095  -5.201   6.757
  137    H    ASP  18           H        ASP  18  11.527  -7.350  10.856
  138    HA   ASP  18           HA       ASP  18   9.725  -7.485  13.149
  139    HB2  ASP  18          2HB       ASP  18  11.785  -7.563  14.466
  140    HB3  ASP  18          1HB       ASP  18  11.918  -8.673  13.107
  141    H    VAL  19           H        VAL  19  10.208  -5.057  11.177
  142    HA   VAL  19           HA       VAL  19  10.584  -2.992  13.312
  143    HB   VAL  19           HB       VAL  19  10.867  -2.651  10.314
  144   HG11  VAL  19          1HG1      VAL  19  10.434  -0.544  11.312
  145   HG12  VAL  19          2HG1      VAL  19  12.191  -0.612  11.170
  146   HG13  VAL  19          3HG1      VAL  19  11.418  -0.918  12.726
  147   HG21  VAL  19          1HG2      VAL  19  13.370  -2.479  11.038
  148   HG22  VAL  19          2HG2      VAL  19  12.656  -4.083  10.870
  149   HG23  VAL  19          3HG2      VAL  19  12.852  -3.368  12.471
  150    H    ALA  20           H        ALA  20   8.918  -1.543  13.656
  151    HA   ALA  20           HA       ALA  20   6.333  -2.110  12.496
  152    HB1  ALA  20          1HB       ALA  20   5.505  -0.363  13.897
  153    HB2  ALA  20          2HB       ALA  20   7.094   0.396  14.002
  154    HB3  ALA  20          3HB       ALA  20   6.794  -1.140  14.816
  155    HA   PRO  21           HA       PRO  21   6.632   0.262   8.702
  156    HB2  PRO  21          2HB       PRO  21   3.936   1.305   9.439
  157    HB3  PRO  21          1HB       PRO  21   4.480   0.557   7.927
  158    HG2  PRO  21          2HG       PRO  21   2.973  -0.755   9.712
  159    HG3  PRO  21          1HG       PRO  21   4.187  -1.565   8.711
  160    HD2  PRO  21          2HD       PRO  21   4.251  -0.981  11.615
  161    HD3  PRO  21          1HD       PRO  21   5.111  -2.226  10.680
  162    H    ALA  22           H        ALA  22   5.553   1.763  11.698
  163    HA   ALA  22           HA       ALA  22   5.923   4.500  10.843
  164    HB1  ALA  22          1HB       ALA  22   6.322   4.198  13.672
  165    HB2  ALA  22          2HB       ALA  22   5.005   3.139  13.168
  166    HB3  ALA  22          3HB       ALA  22   4.926   4.870  12.828
  167    H    ASP  23           H        ASP  23   8.061   1.986  11.862
  168    HA   ASP  23           HA       ASP  23  10.244   3.950  12.358
  169    HB2  ASP  23          2HB       ASP  23  10.029   0.987  12.958
  170    HB3  ASP  23          1HB       ASP  23  11.480   1.948  13.241
  171    H    VAL  24           H        VAL  24   8.981   2.556   9.760
  172    HA   VAL  24           HA       VAL  24  11.572   1.668   8.589
  173    HB   VAL  24           HB       VAL  24   8.748   1.461   7.491
  174   HG11  VAL  24          1HG1      VAL  24   9.835  -0.106   5.868
  175   HG12  VAL  24          2HG1      VAL  24  11.405   0.363   6.521
  176   HG13  VAL  24          3HG1      VAL  24  10.399   1.557   5.701
  177   HG21  VAL  24          1HG2      VAL  24  10.541  -0.404   9.032
  178   HG22  VAL  24          2HG2      VAL  24   9.353  -1.053   7.902
  179   HG23  VAL  24          3HG2      VAL  24   8.827  -0.071   9.269
  180    H    ASP  25           H        ASP  25  12.566   2.892   7.016
  181    HA   ASP  25           HA       ASP  25  11.748   5.630   6.673
  182    HB2  ASP  25          2HB       ASP  25  13.744   3.933   5.143
  183    HB3  ASP  25          1HB       ASP  25  13.556   5.675   4.932
  184    H    VAL  26           H        VAL  26   9.594   5.550   5.849
  185    HA   VAL  26           HA       VAL  26   8.777   4.044   3.573
  186    HB   VAL  26           HB       VAL  26   6.880   5.568   3.454
  187   HG11  VAL  26          1HG1      VAL  26   6.228   4.391   5.268
  188   HG12  VAL  26          2HG1      VAL  26   6.775   5.760   6.237
  189   HG13  VAL  26          3HG1      VAL  26   7.857   4.398   5.942
  190   HG21  VAL  26          1HG2      VAL  26   8.845   7.404   4.631
  191   HG22  VAL  26          2HG2      VAL  26   7.280   7.459   5.444
  192   HG23  VAL  26          3HG2      VAL  26   7.385   7.765   3.710
  193    H    ASP  27           H        ASP  27  11.235   6.162   3.589
  194    HA   ASP  27           HA       ASP  27  10.581   7.559   1.069
  195    HB2  ASP  27          2HB       ASP  27  11.880   8.694   2.897
  196    HB3  ASP  27          1HB       ASP  27  13.183   7.532   2.631
  197    H    LEU  28           H        LEU  28  11.399   4.515   1.807
  198    HA   LEU  28           HA       LEU  28  13.447   4.147  -0.308
  199    HB2  LEU  28          2HB       LEU  28  13.664   2.972   1.896
  200    HB3  LEU  28          1HB       LEU  28  12.177   2.101   1.535
  201    HG   LEU  28           HG       LEU  28  13.503   1.557  -0.730
  202   HD11  LEU  28          1HD1      LEU  28  15.478   2.875  -0.119
  203   HD12  LEU  28          2HD1      LEU  28  15.891   1.162  -0.204
  204   HD13  LEU  28          3HD1      LEU  28  15.661   1.938   1.363
  205   HD21  LEU  28          1HD2      LEU  28  12.689  -0.245   0.543
  206   HD22  LEU  28          2HD2      LEU  28  13.611   0.229   1.972
  207   HD23  LEU  28          3HD2      LEU  28  14.435  -0.491   0.589
  208    H    ASP  29           H        ASP  29  12.929   3.297  -2.296
  209    HA   ASP  29           HA       ASP  29  10.168   3.089  -3.072
  210    HB2  ASP  29          2HB       ASP  29  12.702   2.101  -4.420
  211    HB3  ASP  29          1HB       ASP  29  11.110   2.081  -5.178
  212    H    LEU  30           H        LEU  30   8.830   1.411  -2.596
  213    HA   LEU  30           HA       LEU  30   9.895  -1.012  -1.404
  214    HB2  LEU  30          2HB       LEU  30   7.576  -1.702  -1.192
  215    HB3  LEU  30          1HB       LEU  30   7.700   0.002  -0.753
  216    HG   LEU  30           HG       LEU  30   7.280   0.003  -3.527
  217   HD11  LEU  30          1HD1      LEU  30   5.133  -1.305  -3.671
  218   HD12  LEU  30          2HD1      LEU  30   5.516  -2.014  -2.103
  219   HD13  LEU  30          3HD1      LEU  30   6.566  -2.317  -3.489
  220   HD21  LEU  30          1HD2      LEU  30   6.395   1.658  -1.987
  221   HD22  LEU  30          2HD2      LEU  30   5.403   0.439  -1.185
  222   HD23  LEU  30          3HD2      LEU  30   5.043   0.920  -2.844
  223    H    VAL  31           H        VAL  31  10.107  -0.128  -4.479
  224    HA   VAL  31           HA       VAL  31   8.907  -2.144  -6.047
  225    HB   VAL  31           HB       VAL  31  10.287  -0.116  -6.829
  226   HG11  VAL  31          1HG1      VAL  31  12.283  -0.870  -5.408
  227   HG12  VAL  31          2HG1      VAL  31  12.645  -0.382  -7.063
  228   HG13  VAL  31          3HG1      VAL  31  12.568  -2.094  -6.645
  229   HG21  VAL  31          1HG2      VAL  31  10.930  -1.250  -8.907
  230   HG22  VAL  31          2HG2      VAL  31   9.380  -1.873  -8.342
  231   HG23  VAL  31          3HG2      VAL  31  10.851  -2.815  -8.099
  232    H    ASP  32           H        ASP  32  11.890  -2.219  -4.143
  233    HA   ASP  32           HA       ASP  32  12.860  -4.752  -5.000
  234    HB2  ASP  32          2HB       ASP  32  12.998  -3.425  -2.271
  235    HB3  ASP  32          1HB       ASP  32  13.911  -4.867  -2.715
  236    H    ASN  33           H        ASN  33  10.370  -3.811  -2.716
  237    HA   ASN  33           HA       ASN  33   9.823  -6.572  -1.891
  238    HB2  ASN  33          2HB       ASN  33   8.254  -4.037  -1.385
  239    HB3  ASN  33          1HB       ASN  33   8.024  -5.579  -0.566
  240   HD21  ASN  33          1HD2      ASN  33   9.196  -2.694   0.150
  241   HD22  ASN  33          2HD2      ASN  33  10.552  -3.095   1.089
  242    H    GLY  34           H        GLY  34   9.510  -5.307  -4.729
  243    HA2  GLY  34          2HA       GLY  34   6.913  -5.123  -5.623
  244    HA3  GLY  34          1HA       GLY  34   8.164  -5.941  -6.560
  245    H    VAL  35           H        VAL  35   8.299  -7.815  -4.039
  246    HA   VAL  35           HA       VAL  35   6.914 -10.015  -5.130
  247    HB   VAL  35           HB       VAL  35   7.595  -9.349  -2.252
  248   HG11  VAL  35          1HG1      VAL  35   5.992 -11.543  -3.395
  249   HG12  VAL  35          2HG1      VAL  35   6.099 -10.978  -1.728
  250   HG13  VAL  35          3HG1      VAL  35   7.320 -12.080  -2.365
  251   HG21  VAL  35          1HG2      VAL  35   8.903 -11.622  -3.528
  252   HG22  VAL  35          2HG2      VAL  35   9.623 -10.219  -2.740
  253   HG23  VAL  35          3HG2      VAL  35   9.154 -10.133  -4.438
  254    H    ILE  36           H        ILE  36   5.798  -7.489  -2.928
  255    HA   ILE  36           HA       ILE  36   3.189  -8.627  -2.440
  256    HB   ILE  36           HB       ILE  36   4.487  -6.731  -1.180
  257   HG12  ILE  36          2HG1      ILE  36   1.517  -6.618  -1.781
  258   HG13  ILE  36          1HG1      ILE  36   2.300  -7.508  -0.477
  259   HG21  ILE  36          1HG2      ILE  36   2.831  -5.008  -3.019
  260   HG22  ILE  36          2HG2      ILE  36   4.509  -5.393  -3.408
  261   HG23  ILE  36          3HG2      ILE  36   4.125  -4.521  -1.924
  262   HD11  ILE  36          1HD1      ILE  36   1.954  -5.672   0.797
  263   HD12  ILE  36          2HD1      ILE  36   1.571  -4.680  -0.611
  264   HD13  ILE  36          3HD1      ILE  36   3.252  -4.925  -0.137
  265    H    ASP  37           H        ASP  37   4.558  -6.713  -5.006
  266    HA   ASP  37           HA       ASP  37   2.209  -5.511  -6.035
  267    HB2  ASP  37          2HB       ASP  37   4.672  -6.467  -7.513
  268    HB3  ASP  37          1HB       ASP  37   3.431  -5.425  -8.203
  269    H    SER  38           H        SER  38   3.424  -8.813  -6.475
  270    HA   SER  38           HA       SER  38   1.159  -9.307  -8.343
  271    HB2  SER  38          2HB       SER  38   3.040 -11.509  -7.922
  272    HB3  SER  38          1HB       SER  38   2.487 -10.773  -9.424
  273    H    LEU  39           H        LEU  39   2.808 -11.247  -5.823
  274    HA   LEU  39           HA       LEU  39   0.446 -12.836  -5.393
  275    HB2  LEU  39          2HB       LEU  39   2.972 -12.549  -3.772
  276    HB3  LEU  39          1HB       LEU  39   1.722 -13.742  -3.436
  277    HG   LEU  39           HG       LEU  39   2.144 -14.143  -6.112
  278   HD11  LEU  39          1HD1      LEU  39   4.121 -12.464  -5.748
  279   HD12  LEU  39          2HD1      LEU  39   4.406 -13.936  -6.676
  280   HD13  LEU  39          3HD1      LEU  39   4.918 -13.843  -4.992
  281   HD21  LEU  39          1HD2      LEU  39   2.031 -15.847  -4.303
  282   HD22  LEU  39          2HD2      LEU  39   3.676 -15.427  -3.828
  283   HD23  LEU  39          3HD2      LEU  39   3.372 -16.149  -5.408
  284    H    GLY  40           H        GLY  40   2.039 -10.400  -3.328
  285    HA2  GLY  40          2HA       GLY  40  -0.017 -10.450  -1.327
  286    HA3  GLY  40          1HA       GLY  40   1.165  -9.160  -1.537
  287    H    LEU  41           H        LEU  41   0.460  -8.524  -4.242
  288    HA   LEU  41           HA       LEU  41  -1.569  -6.588  -3.820
  289    HB2  LEU  41          2HB       LEU  41   0.146  -6.562  -5.650
  290    HB3  LEU  41          1HB       LEU  41  -0.763  -7.835  -6.462
  291    HG   LEU  41           HG       LEU  41  -2.778  -6.146  -6.141
  292   HD11  LEU  41          1HD1      LEU  41  -0.321  -4.376  -6.091
  293   HD12  LEU  41          2HD1      LEU  41  -1.537  -4.514  -4.821
  294   HD13  LEU  41          3HD1      LEU  41  -1.963  -3.801  -6.377
  295   HD21  LEU  41          1HD2      LEU  41  -1.815  -6.955  -8.300
  296   HD22  LEU  41          2HD2      LEU  41  -0.602  -5.678  -8.205
  297   HD23  LEU  41          3HD2      LEU  41  -2.308  -5.264  -8.375
  298    H    LEU  42           H        LEU  42  -1.731  -9.839  -5.239
  299    HA   LEU  42           HA       LEU  42  -4.501  -9.676  -5.988
  300    HB2  LEU  42          2HB       LEU  42  -2.871 -11.410  -6.813
  301    HB3  LEU  42          1HB       LEU  42  -2.949 -12.164  -5.227
  302    HG   LEU  42           HG       LEU  42  -5.538 -12.130  -5.622
  303   HD11  LEU  42          1HD1      LEU  42  -4.780 -10.854  -7.915
  304   HD12  LEU  42          2HD1      LEU  42  -6.296 -11.734  -7.729
  305   HD13  LEU  42          3HD1      LEU  42  -4.905 -12.519  -8.476
  306   HD21  LEU  42          1HD2      LEU  42  -5.322 -14.325  -6.854
  307   HD22  LEU  42          2HD2      LEU  42  -4.290 -14.196  -5.430
  308   HD23  LEU  42          3HD2      LEU  42  -3.601 -13.985  -7.038
  309    H    LYS  43           H        LYS  43  -2.879 -10.920  -3.065
  310    HA   LYS  43           HA       LYS  43  -5.294 -11.749  -1.755
  311    HB2  LYS  43          2HB       LYS  43  -2.595 -10.971  -0.643
  312    HB3  LYS  43          1HB       LYS  43  -3.877 -11.724   0.297
  313    HG2  LYS  43          2HG       LYS  43  -3.874 -13.639  -1.307
  314    HG3  LYS  43          1HG       LYS  43  -2.500 -12.901  -2.132
  315    HD2  LYS  43          2HD       LYS  43  -1.223 -12.970   0.010
  316    HD3  LYS  43          1HD       LYS  43  -2.580 -13.811   0.760
  317    HE2  LYS  43          2HE       LYS  43  -2.144 -15.776  -0.331
  318    HE3  LYS  43          1HE       LYS  43  -1.577 -14.961  -1.789
  319    HZ1  LYS  43          1HZ       LYS  43   0.335 -14.242  -0.145
  320    HZ2  LYS  43          2HZ       LYS  43   0.391 -15.712  -0.995
  321    HZ3  LYS  43          3HZ       LYS  43  -0.108 -15.685   0.629
  322    H    VAL  44           H        VAL  44  -3.461  -8.713  -1.736
  323    HA   VAL  44           HA       VAL  44  -4.934  -7.444   0.361
  324    HB   VAL  44           HB       VAL  44  -3.459  -6.270  -2.009
  325   HG11  VAL  44          1HG1      VAL  44  -4.801  -5.031   0.384
  326   HG12  VAL  44          2HG1      VAL  44  -4.857  -4.520  -1.303
  327   HG13  VAL  44          3HG1      VAL  44  -3.396  -4.257  -0.350
  328   HG21  VAL  44          1HG2      VAL  44  -2.346  -5.947   0.673
  329   HG22  VAL  44          2HG2      VAL  44  -1.580  -6.572  -0.788
  330   HG23  VAL  44          3HG2      VAL  44  -2.536  -7.645   0.235
  331    H    ILE  45           H        ILE  45  -5.400  -7.386  -3.179
  332    HA   ILE  45           HA       ILE  45  -7.568  -5.560  -3.202
  333    HB   ILE  45           HB       ILE  45  -6.496  -7.642  -5.025
  334   HG12  ILE  45          2HG1      ILE  45  -6.459  -5.802  -6.574
  335   HG13  ILE  45          1HG1      ILE  45  -7.557  -4.858  -5.568
  336   HG21  ILE  45          1HG2      ILE  45  -8.773  -8.317  -5.196
  337   HG22  ILE  45          2HG2      ILE  45  -8.502  -7.233  -6.559
  338   HG23  ILE  45          3HG2      ILE  45  -9.350  -6.652  -5.128
  339   HD11  ILE  45          1HD1      ILE  45  -5.910  -4.267  -4.081
  340   HD12  ILE  45          2HD1      ILE  45  -4.893  -4.508  -5.501
  341   HD13  ILE  45          3HD1      ILE  45  -5.032  -5.781  -4.291
  342    H    ALA  46           H        ALA  46  -7.600  -9.123  -2.980
  343    HA   ALA  46           HA       ALA  46 -10.457  -9.345  -2.813
  344    HB1  ALA  46          1HB       ALA  46  -9.793 -11.604  -1.687
  345    HB2  ALA  46          2HB       ALA  46  -8.145 -11.133  -2.106
  346    HB3  ALA  46          3HB       ALA  46  -9.355 -11.336  -3.374
  347    H    TRP  47           H        TRP  47  -7.930  -9.234  -0.294
  348    HA   TRP  47           HA       TRP  47  -9.841  -9.459   1.874
  349    HB2  TRP  47          2HB       TRP  47  -7.746 -10.189   2.515
  350    HB3  TRP  47          1HB       TRP  47  -6.917  -8.906   1.636
  351    HD1  TRP  47           HD       TRP  47  -9.700  -8.596   4.316
  352    HE1  TRP  47          1HE       TRP  47  -8.808  -7.060   6.191
  353    HE3  TRP  47          3HE       TRP  47  -4.984  -7.818   2.610
  354    HZ2  TRP  47          2HZ       TRP  47  -6.381  -5.681   6.869
  355    HZ3  TRP  47          3HZ       TRP  47  -3.386  -6.398   3.872
  356    HH2  TRP  47           HH       TRP  47  -4.082  -5.329   5.996
  357    H    LEU  48           H        LEU  48  -8.094  -6.757   0.376
  358    HA   LEU  48           HA       LEU  48  -8.926  -4.726   2.162
  359    HB2  LEU  48          2HB       LEU  48  -7.209  -4.476   0.347
  360    HB3  LEU  48          1HB       LEU  48  -8.514  -4.455  -0.827
  361    HG   LEU  48           HG       LEU  48  -9.471  -2.538   0.670
  362   HD11  LEU  48          1HD1      LEU  48  -6.654  -1.839   1.199
  363   HD12  LEU  48          2HD1      LEU  48  -7.290  -3.154   2.182
  364   HD13  LEU  48          3HD1      LEU  48  -8.083  -1.580   2.198
  365   HD21  LEU  48          1HD2      LEU  48  -7.379  -2.564  -1.428
  366   HD22  LEU  48          2HD2      LEU  48  -7.560  -1.041  -0.557
  367   HD23  LEU  48          3HD2      LEU  48  -8.938  -1.740  -1.408
  368    H    GLU  49           H        GLU  49 -10.537  -6.074  -0.711
  369    HA   GLU  49           HA       GLU  49 -12.720  -4.232  -0.771
  370    HB2  GLU  49          2HB       GLU  49 -12.471  -5.606  -2.678
  371    HB3  GLU  49          1HB       GLU  49 -12.386  -7.078  -1.713
  372    HG2  GLU  49          2HG       GLU  49 -14.872  -5.482  -1.427
  373    HG3  GLU  49          1HG       GLU  49 -14.635  -6.269  -2.982
  374    H    ASP  50           H        ASP  50 -12.297  -7.330   0.936
  375    HA   ASP  50           HA       ASP  50 -14.936  -7.418   2.036
  376    HB2  ASP  50          2HB       ASP  50 -13.301  -9.327   1.961
  377    HB3  ASP  50          1HB       ASP  50 -12.421  -8.541   3.269
  378    H    ARG  51           H        ARG  51 -11.897  -6.083   3.312
  379    HA   ARG  51           HA       ARG  51 -12.964  -5.347   5.862
  380    HB2  ARG  51          2HB       ARG  51 -10.535  -5.517   5.351
  381    HB3  ARG  51          1HB       ARG  51 -10.666  -4.051   4.378
  382    HG2  ARG  51          2HG       ARG  51 -11.442  -2.796   6.344
  383    HG3  ARG  51          1HG       ARG  51 -11.352  -4.259   7.324
  384    HD2  ARG  51          2HD       ARG  51  -8.918  -4.404   6.832
  385    HD3  ARG  51          1HD       ARG  51  -9.029  -2.885   5.942
  386    HE   ARG  51           HE       ARG  51 -10.027  -2.117   8.328
  387   HH11  ARG  51          1HH1      ARG  51  -8.847  -1.558  10.169
  388   HH12  ARG  51          2HH1      ARG  51  -7.280  -2.250  10.421
  389   HH21  ARG  51          1HH2      ARG  51  -7.339  -4.122   7.506
  390   HH22  ARG  51          2HH2      ARG  51  -6.427  -3.699   8.915
  391    H    PHE  52           H        PHE  52 -12.608  -3.412   2.854
  392    HA   PHE  52           HA       PHE  52 -14.181  -1.266   4.195
  393    HB2  PHE  52          2HB       PHE  52 -12.440  -1.250   1.721
  394    HB3  PHE  52          1HB       PHE  52 -13.389   0.126   2.267
  395    HD1  PHE  52          1HD       PHE  52 -10.396  -1.869   2.813
  396    HD2  PHE  52          2HD       PHE  52 -12.920   1.174   4.494
  397    HE1  PHE  52          1HE       PHE  52  -8.595  -1.253   4.404
  398    HE2  PHE  52          2HE       PHE  52 -11.120   1.789   6.084
  399    HZ   PHE  52           HZ       PHE  52  -8.958   0.576   6.039
  400    H    GLY  53           H        GLY  53 -14.666  -3.847   2.094
  401    HA2  GLY  53          2HA       GLY  53 -16.569  -4.409   0.817
  402    HA3  GLY  53          1HA       GLY  53 -17.339  -2.950   1.446
  403    H    ILE  54           H        ILE  54 -14.253  -2.930  -0.250
  404    HA   ILE  54           HA       ILE  54 -15.488  -1.176  -2.305
  405    HB   ILE  54           HB       ILE  54 -12.572  -1.791  -1.740
  406   HG12  ILE  54          2HG1      ILE  54 -14.153   0.710  -1.091
  407   HG13  ILE  54          1HG1      ILE  54 -13.877  -0.582   0.076
  408   HG21  ILE  54          1HG2      ILE  54 -12.693   0.625  -3.030
  409   HG22  ILE  54          2HG2      ILE  54 -14.000  -0.258  -3.820
  410   HG23  ILE  54          3HG2      ILE  54 -12.361  -0.912  -3.829
  411   HD11  ILE  54          1HD1      ILE  54 -11.685   0.917  -1.385
  412   HD12  ILE  54          2HD1      ILE  54 -11.460  -0.306  -0.136
  413   HD13  ILE  54          3HD1      ILE  54 -12.194   1.245   0.272
  414    H    ALA  55           H        ALA  55 -15.394  -1.682  -4.518
  415    HA   ALA  55           HA       ALA  55 -15.477  -4.436  -5.238
  416    HB1  ALA  55          1HB       ALA  55 -14.987  -2.024  -7.013
  417    HB2  ALA  55          2HB       ALA  55 -16.569  -2.667  -6.570
  418    HB3  ALA  55          3HB       ALA  55 -15.476  -3.624  -7.571
  419    H    ALA  56           H        ALA  56 -13.946  -5.768  -6.237
  420    HA   ALA  56           HA       ALA  56 -11.215  -5.396  -5.515
  421    HB1  ALA  56          1HB       ALA  56 -10.770  -7.383  -6.824
  422    HB2  ALA  56          2HB       ALA  56 -12.269  -7.176  -7.729
  423    HB3  ALA  56          3HB       ALA  56 -12.324  -7.602  -6.019
  424    H    ASP  57           H        ASP  57 -13.017  -4.472  -8.383
  425    HA   ASP  57           HA       ASP  57 -12.345  -3.287 -10.295
  426    HB2  ASP  57          2HB       ASP  57 -10.219  -2.361  -8.353
  427    HB3  ASP  57          1HB       ASP  57 -10.519  -1.626  -9.925
  428    H    ASP  58           H        ASP  58 -11.611  -5.890 -10.446
  429    HA   ASP  58           HA       ASP  58  -9.004  -6.729 -10.612
  430    HB2  ASP  58          2HB       ASP  58 -10.974  -8.087 -11.292
  431    HB3  ASP  58          1HB       ASP  58 -11.049  -7.169 -12.794
  432    H    VAL  59           H        VAL  59  -7.550  -5.040 -11.085
  433    HA   VAL  59           HA       VAL  59  -7.418  -4.315 -13.977
  434    HB   VAL  59           HB       VAL  59  -8.329  -2.398 -12.644
  435   HG11  VAL  59          1HG1      VAL  59  -5.599  -2.349 -11.337
  436   HG12  VAL  59          2HG1      VAL  59  -7.015  -3.061 -10.563
  437   HG13  VAL  59          3HG1      VAL  59  -6.995  -1.342 -10.956
  438   HG21  VAL  59          1HG2      VAL  59  -7.040  -1.943 -14.670
  439   HG22  VAL  59          2HG2      VAL  59  -5.528  -2.076 -13.770
  440   HG23  VAL  59          3HG2      VAL  59  -6.634  -0.742 -13.444
  441    H    GLU  60           H        GLU  60  -5.280  -4.240 -14.790
  442    HA   GLU  60           HA       GLU  60  -3.278  -5.521 -13.038
  443    HB2  GLU  60          2HB       GLU  60  -3.596  -6.320 -15.372
  444    HB3  GLU  60          1HB       GLU  60  -3.066  -4.747 -15.958
  445    HG2  GLU  60          2HG       GLU  60  -0.920  -5.047 -14.782
  446    HG3  GLU  60          1HG       GLU  60  -1.446  -6.638 -14.249
  447    H    LEU  61           H        LEU  61  -1.575  -4.456 -12.151
  448    HA   LEU  61           HA       LEU  61  -1.250  -1.576 -12.849
  449    HB2  LEU  61          2HB       LEU  61  -0.378  -2.995 -10.319
  450    HB3  LEU  61          1HB       LEU  61  -0.410  -1.256 -10.602
  451    HG   LEU  61           HG       LEU  61  -2.778  -3.120 -10.426
  452   HD11  LEU  61          1HD1      LEU  61  -1.953  -2.451  -8.259
  453   HD12  LEU  61          2HD1      LEU  61  -3.406  -1.507  -8.592
  454   HD13  LEU  61          3HD1      LEU  61  -1.814  -0.771  -8.777
  455   HD21  LEU  61          1HD2      LEU  61  -3.424  -1.640 -12.131
  456   HD22  LEU  61          2HD2      LEU  61  -2.517  -0.296 -11.435
  457   HD23  LEU  61          3HD2      LEU  61  -4.016  -0.834 -10.677
  458    H    SER  62           H        SER  62   0.793  -0.831 -13.426
  459    HA   SER  62           HA       SER  62   2.750  -2.887 -14.175
  460    HB2  SER  62          2HB       SER  62   3.108  -1.378 -15.811
  461    HB3  SER  62          1HB       SER  62   2.126  -0.179 -14.974
  462    HG   SER  62           HG       SER  62   4.886  -0.746 -14.676
  463    HA   PRO  63           HA       PRO  63   5.459  -2.591 -10.724
  464    HB2  PRO  63          2HB       PRO  63   7.921  -2.311 -11.999
  465    HB3  PRO  63          1HB       PRO  63   7.086  -3.848 -11.715
  466    HG2  PRO  63          2HG       PRO  63   7.234  -2.199 -14.176
  467    HG3  PRO  63          1HG       PRO  63   7.178  -3.960 -13.992
  468    HD2  PRO  63          2HD       PRO  63   5.011  -2.517 -14.773
  469    HD3  PRO  63          1HD       PRO  63   4.865  -4.006 -13.812
  470    H    GLU  64           H        GLU  64   5.734  -0.107 -13.194
  471    HA   GLU  64           HA       GLU  64   7.414   1.714 -11.772
  472    HB2  GLU  64          2HB       GLU  64   5.264   2.236 -13.828
  473    HB3  GLU  64          1HB       GLU  64   6.428   3.435 -13.282
  474    HG2  GLU  64          2HG       GLU  64   8.264   1.950 -14.030
  475    HG3  GLU  64          1HG       GLU  64   7.068   0.814 -14.642
  476    H    HIS  65           H        HIS  65   3.989   1.007 -11.572
  477    HA   HIS  65           HA       HIS  65   3.211   3.373 -10.135
  478    HB2  HIS  65          2HB       HIS  65   1.571   1.899 -11.228
  479    HB3  HIS  65          1HB       HIS  65   1.991   0.596 -10.116
  480    HD1  HIS  65          1HD       HIS  65   1.048   4.280  -9.658
  481    HD2  HIS  65          2HD       HIS  65   0.132   0.524  -8.091
  482    HE1  HIS  65          1HE       HIS  65  -0.657   4.663  -7.822
  483    HE2  HIS  65          2HE       HIS  65  -1.225   2.384  -6.867
  484    H    PHE  66           H        PHE  66   4.762   0.395  -9.172
  485    HA   PHE  66           HA       PHE  66   4.315   0.983  -6.302
  486    HB2  PHE  66          2HB       PHE  66   5.804  -1.295  -7.644
  487    HB3  PHE  66          1HB       PHE  66   5.428  -1.180  -5.924
  488    HD1  PHE  66          1HD       PHE  66   3.187  -1.586  -5.091
  489    HD2  PHE  66          2HD       PHE  66   4.005  -1.577  -9.307
  490    HE1  PHE  66          1HE       PHE  66   0.949  -2.562  -5.530
  491    HE2  PHE  66          2HE       PHE  66   1.775  -2.558  -9.745
  492    HZ   PHE  66           HZ       PHE  66   0.243  -3.049  -7.860
  493    H    ARG  67           H        ARG  67   6.296   2.225  -8.529
  494    HA   ARG  67           HA       ARG  67   8.936   1.895  -7.604
  495    HB2  ARG  67          2HB       ARG  67   8.275   3.151  -9.665
  496    HB3  ARG  67          1HB       ARG  67   7.697   4.463  -8.645
  497    HG2  ARG  67          2HG       ARG  67   9.864   5.164  -9.198
  498    HG3  ARG  67          1HG       ARG  67  10.102   4.398  -7.631
  499    HD2  ARG  67          2HD       ARG  67  10.808   2.312  -8.746
  500    HD3  ARG  67          1HD       ARG  67  10.552   3.067 -10.318
  501    HE   ARG  67           HE       ARG  67  12.828   3.518  -8.546
  502   HH11  ARG  67          1HH1      ARG  67  14.403   4.931  -9.342
  503   HH12  ARG  67          2HH1      ARG  67  14.034   5.941 -10.700
  504   HH21  ARG  67          1HH2      ARG  67  10.794   4.753 -11.041
  505   HH22  ARG  67          2HH2      ARG  67  11.991   5.840 -11.662
  506    H    SER  68           H        SER  68   6.377   4.055  -6.401
  507    HA   SER  68           HA       SER  68   8.006   4.403  -3.931
  508    HB2  SER  68          2HB       SER  68   7.547   6.786  -3.868
  509    HB3  SER  68          1HB       SER  68   8.298   6.404  -5.414
  510    HG   SER  68           HG       SER  68   5.841   7.412  -4.876
  511    H    ILE  69           H        ILE  69   6.734   4.777  -2.039
  512    HA   ILE  69           HA       ILE  69   4.192   3.489  -1.980
  513    HB   ILE  69           HB       ILE  69   5.411   5.422   0.012
  514   HG12  ILE  69          2HG1      ILE  69   5.484   2.404  -0.028
  515   HG13  ILE  69          1HG1      ILE  69   6.806   3.417  -0.587
  516   HG21  ILE  69          1HG2      ILE  69   2.937   3.880  -0.081
  517   HG22  ILE  69          2HG2      ILE  69   3.406   5.185   1.009
  518   HG23  ILE  69          3HG2      ILE  69   3.912   3.529   1.344
  519   HD11  ILE  69          1HD1      ILE  69   5.756   4.109   2.084
  520   HD12  ILE  69          2HD1      ILE  69   7.425   4.005   1.524
  521   HD13  ILE  69          3HD1      ILE  69   6.556   2.540   1.981
  522    H    ARG  70           H        ARG  70   5.130   6.901  -2.180
  523    HA   ARG  70           HA       ARG  70   2.562   8.038  -1.723
  524    HB2  ARG  70          2HB       ARG  70   4.854   9.036  -3.438
  525    HB3  ARG  70          1HB       ARG  70   3.458  10.007  -2.970
  526    HG2  ARG  70          2HG       ARG  70   4.016   9.567  -0.571
  527    HG3  ARG  70          1HG       ARG  70   5.481   8.740  -1.102
  528    HD2  ARG  70          2HD       ARG  70   4.772  11.639  -1.635
  529    HD3  ARG  70          1HD       ARG  70   6.014  11.058  -0.528
  530    HE   ARG  70           HE       ARG  70   6.811   9.945  -2.887
  531   HH11  ARG  70          1HH1      ARG  70   8.070  10.989  -4.448
  532   HH12  ARG  70          2HH1      ARG  70   8.022  12.717  -4.565
  533   HH21  ARG  70          1HH2      ARG  70   5.750  13.095  -1.974
  534   HH22  ARG  70          2HH2      ARG  70   6.709  13.909  -3.164
  535    H    SER  71           H        SER  71   4.036   6.769  -4.702
  536    HA   SER  71           HA       SER  71   2.104   7.740  -6.534
  537    HB2  SER  71          2HB       SER  71   3.521   5.063  -6.639
  538    HB3  SER  71          1HB       SER  71   2.835   5.944  -7.998
  539    HG   SER  71           HG       SER  71   4.692   6.904  -8.109
  540    H    ILE  72           H        ILE  72   2.130   4.747  -4.594
  541    HA   ILE  72           HA       ILE  72  -0.362   3.746  -5.593
  542    HB   ILE  72           HB       ILE  72   1.008   3.257  -2.931
  543   HG12  ILE  72          2HG1      ILE  72   1.108   1.668  -5.516
  544   HG13  ILE  72          1HG1      ILE  72   2.388   2.745  -4.959
  545   HG21  ILE  72          1HG2      ILE  72  -1.330   2.572  -2.902
  546   HG22  ILE  72          2HG2      ILE  72  -0.302   1.142  -2.992
  547   HG23  ILE  72          3HG2      ILE  72  -1.129   1.727  -4.435
  548   HD11  ILE  72          1HD1      ILE  72   1.421   0.184  -3.686
  549   HD12  ILE  72          2HD1      ILE  72   2.368   1.367  -2.785
  550   HD13  ILE  72          3HD1      ILE  72   3.053   0.592  -4.213
  551    H    ASP  73           H        ASP  73   0.513   5.831  -2.867
  552    HA   ASP  73           HA       ASP  73  -1.999   5.927  -1.575
  553    HB2  ASP  73          2HB       ASP  73   0.126   8.069  -1.865
  554    HB3  ASP  73          1HB       ASP  73  -1.218   8.143  -0.730
  555    H    ALA  74           H        ALA  74  -0.763   7.775  -4.346
  556    HA   ALA  74           HA       ALA  74  -2.959   9.599  -4.521
  557    HB1  ALA  74          1HB       ALA  74  -2.225   9.800  -6.946
  558    HB2  ALA  74          2HB       ALA  74  -1.026   8.554  -6.600
  559    HB3  ALA  74          3HB       ALA  74  -0.962  10.100  -5.752
  560    H    PHE  75           H        PHE  75  -2.415   6.405  -5.995
  561    HA   PHE  75           HA       PHE  75  -4.778   6.390  -7.599
  562    HB2  PHE  75          2HB       PHE  75  -2.926   4.745  -7.826
  563    HB3  PHE  75          1HB       PHE  75  -3.419   4.024  -6.296
  564    HD1  PHE  75          1HD       PHE  75  -4.435   4.658  -9.801
  565    HD2  PHE  75          2HD       PHE  75  -5.380   2.635  -6.131
  566    HE1  PHE  75          1HE       PHE  75  -6.139   3.304 -10.987
  567    HE2  PHE  75          2HE       PHE  75  -7.085   1.280  -7.318
  568    HZ   PHE  75           HZ       PHE  75  -7.464   1.615  -9.746
  569    H    VAL  76           H        VAL  76  -4.209   5.202  -4.282
  570    HA   VAL  76           HA       VAL  76  -6.853   4.230  -3.853
  571    HB   VAL  76           HB       VAL  76  -4.737   5.254  -1.947
  572   HG11  VAL  76          1HG1      VAL  76  -6.620   5.467  -0.620
  573   HG12  VAL  76          2HG1      VAL  76  -6.243   3.764  -0.358
  574   HG13  VAL  76          3HG1      VAL  76  -7.507   4.224  -1.499
  575   HG21  VAL  76          1HG2      VAL  76  -4.986   2.890  -3.458
  576   HG22  VAL  76          2HG2      VAL  76  -5.449   2.445  -1.817
  577   HG23  VAL  76          3HG2      VAL  76  -3.873   3.176  -2.119
  578    H    VAL  77           H        VAL  77  -5.379   7.415  -3.207
  579    HA   VAL  77           HA       VAL  77  -7.665   8.573  -1.953
  580    HB   VAL  77           HB       VAL  77  -5.378   9.787  -3.521
  581   HG11  VAL  77          1HG1      VAL  77  -6.760  11.590  -3.622
  582   HG12  VAL  77          2HG1      VAL  77  -6.318  11.781  -1.925
  583   HG13  VAL  77          3HG1      VAL  77  -7.823  10.970  -2.359
  584   HG21  VAL  77          1HG2      VAL  77  -5.437  10.456  -0.741
  585   HG22  VAL  77          2HG2      VAL  77  -4.239   9.485  -1.599
  586   HG23  VAL  77          3HG2      VAL  77  -5.651   8.711  -0.880
  587    H    GLY  78           H        GLY  78  -6.640   8.418  -5.351
  588    HA2  GLY  78          2HA       GLY  78  -8.607  10.132  -6.448
  589    HA3  GLY  78          1HA       GLY  78  -7.854   8.797  -7.320
  590    H    ALA  79           H        ALA  79  -8.827   6.715  -5.515
  591    HA   ALA  79           HA       ALA  79 -11.626   6.660  -6.499
  592    HB1  ALA  79          1HB       ALA  79 -10.065   4.380  -5.272
  593    HB2  ALA  79          2HB       ALA  79 -10.000   4.771  -6.991
  594    HB3  ALA  79          3HB       ALA  79 -11.527   4.278  -6.255
  595    H    THR  80           H        THR  80  -9.795   5.988  -3.512
  596    HA   THR  80           HA       THR  80 -12.270   6.671  -1.985
  597    HB   THR  80           HB       THR  80 -10.321   4.474  -1.268
  598    HG1  THR  80          1HG       THR  80 -12.072   3.118  -1.842
  599   HG21  THR  80          1HG2      THR  80 -12.200   3.890   0.337
  600   HG22  THR  80          2HG2      THR  80 -12.912   5.454  -0.061
  601   HG23  THR  80          3HG2      THR  80 -11.327   5.378   0.709
  602    H    THR  81           H        THR  81 -11.907   8.106  -0.322
  603    HA   THR  81           HA       THR  81  -9.065   8.600   0.460
  604    HB   THR  81           HB       THR  81  -9.558  10.477  -0.866
  605    HG1  THR  81          1HG       THR  81 -10.242  12.096   0.852
  606   HG21  THR  81          1HG2      THR  81 -11.897  10.059  -1.296
  607   HG22  THR  81          2HG2      THR  81 -11.754  11.693  -0.647
  608   HG23  THR  81          3HG2      THR  81 -12.313  10.378   0.387
  609    HA   PRO  82           HA       PRO  82 -11.548   7.737   4.258
  610    HB2  PRO  82          2HB       PRO  82  -9.072   6.586   5.290
  611    HB3  PRO  82          1HB       PRO  82 -10.635   5.798   5.022
  612    HG2  PRO  82          2HG       PRO  82  -8.402   5.293   3.554
  613    HG3  PRO  82          1HG       PRO  82 -10.055   5.072   2.957
  614    HD2  PRO  82          2HD       PRO  82  -8.118   7.276   2.372
  615    HD3  PRO  82          1HD       PRO  82  -9.356   6.545   1.325
  616    HA   PRO  83           HA       PRO  83 -10.059  10.861   7.032
  617    HB2  PRO  83          2HB       PRO  83  -9.292   8.944   9.160
  618    HB3  PRO  83          1HB       PRO  83 -10.471  10.266   9.207
  619    HG2  PRO  83          2HG       PRO  83 -11.211   7.693   9.140
  620    HG3  PRO  83          1HG       PRO  83 -12.157   8.976   8.368
  621    HD2  PRO  83          2HD       PRO  83 -10.391   6.923   7.108
  622    HD3  PRO  83          1HD       PRO  83 -11.874   7.676   6.485
  623    H    VAL  84           H        VAL  84  -8.100  11.905   7.711
  624    HA   VAL  84           HA       VAL  84  -5.649  10.524   6.784
  625    HB   VAL  84           HB       VAL  84  -6.027  13.394   7.687
  626   HG11  VAL  84          1HG1      VAL  84  -3.830  12.070   6.067
  627   HG12  VAL  84          2HG1      VAL  84  -3.696  12.523   7.766
  628   HG13  VAL  84          3HG1      VAL  84  -3.899  13.769   6.534
  629   HG21  VAL  84          1HG2      VAL  84  -7.272  13.457   5.764
  630   HG22  VAL  84          2HG2      VAL  84  -6.551  11.978   5.129
  631   HG23  VAL  84          3HG2      VAL  84  -5.684  13.509   4.998
  632    H    GLU  85           H        GLU  85  -4.146   9.747   8.181
  633    HA   GLU  85           HA       GLU  85  -4.191  10.702  11.000
  634    HB2  GLU  85          2HB       GLU  85  -4.018   7.808  10.107
  635    HB3  GLU  85          1HB       GLU  85  -3.867   8.373  11.771
  636    HG2  GLU  85          2HG       GLU  85  -6.153   9.344  11.621
  637    HG3  GLU  85          1HG       GLU  85  -6.303   8.685   9.991
  638    H    ALA  86           H        ALA  86  -2.109  10.248  12.124
  639    HA   ALA  86           HA       ALA  86   0.148  10.342  10.177
  640    HB1  ALA  86          1HB       ALA  86   0.992  10.888  12.857
  641    HB2  ALA  86          2HB       ALA  86  -0.471  11.819  12.540
  642    HB3  ALA  86          3HB       ALA  86   0.933  11.995  11.487
  643    H    LYS  87           H        LYS  87   1.892   8.889  10.381
  644    HA   LYS  87           HA       LYS  87   1.343   6.290  11.379
  645    HB2  LYS  87          2HB       LYS  87   4.008   7.630  10.827
  646    HB3  LYS  87          1HB       LYS  87   3.806   5.903  11.131
  647    HG2  LYS  87          2HG       LYS  87   2.211   5.811   9.196
  648    HG3  LYS  87          1HG       LYS  87   2.606   7.494   8.849
  649    HD2  LYS  87          2HD       LYS  87   4.999   6.866   8.621
  650    HD3  LYS  87          1HD       LYS  87   4.563   5.178   8.894
  651    HE2  LYS  87          2HE       LYS  87   4.567   5.274   6.564
  652    HE3  LYS  87          1HE       LYS  87   2.872   5.598   6.920
  653    HZ1  LYS  87          1HZ       LYS  87   4.124   8.038   7.057
  654    HZ2  LYS  87          2HZ       LYS  87   3.122   7.480   5.804
  655    HZ3  LYS  87          3HZ       LYS  87   4.806   7.286   5.699
  656    H    LEU  88           H        LEU  88   2.870   9.079  12.912
  657    HA   LEU  88           HA       LEU  88   3.395   7.464  15.350
  658    HB2  LEU  88          2HB       LEU  88   5.161   9.022  14.488
  659    HB3  LEU  88          1HB       LEU  88   4.063  10.368  14.786
  660    HG   LEU  88           HG       LEU  88   3.924   9.619  17.193
  661   HD11  LEU  88          1HD1      LEU  88   5.558   7.469  16.088
  662   HD12  LEU  88          2HD1      LEU  88   4.720   7.554  17.636
  663   HD13  LEU  88          3HD1      LEU  88   6.336   8.239  17.470
  664   HD21  LEU  88          1HD2      LEU  88   6.352  10.679  15.828
  665   HD22  LEU  88          2HD2      LEU  88   6.522  10.232  17.526
  666   HD23  LEU  88          3HD2      LEU  88   5.328  11.437  17.046
  667    H    GLN  89           H        GLN  89   2.050   7.586  17.092
  668    HA   GLN  89           HA       GLN  89   0.065   8.125  18.251
  669    HB2  GLN  89          2HB       GLN  89   1.697   9.869  18.997
  670    HB3  GLN  89          1HB       GLN  89   1.104  10.924  17.714
  671    HG2  GLN  89          2HG       GLN  89  -1.159  10.848  18.674
  672    HG3  GLN  89          1HG       GLN  89  -0.592   9.765  19.945
  673   HE21  GLN  89          1HE2      GLN  89  -1.687  12.123  20.841
  674   HE22  GLN  89          2HE2      GLN  89  -0.478  13.189  21.376
  675    H1   PN7 101          3HO       SAT 101   2.161  -9.081 -12.905
  676    H2   PN7 101          1H1       SAT 101   4.974  -7.975 -11.847
  677    H3   PN7 101          2H1       SAT 101   4.591  -7.458 -10.204
  678    H5   PN7 101          1HE1      SAT 101   3.611  -5.074 -10.618
  679    H6   PN7 101          2HE1      SAT 101   3.116  -4.829 -12.293
  680    H7   PN7 101          3HE1      SAT 101   4.721  -5.462 -11.932
  681    H8   PN7 101          2HE2      SAT 101   1.186  -7.685 -11.252
  682    H9   PN7 101          3HE2      SAT 101   1.388  -5.995 -10.789
  683    H10  PN7 101          1HE2      SAT 101   2.122  -7.271  -9.816
  684    H11  PN7 101          3H        SAT 101   1.785  -6.956 -13.338
  685    H12  PN7 101          5H        SAT 101   3.166  -4.655 -14.250
  686    H13  PN7 101          1H6       SAT 101   2.947  -6.590 -16.495
  687    H14  PN7 101          2H6       SAT 101   2.330  -4.938 -16.504
  688    H15  PN7 101          1H7       SAT 101   5.122  -4.727 -16.112
  689    H16  PN7 101          2H7       SAT 101   4.213  -4.299 -17.562
  690    H17  PN7 101          9H        SAT 101   4.868  -7.753 -16.327
  691    H18  PN7 101          1H10      SAT 101   7.004  -8.321 -17.955
  692    H19  PN7 101          2H10      SAT 101   7.574  -6.917 -17.054
  693    H20  PN7 101          1H11      SAT 101   6.602  -8.417 -15.015
  694    H21  PN7 101          2H11      SAT 101   8.275  -8.512 -15.568
  695    H22  PN7 101          2HS1      SAT 101   7.610 -10.606 -17.017
  Start of MODEL    7
    1    H1   MET   1          1HT       MET   1   0.661  13.228  -1.793
    2    H2   MET   1          2HT       MET   1   1.163  14.287  -0.563
    3    H3   MET   1          3HT       MET   1  -0.485  13.919  -0.751
    4    HA   MET   1           HA       MET   1   0.638  11.471  -0.454
    5    HB2  MET   1          2HB       MET   1   2.051  13.525   1.258
    6    HB3  MET   1          1HB       MET   1   1.965  11.818   1.697
    7    HG2  MET   1          2HG       MET   1   2.974  11.226  -0.492
    8    HG3  MET   1          1HG       MET   1   3.123  12.943  -0.866
    9    HE1  MET   1          1HE       MET   1   3.988   9.992   1.137
   10    HE2  MET   1          2HE       MET   1   3.844  10.913   2.632
   11    HE3  MET   1          3HE       MET   1   5.430  10.371   2.089
   12    H    GLN   2           H        GLN   2  -1.831  11.954  -0.335
   13    HA   GLN   2           HA       GLN   2  -2.760  12.786   2.333
   14    HB2  GLN   2          2HB       GLN   2  -4.259  11.688  -0.069
   15    HB3  GLN   2          1HB       GLN   2  -5.018  12.282   1.409
   16    HG2  GLN   2          2HG       GLN   2  -4.023  14.501   1.048
   17    HG3  GLN   2          1HG       GLN   2  -3.230  13.914  -0.414
   18   HE21  GLN   2          1HE2      GLN   2  -5.086  16.080  -0.542
   19   HE22  GLN   2          2HE2      GLN   2  -6.470  15.558  -1.376
   20    H    HIS   3           H        HIS   3  -2.988  11.352   3.994
   21    HA   HIS   3           HA       HIS   3  -3.026   9.295   5.133
   22    HB2  HIS   3          2HB       HIS   3  -4.241   7.843   2.858
   23    HB3  HIS   3          1HB       HIS   3  -4.792   7.977   4.526
   24    HD1  HIS   3          1HD       HIS   3  -6.011  10.303   5.159
   25    HD2  HIS   3          2HD       HIS   3  -5.527   9.560   1.083
   26    HE1  HIS   3          1HE       HIS   3  -7.583  11.883   3.948
   27    HE2  HIS   3          2HE       HIS   3  -7.294  11.438   1.469
   28    H    ALA   4           H        ALA   4  -0.920   9.976   2.982
   29    HA   ALA   4           HA       ALA   4  -0.073   7.575   1.707
   30    HB1  ALA   4          1HB       ALA   4   0.762   9.923   1.248
   31    HB2  ALA   4          2HB       ALA   4   2.020   8.691   1.344
   32    HB3  ALA   4          3HB       ALA   4   1.744   9.777   2.705
   33    H    SER   5           H        SER   5   0.689   8.899   4.925
   34    HA   SER   5           HA       SER   5   2.677   6.953   5.589
   35    HB2  SER   5          2HB       SER   5   2.367   7.669   7.883
   36    HB3  SER   5          1HB       SER   5   2.245   9.088   6.846
   37    HG   SER   5           HG       SER   5   0.308   7.771   8.341
   38    H    VAL   6           H        VAL   6  -0.847   6.917   5.843
   39    HA   VAL   6           HA       VAL   6  -1.021   4.528   7.431
   40    HB   VAL   6           HB       VAL   6  -2.963   5.774   5.481
   41   HG11  VAL   6          1HG1      VAL   6  -3.954   3.724   5.581
   42   HG12  VAL   6          2HG1      VAL   6  -4.467   4.259   7.181
   43   HG13  VAL   6          3HG1      VAL   6  -3.035   3.244   7.007
   44   HG21  VAL   6          1HG2      VAL   6  -2.120   6.506   8.071
   45   HG22  VAL   6          2HG2      VAL   6  -3.707   5.767   8.276
   46   HG23  VAL   6          3HG2      VAL   6  -3.509   7.141   7.189
   47    H    ILE   7           H        ILE   7  -0.928   5.122   3.948
   48    HA   ILE   7           HA       ILE   7  -1.454   2.475   3.071
   49    HB   ILE   7           HB       ILE   7   0.320   4.585   1.814
   50   HG12  ILE   7          2HG1      ILE   7  -2.593   3.907   1.305
   51   HG13  ILE   7          1HG1      ILE   7  -2.056   5.254   2.309
   52   HG21  ILE   7          1HG2      ILE   7  -0.324   3.335  -0.301
   53   HG22  ILE   7          2HG2      ILE   7  -0.944   2.051   0.738
   54   HG23  ILE   7          3HG2      ILE   7   0.770   2.463   0.773
   55   HD11  ILE   7          1HD1      ILE   7  -1.809   4.889  -0.658
   56   HD12  ILE   7          2HD1      ILE   7  -0.621   5.878   0.190
   57   HD13  ILE   7          3HD1      ILE   7  -2.331   6.307   0.252
   58    H    ALA   8           H        ALA   8   1.634   4.040   3.920
   59    HA   ALA   8           HA       ALA   8   3.294   1.820   3.218
   60    HB1  ALA   8          1HB       ALA   8   3.724   4.369   4.201
   61    HB2  ALA   8          2HB       ALA   8   4.970   3.143   3.972
   62    HB3  ALA   8          3HB       ALA   8   4.208   3.342   5.550
   63    H    GLN   9           H        GLN   9   1.898   2.768   6.362
   64    HA   GLN   9           HA       GLN   9   2.858   0.402   7.697
   65    HB2  GLN   9          2HB       GLN   9   1.955   1.309   9.586
   66    HB3  GLN   9          1HB       GLN   9   1.889   2.758   8.588
   67    HG2  GLN   9          2HG       GLN   9  -0.282   2.598   9.484
   68    HG3  GLN   9          1HG       GLN   9  -0.448   1.914   7.872
   69   HE21  GLN   9          1HE2      GLN   9  -1.992   0.262   8.167
   70   HE22  GLN   9          2HE2      GLN   9  -1.855  -0.975   9.320
   71    H    PHE  10           H        PHE  10  -0.091   1.201   5.955
   72    HA   PHE  10           HA       PHE  10  -1.610  -1.086   6.789
   73    HB2  PHE  10          2HB       PHE  10  -2.551   0.952   5.667
   74    HB3  PHE  10          1HB       PHE  10  -1.801   0.415   4.165
   75    HD1  PHE  10          1HD       PHE  10  -4.348  -0.401   6.729
   76    HD2  PHE  10          2HD       PHE  10  -2.709  -1.414   2.889
   77    HE1  PHE  10          1HE       PHE  10  -6.292  -1.876   6.289
   78    HE2  PHE  10          2HE       PHE  10  -4.654  -2.890   2.450
   79    HZ   PHE  10           HZ       PHE  10  -6.446  -3.119   4.149
   80    H    VAL  11           H        VAL  11   0.288  -0.512   3.810
   81    HA   VAL  11           HA       VAL  11  -0.036  -3.237   2.898
   82    HB   VAL  11           HB       VAL  11   1.538  -2.631   1.159
   83   HG11  VAL  11          1HG1      VAL  11   0.484  -0.474   0.379
   84   HG12  VAL  11          2HG1      VAL  11  -0.335  -0.385   1.940
   85   HG13  VAL  11          3HG1      VAL  11  -0.673  -1.723   0.841
   86   HG21  VAL  11          1HG2      VAL  11   2.443  -0.149   1.411
   87   HG22  VAL  11          2HG2      VAL  11   3.319  -1.501   2.129
   88   HG23  VAL  11          3HG2      VAL  11   2.270  -0.498   3.130
   89    H    VAL  12           H        VAL  12   2.541  -1.486   4.612
   90    HA   VAL  12           HA       VAL  12   4.454  -3.611   4.557
   91    HB   VAL  12           HB       VAL  12   4.084  -1.375   6.555
   92   HG11  VAL  12          1HG1      VAL  12   5.507  -2.788   7.706
   93   HG12  VAL  12          2HG1      VAL  12   6.682  -1.920   6.722
   94   HG13  VAL  12          3HG1      VAL  12   6.136  -3.524   6.234
   95   HG21  VAL  12          1HG2      VAL  12   4.612  -1.051   3.959
   96   HG22  VAL  12          2HG2      VAL  12   6.242  -1.471   4.487
   97   HG23  VAL  12          3HG2      VAL  12   5.422  -0.075   5.184
   98    H    GLU  13           H        GLU  13   1.855  -2.823   6.834
   99    HA   GLU  13           HA       GLU  13   2.501  -4.661   8.879
  100    HB2  GLU  13          2HB       GLU  13   0.675  -2.967   9.015
  101    HB3  GLU  13          1HB       GLU  13  -0.274  -3.958   7.915
  102    HG2  GLU  13          2HG       GLU  13  -0.112  -5.850   9.522
  103    HG3  GLU  13          1HG       GLU  13   0.740  -4.785  10.637
  104    H    GLU  14           H        GLU  14   1.057  -5.184   5.728
  105    HA   GLU  14           HA       GLU  14   0.072  -7.835   6.212
  106    HB2  GLU  14          2HB       GLU  14  -0.519  -6.429   4.220
  107    HB3  GLU  14          1HB       GLU  14   1.113  -6.689   3.603
  108    HG2  GLU  14          2HG       GLU  14   0.709  -9.147   3.670
  109    HG3  GLU  14          1HG       GLU  14  -0.951  -8.832   4.175
  110    H    PHE  15           H        PHE  15   3.247  -6.540   5.485
  111    HA   PHE  15           HA       PHE  15   4.416  -9.196   6.047
  112    HB2  PHE  15          2HB       PHE  15   5.704  -9.304   4.028
  113    HB3  PHE  15          1HB       PHE  15   4.041  -8.990   3.533
  114    HD1  PHE  15          1HD       PHE  15   3.357  -6.501   3.219
  115    HD2  PHE  15          2HD       PHE  15   7.428  -7.864   3.334
  116    HE1  PHE  15          1HE       PHE  15   4.083  -4.428   2.071
  117    HE2  PHE  15          2HE       PHE  15   8.155  -5.789   2.187
  118    HZ   PHE  15           HZ       PHE  15   6.482  -4.071   1.555
  119    H    LEU  16           H        LEU  16   4.512  -7.034   7.747
  120    HA   LEU  16           HA       LEU  16   6.882  -5.442   7.223
  121    HB2  LEU  16          2HB       LEU  16   6.384  -4.278   9.188
  122    HB3  LEU  16          1HB       LEU  16   4.806  -4.756   8.603
  123    HG   LEU  16           HG       LEU  16   6.387  -6.238  10.725
  124   HD11  LEU  16          1HD1      LEU  16   4.727  -5.339  12.279
  125   HD12  LEU  16          2HD1      LEU  16   3.933  -4.480  10.960
  126   HD13  LEU  16          3HD1      LEU  16   5.562  -4.020  11.458
  127   HD21  LEU  16          1HD2      LEU  16   3.556  -6.573   9.667
  128   HD22  LEU  16          2HD2      LEU  16   4.224  -7.438  11.050
  129   HD23  LEU  16          3HD2      LEU  16   4.879  -7.713   9.440
  130    HA   PRO  17           HA       PRO  17   9.698  -8.431   8.959
  131    HB2  PRO  17          2HB       PRO  17  11.902  -6.832   9.197
  132    HB3  PRO  17          1HB       PRO  17  11.330  -7.445   7.635
  133    HG2  PRO  17          2HG       PRO  17  10.953  -4.762   8.866
  134    HG3  PRO  17          1HG       PRO  17  11.298  -5.194   7.183
  135    HD2  PRO  17          2HD       PRO  17   8.797  -4.531   8.085
  136    HD3  PRO  17          1HD       PRO  17   9.088  -5.607   6.701
  137    H    ASP  18           H        ASP  18  11.767  -7.535  10.808
  138    HA   ASP  18           HA       ASP  18  10.160  -7.403  13.242
  139    HB2  ASP  18          2HB       ASP  18  13.144  -7.418  12.758
  140    HB3  ASP  18          1HB       ASP  18  12.410  -7.429  14.357
  141    H    VAL  19           H        VAL  19  10.631  -5.123  11.117
  142    HA   VAL  19           HA       VAL  19  11.391  -2.999  13.085
  143    HB   VAL  19           HB       VAL  19  11.403  -2.868  10.059
  144   HG11  VAL  19          1HG1      VAL  19  11.212  -0.662  10.863
  145   HG12  VAL  19          2HG1      VAL  19  12.953  -0.874  10.681
  146   HG13  VAL  19          3HG1      VAL  19  12.212  -0.993  12.276
  147   HG21  VAL  19          1HG2      VAL  19  13.199  -4.193  11.802
  148   HG22  VAL  19          2HG2      VAL  19  13.999  -2.698  11.318
  149   HG23  VAL  19          3HG2      VAL  19  13.441  -3.836  10.092
  150    H    ALA  20           H        ALA  20   9.890  -1.410  13.526
  151    HA   ALA  20           HA       ALA  20   7.166  -1.789  12.599
  152    HB1  ALA  20          1HB       ALA  20   7.538  -0.959  14.849
  153    HB2  ALA  20          2HB       ALA  20   6.725   0.300  13.920
  154    HB3  ALA  20          3HB       ALA  20   8.459   0.412  14.230
  155    HA   PRO  21           HA       PRO  21   7.382   0.584   8.804
  156    HB2  PRO  21          2HB       PRO  21   4.822   1.817   9.706
  157    HB3  PRO  21          1HB       PRO  21   5.210   1.021   8.170
  158    HG2  PRO  21          2HG       PRO  21   3.730  -0.151  10.082
  159    HG3  PRO  21          1HG       PRO  21   4.779  -1.056   8.982
  160    HD2  PRO  21          2HD       PRO  21   5.128  -0.525  11.871
  161    HD3  PRO  21          1HD       PRO  21   5.823  -1.807  10.855
  162    H    ALA  22           H        ALA  22   6.522   2.176  11.840
  163    HA   ALA  22           HA       ALA  22   7.039   4.871  10.974
  164    HB1  ALA  22          1HB       ALA  22   5.798   4.708  12.967
  165    HB2  ALA  22          2HB       ALA  22   7.397   5.183  13.539
  166    HB3  ALA  22          3HB       ALA  22   6.886   3.498  13.651
  167    H    ASP  23           H        ASP  23   9.076   2.225  11.792
  168    HA   ASP  23           HA       ASP  23  11.417   3.991  12.250
  169    HB2  ASP  23          2HB       ASP  23  11.073   0.984  12.446
  170    HB3  ASP  23          1HB       ASP  23  12.597   1.825  12.727
  171    H    VAL  24           H        VAL  24   9.792   2.763   9.686
  172    HA   VAL  24           HA       VAL  24  12.264   2.272   8.085
  173    HB   VAL  24           HB       VAL  24   9.377   1.670   7.365
  174   HG11  VAL  24          1HG1      VAL  24  11.402   0.095   6.040
  175   HG12  VAL  24          2HG1      VAL  24  11.738   1.813   5.814
  176   HG13  VAL  24          3HG1      VAL  24  10.178   1.147   5.328
  177   HG21  VAL  24          1HG2      VAL  24  10.186  -0.733   7.756
  178   HG22  VAL  24          2HG2      VAL  24   9.917   0.243   9.201
  179   HG23  VAL  24          3HG2      VAL  24  11.557  -0.021   8.608
  180    H    ASP  25           H        ASP  25  12.786   3.747   6.501
  181    HA   ASP  25           HA       ASP  25  11.383   6.272   6.452
  182    HB2  ASP  25          2HB       ASP  25  13.528   5.143   4.630
  183    HB3  ASP  25          1HB       ASP  25  12.958   6.812   4.586
  184    H    VAL  26           H        VAL  26   9.280   6.079   5.703
  185    HA   VAL  26           HA       VAL  26   8.416   4.403   3.568
  186    HB   VAL  26           HB       VAL  26   6.408   5.779   3.519
  187   HG11  VAL  26          1HG1      VAL  26   5.775   5.008   5.545
  188   HG12  VAL  26          2HG1      VAL  26   6.887   6.093   6.380
  189   HG13  VAL  26          3HG1      VAL  26   7.456   4.532   5.787
  190   HG21  VAL  26          1HG2      VAL  26   7.120   8.009   3.479
  191   HG22  VAL  26          2HG2      VAL  26   8.250   7.775   4.814
  192   HG23  VAL  26          3HG2      VAL  26   6.517   7.856   5.129
  193    H    ASP  27           H        ASP  27  10.702   6.702   3.280
  194    HA   ASP  27           HA       ASP  27   9.747   7.849   0.731
  195    HB2  ASP  27          2HB       ASP  27  11.785   9.190   0.826
  196    HB3  ASP  27          1HB       ASP  27  10.962   9.276   2.379
  197    H    LEU  28           H        LEU  28  10.838   4.959   1.544
  198    HA   LEU  28           HA       LEU  28  12.918   4.669  -0.548
  199    HB2  LEU  28          2HB       LEU  28  13.179   3.570   1.690
  200    HB3  LEU  28          1HB       LEU  28  11.763   2.588   1.330
  201    HG   LEU  28           HG       LEU  28  13.111   2.026  -0.881
  202   HD11  LEU  28          1HD1      LEU  28  15.290   2.759   1.095
  203   HD12  LEU  28          2HD1      LEU  28  14.942   3.604  -0.413
  204   HD13  LEU  28          3HD1      LEU  28  15.539   1.945  -0.449
  205   HD21  LEU  28          1HD2      LEU  28  14.291   0.176   0.503
  206   HD22  LEU  28          2HD2      LEU  28  12.529   0.253   0.567
  207   HD23  LEU  28          3HD2      LEU  28  13.491   0.906   1.894
  208    H    ASP  29           H        ASP  29  12.517   3.663  -2.496
  209    HA   ASP  29           HA       ASP  29   9.812   3.335  -3.375
  210    HB2  ASP  29          2HB       ASP  29  12.413   2.258  -4.512
  211    HB3  ASP  29          1HB       ASP  29  10.860   2.169  -5.343
  212    H    LEU  30           H        LEU  30   8.458   1.695  -2.836
  213    HA   LEU  30           HA       LEU  30   9.410  -0.592  -1.350
  214    HB2  LEU  30          2HB       LEU  30   7.037  -1.372  -1.539
  215    HB3  LEU  30          1HB       LEU  30   7.176   0.280  -0.932
  216    HG   LEU  30           HG       LEU  30   7.055   0.158  -3.853
  217   HD11  LEU  30          1HD1      LEU  30   5.621  -1.772  -3.441
  218   HD12  LEU  30          2HD1      LEU  30   4.619  -0.397  -3.907
  219   HD13  LEU  30          3HD1      LEU  30   4.723  -0.878  -2.213
  220   HD21  LEU  30          1HD2      LEU  30   6.791   2.166  -2.324
  221   HD22  LEU  30          2HD2      LEU  30   5.227   1.505  -1.849
  222   HD23  LEU  30          3HD2      LEU  30   5.512   1.977  -3.524
  223    H    VAL  31           H        VAL  31   9.885   0.030  -4.491
  224    HA   VAL  31           HA       VAL  31   8.933  -2.182  -5.951
  225    HB   VAL  31           HB       VAL  31  10.298  -0.176  -6.802
  226   HG11  VAL  31          1HG1      VAL  31  12.631  -2.005  -6.204
  227   HG12  VAL  31          2HG1      VAL  31  12.174  -0.681  -5.132
  228   HG13  VAL  31          3HG1      VAL  31  12.678  -0.341  -6.788
  229   HG21  VAL  31          1HG2      VAL  31  10.320  -2.989  -7.677
  230   HG22  VAL  31          2HG2      VAL  31  11.632  -2.021  -8.351
  231   HG23  VAL  31          3HG2      VAL  31   9.957  -1.529  -8.598
  232    H    ASP  32           H        ASP  32  11.751  -1.933  -3.817
  233    HA   ASP  32           HA       ASP  32  12.859  -4.506  -4.327
  234    HB2  ASP  32          2HB       ASP  32  12.770  -2.884  -1.760
  235    HB3  ASP  32          1HB       ASP  32  13.756  -4.330  -1.981
  236    H    ASN  33           H        ASN  33  10.204  -3.414  -2.309
  237    HA   ASN  33           HA       ASN  33   9.678  -6.102  -1.253
  238    HB2  ASN  33          2HB       ASN  33   8.049  -3.564  -1.035
  239    HB3  ASN  33          1HB       ASN  33   7.801  -5.036  -0.101
  240   HD21  ASN  33          1HD2      ASN  33   8.901  -2.083   0.426
  241   HD22  ASN  33          2HD2      ASN  33  10.216  -2.383   1.456
  242    H    GLY  34           H        GLY  34   9.469  -5.101  -4.203
  243    HA2  GLY  34          2HA       GLY  34   6.912  -5.040  -5.217
  244    HA3  GLY  34          1HA       GLY  34   8.211  -5.920  -6.024
  245    H    VAL  35           H        VAL  35   8.263  -7.563  -3.344
  246    HA   VAL  35           HA       VAL  35   6.936  -9.864  -4.287
  247    HB   VAL  35           HB       VAL  35   7.504  -8.948  -1.454
  248   HG11  VAL  35          1HG1      VAL  35   6.033 -10.565  -0.840
  249   HG12  VAL  35          2HG1      VAL  35   7.279 -11.693  -1.372
  250   HG13  VAL  35          3HG1      VAL  35   5.969 -11.247  -2.465
  251   HG21  VAL  35          1HG2      VAL  35   9.512 -10.047  -1.667
  252   HG22  VAL  35          2HG2      VAL  35   9.262  -9.665  -3.370
  253   HG23  VAL  35          3HG2      VAL  35   8.848 -11.265  -2.755
  254    H    ILE  36           H        ILE  36   5.723  -7.158  -2.372
  255    HA   ILE  36           HA       ILE  36   3.114  -8.280  -1.855
  256    HB   ILE  36           HB       ILE  36   4.354  -6.239  -0.757
  257   HG12  ILE  36          2HG1      ILE  36   1.395  -6.288  -1.417
  258   HG13  ILE  36          1HG1      ILE  36   2.181  -7.003  -0.011
  259   HG21  ILE  36          1HG2      ILE  36   4.380  -5.128  -3.111
  260   HG22  ILE  36          2HG2      ILE  36   3.959  -4.124  -1.723
  261   HG23  ILE  36          3HG2      ILE  36   2.690  -4.746  -2.780
  262   HD11  ILE  36          1HD1      ILE  36   3.021  -4.353   0.053
  263   HD12  ILE  36          2HD1      ILE  36   1.755  -5.060   1.057
  264   HD13  ILE  36          3HD1      ILE  36   1.334  -4.244  -0.449
  265    H    ASP  37           H        ASP  37   4.537  -6.604  -4.552
  266    HA   ASP  37           HA       ASP  37   2.208  -5.546  -5.766
  267    HB2  ASP  37          2HB       ASP  37   4.727  -6.613  -7.063
  268    HB3  ASP  37          1HB       ASP  37   3.498  -5.664  -7.895
  269    H    SER  38           H        SER  38   3.487  -8.852  -5.841
  270    HA   SER  38           HA       SER  38   1.277  -9.578  -7.701
  271    HB2  SER  38          2HB       SER  38   3.503 -11.425  -6.888
  272    HB3  SER  38          1HB       SER  38   2.535 -11.440  -8.360
  273    H    LEU  39           H        LEU  39   2.905 -11.217  -4.961
  274    HA   LEU  39           HA       LEU  39   0.571 -12.817  -4.428
  275    HB2  LEU  39          2HB       LEU  39   3.042 -12.295  -2.782
  276    HB3  LEU  39          1HB       LEU  39   1.814 -13.481  -2.356
  277    HG   LEU  39           HG       LEU  39   2.322 -14.142  -4.965
  278   HD11  LEU  39          1HD1      LEU  39   4.591 -13.928  -5.492
  279   HD12  LEU  39          2HD1      LEU  39   5.055 -13.653  -3.814
  280   HD13  LEU  39          3HD1      LEU  39   4.245 -12.378  -4.724
  281   HD21  LEU  39          1HD2      LEU  39   2.191 -15.718  -3.104
  282   HD22  LEU  39          2HD2      LEU  39   3.716 -15.117  -2.453
  283   HD23  LEU  39          3HD2      LEU  39   3.695 -15.990  -3.985
  284    H    GLY  40           H        GLY  40   2.043 -10.141  -2.581
  285    HA2  GLY  40          2HA       GLY  40  -0.073 -10.044  -0.642
  286    HA3  GLY  40          1HA       GLY  40   1.089  -8.755  -0.944
  287    H    LEU  41           H        LEU  41   0.455  -8.403  -3.721
  288    HA   LEU  41           HA       LEU  41  -1.618  -6.478  -3.548
  289    HB2  LEU  41          2HB       LEU  41   0.131  -6.596  -5.335
  290    HB3  LEU  41          1HB       LEU  41  -0.720  -7.976  -6.026
  291    HG   LEU  41           HG       LEU  41  -2.790  -6.309  -5.921
  292   HD11  LEU  41          1HD1      LEU  41  -2.067  -3.995  -6.371
  293   HD12  LEU  41          2HD1      LEU  41  -0.386  -4.474  -6.135
  294   HD13  LEU  41          3HD1      LEU  41  -1.517  -4.529  -4.782
  295   HD21  LEU  41          1HD2      LEU  41  -2.325  -5.709  -8.239
  296   HD22  LEU  41          2HD2      LEU  41  -1.768  -7.357  -7.957
  297   HD23  LEU  41          3HD2      LEU  41  -0.606  -6.031  -8.011
  298    H    LEU  42           H        LEU  42  -1.697  -9.859  -4.643
  299    HA   LEU  42           HA       LEU  42  -4.459  -9.828  -5.434
  300    HB2  LEU  42          2HB       LEU  42  -2.792 -11.610  -6.058
  301    HB3  LEU  42          1HB       LEU  42  -2.870 -12.193  -4.402
  302    HG   LEU  42           HG       LEU  42  -5.452 -12.260  -4.811
  303   HD11  LEU  42          1HD1      LEU  42  -4.699 -11.210  -7.226
  304   HD12  LEU  42          2HD1      LEU  42  -6.209 -12.076  -6.944
  305   HD13  LEU  42          3HD1      LEU  42  -4.815 -12.927  -7.608
  306   HD21  LEU  42          1HD2      LEU  42  -5.162 -14.560  -5.862
  307   HD22  LEU  42          2HD2      LEU  42  -4.209 -14.279  -4.406
  308   HD23  LEU  42          3HD2      LEU  42  -3.442 -14.196  -5.992
  309    H    LYS  43           H        LYS  43  -2.846 -10.726  -2.387
  310    HA   LYS  43           HA       LYS  43  -5.255 -11.452  -1.006
  311    HB2  LYS  43          2HB       LYS  43  -2.582 -10.496   0.030
  312    HB3  LYS  43          1HB       LYS  43  -3.855 -11.174   1.038
  313    HG2  LYS  43          2HG       LYS  43  -3.793 -13.249  -0.349
  314    HG3  LYS  43          1HG       LYS  43  -2.429 -12.574  -1.238
  315    HD2  LYS  43          2HD       LYS  43  -1.178 -12.375   0.916
  316    HD3  LYS  43          1HD       LYS  43  -2.519 -13.179   1.731
  317    HE2  LYS  43          2HE       LYS  43  -2.040 -14.883  -0.370
  318    HE3  LYS  43          1HE       LYS  43  -0.415 -14.317   0.013
  319    HZ1  LYS  43          1HZ       LYS  43  -1.897 -16.219   1.371
  320    HZ2  LYS  43          2HZ       LYS  43  -1.836 -14.862   2.392
  321    HZ3  LYS  43          3HZ       LYS  43  -0.399 -15.566   1.824
  322    H    VAL  44           H        VAL  44  -3.511  -8.400  -1.394
  323    HA   VAL  44           HA       VAL  44  -4.938  -6.896   0.561
  324    HB   VAL  44           HB       VAL  44  -3.617  -6.042  -2.025
  325   HG11  VAL  44          1HG1      VAL  44  -5.213  -4.336  -1.453
  326   HG12  VAL  44          2HG1      VAL  44  -3.637  -3.766  -0.903
  327   HG13  VAL  44          3HG1      VAL  44  -4.789  -4.430   0.256
  328   HG21  VAL  44          1HG2      VAL  44  -2.517  -7.031   0.295
  329   HG22  VAL  44          2HG2      VAL  44  -2.500  -5.294   0.600
  330   HG23  VAL  44          3HG2      VAL  44  -1.687  -5.948  -0.823
  331    H    ILE  45           H        ILE  45  -5.605  -7.386  -2.913
  332    HA   ILE  45           HA       ILE  45  -7.854  -5.664  -3.061
  333    HB   ILE  45           HB       ILE  45  -6.822  -7.979  -4.618
  334   HG12  ILE  45          2HG1      ILE  45  -7.216  -6.333  -6.477
  335   HG13  ILE  45          1HG1      ILE  45  -7.826  -5.193  -5.278
  336   HG21  ILE  45          1HG2      ILE  45  -9.081  -8.707  -4.546
  337   HG22  ILE  45          2HG2      ILE  45  -8.932  -7.821  -6.063
  338   HG23  ILE  45          3HG2      ILE  45  -9.697  -7.059  -4.670
  339   HD11  ILE  45          1HD1      ILE  45  -5.035  -6.342  -5.481
  340   HD12  ILE  45          2HD1      ILE  45  -5.612  -5.478  -4.055
  341   HD13  ILE  45          3HD1      ILE  45  -5.516  -4.650  -5.609
  342    H    ALA  46           H        ALA  46  -7.698  -9.156  -2.344
  343    HA   ALA  46           HA       ALA  46 -10.521  -9.459  -1.915
  344    HB1  ALA  46          1HB       ALA  46  -9.396 -11.472  -2.294
  345    HB2  ALA  46          2HB       ALA  46  -9.641 -11.514  -0.548
  346    HB3  ALA  46          3HB       ALA  46  -8.073 -11.048  -1.208
  347    H    TRP  47           H        TRP  47  -7.814  -8.915   0.351
  348    HA   TRP  47           HA       TRP  47  -9.548  -8.927   2.677
  349    HB2  TRP  47          2HB       TRP  47  -7.379  -9.506   3.232
  350    HB3  TRP  47          1HB       TRP  47  -6.673  -8.307   2.149
  351    HD1  TRP  47           HD       TRP  47  -9.264  -7.806   4.990
  352    HE1  TRP  47          1HE       TRP  47  -8.325  -6.013   6.594
  353    HE3  TRP  47          3HE       TRP  47  -4.740  -7.008   2.825
  354    HZ2  TRP  47          2HZ       TRP  47  -5.941  -4.442   6.904
  355    HZ3  TRP  47          3HZ       TRP  47  -3.142  -5.365   3.777
  356    HH2  TRP  47           HH       TRP  47  -3.739  -4.083   5.810
  357    H    LEU  48           H        LEU  48  -7.983  -6.372   0.763
  358    HA   LEU  48           HA       LEU  48  -8.797  -4.168   2.330
  359    HB2  LEU  48          2HB       LEU  48  -7.189  -4.096   0.410
  360    HB3  LEU  48          1HB       LEU  48  -8.550  -4.260  -0.689
  361    HG   LEU  48           HG       LEU  48  -9.482  -2.196   0.659
  362   HD11  LEU  48          1HD1      LEU  48  -6.484  -2.022   1.035
  363   HD12  LEU  48          2HD1      LEU  48  -7.678  -2.195   2.318
  364   HD13  LEU  48          3HD1      LEU  48  -7.620  -0.714   1.363
  365   HD21  LEU  48          1HD2      LEU  48  -9.177  -1.714  -1.568
  366   HD22  LEU  48          2HD2      LEU  48  -7.560  -2.417  -1.601
  367   HD23  LEU  48          3HD2      LEU  48  -7.806  -0.802  -0.936
  368    H    GLU  49           H        GLU  49 -10.517  -5.905  -0.258
  369    HA   GLU  49           HA       GLU  49 -12.760  -4.145  -0.399
  370    HB2  GLU  49          2HB       GLU  49 -12.684  -5.679  -2.155
  371    HB3  GLU  49          1HB       GLU  49 -12.291  -7.027  -1.101
  372    HG2  GLU  49          2HG       GLU  49 -14.549  -7.099  -0.247
  373    HG3  GLU  49          1HG       GLU  49 -14.969  -5.622  -1.104
  374    H    ASP  50           H        ASP  50 -12.130  -6.997   1.633
  375    HA   ASP  50           HA       ASP  50 -14.690  -6.987   2.925
  376    HB2  ASP  50          2HB       ASP  50 -13.042  -8.887   2.929
  377    HB3  ASP  50          1HB       ASP  50 -12.076  -7.959   4.075
  378    H    ARG  51           H        ARG  51 -11.575  -5.521   3.807
  379    HA   ARG  51           HA       ARG  51 -12.419  -4.515   6.343
  380    HB2  ARG  51          2HB       ARG  51 -10.042  -4.707   5.572
  381    HB3  ARG  51          1HB       ARG  51 -10.319  -3.316   4.521
  382    HG2  ARG  51          2HG       ARG  51 -10.951  -1.960   6.495
  383    HG3  ARG  51          1HG       ARG  51 -10.634  -3.347   7.539
  384    HD2  ARG  51          2HD       ARG  51  -8.280  -3.387   6.663
  385    HD3  ARG  51          1HD       ARG  51  -8.625  -1.891   5.798
  386    HE   ARG  51           HE       ARG  51  -8.048  -2.097   8.613
  387   HH11  ARG  51          1HH1      ARG  51  -8.279  -0.219   9.851
  388   HH12  ARG  51          2HH1      ARG  51  -9.208   1.104   9.228
  389   HH21  ARG  51          1HH2      ARG  51  -9.992  -0.499   6.255
  390   HH22  ARG  51          2HH2      ARG  51 -10.178   0.945   7.194
  391    H    PHE  52           H        PHE  52 -12.401  -2.928   3.121
  392    HA   PHE  52           HA       PHE  52 -13.875  -0.654   4.354
  393    HB2  PHE  52          2HB       PHE  52 -12.433  -0.942   1.710
  394    HB3  PHE  52          1HB       PHE  52 -13.334   0.490   2.192
  395    HD1  PHE  52          1HD       PHE  52 -10.280  -1.448   2.661
  396    HD2  PHE  52          2HD       PHE  52 -12.600   1.848   4.145
  397    HE1  PHE  52          1HE       PHE  52  -8.308  -0.628   3.920
  398    HE2  PHE  52          2HE       PHE  52 -10.628   2.667   5.407
  399    HZ   PHE  52           HZ       PHE  52  -8.483   1.430   5.294
  400    H    GLY  53           H        GLY  53 -14.448  -3.453   2.505
  401    HA2  GLY  53          2HA       GLY  53 -16.488  -4.205   1.577
  402    HA3  GLY  53          1HA       GLY  53 -17.229  -2.697   2.115
  403    H    ILE  54           H        ILE  54 -14.330  -2.567   0.182
  404    HA   ILE  54           HA       ILE  54 -15.902  -1.278  -1.980
  405    HB   ILE  54           HB       ILE  54 -12.900  -1.495  -1.608
  406   HG12  ILE  54          2HG1      ILE  54 -14.720   0.871  -1.083
  407   HG13  ILE  54          1HG1      ILE  54 -14.156  -0.221   0.183
  408   HG21  ILE  54          1HG2      ILE  54 -14.594   0.253  -3.419
  409   HG22  ILE  54          2HG2      ILE  54 -13.605  -1.111  -3.942
  410   HG23  ILE  54          3HG2      ILE  54 -12.838   0.328  -3.271
  411   HD11  ILE  54          1HD1      ILE  54 -12.802   2.028  -0.820
  412   HD12  ILE  54          2HD1      ILE  54 -11.947   0.636  -1.486
  413   HD13  ILE  54          3HD1      ILE  54 -12.148   0.795   0.258
  414    H    ALA  55           H        ALA  55 -15.956  -2.105  -4.086
  415    HA   ALA  55           HA       ALA  55 -15.675  -4.918  -4.437
  416    HB1  ALA  55          1HB       ALA  55 -17.121  -3.952  -5.990
  417    HB2  ALA  55          2HB       ALA  55 -15.671  -4.174  -6.970
  418    HB3  ALA  55          3HB       ALA  55 -16.045  -2.588  -6.295
  419    H    ALA  56           H        ALA  56 -14.064  -6.119  -5.574
  420    HA   ALA  56           HA       ALA  56 -11.381  -5.428  -5.042
  421    HB1  ALA  56          1HB       ALA  56 -10.926  -7.149  -6.959
  422    HB2  ALA  56          2HB       ALA  56 -12.676  -7.366  -6.945
  423    HB3  ALA  56          3HB       ALA  56 -11.734  -7.704  -5.493
  424    H    ASP  57           H        ASP  57 -13.312  -4.916  -7.984
  425    HA   ASP  57           HA       ASP  57 -12.831  -3.643  -9.904
  426    HB2  ASP  57          2HB       ASP  57 -11.361  -2.062  -7.786
  427    HB3  ASP  57          1HB       ASP  57 -11.690  -1.473  -9.414
  428    H    ASP  58           H        ASP  58 -11.226  -5.876  -9.772
  429    HA   ASP  58           HA       ASP  58  -8.420  -5.365  -9.788
  430    HB2  ASP  58          2HB       ASP  58 -10.055  -7.496 -11.168
  431    HB3  ASP  58          1HB       ASP  58  -8.294  -7.503 -11.105
  432    H    VAL  59           H        VAL  59  -7.249  -4.225 -11.213
  433    HA   VAL  59           HA       VAL  59  -8.132  -4.128 -14.057
  434    HB   VAL  59           HB       VAL  59  -7.478  -1.710 -14.112
  435   HG11  VAL  59          1HG1      VAL  59  -9.653  -1.245 -13.740
  436   HG12  VAL  59          2HG1      VAL  59  -9.479  -1.561 -12.013
  437   HG13  VAL  59          3HG1      VAL  59  -9.828  -2.888 -13.120
  438   HG21  VAL  59          1HG2      VAL  59  -7.737  -1.083 -11.358
  439   HG22  VAL  59          2HG2      VAL  59  -6.307  -0.887 -12.370
  440   HG23  VAL  59          3HG2      VAL  59  -6.549  -2.382 -11.466
  441    H    GLU  60           H        GLU  60  -6.270  -3.473 -15.505
  442    HA   GLU  60           HA       GLU  60  -3.922  -4.987 -14.847
  443    HB2  GLU  60          2HB       GLU  60  -4.300  -2.860 -16.971
  444    HB3  GLU  60          1HB       GLU  60  -2.994  -4.043 -16.921
  445    HG2  GLU  60          2HG       GLU  60  -4.705  -5.847 -16.936
  446    HG3  GLU  60          1HG       GLU  60  -5.941  -4.618 -17.165
  447    H    LEU  61           H        LEU  61  -2.085  -4.375 -13.800
  448    HA   LEU  61           HA       LEU  61  -1.728  -1.466 -13.223
  449    HB2  LEU  61          2HB       LEU  61  -0.826  -3.635 -11.341
  450    HB3  LEU  61          1HB       LEU  61  -1.160  -1.943 -10.992
  451    HG   LEU  61           HG       LEU  61  -3.226  -4.019 -11.737
  452   HD11  LEU  61          1HD1      LEU  61  -3.625  -4.333  -9.525
  453   HD12  LEU  61          2HD1      LEU  61  -3.346  -2.634  -9.137
  454   HD13  LEU  61          3HD1      LEU  61  -1.978  -3.731  -9.329
  455   HD21  LEU  61          1HD2      LEU  61  -3.273  -1.090 -11.635
  456   HD22  LEU  61          2HD2      LEU  61  -4.502  -1.828 -10.615
  457   HD23  LEU  61          3HD2      LEU  61  -4.446  -2.204 -12.336
  458    H    SER  62           H        SER  62   0.425  -0.713 -13.237
  459    HA   SER  62           HA       SER  62   2.398  -2.623 -14.408
  460    HB2  SER  62          2HB       SER  62   3.418  -0.093 -14.832
  461    HB3  SER  62          1HB       SER  62   2.513  -1.031 -16.016
  462    HG   SER  62           HG       SER  62   0.961   0.361 -15.823
  463    HA   PRO  63           HA       PRO  63   5.000  -2.266 -10.883
  464    HB2  PRO  63          2HB       PRO  63   7.471  -1.807 -12.087
  465    HB3  PRO  63          1HB       PRO  63   6.723  -3.397 -11.865
  466    HG2  PRO  63          2HG       PRO  63   6.836  -1.678 -14.277
  467    HG3  PRO  63          1HG       PRO  63   6.874  -3.443 -14.140
  468    HD2  PRO  63          2HD       PRO  63   4.650  -2.095 -14.941
  469    HD3  PRO  63          1HD       PRO  63   4.564  -3.621 -14.031
  470    H    GLU  64           H        GLU  64   5.105   0.313 -13.255
  471    HA   GLU  64           HA       GLU  64   6.686   2.186 -11.790
  472    HB2  GLU  64          2HB       GLU  64   4.449   2.646 -13.767
  473    HB3  GLU  64          1HB       GLU  64   5.541   3.898 -13.195
  474    HG2  GLU  64          2HG       GLU  64   7.455   2.581 -14.055
  475    HG3  GLU  64          1HG       GLU  64   6.324   1.393 -14.691
  476    H    HIS  65           H        HIS  65   3.291   1.290 -11.590
  477    HA   HIS  65           HA       HIS  65   2.454   3.517  -9.969
  478    HB2  HIS  65          2HB       HIS  65   0.833   2.100 -11.148
  479    HB3  HIS  65          1HB       HIS  65   1.316   0.713 -10.171
  480    HD1  HIS  65          1HD       HIS  65   0.283   0.483  -7.869
  481    HD2  HIS  65          2HD       HIS  65  -0.495   4.201  -9.594
  482    HE1  HIS  65          1HE       HIS  65  -1.386   1.645  -6.354
  483    HE2  HIS  65          2HE       HIS  65  -1.860   3.907  -7.392
  484    H    PHE  66           H        PHE  66   4.093   0.511  -9.264
  485    HA   PHE  66           HA       PHE  66   3.722   0.938  -6.347
  486    HB2  PHE  66          2HB       PHE  66   5.017  -1.346  -7.867
  487    HB3  PHE  66          1HB       PHE  66   4.774  -1.290  -6.121
  488    HD1  PHE  66          1HD       PHE  66   2.503  -1.391  -5.156
  489    HD2  PHE  66          2HD       PHE  66   3.166  -1.712  -9.388
  490    HE1  PHE  66          1HE       PHE  66   0.195  -2.250  -5.453
  491    HE2  PHE  66          2HE       PHE  66   0.860  -2.572  -9.685
  492    HZ   PHE  66           HZ       PHE  66  -0.625  -2.840  -7.718
  493    H    ARG  67           H        ARG  67   5.693   2.176  -8.595
  494    HA   ARG  67           HA       ARG  67   8.336   1.668  -7.743
  495    HB2  ARG  67          2HB       ARG  67   7.725   2.989  -9.768
  496    HB3  ARG  67          1HB       ARG  67   7.210   4.310  -8.727
  497    HG2  ARG  67          2HG       ARG  67   9.403   4.916  -9.314
  498    HG3  ARG  67          1HG       ARG  67   9.611   4.163  -7.740
  499    HD2  ARG  67          2HD       ARG  67  10.252   2.044  -8.814
  500    HD3  ARG  67          1HD       ARG  67   9.995   2.765 -10.402
  501    HE   ARG  67           HE       ARG  67  12.284   3.254  -8.627
  502   HH11  ARG  67          1HH1      ARG  67  13.920   4.521  -9.537
  503   HH12  ARG  67          2HH1      ARG  67  13.612   5.383 -11.007
  504   HH21  ARG  67          1HH2      ARG  67  10.343   4.263 -11.292
  505   HH22  ARG  67          2HH2      ARG  67  11.587   5.237 -12.001
  506    H    SER  68           H        SER  68   5.936   3.955  -6.440
  507    HA   SER  68           HA       SER  68   7.594   4.102  -3.978
  508    HB2  SER  68          2HB       SER  68   7.473   6.519  -3.884
  509    HB3  SER  68          1HB       SER  68   8.158   6.068  -5.441
  510    HG   SER  68           HG       SER  68   6.429   7.670  -5.492
  511    H    ILE  69           H        ILE  69   6.356   4.796  -2.102
  512    HA   ILE  69           HA       ILE  69   3.714   3.745  -1.994
  513    HB   ILE  69           HB       ILE  69   5.084   5.708  -0.133
  514   HG12  ILE  69          2HG1      ILE  69   4.867   2.703   0.062
  515   HG13  ILE  69          1HG1      ILE  69   6.279   3.534  -0.571
  516   HG21  ILE  69          1HG2      ILE  69   3.328   3.928   1.185
  517   HG22  ILE  69          2HG2      ILE  69   2.445   4.606  -0.183
  518   HG23  ILE  69          3HG2      ILE  69   3.166   5.675   1.020
  519   HD11  ILE  69          1HD1      ILE  69   6.104   2.878   2.006
  520   HD12  ILE  69          2HD1      ILE  69   5.230   4.407   2.082
  521   HD13  ILE  69          3HD1      ILE  69   6.891   4.370   1.491
  522    H    ARG  70           H        ARG  70   4.937   7.039  -2.450
  523    HA   ARG  70           HA       ARG  70   2.481   8.431  -2.121
  524    HB2  ARG  70          2HB       ARG  70   4.699   9.536  -2.280
  525    HB3  ARG  70          1HB       ARG  70   4.768   9.114  -3.990
  526    HG2  ARG  70          2HG       ARG  70   2.743  10.427  -4.424
  527    HG3  ARG  70          1HG       ARG  70   2.606  10.810  -2.708
  528    HD2  ARG  70          2HD       ARG  70   3.658  12.697  -3.779
  529    HD3  ARG  70          1HD       ARG  70   4.902  11.859  -2.851
  530    HE   ARG  70           HE       ARG  70   5.023  10.735  -5.406
  531   HH11  ARG  70          1HH1      ARG  70   6.440  11.532  -6.975
  532   HH12  ARG  70          2HH1      ARG  70   7.004  13.167  -6.863
  533   HH21  ARG  70          1HH2      ARG  70   5.236  13.859  -3.961
  534   HH22  ARG  70          2HH2      ARG  70   6.322  14.483  -5.157
  535    H    SER  71           H        SER  71   3.863   6.844  -4.998
  536    HA   SER  71           HA       SER  71   1.958   7.797  -6.878
  537    HB2  SER  71          2HB       SER  71   2.654   5.939  -8.261
  538    HB3  SER  71          1HB       SER  71   4.072   6.539  -7.411
  539    HG   SER  71           HG       SER  71   2.439   4.352  -6.611
  540    H    ILE  72           H        ILE  72   1.849   5.059  -4.627
  541    HA   ILE  72           HA       ILE  72  -0.604   3.949  -5.622
  542    HB   ILE  72           HB       ILE  72   0.624   3.792  -2.854
  543   HG12  ILE  72          2HG1      ILE  72   0.846   1.889  -5.209
  544   HG13  ILE  72          1HG1      ILE  72   2.106   3.027  -4.727
  545   HG21  ILE  72          1HG2      ILE  72  -0.793   1.454  -3.555
  546   HG22  ILE  72          2HG2      ILE  72  -1.840   2.810  -3.973
  547   HG23  ILE  72          3HG2      ILE  72  -1.230   2.642  -2.327
  548   HD11  ILE  72          1HD1      ILE  72   1.739   0.426  -3.741
  549   HD12  ILE  72          2HD1      ILE  72   1.176   1.485  -2.449
  550   HD13  ILE  72          3HD1      ILE  72   2.813   1.659  -3.082
  551    H    ASP  73           H        ASP  73   0.174   6.350  -3.136
  552    HA   ASP  73           HA       ASP  73  -2.406   6.633  -2.001
  553    HB2  ASP  73          2HB       ASP  73  -0.254   7.681  -1.171
  554    HB3  ASP  73          1HB       ASP  73  -0.430   8.883  -2.448
  555    H    ALA  74           H        ALA  74  -1.000   8.122  -4.908
  556    HA   ALA  74           HA       ALA  74  -3.170   9.924  -5.395
  557    HB1  ALA  74          1HB       ALA  74  -0.878   8.853  -6.931
  558    HB2  ALA  74          2HB       ALA  74  -1.469  10.510  -6.800
  559    HB3  ALA  74          3HB       ALA  74  -2.252   9.379  -7.904
  560    H    PHE  75           H        PHE  75  -2.565   6.601  -6.527
  561    HA   PHE  75           HA       PHE  75  -4.937   6.433  -8.132
  562    HB2  PHE  75          2HB       PHE  75  -3.037   4.836  -8.291
  563    HB3  PHE  75          1HB       PHE  75  -3.487   4.190  -6.715
  564    HD1  PHE  75          1HD       PHE  75  -4.574   4.594 -10.233
  565    HD2  PHE  75          2HD       PHE  75  -5.398   2.747  -6.444
  566    HE1  PHE  75          1HE       PHE  75  -6.251   3.122 -11.315
  567    HE2  PHE  75          2HE       PHE  75  -7.075   1.274  -7.525
  568    HZ   PHE  75           HZ       PHE  75  -7.501   1.462  -9.961
  569    H    VAL  76           H        VAL  76  -4.276   5.435  -4.769
  570    HA   VAL  76           HA       VAL  76  -6.911   4.465  -4.235
  571    HB   VAL  76           HB       VAL  76  -4.732   5.545  -2.431
  572   HG11  VAL  76          1HG1      VAL  76  -6.272   4.030  -0.811
  573   HG12  VAL  76          2HG1      VAL  76  -7.514   4.679  -1.880
  574   HG13  VAL  76          3HG1      VAL  76  -6.473   5.774  -0.972
  575   HG21  VAL  76          1HG2      VAL  76  -5.726   2.710  -2.815
  576   HG22  VAL  76          2HG2      VAL  76  -4.247   3.234  -2.011
  577   HG23  VAL  76          3HG2      VAL  76  -4.402   3.389  -3.761
  578    H    VAL  77           H        VAL  77  -5.413   7.678  -3.774
  579    HA   VAL  77           HA       VAL  77  -7.657   8.872  -2.473
  580    HB   VAL  77           HB       VAL  77  -5.409  10.022  -4.139
  581   HG11  VAL  77          1HG1      VAL  77  -7.196  11.598  -4.313
  582   HG12  VAL  77          2HG1      VAL  77  -6.133  12.199  -3.042
  583   HG13  VAL  77          3HG1      VAL  77  -7.639  11.383  -2.621
  584   HG21  VAL  77          1HG2      VAL  77  -5.825  10.468  -1.207
  585   HG22  VAL  77          2HG2      VAL  77  -4.319  10.370  -2.119
  586   HG23  VAL  77          3HG2      VAL  77  -5.213   8.900  -1.731
  587    H    GLY  78           H        GLY  78  -6.748   8.626  -5.900
  588    HA2  GLY  78          2HA       GLY  78  -8.780  10.285  -6.967
  589    HA3  GLY  78          1HA       GLY  78  -8.025   8.950  -7.836
  590    H    ALA  79           H        ALA  79  -8.908   6.905  -5.914
  591    HA   ALA  79           HA       ALA  79 -11.730   6.760  -6.828
  592    HB1  ALA  79          1HB       ALA  79  -9.820   4.918  -7.125
  593    HB2  ALA  79          2HB       ALA  79 -11.508   4.469  -6.885
  594    HB3  ALA  79          3HB       ALA  79 -10.386   4.441  -5.524
  595    H    THR  80           H        THR  80  -9.793   6.176  -3.886
  596    HA   THR  80           HA       THR  80 -12.262   6.762  -2.304
  597    HB   THR  80           HB       THR  80 -10.153   4.719  -1.592
  598    HG1  THR  80          1HG       THR  80 -12.821   4.166  -2.271
  599   HG21  THR  80          1HG2      THR  80 -11.775   4.081   0.156
  600   HG22  THR  80          2HG2      THR  80 -12.839   5.388  -0.363
  601   HG23  THR  80          3HG2      THR  80 -11.264   5.758   0.339
  602    H    THR  81           H        THR  81 -11.970   8.161  -0.600
  603    HA   THR  81           HA       THR  81  -9.169   8.939   0.071
  604    HB   THR  81           HB       THR  81 -10.240  10.654  -1.371
  605    HG1  THR  81          1HG       THR  81  -9.521  12.246  -0.132
  606   HG21  THR  81          1HG2      THR  81 -12.112  11.490   0.751
  607   HG22  THR  81          2HG2      THR  81 -12.542   9.982  -0.056
  608   HG23  THR  81          3HG2      THR  81 -12.333  11.459  -0.998
  609    HA   PRO  82           HA       PRO  82 -11.418   7.913   3.945
  610    HB2  PRO  82          2HB       PRO  82  -9.449   6.439   5.090
  611    HB3  PRO  82          1HB       PRO  82 -10.557   5.770   3.876
  612    HG2  PRO  82          2HG       PRO  82  -7.731   6.600   3.604
  613    HG3  PRO  82          1HG       PRO  82  -8.624   5.324   2.765
  614    HD2  PRO  82          2HD       PRO  82  -8.026   7.874   1.728
  615    HD3  PRO  82          1HD       PRO  82  -9.199   6.722   1.056
  616    HA   PRO  83           HA       PRO  83  -9.761  11.024   6.609
  617    HB2  PRO  83          2HB       PRO  83  -9.916   9.727   9.076
  618    HB3  PRO  83          1HB       PRO  83 -11.248  10.588   8.284
  619    HG2  PRO  83          2HG       PRO  83 -10.678   7.680   8.401
  620    HG3  PRO  83          1HG       PRO  83 -12.232   8.532   8.389
  621    HD2  PRO  83          2HD       PRO  83 -11.267   7.261   6.191
  622    HD3  PRO  83          1HD       PRO  83 -12.264   8.728   6.077
  623    H    VAL  84           H        VAL  84  -7.817  11.619   7.722
  624    HA   VAL  84           HA       VAL  84  -5.622   9.673   7.380
  625    HB   VAL  84           HB       VAL  84  -5.535  12.559   8.312
  626   HG11  VAL  84          1HG1      VAL  84  -3.479  10.472   7.668
  627   HG12  VAL  84          2HG1      VAL  84  -3.486  11.670   8.963
  628   HG13  VAL  84          3HG1      VAL  84  -3.122  12.161   7.309
  629   HG21  VAL  84          1HG2      VAL  84  -5.239  13.212   6.092
  630   HG22  VAL  84          2HG2      VAL  84  -6.413  11.911   5.908
  631   HG23  VAL  84          3HG2      VAL  84  -4.706  11.609   5.587
  632    H    GLU  85           H        GLU  85  -4.716   8.576   9.048
  633    HA   GLU  85           HA       GLU  85  -5.322   9.470  11.829
  634    HB2  GLU  85          2HB       GLU  85  -5.270   6.616  10.797
  635    HB3  GLU  85          1HB       GLU  85  -5.514   7.093  12.477
  636    HG2  GLU  85          2HG       GLU  85  -7.537   8.371  11.797
  637    HG3  GLU  85          1HG       GLU  85  -7.313   7.802  10.141
  638    H    ALA  86           H        ALA  86  -3.694   8.538  13.416
  639    HA   ALA  86           HA       ALA  86  -1.048   9.163  12.674
  640    HB1  ALA  86          1HB       ALA  86  -1.912   7.190  14.813
  641    HB2  ALA  86          2HB       ALA  86  -1.833   8.938  15.027
  642    HB3  ALA  86          3HB       ALA  86  -0.358   8.019  14.729
  643    H    LYS  87           H        LYS  87   0.683   7.915  11.903
  644    HA   LYS  87           HA       LYS  87   0.109   5.757  10.157
  645    HB2  LYS  87          2HB       LYS  87   2.185   7.184  10.113
  646    HB3  LYS  87          1HB       LYS  87   2.767   6.287  11.515
  647    HG2  LYS  87          2HG       LYS  87   2.600   4.179  10.230
  648    HG3  LYS  87          1HG       LYS  87   2.048   5.088   8.823
  649    HD2  LYS  87          2HD       LYS  87   4.194   6.428   8.971
  650    HD3  LYS  87          1HD       LYS  87   4.745   5.274  10.187
  651    HE2  LYS  87          2HE       LYS  87   4.050   3.494   8.356
  652    HE3  LYS  87          1HE       LYS  87   4.267   4.857   7.257
  653    HZ1  LYS  87          1HZ       LYS  87   6.285   3.441   7.689
  654    HZ2  LYS  87          2HZ       LYS  87   6.309   4.090   9.259
  655    HZ3  LYS  87          3HZ       LYS  87   6.491   5.109   7.911
  656    H    LEU  88           H        LEU  88   1.104   5.773  13.557
  657    HA   LEU  88           HA       LEU  88   1.095   2.807  13.587
  658    HB2  LEU  88          2HB       LEU  88   1.684   4.762  15.831
  659    HB3  LEU  88          1HB       LEU  88   1.974   3.023  15.857
  660    HG   LEU  88           HG       LEU  88   3.295   5.029  14.005
  661   HD11  LEU  88          1HD1      LEU  88   5.344   4.001  15.260
  662   HD12  LEU  88          2HD1      LEU  88   4.153   3.524  16.468
  663   HD13  LEU  88          3HD1      LEU  88   4.379   5.229  16.079
  664   HD21  LEU  88          1HD2      LEU  88   3.240   3.119  12.686
  665   HD22  LEU  88          2HD2      LEU  88   3.191   2.035  14.077
  666   HD23  LEU  88          3HD2      LEU  88   4.707   2.806  13.615
  667    H    GLN  89           H        GLN  89  -0.466   1.616  14.694
  668    HA   GLN  89           HA       GLN  89  -2.940   3.091  15.368
  669    HB2  GLN  89          2HB       GLN  89  -2.427   0.102  15.319
  670    HB3  GLN  89          1HB       GLN  89  -4.000   0.895  15.403
  671    HG2  GLN  89          2HG       GLN  89  -2.026   1.110  13.110
  672    HG3  GLN  89          1HG       GLN  89  -3.529   0.188  13.097
  673   HE21  GLN  89          1HE2      GLN  89  -2.400   2.926  11.812
  674   HE22  GLN  89          2HE2      GLN  89  -3.763   3.930  11.922
  675    H1   PN7 101          3HO       SAT 101   5.913  -8.509 -11.061
  676    H2   PN7 101          1H1       SAT 101   2.497  -7.303 -10.336
  677    H3   PN7 101          2H1       SAT 101   2.773  -8.397 -11.690
  678    H5   PN7 101          1HE1      SAT 101   4.074  -4.449 -11.631
  679    H6   PN7 101          2HE1      SAT 101   3.551  -5.240 -10.143
  680    H7   PN7 101          3HE1      SAT 101   2.429  -5.072 -11.493
  681    H8   PN7 101          2HE2      SAT 101   3.946  -7.601 -13.665
  682    H9   PN7 101          3HE2      SAT 101   3.965  -5.842 -13.785
  683    H10  PN7 101          1HE2      SAT 101   2.474  -6.680 -13.354
  684    H11  PN7 101          3H        SAT 101   5.922  -6.030 -12.316
  685    H12  PN7 101          5H        SAT 101   5.363  -4.431  -9.980
  686    H13  PN7 101          1H6       SAT 101   7.551  -3.578  -9.738
  687    H14  PN7 101          2H6       SAT 101   7.700  -4.905  -8.586
  688    H15  PN7 101          1H7       SAT 101   7.998  -5.522 -11.500
  689    H16  PN7 101          2H7       SAT 101   8.765  -6.288 -10.108
  690    H17  PN7 101          9H        SAT 101   9.688  -4.491 -12.722
  691    H18  PN7 101          1H10      SAT 101  11.995  -4.274 -13.094
  692    H19  PN7 101          2H10      SAT 101  12.065  -3.434 -11.546
  693    H20  PN7 101          1H11      SAT 101  11.702  -6.382 -11.425
  694    H21  PN7 101          2H11      SAT 101  12.671  -5.324 -10.397
  695    H22  PN7 101          2HS1      SAT 101  14.335  -6.684 -11.884
  Start of MODEL    8
    1    H1   MET   1          1HT       MET   1  -1.902  14.349   1.754
    2    H2   MET   1          2HT       MET   1  -1.774  13.561   0.254
    3    H3   MET   1          3HT       MET   1  -0.379  14.135   1.037
    4    HA   MET   1           HA       MET   1  -1.419  11.603   1.192
    5    HB2  MET   1          2HB       MET   1   0.608  13.150   2.811
    6    HB3  MET   1          1HB       MET   1   0.320  11.429   3.070
    7    HG2  MET   1          2HG       MET   1   0.784  11.013   0.668
    8    HG3  MET   1          1HG       MET   1   1.151  12.726   0.461
    9    HE1  MET   1          1HE       MET   1   2.575  13.975   1.913
   10    HE2  MET   1          2HE       MET   1   4.186  13.470   2.414
   11    HE3  MET   1          3HE       MET   1   2.817  13.219   3.494
   12    H    GLN   2           H        GLN   2  -3.339  11.104   2.132
   13    HA   GLN   2           HA       GLN   2  -3.916  12.233   4.840
   14    HB2  GLN   2          2HB       GLN   2  -5.775  10.924   2.827
   15    HB3  GLN   2          1HB       GLN   2  -6.260  11.563   4.398
   16    HG2  GLN   2          2HG       GLN   2  -5.508  13.811   3.728
   17    HG3  GLN   2          1HG       GLN   2  -4.999  13.177   2.161
   18   HE21  GLN   2          1HE2      GLN   2  -6.990  15.224   2.337
   19   HE22  GLN   2          2HE2      GLN   2  -8.475  14.576   1.837
   20    H    HIS   3           H        HIS   3  -4.137  10.800   6.567
   21    HA   HIS   3           HA       HIS   3  -3.656   8.788   7.711
   22    HB2  HIS   3          2HB       HIS   3  -5.926   8.499   6.006
   23    HB3  HIS   3          1HB       HIS   3  -5.024   6.984   5.948
   24    HD1  HIS   3          1HD       HIS   3  -6.041   9.451   8.695
   25    HD2  HIS   3          2HD       HIS   3  -5.775   5.342   8.026
   26    HE1  HIS   3          1HE       HIS   3  -6.857   8.324  10.814
   27    HE2  HIS   3          2HE       HIS   3  -6.698   5.824  10.417
   28    H    ALA   4           H        ALA   4  -1.831   9.577   5.473
   29    HA   ALA   4           HA       ALA   4  -1.052   7.332   3.914
   30    HB1  ALA   4          1HB       ALA   4   1.311   8.617   4.292
   31    HB2  ALA   4          2HB       ALA   4   0.182   9.890   4.754
   32    HB3  ALA   4          3HB       ALA   4   0.080   9.159   3.152
   33    H    SER   5           H        SER   5  -0.186   8.283   7.221
   34    HA   SER   5           HA       SER   5   1.928   6.431   7.623
   35    HB2  SER   5          2HB       SER   5   1.265   8.270   9.209
   36    HB3  SER   5          1HB       SER   5  -0.120   7.291   9.685
   37    HG   SER   5           HG       SER   5   2.136   5.823   9.721
   38    H    VAL   6           H        VAL   6  -1.583   6.039   7.952
   39    HA   VAL   6           HA       VAL   6  -1.475   3.360   8.994
   40    HB   VAL   6           HB       VAL   6  -3.630   4.802   7.436
   41   HG11  VAL   6          1HG1      VAL   6  -4.013   2.445   7.162
   42   HG12  VAL   6          2HG1      VAL   6  -5.108   2.994   8.432
   43   HG13  VAL   6          3HG1      VAL   6  -3.631   2.128   8.854
   44   HG21  VAL   6          1HG2      VAL   6  -2.939   4.472  10.338
   45   HG22  VAL   6          2HG2      VAL   6  -4.633   4.629   9.875
   46   HG23  VAL   6          3HG2      VAL   6  -3.490   5.911   9.480
   47    H    ILE   7           H        ILE   7  -1.562   4.690   5.718
   48    HA   ILE   7           HA       ILE   7  -1.967   2.251   4.316
   49    HB   ILE   7           HB       ILE   7  -0.341   4.673   3.489
   50   HG12  ILE   7          2HG1      ILE   7  -3.239   3.965   2.934
   51   HG13  ILE   7          1HG1      ILE   7  -2.717   5.124   4.155
   52   HG21  ILE   7          1HG2      ILE   7   0.135   2.745   2.066
   53   HG22  ILE   7          2HG2      ILE   7  -0.891   3.877   1.183
   54   HG23  ILE   7          3HG2      ILE   7  -1.588   2.417   1.887
   55   HD11  ILE   7          1HD1      ILE   7  -1.353   5.895   1.840
   56   HD12  ILE   7          2HD1      ILE   7  -2.762   6.693   2.538
   57   HD13  ILE   7          3HD1      ILE   7  -2.971   5.476   1.280
   58    H    ALA   8           H        ALA   8   1.087   3.887   5.195
   59    HA   ALA   8           HA       ALA   8   2.793   1.801   4.213
   60    HB1  ALA   8          1HB       ALA   8   4.371   2.857   6.060
   61    HB2  ALA   8          2HB       ALA   8   3.117   4.095   6.116
   62    HB3  ALA   8          3HB       ALA   8   3.968   3.769   4.605
   63    H    GLN   9           H        GLN   9   1.543   2.510   7.464
   64    HA   GLN   9           HA       GLN   9   2.731   0.259   8.762
   65    HB2  GLN   9          2HB       GLN   9   1.745   2.212   9.951
   66    HB3  GLN   9          1HB       GLN   9   0.141   1.683   9.443
   67    HG2  GLN   9          2HG       GLN   9   1.299  -0.598  10.569
   68    HG3  GLN   9          1HG       GLN   9   1.783   0.716  11.640
   69   HE21  GLN   9          1HE2      GLN   9  -1.193  -0.297   9.852
   70   HE22  GLN   9          2HE2      GLN   9  -2.252   0.049  11.134
   71    H    PHE  10           H        PHE  10  -0.392   0.695   7.154
   72    HA   PHE  10           HA       PHE  10  -1.456  -1.880   7.821
   73    HB2  PHE  10          2HB       PHE  10  -2.804   0.059   7.008
   74    HB3  PHE  10          1HB       PHE  10  -2.092  -0.160   5.411
   75    HD1  PHE  10          1HD       PHE  10  -4.253  -1.708   7.990
   76    HD2  PHE  10          2HD       PHE  10  -2.783  -1.946   3.963
   77    HE1  PHE  10          1HE       PHE  10  -5.951  -3.443   7.475
   78    HE2  PHE  10          2HE       PHE  10  -4.479  -3.682   3.446
   79    HZ   PHE  10           HZ       PHE  10  -6.063  -4.428   5.203
   80    H    VAL  11           H        VAL  11   0.087  -0.712   4.816
   81    HA   VAL  11           HA       VAL  11   0.085  -3.327   3.591
   82    HB   VAL  11           HB       VAL  11   0.307  -1.019   2.447
   83   HG11  VAL  11          1HG1      VAL  11   3.245  -1.531   2.952
   84   HG12  VAL  11          2HG1      VAL  11   2.297  -0.413   3.931
   85   HG13  VAL  11          3HG1      VAL  11   2.504  -0.115   2.206
   86   HG21  VAL  11          1HG2      VAL  11   0.481  -3.174   1.256
   87   HG22  VAL  11          2HG2      VAL  11   2.184  -3.285   1.698
   88   HG23  VAL  11          3HG2      VAL  11   1.636  -2.009   0.609
   89    H    VAL  12           H        VAL  12   2.527  -1.478   5.397
   90    HA   VAL  12           HA       VAL  12   4.654  -3.360   5.050
   91    HB   VAL  12           HB       VAL  12   4.145  -1.400   7.294
   92   HG11  VAL  12          1HG1      VAL  12   5.758  -3.156   7.926
   93   HG12  VAL  12          2HG1      VAL  12   6.567  -1.607   7.722
   94   HG13  VAL  12          3HG1      VAL  12   6.682  -2.836   6.463
   95   HG21  VAL  12          1HG2      VAL  12   4.489  -0.761   4.712
   96   HG22  VAL  12          2HG2      VAL  12   6.181  -0.983   5.156
   97   HG23  VAL  12          3HG2      VAL  12   5.194   0.202   6.010
   98    H    GLU  13           H        GLU  13   2.031  -3.134   7.405
   99    HA   GLU  13           HA       GLU  13   2.937  -5.043   9.283
  100    HB2  GLU  13          2HB       GLU  13   0.906  -3.625   9.567
  101    HB3  GLU  13          1HB       GLU  13   0.087  -4.626   8.375
  102    HG2  GLU  13          2HG       GLU  13   0.509  -6.622   9.800
  103    HG3  GLU  13          1HG       GLU  13   1.218  -5.561  11.014
  104    H    GLU  14           H        GLU  14   1.519  -5.464   6.101
  105    HA   GLU  14           HA       GLU  14   0.896  -8.251   6.341
  106    HB2  GLU  14          2HB       GLU  14   0.072  -6.757   4.511
  107    HB3  GLU  14          1HB       GLU  14   1.703  -6.735   3.843
  108    HG2  GLU  14          2HG       GLU  14   1.628  -9.220   3.667
  109    HG3  GLU  14          1HG       GLU  14  -0.043  -9.181   4.232
  110    H    PHE  15           H        PHE  15   3.881  -6.523   5.615
  111    HA   PHE  15           HA       PHE  15   5.324  -9.111   5.839
  112    HB2  PHE  15          2HB       PHE  15   6.652  -8.697   3.861
  113    HB3  PHE  15          1HB       PHE  15   4.954  -8.589   3.400
  114    HD1  PHE  15          1HD       PHE  15   3.866  -6.287   3.272
  115    HD2  PHE  15          2HD       PHE  15   8.113  -6.848   3.582
  116    HE1  PHE  15          1HE       PHE  15   4.231  -3.976   2.451
  117    HE2  PHE  15          2HE       PHE  15   8.478  -4.535   2.763
  118    HZ   PHE  15           HZ       PHE  15   6.537  -3.101   2.197
  119    H    LEU  16           H        LEU  16   5.169  -7.183   7.842
  120    HA   LEU  16           HA       LEU  16   7.439  -5.381   7.633
  121    HB2  LEU  16          2HB       LEU  16   6.670  -4.406   9.544
  122    HB3  LEU  16          1HB       LEU  16   5.195  -5.234   9.087
  123    HG   LEU  16           HG       LEU  16   7.264  -6.257  11.066
  124   HD11  LEU  16          1HD1      LEU  16   4.791  -6.000  12.302
  125   HD12  LEU  16          2HD1      LEU  16   4.904  -4.561  11.287
  126   HD13  LEU  16          3HD1      LEU  16   6.160  -4.901  12.478
  127   HD21  LEU  16          1HD2      LEU  16   6.191  -8.263  11.065
  128   HD22  LEU  16          2HD2      LEU  16   5.497  -7.761   9.527
  129   HD23  LEU  16          3HD2      LEU  16   4.605  -7.497  11.021
  130    HA   PRO  17           HA       PRO  17  10.355  -8.420   9.150
  131    HB2  PRO  17          2HB       PRO  17  12.515  -6.805   9.455
  132    HB3  PRO  17          1HB       PRO  17  11.900  -7.244   7.851
  133    HG2  PRO  17          2HG       PRO  17  11.487  -4.737   9.408
  134    HG3  PRO  17          1HG       PRO  17  11.832  -4.948   7.685
  135    HD2  PRO  17          2HD       PRO  17   9.313  -4.485   8.671
  136    HD3  PRO  17          1HD       PRO  17   9.636  -5.362   7.160
  137    H    ASP  18           H        ASP  18  12.414  -7.476  11.057
  138    HA   ASP  18           HA       ASP  18  10.813  -7.630  13.493
  139    HB2  ASP  18          2HB       ASP  18  12.977  -7.683  14.632
  140    HB3  ASP  18          1HB       ASP  18  13.007  -8.791  13.265
  141    H    VAL  19           H        VAL  19  11.078  -5.189  11.504
  142    HA   VAL  19           HA       VAL  19  11.628  -3.128  13.605
  143    HB   VAL  19           HB       VAL  19  11.628  -2.789  10.592
  144   HG11  VAL  19          1HG1      VAL  19  11.288  -0.659  11.483
  145   HG12  VAL  19          2HG1      VAL  19  13.049  -0.737  11.428
  146   HG13  VAL  19          3HG1      VAL  19  12.201  -1.015  12.950
  147   HG21  VAL  19          1HG2      VAL  19  14.176  -2.551  11.081
  148   HG22  VAL  19          2HG2      VAL  19  13.492  -4.176  11.011
  149   HG23  VAL  19          3HG2      VAL  19  13.817  -3.422  12.572
  150    H    ALA  20           H        ALA  20   9.978  -1.715  14.124
  151    HA   ALA  20           HA       ALA  20   7.301  -2.316  13.245
  152    HB1  ALA  20          1HB       ALA  20   7.650  -1.390  15.459
  153    HB2  ALA  20          2HB       ALA  20   6.707  -0.231  14.521
  154    HB3  ALA  20          3HB       ALA  20   8.431   0.038  14.780
  155    HA   PRO  21           HA       PRO  21   7.220  -0.062   9.368
  156    HB2  PRO  21          2HB       PRO  21   4.555   0.915  10.279
  157    HB3  PRO  21          1HB       PRO  21   5.009   0.125   8.758
  158    HG2  PRO  21          2HG       PRO  21   3.691  -1.153  10.719
  159    HG3  PRO  21          1HG       PRO  21   4.824  -1.968   9.631
  160    HD2  PRO  21          2HD       PRO  21   5.141  -1.313  12.499
  161    HD3  PRO  21          1HD       PRO  21   5.964  -2.542  11.513
  162    H    ALA  22           H        ALA  22   6.448   1.498  12.421
  163    HA   ALA  22           HA       ALA  22   6.567   4.209  11.399
  164    HB1  ALA  22          1HB       ALA  22   5.490   4.275  13.418
  165    HB2  ALA  22          2HB       ALA  22   7.126   4.497  14.037
  166    HB3  ALA  22          3HB       ALA  22   6.387   2.896  14.054
  167    H    ASP  23           H        ASP  23   8.933   1.843  12.175
  168    HA   ASP  23           HA       ASP  23  11.046   3.929  12.432
  169    HB2  ASP  23          2HB       ASP  23  11.062   0.969  13.074
  170    HB3  ASP  23          1HB       ASP  23  12.478   2.014  13.194
  171    H    VAL  24           H        VAL  24   9.624   2.365   9.967
  172    HA   VAL  24           HA       VAL  24  12.132   1.581   8.602
  173    HB   VAL  24           HB       VAL  24  10.753   0.526   6.978
  174   HG11  VAL  24          1HG1      VAL  24  10.805  -0.687   9.086
  175   HG12  VAL  24          2HG1      VAL  24   9.205  -0.852   8.363
  176   HG13  VAL  24          3HG1      VAL  24   9.458   0.270   9.699
  177   HG21  VAL  24          1HG2      VAL  24   8.762   2.506   7.922
  178   HG22  VAL  24          2HG2      VAL  24   8.117   0.931   7.472
  179   HG23  VAL  24          3HG2      VAL  24   9.035   1.875   6.300
  180    H    ASP  25           H        ASP  25  12.873   2.670   6.749
  181    HA   ASP  25           HA       ASP  25  12.184   5.470   6.576
  182    HB2  ASP  25          2HB       ASP  25  13.826   3.687   4.751
  183    HB3  ASP  25          1HB       ASP  25  13.702   5.439   4.576
  184    H    VAL  26           H        VAL  26   9.907   5.466   6.112
  185    HA   VAL  26           HA       VAL  26   8.712   4.062   3.930
  186    HB   VAL  26           HB       VAL  26   6.869   5.674   4.152
  187   HG11  VAL  26          1HG1      VAL  26   7.477   5.525   6.989
  188   HG12  VAL  26          2HG1      VAL  26   7.898   4.019   6.174
  189   HG13  VAL  26          3HG1      VAL  26   6.255   4.650   6.065
  190   HG21  VAL  26          1HG2      VAL  26   7.342   7.452   6.057
  191   HG22  VAL  26          2HG2      VAL  26   7.807   7.795   4.391
  192   HG23  VAL  26          3HG2      VAL  26   9.017   7.241   5.547
  193    H    ASP  27           H        ASP  27  11.189   6.139   3.675
  194    HA   ASP  27           HA       ASP  27  10.180   7.550   1.261
  195    HB2  ASP  27          2HB       ASP  27  12.770   7.803   2.822
  196    HB3  ASP  27          1HB       ASP  27  12.395   8.727   1.367
  197    H    LEU  28           H        LEU  28  11.277   4.592   1.885
  198    HA   LEU  28           HA       LEU  28  13.234   4.428  -0.342
  199    HB2  LEU  28          2HB       LEU  28  13.685   3.265   1.834
  200    HB3  LEU  28          1HB       LEU  28  12.272   2.255   1.540
  201    HG   LEU  28           HG       LEU  28  13.483   1.824  -0.785
  202   HD11  LEU  28          1HD1      LEU  28  15.305   3.481  -0.146
  203   HD12  LEU  28          2HD1      LEU  28  15.873   1.893  -0.663
  204   HD13  LEU  28          3HD1      LEU  28  15.838   2.301   1.053
  205   HD21  LEU  28          1HD2      LEU  28  14.094   0.583   1.901
  206   HD22  LEU  28          2HD2      LEU  28  14.738  -0.085   0.402
  207   HD23  LEU  28          3HD2      LEU  28  12.994  -0.003   0.652
  208    H    ASP  29           H        ASP  29  12.702   3.506  -2.295
  209    HA   ASP  29           HA       ASP  29   9.941   3.111  -2.959
  210    HB2  ASP  29          2HB       ASP  29  12.470   2.214  -4.381
  211    HB3  ASP  29          1HB       ASP  29  10.851   2.113  -5.076
  212    H    LEU  30           H        LEU  30   8.711   1.382  -2.411
  213    HA   LEU  30           HA       LEU  30   9.838  -0.915  -1.101
  214    HB2  LEU  30          2HB       LEU  30   7.513  -1.835  -1.266
  215    HB3  LEU  30          1HB       LEU  30   7.569  -0.208  -0.585
  216    HG   LEU  30           HG       LEU  30   7.369  -0.199  -3.504
  217   HD11  LEU  30          1HD1      LEU  30   6.023  -2.137  -3.362
  218   HD12  LEU  30          2HD1      LEU  30   4.860  -0.812  -3.326
  219   HD13  LEU  30          3HD1      LEU  30   5.307  -1.633  -1.831
  220   HD21  LEU  30          1HD2      LEU  30   7.028   1.716  -1.873
  221   HD22  LEU  30          2HD2      LEU  30   5.525   0.935  -1.383
  222   HD23  LEU  30          3HD2      LEU  30   5.725   1.501  -3.041
  223    H    VAL  31           H        VAL  31  10.239  -0.155  -4.203
  224    HA   VAL  31           HA       VAL  31   9.353  -2.341  -5.745
  225    HB   VAL  31           HB       VAL  31  10.634  -0.233  -6.508
  226   HG11  VAL  31          1HG1      VAL  31  12.568  -0.776  -4.922
  227   HG12  VAL  31          2HG1      VAL  31  13.019  -0.345  -6.571
  228   HG13  VAL  31          3HG1      VAL  31  13.024  -2.035  -6.070
  229   HG21  VAL  31          1HG2      VAL  31  10.878  -3.025  -7.535
  230   HG22  VAL  31          2HG2      VAL  31  11.908  -1.801  -8.278
  231   HG23  VAL  31          3HG2      VAL  31  10.155  -1.607  -8.295
  232    H    ASP  32           H        ASP  32  12.198  -2.062  -3.645
  233    HA   ASP  32           HA       ASP  32  13.387  -4.574  -4.273
  234    HB2  ASP  32          2HB       ASP  32  14.385  -2.762  -2.797
  235    HB3  ASP  32          1HB       ASP  32  13.294  -3.302  -1.521
  236    H    ASN  33           H        ASN  33  10.736  -3.644  -2.172
  237    HA   ASN  33           HA       ASN  33  10.326  -6.379  -1.189
  238    HB2  ASN  33          2HB       ASN  33   8.624  -3.900  -0.864
  239    HB3  ASN  33          1HB       ASN  33   8.424  -5.410   0.021
  240   HD21  ASN  33          1HD2      ASN  33  10.054  -2.388   0.026
  241   HD22  ASN  33          2HD2      ASN  33  11.140  -2.718   1.289
  242    H    GLY  34           H        GLY  34  10.028  -5.300  -4.107
  243    HA2  GLY  34          2HA       GLY  34   7.453  -5.298  -5.073
  244    HA3  GLY  34          1HA       GLY  34   8.763  -6.111  -5.929
  245    H    VAL  35           H        VAL  35   8.933  -7.854  -3.329
  246    HA   VAL  35           HA       VAL  35   7.616 -10.143  -4.324
  247    HB   VAL  35           HB       VAL  35   8.286  -9.347  -1.474
  248   HG11  VAL  35          1HG1      VAL  35   6.767 -11.630  -2.539
  249   HG12  VAL  35          2HG1      VAL  35   6.887 -11.034  -0.883
  250   HG13  VAL  35          3HG1      VAL  35   8.136 -12.099  -1.530
  251   HG21  VAL  35          1HG2      VAL  35  10.138  -9.703  -3.171
  252   HG22  VAL  35          2HG2      VAL  35   9.588 -11.372  -3.316
  253   HG23  VAL  35          3HG2      VAL  35  10.204 -10.777  -1.773
  254    H    ILE  36           H        ILE  36   6.444  -7.545  -2.239
  255    HA   ILE  36           HA       ILE  36   3.877  -8.735  -1.656
  256    HB   ILE  36           HB       ILE  36   5.122  -6.726  -0.520
  257   HG12  ILE  36          2HG1      ILE  36   2.150  -6.845  -1.092
  258   HG13  ILE  36          1HG1      ILE  36   3.007  -7.486   0.308
  259   HG21  ILE  36          1HG2      ILE  36   3.395  -5.169  -2.439
  260   HG22  ILE  36          2HG2      ILE  36   5.080  -5.521  -2.823
  261   HG23  ILE  36          3HG2      ILE  36   4.682  -4.577  -1.387
  262   HD11  ILE  36          1HD1      ILE  36   3.759  -4.862   0.394
  263   HD12  ILE  36          2HD1      ILE  36   2.398  -5.528   1.295
  264   HD13  ILE  36          3HD1      ILE  36   2.124  -4.727  -0.253
  265    H    ASP  37           H        ASP  37   5.161  -6.921  -4.334
  266    HA   ASP  37           HA       ASP  37   2.734  -5.907  -5.418
  267    HB2  ASP  37          2HB       ASP  37   5.273  -6.752  -6.839
  268    HB3  ASP  37          1HB       ASP  37   3.968  -5.830  -7.581
  269    H    SER  38           H        SER  38   4.149  -9.130  -5.582
  270    HA   SER  38           HA       SER  38   2.018  -9.922  -7.506
  271    HB2  SER  38          2HB       SER  38   4.469 -11.461  -6.626
  272    HB3  SER  38          1HB       SER  38   3.351 -11.921  -7.908
  273    H    LEU  39           H        LEU  39   3.632 -11.508  -4.730
  274    HA   LEU  39           HA       LEU  39   1.315 -13.157  -4.229
  275    HB2  LEU  39          2HB       LEU  39   3.638 -12.621  -2.388
  276    HB3  LEU  39          1HB       LEU  39   2.547 -13.999  -2.336
  277    HG   LEU  39           HG       LEU  39   4.575 -13.335  -4.468
  278   HD11  LEU  39          1HD1      LEU  39   4.136 -15.649  -2.577
  279   HD12  LEU  39          2HD1      LEU  39   5.495 -14.526  -2.591
  280   HD13  LEU  39          3HD1      LEU  39   5.297 -15.687  -3.904
  281   HD21  LEU  39          1HD2      LEU  39   3.666 -15.547  -5.473
  282   HD22  LEU  39          2HD2      LEU  39   2.732 -14.077  -5.750
  283   HD23  LEU  39          3HD2      LEU  39   2.224 -15.226  -4.511
  284    H    GLY  40           H        GLY  40   2.774 -10.490  -2.364
  285    HA2  GLY  40          2HA       GLY  40   0.693 -10.401  -0.405
  286    HA3  GLY  40          1HA       GLY  40   1.804  -9.081  -0.758
  287    H    LEU  41           H        LEU  41   1.112  -8.824  -3.530
  288    HA   LEU  41           HA       LEU  41  -1.075  -7.005  -3.334
  289    HB2  LEU  41          2HB       LEU  41   0.700  -6.978  -5.111
  290    HB3  LEU  41          1HB       LEU  41  -0.067  -8.393  -5.833
  291    HG   LEU  41           HG       LEU  41  -1.886  -6.125  -5.262
  292   HD11  LEU  41          1HD1      LEU  41   0.134  -4.935  -6.044
  293   HD12  LEU  41          2HD1      LEU  41  -1.149  -4.869  -7.253
  294   HD13  LEU  41          3HD1      LEU  41   0.201  -5.985  -7.460
  295   HD21  LEU  41          1HD2      LEU  41  -1.503  -7.517  -7.897
  296   HD22  LEU  41          2HD2      LEU  41  -2.990  -6.933  -7.154
  297   HD23  LEU  41          3HD2      LEU  41  -2.227  -8.405  -6.559
  298    H    LEU  42           H        LEU  42  -0.890 -10.384  -4.388
  299    HA   LEU  42           HA       LEU  42  -3.577 -10.619  -5.313
  300    HB2  LEU  42          2HB       LEU  42  -1.782 -12.354  -5.620
  301    HB3  LEU  42          1HB       LEU  42  -1.937 -12.755  -3.916
  302    HG   LEU  42           HG       LEU  42  -4.491 -13.013  -4.503
  303   HD11  LEU  42          1HD1      LEU  42  -4.332 -12.184  -6.786
  304   HD12  LEU  42          2HD1      LEU  42  -4.752 -13.897  -6.824
  305   HD13  LEU  42          3HD1      LEU  42  -3.099 -13.384  -7.165
  306   HD21  LEU  42          1HD2      LEU  42  -3.834 -15.418  -5.388
  307   HD22  LEU  42          2HD2      LEU  42  -3.444 -14.948  -3.734
  308   HD23  LEU  42          3HD2      LEU  42  -2.200 -14.892  -4.983
  309    H    LYS  43           H        LYS  43  -2.148 -11.079  -2.082
  310    HA   LYS  43           HA       LYS  43  -4.623 -11.772  -0.793
  311    HB2  LYS  43          2HB       LYS  43  -2.073 -10.579   0.306
  312    HB3  LYS  43          1HB       LYS  43  -3.389 -11.198   1.296
  313    HG2  LYS  43          2HG       LYS  43  -3.140 -13.413   0.170
  314    HG3  LYS  43          1HG       LYS  43  -1.741 -12.778  -0.696
  315    HD2  LYS  43          2HD       LYS  43  -0.664 -12.272   1.502
  316    HD3  LYS  43          1HD       LYS  43  -2.029 -13.042   2.311
  317    HE2  LYS  43          2HE       LYS  43  -0.216 -14.658   2.098
  318    HE3  LYS  43          1HE       LYS  43  -1.545 -15.139   1.044
  319    HZ1  LYS  43          1HZ       LYS  43   0.603 -15.268  -0.077
  320    HZ2  LYS  43          2HZ       LYS  43   0.853 -13.608   0.189
  321    HZ3  LYS  43          3HZ       LYS  43  -0.413 -14.130  -0.818
  322    H    VAL  44           H        VAL  44  -2.909  -8.706  -1.300
  323    HA   VAL  44           HA       VAL  44  -4.667  -7.084   0.281
  324    HB   VAL  44           HB       VAL  44  -2.896  -6.421  -2.086
  325   HG11  VAL  44          1HG1      VAL  44  -4.038  -4.470  -2.163
  326   HG12  VAL  44          2HG1      VAL  44  -3.267  -4.101  -0.620
  327   HG13  VAL  44          3HG1      VAL  44  -4.879  -4.810  -0.652
  328   HG21  VAL  44          1HG2      VAL  44  -2.353  -5.470   0.674
  329   HG22  VAL  44          2HG2      VAL  44  -1.232  -6.061  -0.553
  330   HG23  VAL  44          3HG2      VAL  44  -2.172  -7.203   0.407
  331    H    ILE  45           H        ILE  45  -4.656  -7.834  -3.209
  332    HA   ILE  45           HA       ILE  45  -6.920  -6.229  -3.866
  333    HB   ILE  45           HB       ILE  45  -5.426  -8.467  -5.129
  334   HG12  ILE  45          2HG1      ILE  45  -5.269  -6.900  -6.950
  335   HG13  ILE  45          1HG1      ILE  45  -6.566  -5.908  -6.284
  336   HG21  ILE  45          1HG2      ILE  45  -7.199  -8.478  -6.980
  337   HG22  ILE  45          2HG2      ILE  45  -8.290  -7.764  -5.794
  338   HG23  ILE  45          3HG2      ILE  45  -7.597  -9.362  -5.507
  339   HD11  ILE  45          1HD1      ILE  45  -5.209  -4.965  -4.679
  340   HD12  ILE  45          2HD1      ILE  45  -3.987  -5.297  -5.904
  341   HD13  ILE  45          3HD1      ILE  45  -4.193  -6.398  -4.545
  342    H    ALA  46           H        ALA  46  -6.658  -9.627  -2.841
  343    HA   ALA  46           HA       ALA  46  -9.427 -10.268  -3.147
  344    HB1  ALA  46          1HB       ALA  46  -7.167 -11.378  -1.505
  345    HB2  ALA  46          2HB       ALA  46  -8.067 -12.141  -2.817
  346    HB3  ALA  46          3HB       ALA  46  -8.810 -11.957  -1.228
  347    H    TRP  47           H        TRP  47  -7.601  -8.913  -0.411
  348    HA   TRP  47           HA       TRP  47  -9.956  -8.834   1.309
  349    HB2  TRP  47          2HB       TRP  47  -8.105  -8.912   2.660
  350    HB3  TRP  47          1HB       TRP  47  -7.097  -8.042   1.504
  351    HD1  TRP  47           HD       TRP  47  -9.757  -7.441   4.202
  352    HE1  TRP  47          1HE       TRP  47  -9.582  -4.991   4.979
  353    HE3  TRP  47          3HE       TRP  47  -6.317  -5.692   0.874
  354    HZ2  TRP  47          2HZ       TRP  47  -8.165  -2.603   4.287
  355    HZ3  TRP  47          3HZ       TRP  47  -5.566  -3.335   0.950
  356    HH2  TRP  47           HH       TRP  47  -6.486  -1.790   2.650
  357    H    LEU  48           H        LEU  48  -8.010  -6.384  -0.410
  358    HA   LEU  48           HA       LEU  48  -9.563  -4.135   0.331
  359    HB2  LEU  48          2HB       LEU  48  -7.307  -4.091  -0.773
  360    HB3  LEU  48          1HB       LEU  48  -8.089  -4.536  -2.281
  361    HG   LEU  48           HG       LEU  48  -9.624  -2.469  -1.752
  362   HD11  LEU  48          1HD1      LEU  48  -8.837  -0.935  -0.244
  363   HD12  LEU  48          2HD1      LEU  48  -7.151  -1.349  -0.556
  364   HD13  LEU  48          3HD1      LEU  48  -8.132  -2.377   0.486
  365   HD21  LEU  48          1HD2      LEU  48  -6.927  -2.695  -2.981
  366   HD22  LEU  48          2HD2      LEU  48  -7.519  -1.057  -2.703
  367   HD23  LEU  48          3HD2      LEU  48  -8.449  -2.173  -3.703
  368    H    GLU  49           H        GLU  49  -9.895  -6.296  -2.501
  369    HA   GLU  49           HA       GLU  49 -12.058  -4.815  -3.668
  370    HB2  GLU  49          2HB       GLU  49 -12.401  -6.784  -5.046
  371    HB3  GLU  49          1HB       GLU  49 -10.669  -6.541  -4.859
  372    HG2  GLU  49          2HG       GLU  49 -10.736  -8.764  -4.313
  373    HG3  GLU  49          1HG       GLU  49 -11.118  -8.102  -2.727
  374    H    ASP  50           H        ASP  50 -11.893  -7.422  -1.298
  375    HA   ASP  50           HA       ASP  50 -14.743  -7.882  -1.181
  376    HB2  ASP  50          2HB       ASP  50 -12.947  -9.488  -0.421
  377    HB3  ASP  50          1HB       ASP  50 -12.700  -8.432   0.967
  378    H    ARG  51           H        ARG  51 -12.476  -6.011   0.821
  379    HA   ARG  51           HA       ARG  51 -14.357  -5.150   2.762
  380    HB2  ARG  51          2HB       ARG  51 -11.897  -4.923   2.999
  381    HB3  ARG  51          1HB       ARG  51 -11.918  -3.650   1.776
  382    HG2  ARG  51          2HG       ARG  51 -13.460  -2.328   3.191
  383    HG3  ARG  51          1HG       ARG  51 -13.401  -3.588   4.422
  384    HD2  ARG  51          2HD       ARG  51 -10.977  -2.079   3.401
  385    HD3  ARG  51          1HD       ARG  51 -11.839  -1.692   4.890
  386    HE   ARG  51           HE       ARG  51 -10.872  -4.468   4.659
  387   HH11  ARG  51          1HH1      ARG  51  -9.433  -5.075   6.292
  388   HH12  ARG  51          2HH1      ARG  51  -8.755  -3.863   7.326
  389   HH21  ARG  51          1HH2      ARG  51 -10.413  -1.237   5.785
  390   HH22  ARG  51          2HH2      ARG  51  -9.309  -1.693   7.039
  391    H    PHE  52           H        PHE  52 -13.469  -3.648  -0.364
  392    HA   PHE  52           HA       PHE  52 -15.561  -1.593   0.142
  393    HB2  PHE  52          2HB       PHE  52 -13.331  -1.757  -1.901
  394    HB3  PHE  52          1HB       PHE  52 -14.522  -0.463  -1.833
  395    HD1  PHE  52          1HD       PHE  52 -14.573   1.120   0.048
  396    HD2  PHE  52          2HD       PHE  52 -11.597  -1.966  -0.207
  397    HE1  PHE  52          1HE       PHE  52 -13.236   2.265   1.796
  398    HE2  PHE  52          2HE       PHE  52 -10.261  -0.821   1.541
  399    HZ   PHE  52           HZ       PHE  52 -11.080   1.294   2.542
  400    H    GLY  53           H        GLY  53 -15.205  -4.561  -1.391
  401    HA2  GLY  53          2HA       GLY  53 -16.617  -5.693  -2.890
  402    HA3  GLY  53          1HA       GLY  53 -17.771  -4.377  -2.669
  403    H    ILE  54           H        ILE  54 -14.461  -3.943  -3.818
  404    HA   ILE  54           HA       ILE  54 -15.586  -2.790  -6.322
  405    HB   ILE  54           HB       ILE  54 -12.759  -2.680  -5.227
  406   HG12  ILE  54          2HG1      ILE  54 -14.877  -0.515  -5.179
  407   HG13  ILE  54          1HG1      ILE  54 -14.576  -1.591  -3.813
  408   HG21  ILE  54          1HG2      ILE  54 -12.223  -1.674  -7.168
  409   HG22  ILE  54          2HG2      ILE  54 -13.538  -0.517  -6.964
  410   HG23  ILE  54          3HG2      ILE  54 -13.834  -2.056  -7.772
  411   HD11  ILE  54          1HD1      ILE  54 -13.311   0.507  -3.557
  412   HD12  ILE  54          2HD1      ILE  54 -12.528   0.230  -5.113
  413   HD13  ILE  54          3HD1      ILE  54 -12.215  -0.860  -3.761
  414    H    ALA  55           H        ALA  55 -15.270  -3.793  -8.287
  415    HA   ALA  55           HA       ALA  55 -14.348  -6.497  -8.394
  416    HB1  ALA  55          1HB       ALA  55 -14.102  -5.379 -10.984
  417    HB2  ALA  55          2HB       ALA  55 -15.468  -4.568 -10.219
  418    HB3  ALA  55          3HB       ALA  55 -15.447  -6.326 -10.349
  419    H    ALA  56           H        ALA  56 -12.342  -7.344  -8.829
  420    HA   ALA  56           HA       ALA  56 -10.026  -5.670  -8.490
  421    HB1  ALA  56          1HB       ALA  56 -10.324  -8.202  -7.984
  422    HB2  ALA  56          2HB       ALA  56  -8.769  -7.654  -8.611
  423    HB3  ALA  56          3HB       ALA  56  -9.929  -8.432  -9.688
  424    H    ASP  57           H        ASP  57 -11.741  -6.868 -11.317
  425    HA   ASP  57           HA       ASP  57  -9.563  -6.123 -13.134
  426    HB2  ASP  57          2HB       ASP  57 -11.078  -6.877 -14.891
  427    HB3  ASP  57          1HB       ASP  57 -11.047  -8.064 -13.591
  428    H    ASP  58           H        ASP  58 -11.722  -4.300 -11.445
  429    HA   ASP  58           HA       ASP  58 -12.861  -2.574 -13.401
  430    HB2  ASP  58          2HB       ASP  58 -12.011  -2.059 -10.552
  431    HB3  ASP  58          1HB       ASP  58 -12.882  -0.876 -11.527
  432    H    VAL  59           H        VAL  59  -9.686  -2.562 -11.844
  433    HA   VAL  59           HA       VAL  59  -8.813  -0.551 -13.876
  434    HB   VAL  59           HB       VAL  59  -7.390   0.512 -12.189
  435   HG11  VAL  59          1HG1      VAL  59  -9.811   0.542 -10.577
  436   HG12  VAL  59          2HG1      VAL  59 -10.187   0.630 -12.298
  437   HG13  VAL  59          3HG1      VAL  59  -9.115   1.825 -11.568
  438   HG21  VAL  59          1HG2      VAL  59  -8.616  -1.546 -10.325
  439   HG22  VAL  59          2HG2      VAL  59  -7.639  -0.177  -9.796
  440   HG23  VAL  59          3HG2      VAL  59  -6.920  -1.439 -10.795
  441    H    GLU  60           H        GLU  60  -6.465  -0.682 -14.336
  442    HA   GLU  60           HA       GLU  60  -5.533  -3.494 -14.122
  443    HB2  GLU  60          2HB       GLU  60  -5.564  -2.388 -16.359
  444    HB3  GLU  60          1HB       GLU  60  -4.396  -1.214 -15.763
  445    HG2  GLU  60          2HG       GLU  60  -2.836  -3.062 -15.248
  446    HG3  GLU  60          1HG       GLU  60  -3.992  -4.202 -15.925
  447    H    LEU  61           H        LEU  61  -3.687  -4.039 -12.988
  448    HA   LEU  61           HA       LEU  61  -2.472  -1.865 -11.365
  449    HB2  LEU  61          2HB       LEU  61  -2.204  -4.860 -10.999
  450    HB3  LEU  61          1HB       LEU  61  -1.770  -3.604  -9.843
  451    HG   LEU  61           HG       LEU  61  -4.545  -4.305 -10.805
  452   HD11  LEU  61          1HD1      LEU  61  -4.644  -5.554  -8.941
  453   HD12  LEU  61          2HD1      LEU  61  -4.206  -4.155  -7.961
  454   HD13  LEU  61          3HD1      LEU  61  -2.946  -5.191  -8.632
  455   HD21  LEU  61          1HD2      LEU  61  -3.475  -1.934  -9.288
  456   HD22  LEU  61          2HD2      LEU  61  -5.123  -2.500  -9.011
  457   HD23  LEU  61          3HD2      LEU  61  -4.633  -1.964 -10.618
  458    H    SER  62           H        SER  62  -0.271  -1.439 -11.476
  459    HA   SER  62           HA       SER  62   1.380  -3.176 -13.237
  460    HB2  SER  62          2HB       SER  62   0.538  -0.456 -13.779
  461    HB3  SER  62          1HB       SER  62   2.292  -0.548 -13.656
  462    HG   SER  62           HG       SER  62   0.570  -2.091 -15.305
  463    HA   PRO  63           HA       PRO  63   4.429  -2.870 -10.082
  464    HB2  PRO  63          2HB       PRO  63   6.733  -2.512 -11.593
  465    HB3  PRO  63          1HB       PRO  63   5.954  -4.072 -11.283
  466    HG2  PRO  63          2HG       PRO  63   5.837  -2.339 -13.685
  467    HG3  PRO  63          1HG       PRO  63   5.817  -4.105 -13.560
  468    HD2  PRO  63          2HD       PRO  63   3.571  -2.643 -14.064
  469    HD3  PRO  63          1HD       PRO  63   3.533  -4.190 -13.189
  470    H    GLU  64           H        GLU  64   4.485  -0.352 -12.550
  471    HA   GLU  64           HA       GLU  64   6.213   1.475 -11.187
  472    HB2  GLU  64          2HB       GLU  64   3.979   1.987 -13.154
  473    HB3  GLU  64          1HB       GLU  64   5.146   3.197 -12.642
  474    HG2  GLU  64          2HG       GLU  64   6.972   1.744 -13.471
  475    HG3  GLU  64          1HG       GLU  64   5.769   0.596 -14.048
  476    H    HIS  65           H        HIS  65   2.772   0.793 -10.901
  477    HA   HIS  65           HA       HIS  65   2.112   3.139  -9.367
  478    HB2  HIS  65          2HB       HIS  65   0.412   1.716 -10.494
  479    HB3  HIS  65          1HB       HIS  65   0.760   0.424  -9.344
  480    HD1  HIS  65          1HD       HIS  65  -0.090   4.148  -9.099
  481    HD2  HIS  65          2HD       HIS  65  -0.974   0.537  -7.207
  482    HE1  HIS  65          1HE       HIS  65  -1.726   4.693  -7.241
  483    HE2  HIS  65          2HE       HIS  65  -2.271   2.503  -6.085
  484    H    PHE  66           H        PHE  66   3.549   0.058  -8.547
  485    HA   PHE  66           HA       PHE  66   3.253   0.657  -5.650
  486    HB2  PHE  66          2HB       PHE  66   4.277  -1.802  -7.100
  487    HB3  PHE  66          1HB       PHE  66   4.180  -1.643  -5.345
  488    HD1  PHE  66          1HD       PHE  66   2.303  -2.154  -8.439
  489    HD2  PHE  66          2HD       PHE  66   1.976  -1.401  -4.223
  490    HE1  PHE  66          1HE       PHE  66  -0.089  -2.807  -8.507
  491    HE2  PHE  66          2HE       PHE  66  -0.416  -2.056  -4.291
  492    HZ   PHE  66           HZ       PHE  66  -1.449  -2.757  -6.433
  493    H    ARG  67           H        ARG  67   5.276   1.619  -7.976
  494    HA   ARG  67           HA       ARG  67   7.891   0.966  -7.137
  495    HB2  ARG  67          2HB       ARG  67   7.314   2.251  -9.208
  496    HB3  ARG  67          1HB       ARG  67   6.947   3.648  -8.201
  497    HG2  ARG  67          2HG       ARG  67   9.162   4.059  -8.836
  498    HG3  ARG  67          1HG       ARG  67   9.363   3.281  -7.270
  499    HD2  ARG  67          2HD       ARG  67   9.739   1.110  -8.390
  500    HD3  ARG  67          1HD       ARG  67   9.537   1.890  -9.957
  501    HE   ARG  67           HE       ARG  67  11.891   2.096  -8.214
  502   HH11  ARG  67          1HH1      ARG  67  13.636   3.205  -9.127
  503   HH12  ARG  67          2HH1      ARG  67  13.398   4.128 -10.572
  504   HH21  ARG  67          1HH2      ARG  67  10.025   3.363 -10.821
  505   HH22  ARG  67          2HH2      ARG  67  11.353   4.219 -11.531
  506    H    SER  68           H        SER  68   5.654   3.437  -5.915
  507    HA   SER  68           HA       SER  68   7.430   3.702  -3.530
  508    HB2  SER  68          2HB       SER  68   7.099   6.111  -3.499
  509    HB3  SER  68          1HB       SER  68   7.749   5.651  -5.071
  510    HG   SER  68           HG       SER  68   6.030   6.957  -5.486
  511    H    ILE  69           H        ILE  69   6.287   4.248  -1.576
  512    HA   ILE  69           HA       ILE  69   3.705   3.070  -1.319
  513    HB   ILE  69           HB       ILE  69   5.120   5.028   0.512
  514   HG12  ILE  69          2HG1      ILE  69   5.049   2.008   0.579
  515   HG13  ILE  69          1HG1      ILE  69   6.391   2.946  -0.056
  516   HG21  ILE  69          1HG2      ILE  69   3.519   3.115   1.862
  517   HG22  ILE  69          2HG2      ILE  69   2.526   3.845   0.602
  518   HG23  ILE  69          3HG2      ILE  69   3.305   4.863   1.812
  519   HD11  ILE  69          1HD1      ILE  69   6.015   2.192   2.611
  520   HD12  ILE  69          2HD1      ILE  69   5.594   3.904   2.566
  521   HD13  ILE  69          3HD1      ILE  69   7.181   3.372   2.011
  522    H    ARG  70           H        ARG  70   4.754   6.427  -1.742
  523    HA   ARG  70           HA       ARG  70   2.273   7.696  -1.187
  524    HB2  ARG  70          2HB       ARG  70   4.442   8.888  -1.481
  525    HB3  ARG  70          1HB       ARG  70   4.361   8.550  -3.211
  526    HG2  ARG  70          2HG       ARG  70   2.244   9.788  -3.373
  527    HG3  ARG  70          1HG       ARG  70   2.284  10.102  -1.637
  528    HD2  ARG  70          2HD       ARG  70   3.145  12.066  -2.743
  529    HD3  ARG  70          1HD       ARG  70   4.510  11.246  -1.984
  530    HE   ARG  70           HE       ARG  70   4.306  10.255  -4.628
  531   HH11  ARG  70          1HH1      ARG  70   5.638  11.109  -6.241
  532   HH12  ARG  70          2HH1      ARG  70   6.339  12.678  -6.027
  533   HH21  ARG  70          1HH2      ARG  70   4.895  13.189  -2.916
  534   HH22  ARG  70          2HH2      ARG  70   5.918  13.856  -4.144
  535    H    SER  71           H        SER  71   3.499   6.238  -4.193
  536    HA   SER  71           HA       SER  71   1.463   7.166  -5.935
  537    HB2  SER  71          2HB       SER  71   3.520   5.915  -6.639
  538    HB3  SER  71          1HB       SER  71   2.793   4.442  -6.005
  539    HG   SER  71           HG       SER  71   2.127   5.973  -8.245
  540    H    ILE  72           H        ILE  72   1.525   4.292  -3.822
  541    HA   ILE  72           HA       ILE  72  -0.988   3.230  -4.626
  542    HB   ILE  72           HB       ILE  72   0.382   3.086  -1.923
  543   HG12  ILE  72          2HG1      ILE  72   0.479   1.176  -4.281
  544   HG13  ILE  72          1HG1      ILE  72   1.763   2.312  -3.866
  545   HG21  ILE  72          1HG2      ILE  72  -2.144   2.115  -2.886
  546   HG22  ILE  72          2HG2      ILE  72  -1.424   1.917  -1.289
  547   HG23  ILE  72          3HG2      ILE  72  -1.080   0.747  -2.561
  548   HD11  ILE  72          1HD1      ILE  72   0.869  -0.151  -2.409
  549   HD12  ILE  72          2HD1      ILE  72   1.569   1.178  -1.486
  550   HD13  ILE  72          3HD1      ILE  72   2.504   0.404  -2.764
  551    H    ASP  73           H        ASP  73  -0.099   5.626  -2.164
  552    HA   ASP  73           HA       ASP  73  -2.635   5.913  -0.934
  553    HB2  ASP  73          2HB       ASP  73  -0.468   6.966  -0.168
  554    HB3  ASP  73          1HB       ASP  73  -0.663   8.153  -1.459
  555    H    ALA  74           H        ALA  74  -1.337   7.327  -3.913
  556    HA   ALA  74           HA       ALA  74  -3.445   9.187  -4.381
  557    HB1  ALA  74          1HB       ALA  74  -1.461   9.357  -5.718
  558    HB2  ALA  74          2HB       ALA  74  -2.764   8.912  -6.820
  559    HB3  ALA  74          3HB       ALA  74  -1.616   7.690  -6.271
  560    H    PHE  75           H        PHE  75  -3.104   5.755  -5.255
  561    HA   PHE  75           HA       PHE  75  -5.512   5.585  -6.791
  562    HB2  PHE  75          2HB       PHE  75  -3.772   3.817  -6.771
  563    HB3  PHE  75          1HB       PHE  75  -4.225   3.423  -5.116
  564    HD1  PHE  75          1HD       PHE  75  -6.206   2.164  -4.620
  565    HD2  PHE  75          2HD       PHE  75  -5.418   3.496  -8.627
  566    HE1  PHE  75          1HE       PHE  75  -8.039   0.721  -5.459
  567    HE2  PHE  75          2HE       PHE  75  -7.251   2.053  -9.467
  568    HZ   PHE  75           HZ       PHE  75  -8.563   0.666  -7.883
  569    H    VAL  76           H        VAL  76  -4.897   4.951  -3.333
  570    HA   VAL  76           HA       VAL  76  -7.585   4.251  -2.684
  571    HB   VAL  76           HB       VAL  76  -5.330   5.403  -1.025
  572   HG11  VAL  76          1HG1      VAL  76  -6.745   4.527   0.901
  573   HG12  VAL  76          2HG1      VAL  76  -8.082   4.432  -0.243
  574   HG13  VAL  76          3HG1      VAL  76  -7.343   5.990   0.120
  575   HG21  VAL  76          1HG2      VAL  76  -4.823   3.192  -1.804
  576   HG22  VAL  76          2HG2      VAL  76  -6.463   2.631  -1.481
  577   HG23  VAL  76          3HG2      VAL  76  -5.379   3.009  -0.142
  578    H    VAL  77           H        VAL  77  -5.866   7.378  -2.602
  579    HA   VAL  77           HA       VAL  77  -7.973   8.912  -1.477
  580    HB   VAL  77           HB       VAL  77  -5.728   9.633  -3.370
  581   HG11  VAL  77          1HG1      VAL  77  -6.978  11.487  -3.772
  582   HG12  VAL  77          2HG1      VAL  77  -6.463  11.964  -2.155
  583   HG13  VAL  77          3HG1      VAL  77  -8.031  11.195  -2.390
  584   HG21  VAL  77          1HG2      VAL  77  -5.830   9.038  -0.616
  585   HG22  VAL  77          2HG2      VAL  77  -5.700  10.795  -0.712
  586   HG23  VAL  77          3HG2      VAL  77  -4.488   9.776  -1.489
  587    H    GLY  78           H        GLY  78  -7.230   8.071  -4.843
  588    HA2  GLY  78          2HA       GLY  78  -9.208   9.693  -6.082
  589    HA3  GLY  78          1HA       GLY  78  -8.532   8.225  -6.780
  590    H    ALA  79           H        ALA  79  -9.491   6.538  -4.505
  591    HA   ALA  79           HA       ALA  79 -12.328   6.396  -5.397
  592    HB1  ALA  79          1HB       ALA  79 -10.433   4.344  -4.253
  593    HB2  ALA  79          2HB       ALA  79 -11.203   4.348  -5.840
  594    HB3  ALA  79          3HB       ALA  79 -12.166   4.048  -4.393
  595    H    THR  80           H        THR  80 -10.374   6.064  -2.429
  596    HA   THR  80           HA       THR  80 -12.782   6.975  -0.901
  597    HB   THR  80           HB       THR  80 -12.323   5.416   0.842
  598    HG1  THR  80          1HG       THR  80 -10.352   4.859   1.215
  599   HG21  THR  80          1HG2      THR  80 -12.305   3.228  -0.337
  600   HG22  THR  80          2HG2      THR  80 -11.836   4.055  -1.822
  601   HG23  THR  80          3HG2      THR  80 -13.407   4.380  -1.091
  602    H    THR  81           H        THR  81 -12.248   8.210   1.041
  603    HA   THR  81           HA       THR  81  -9.421   9.119   1.189
  604    HB   THR  81           HB       THR  81 -10.694  10.717  -0.220
  605    HG1  THR  81          1HG       THR  81  -9.462  11.278   2.156
  606   HG21  THR  81          1HG2      THR  81 -12.774  10.174   1.492
  607   HG22  THR  81          2HG2      THR  81 -12.725  11.536   0.372
  608   HG23  THR  81          3HG2      THR  81 -12.246  11.760   2.055
  609    HA   PRO  82           HA       PRO  82 -11.071   8.116   5.390
  610    HB2  PRO  82          2HB       PRO  82  -8.226   7.615   5.955
  611    HB3  PRO  82          1HB       PRO  82  -9.615   6.531   6.147
  612    HG2  PRO  82          2HG       PRO  82  -7.740   6.194   4.242
  613    HG3  PRO  82          1HG       PRO  82  -9.430   5.705   4.036
  614    HD2  PRO  82          2HD       PRO  82  -8.006   8.082   2.907
  615    HD3  PRO  82          1HD       PRO  82  -9.300   7.092   2.194
  616    HA   PRO  83           HA       PRO  83  -9.890  11.668   7.763
  617    HB2  PRO  83          2HB       PRO  83  -8.290  10.144   9.742
  618    HB3  PRO  83          1HB       PRO  83  -9.728  11.150   9.991
  619    HG2  PRO  83          2HG       PRO  83  -9.819   8.480  10.134
  620    HG3  PRO  83          1HG       PRO  83 -11.173   9.442   9.520
  621    HD2  PRO  83          2HD       PRO  83  -9.198   7.788   8.004
  622    HD3  PRO  83          1HD       PRO  83 -10.913   8.100   7.656
  623    H    VAL  84           H        VAL  84  -8.162  13.196   8.008
  624    HA   VAL  84           HA       VAL  84  -5.692  12.411   6.593
  625    HB   VAL  84           HB       VAL  84  -6.538  15.119   7.666
  626   HG11  VAL  84          1HG1      VAL  84  -4.181  14.082   6.205
  627   HG12  VAL  84          2HG1      VAL  84  -4.335  15.514   7.221
  628   HG13  VAL  84          3HG1      VAL  84  -4.882  15.560   5.546
  629   HG21  VAL  84          1HG2      VAL  84  -7.229  13.589   5.220
  630   HG22  VAL  84          2HG2      VAL  84  -6.771  15.273   4.961
  631   HG23  VAL  84          3HG2      VAL  84  -8.119  14.878   6.029
  632    H    GLU  85           H        GLU  85  -3.827  11.957   7.632
  633    HA   GLU  85           HA       GLU  85  -3.412  12.997  10.384
  634    HB2  GLU  85          2HB       GLU  85  -4.296  10.654  10.515
  635    HB3  GLU  85          1HB       GLU  85  -2.906  10.120   9.569
  636    HG2  GLU  85          2HG       GLU  85  -1.397  11.072  11.312
  637    HG3  GLU  85          1HG       GLU  85  -2.816  11.481  12.277
  638    H    ALA  86           H        ALA  86  -1.185  13.340  10.879
  639    HA   ALA  86           HA       ALA  86   0.525  13.976   8.705
  640    HB1  ALA  86          1HB       ALA  86   0.864  13.649  11.649
  641    HB2  ALA  86          2HB       ALA  86   1.258  15.025  10.619
  642    HB3  ALA  86          3HB       ALA  86   2.330  13.626  10.668
  643    H    LYS  87           H        LYS  87   2.082  12.788   7.607
  644    HA   LYS  87           HA       LYS  87   1.839   9.959   7.473
  645    HB2  LYS  87          2HB       LYS  87   2.841  11.436   5.697
  646    HB3  LYS  87          1HB       LYS  87   4.280  11.585   6.706
  647    HG2  LYS  87          2HG       LYS  87   4.543   9.120   6.674
  648    HG3  LYS  87          1HG       LYS  87   3.133   8.994   5.623
  649    HD2  LYS  87          2HD       LYS  87   4.323  10.506   3.987
  650    HD3  LYS  87          1HD       LYS  87   5.762  10.359   4.996
  651    HE2  LYS  87          2HE       LYS  87   5.997   8.687   3.311
  652    HE3  LYS  87          1HE       LYS  87   5.490   7.824   4.765
  653    HZ1  LYS  87          1HZ       LYS  87   3.941   6.996   3.390
  654    HZ2  LYS  87          2HZ       LYS  87   4.062   8.279   2.284
  655    HZ3  LYS  87          3HZ       LYS  87   3.134   8.455   3.696
  656    H    LEU  88           H        LEU  88   4.030  12.022   9.339
  657    HA   LEU  88           HA       LEU  88   5.385   9.637  10.454
  658    HB2  LEU  88          2HB       LEU  88   5.822  12.572  11.083
  659    HB3  LEU  88          1HB       LEU  88   6.878  11.232  11.533
  660    HG   LEU  88           HG       LEU  88   6.245  12.153   8.713
  661   HD11  LEU  88          1HD1      LEU  88   8.873  12.344   8.843
  662   HD12  LEU  88          2HD1      LEU  88   8.578  12.446  10.579
  663   HD13  LEU  88          3HD1      LEU  88   7.864  13.637   9.492
  664   HD21  LEU  88          1HD2      LEU  88   8.186  10.410   8.310
  665   HD22  LEU  88          2HD2      LEU  88   6.521   9.849   8.454
  666   HD23  LEU  88          3HD2      LEU  88   7.615   9.724   9.831
  667    H    GLN  89           H        GLN  89   5.130   8.974  12.596
  668    HA   GLN  89           HA       GLN  89   2.714   9.975  13.956
  669    HB2  GLN  89          2HB       GLN  89   3.208   7.526  13.787
  670    HB3  GLN  89          1HB       GLN  89   4.629   7.780  14.801
  671    HG2  GLN  89          2HG       GLN  89   3.203   8.643  16.610
  672    HG3  GLN  89          1HG       GLN  89   1.775   8.425  15.598
  673   HE21  GLN  89          1HE2      GLN  89   1.717   7.035  17.964
  674   HE22  GLN  89          2HE2      GLN  89   2.012   5.383  17.710
  675    H1   PN7 101          3HO       SAT 101   3.131  -6.033 -13.716
  676    H2   PN7 101          1H1       SAT 101   4.838  -7.972  -9.152
  677    H3   PN7 101          2H1       SAT 101   3.171  -8.201  -9.680
  678    H5   PN7 101          1HE1      SAT 101   5.890  -6.146 -12.236
  679    H6   PN7 101          2HE1      SAT 101   6.059  -7.874 -11.932
  680    H7   PN7 101          3HE1      SAT 101   6.454  -6.713 -10.666
  681    H8   PN7 101          2HE2      SAT 101   3.831  -4.893 -11.035
  682    H9   PN7 101          3HE2      SAT 101   4.819  -5.366  -9.654
  683    H10  PN7 101          1HE2      SAT 101   3.109  -5.792  -9.701
  684    H11  PN7 101          3H        SAT 101   3.362  -8.246 -12.414
  685    H12  PN7 101          5H        SAT 101   1.175  -5.010 -12.448
  686    H13  PN7 101          1H6       SAT 101   1.045  -5.637 -14.740
  687    H14  PN7 101          2H6       SAT 101   1.847  -7.157 -14.340
  688    H15  PN7 101          1H7       SAT 101  -1.002  -6.573 -14.551
  689    H16  PN7 101          2H7       SAT 101  -0.598  -7.294 -12.993
  690    H17  PN7 101          9H        SAT 101   0.503  -9.433 -13.038
  691    H18  PN7 101          1H10      SAT 101   0.196 -11.185 -15.266
  692    H19  PN7 101          2H10      SAT 101  -0.066 -11.643 -13.583
  693    H20  PN7 101          1H11      SAT 101  -2.106 -10.139 -15.243
  694    H21  PN7 101          2H11      SAT 101  -2.349 -10.859 -13.651
  695    H22  PN7 101          2HS1      SAT 101  -2.315 -12.389 -16.323
  Start of MODEL    9
    1    H1   MET   1          1HT       MET   1  -1.565  12.116   1.268
    2    H2   MET   1          2HT       MET   1  -1.744  10.635   0.456
    3    H3   MET   1          3HT       MET   1  -0.319  11.543   0.272
    4    HA   MET   1           HA       MET   1  -0.310   9.517   1.844
    5    HB2  MET   1          2HB       MET   1   0.722  12.255   2.647
    6    HB3  MET   1          1HB       MET   1   1.279  10.728   3.334
    7    HG2  MET   1          2HG       MET   1   1.874   9.987   1.003
    8    HG3  MET   1          1HG       MET   1   1.503  11.618   0.448
    9    HE1  MET   1          1HE       MET   1   2.703  13.337   3.206
   10    HE2  MET   1          2HE       MET   1   2.271  13.622   1.523
   11    HE3  MET   1          3HE       MET   1   3.922  13.917   2.063
   12    H    GLN   2           H        GLN   2  -2.967  11.018   2.121
   13    HA   GLN   2           HA       GLN   2  -3.355  11.812   4.822
   14    HB2  GLN   2          2HB       GLN   2  -5.290  10.513   2.881
   15    HB3  GLN   2          1HB       GLN   2  -5.760  11.268   4.403
   16    HG2  GLN   2          2HG       GLN   2  -4.835  13.413   3.649
   17    HG3  GLN   2          1HG       GLN   2  -4.308  12.669   2.139
   18   HE21  GLN   2          1HE2      GLN   2  -6.147  14.854   2.119
   19   HE22  GLN   2          2HE2      GLN   2  -7.655  14.286   1.586
   20    H    HIS   3           H        HIS   3  -3.473   8.612   3.299
   21    HA   HIS   3           HA       HIS   3  -3.608   7.421   6.043
   22    HB2  HIS   3          2HB       HIS   3  -4.834   5.537   5.107
   23    HB3  HIS   3          1HB       HIS   3  -5.679   7.027   4.690
   24    HD1  HIS   3          1HD       HIS   3  -5.134   7.989   2.205
   25    HD2  HIS   3          2HD       HIS   3  -4.095   4.010   2.906
   26    HE1  HIS   3          1HE       HIS   3  -4.790   6.926  -0.070
   27    HE2  HIS   3          2HE       HIS   3  -4.153   4.506   0.346
   28    H    ALA   4           H        ALA   4  -1.324   8.181   4.177
   29    HA   ALA   4           HA       ALA   4  -0.158   5.848   3.051
   30    HB1  ALA   4          1HB       ALA   4   1.034   7.693   2.388
   31    HB2  ALA   4          2HB       ALA   4   2.037   7.244   3.767
   32    HB3  ALA   4          3HB       ALA   4   0.824   8.512   3.936
   33    H    SER   5           H        SER   5  -0.137   7.084   6.367
   34    HA   SER   5           HA       SER   5   1.906   5.408   7.408
   35    HB2  SER   5          2HB       SER   5   0.775   7.296   8.641
   36    HB3  SER   5          1HB       SER   5  -0.624   6.248   8.851
   37    HG   SER   5           HG       SER   5   1.687   6.320  10.230
   38    H    VAL   6           H        VAL   6  -1.569   4.815   6.967
   39    HA   VAL   6           HA       VAL   6  -1.559   2.202   8.164
   40    HB   VAL   6           HB       VAL   6  -3.385   3.451   6.105
   41   HG11  VAL   6          1HG1      VAL   6  -4.946   1.575   6.815
   42   HG12  VAL   6          2HG1      VAL   6  -3.550   0.812   7.577
   43   HG13  VAL   6          3HG1      VAL   6  -3.571   1.070   5.832
   44   HG21  VAL   6          1HG2      VAL   6  -4.554   2.864   8.670
   45   HG22  VAL   6          2HG2      VAL   6  -4.370   4.430   7.879
   46   HG23  VAL   6          3HG2      VAL   6  -3.078   3.803   8.902
   47    H    ILE   7           H        ILE   7  -1.019   3.370   4.869
   48    HA   ILE   7           HA       ILE   7  -0.967   0.858   3.552
   49    HB   ILE   7           HB       ILE   7   0.653   3.354   2.970
   50   HG12  ILE   7          2HG1      ILE   7  -1.978   2.400   1.793
   51   HG13  ILE   7          1HG1      ILE   7  -1.849   3.621   3.060
   52   HG21  ILE   7          1HG2      ILE   7   1.677   1.859   1.560
   53   HG22  ILE   7          2HG2      ILE   7   0.254   2.176   0.569
   54   HG23  ILE   7          3HG2      ILE   7   0.316   0.739   1.588
   55   HD11  ILE   7          1HD1      ILE   7  -1.457   3.905   0.195
   56   HD12  ILE   7          2HD1      ILE   7  -0.035   4.447   1.088
   57   HD13  ILE   7          3HD1      ILE   7  -1.613   5.156   1.428
   58    H    ALA   8           H        ALA   8   1.740   2.722   4.965
   59    HA   ALA   8           HA       ALA   8   3.721   0.711   4.464
   60    HB1  ALA   8          1HB       ALA   8   4.734   2.714   5.017
   61    HB2  ALA   8          2HB       ALA   8   4.768   1.939   6.601
   62    HB3  ALA   8          3HB       ALA   8   3.510   3.117   6.221
   63    H    GLN   9           H        GLN   9   1.648   1.396   7.252
   64    HA   GLN   9           HA       GLN   9   2.672  -0.686   8.939
   65    HB2  GLN   9          2HB       GLN   9   1.280   1.204   9.760
   66    HB3  GLN   9          1HB       GLN   9  -0.101   0.547   8.882
   67    HG2  GLN   9          2HG       GLN   9   0.905  -1.606  10.383
   68    HG3  GLN   9          1HG       GLN   9   0.943  -0.222  11.473
   69   HE21  GLN   9          1HE2      GLN   9  -1.288  -1.753   9.081
   70   HE22  GLN   9          2HE2      GLN   9  -2.697  -1.414   9.965
   71    H    PHE  10           H        PHE  10   0.058  -0.570   6.565
   72    HA   PHE  10           HA       PHE  10  -1.058  -3.132   7.073
   73    HB2  PHE  10          2HB       PHE  10  -2.002  -1.278   5.612
   74    HB3  PHE  10          1HB       PHE  10  -0.861  -1.788   4.369
   75    HD1  PHE  10          1HD       PHE  10  -3.828  -2.743   6.334
   76    HD2  PHE  10          2HD       PHE  10  -1.156  -3.882   3.172
   77    HE1  PHE  10          1HE       PHE  10  -5.416  -4.515   5.634
   78    HE2  PHE  10          2HE       PHE  10  -2.743  -5.656   2.471
   79    HZ   PHE  10           HZ       PHE  10  -4.875  -5.968   3.700
   80    H    VAL  11           H        VAL  11   1.385  -2.171   4.651
   81    HA   VAL  11           HA       VAL  11   1.874  -4.901   3.821
   82    HB   VAL  11           HB       VAL  11   2.284  -2.964   2.342
   83   HG11  VAL  11          1HG1      VAL  11   4.027  -1.403   2.738
   84   HG12  VAL  11          2HG1      VAL  11   4.718  -2.382   4.031
   85   HG13  VAL  11          3HG1      VAL  11   3.185  -1.545   4.280
   86   HG21  VAL  11          1HG2      VAL  11   4.737  -4.610   3.033
   87   HG22  VAL  11          2HG2      VAL  11   4.552  -3.668   1.556
   88   HG23  VAL  11          3HG2      VAL  11   3.482  -5.034   1.870
   89    H    VAL  12           H        VAL  12   3.759  -2.617   5.830
   90    HA   VAL  12           HA       VAL  12   5.916  -4.375   6.396
   91    HB   VAL  12           HB       VAL  12   4.757  -2.087   7.979
   92   HG11  VAL  12          1HG1      VAL  12   5.949  -3.197   9.641
   93   HG12  VAL  12          2HG1      VAL  12   7.217  -2.196   8.935
   94   HG13  VAL  12          3HG1      VAL  12   7.089  -3.899   8.493
   95   HG21  VAL  12          1HG2      VAL  12   6.357  -2.275   5.622
   96   HG22  VAL  12          2HG2      VAL  12   7.378  -1.651   6.916
   97   HG23  VAL  12          3HG2      VAL  12   5.881  -0.820   6.494
   98    H    GLU  13           H        GLU  13   2.791  -4.023   8.015
   99    HA   GLU  13           HA       GLU  13   3.392  -5.533  10.342
  100    HB2  GLU  13          2HB       GLU  13   1.304  -4.224  10.030
  101    HB3  GLU  13          1HB       GLU  13   0.757  -5.423   8.866
  102    HG2  GLU  13          2HG       GLU  13   0.956  -7.170  10.644
  103    HG3  GLU  13          1HG       GLU  13   1.348  -5.889  11.789
  104    H    GLU  14           H        GLU  14   2.500  -6.559   7.096
  105    HA   GLU  14           HA       GLU  14   2.013  -9.307   7.734
  106    HB2  GLU  14          2HB       GLU  14   1.316  -8.198   5.612
  107    HB3  GLU  14          1HB       GLU  14   3.009  -8.152   5.119
  108    HG2  GLU  14          2HG       GLU  14   3.109 -10.631   5.350
  109    HG3  GLU  14          1HG       GLU  14   1.387 -10.637   5.728
  110    H    PHE  15           H        PHE  15   4.997  -7.572   6.876
  111    HA   PHE  15           HA       PHE  15   6.472 -10.152   7.023
  112    HB2  PHE  15          2HB       PHE  15   7.545  -7.433   6.236
  113    HB3  PHE  15          1HB       PHE  15   8.304  -9.003   5.965
  114    HD1  PHE  15          1HD       PHE  15   7.342 -10.602   4.317
  115    HD2  PHE  15          2HD       PHE  15   5.742  -6.662   4.875
  116    HE1  PHE  15          1HE       PHE  15   6.084 -10.810   2.187
  117    HE2  PHE  15          2HE       PHE  15   4.481  -6.865   2.758
  118    HZ   PHE  15           HZ       PHE  15   4.653  -8.939   1.405
  119    H    LEU  16           H        LEU  16   6.951  -6.807   8.269
  120    HA   LEU  16           HA       LEU  16   8.228  -8.063  10.675
  121    HB2  LEU  16          2HB       LEU  16   9.207  -6.069   8.801
  122    HB3  LEU  16          1HB       LEU  16   9.239  -5.472  10.458
  123    HG   LEU  16           HG       LEU  16  10.419  -7.550  11.156
  124   HD11  LEU  16          1HD1      LEU  16   9.796  -8.241   8.362
  125   HD12  LEU  16          2HD1      LEU  16  10.126  -9.298   9.735
  126   HD13  LEU  16          3HD1      LEU  16  11.462  -8.586   8.830
  127   HD21  LEU  16          1HD2      LEU  16  12.311  -6.844   9.131
  128   HD22  LEU  16          2HD2      LEU  16  12.276  -6.322  10.815
  129   HD23  LEU  16          3HD2      LEU  16  11.432  -5.384   9.584
  130    HA   PRO  17           HA       PRO  17   4.941  -5.345  12.340
  131    HB2  PRO  17          2HB       PRO  17   3.687  -7.266  13.833
  132    HB3  PRO  17          1HB       PRO  17   3.321  -6.957  12.129
  133    HG2  PRO  17          2HG       PRO  17   4.646  -9.234  13.335
  134    HG3  PRO  17          1HG       PRO  17   3.996  -9.043  11.702
  135    HD2  PRO  17          2HD       PRO  17   6.770  -8.842  12.582
  136    HD3  PRO  17          1HD       PRO  17   6.124  -8.861  10.926
  137    H    ASP  18           H        ASP  18   7.318  -7.419  13.789
  138    HA   ASP  18           HA       ASP  18   6.832  -6.610  16.540
  139    HB2  ASP  18          2HB       ASP  18   9.193  -7.924  15.188
  140    HB3  ASP  18          1HB       ASP  18   9.085  -7.652  16.922
  141    H    VAL  19           H        VAL  19   8.001  -5.009  13.888
  142    HA   VAL  19           HA       VAL  19   9.715  -3.202  15.547
  143    HB   VAL  19           HB       VAL  19   9.680  -3.516  12.526
  144   HG11  VAL  19          1HG1      VAL  19  11.995  -2.337  12.989
  145   HG12  VAL  19          2HG1      VAL  19  11.204  -1.821  14.479
  146   HG13  VAL  19          3HG1      VAL  19  10.517  -1.377  12.916
  147   HG21  VAL  19          1HG2      VAL  19  11.608  -4.870  12.706
  148   HG22  VAL  19          2HG2      VAL  19  10.555  -5.484  13.982
  149   HG23  VAL  19          3HG2      VAL  19  11.888  -4.401  14.383
  150    H    ALA  20           H        ALA  20   9.181  -0.939  15.458
  151    HA   ALA  20           HA       ALA  20   6.438  -0.331  15.055
  152    HB1  ALA  20          1HB       ALA  20   8.929   1.296  15.392
  153    HB2  ALA  20          2HB       ALA  20   7.496   1.225  16.418
  154    HB3  ALA  20          3HB       ALA  20   7.447   2.112  14.894
  155    HA   PRO  21           HA       PRO  21   6.798  -0.334  10.538
  156    HB2  PRO  21          2HB       PRO  21   4.100   0.529  10.230
  157    HB3  PRO  21          1HB       PRO  21   4.740  -1.109  10.037
  158    HG2  PRO  21          2HG       PRO  21   3.113  -0.063  12.138
  159    HG3  PRO  21          1HG       PRO  21   3.681  -1.719  11.894
  160    HD2  PRO  21          2HD       PRO  21   4.567   0.174  13.856
  161    HD3  PRO  21          1HD       PRO  21   5.149  -1.480  13.592
  162    H    ALA  22           H        ALA  22   5.677   2.275  12.553
  163    HA   ALA  22           HA       ALA  22   5.564   4.292  10.485
  164    HB1  ALA  22          1HB       ALA  22   4.554   5.318  12.219
  165    HB2  ALA  22          2HB       ALA  22   6.156   5.574  12.910
  166    HB3  ALA  22          3HB       ALA  22   5.218   4.151  13.364
  167    H    ASP  23           H        ASP  23   8.171   2.722  12.084
  168    HA   ASP  23           HA       ASP  23  10.022   4.981  11.673
  169    HB2  ASP  23          2HB       ASP  23  11.701   3.559  12.711
  170    HB3  ASP  23          1HB       ASP  23  10.227   3.499  13.675
  171    H    VAL  24           H        VAL  24   8.657   2.824   9.639
  172    HA   VAL  24           HA       VAL  24  11.021   1.934   8.188
  173    HB   VAL  24           HB       VAL  24   9.446   1.088   6.550
  174   HG11  VAL  24          1HG1      VAL  24   9.121   0.621   9.412
  175   HG12  VAL  24          2HG1      VAL  24   9.177  -0.541   8.087
  176   HG13  VAL  24          3HG1      VAL  24   7.656   0.248   8.502
  177   HG21  VAL  24          1HG2      VAL  24   6.907   1.676   7.389
  178   HG22  VAL  24          2HG2      VAL  24   7.743   2.525   6.089
  179   HG23  VAL  24          3HG2      VAL  24   7.744   3.193   7.722
  180    H    ASP  25           H        ASP  25  11.922   2.924   6.365
  181    HA   ASP  25           HA       ASP  25  11.529   5.754   6.076
  182    HB2  ASP  25          2HB       ASP  25  12.907   3.738   4.278
  183    HB3  ASP  25          1HB       ASP  25  12.981   5.485   4.044
  184    H    VAL  26           H        VAL  26   9.184   5.846   5.724
  185    HA   VAL  26           HA       VAL  26   7.885   4.596   3.502
  186    HB   VAL  26           HB       VAL  26   6.095   6.193   3.865
  187   HG11  VAL  26          1HG1      VAL  26   6.546   6.194   6.635
  188   HG12  VAL  26          2HG1      VAL  26   7.411   4.780   6.036
  189   HG13  VAL  26          3HG1      VAL  26   5.688   4.962   5.710
  190   HG21  VAL  26          1HG2      VAL  26   8.341   7.848   4.791
  191   HG22  VAL  26          2HG2      VAL  26   6.933   7.926   5.849
  192   HG23  VAL  26          3HG2      VAL  26   6.777   8.340   4.142
  193    H    ASP  27           H        ASP  27  10.447   6.575   3.313
  194    HA   ASP  27           HA       ASP  27   9.462   8.073   0.929
  195    HB2  ASP  27          2HB       ASP  27  11.982   8.366   2.595
  196    HB3  ASP  27          1HB       ASP  27  11.644   9.304   1.140
  197    H    LEU  28           H        LEU  28  10.613   5.133   1.522
  198    HA   LEU  28           HA       LEU  28  12.641   5.086  -0.650
  199    HB2  LEU  28          2HB       LEU  28  13.095   3.910   1.519
  200    HB3  LEU  28          1HB       LEU  28  11.737   2.844   1.178
  201    HG   LEU  28           HG       LEU  28  12.959   2.416  -1.093
  202   HD11  LEU  28          1HD1      LEU  28  15.084   3.158  -1.348
  203   HD12  LEU  28          2HD1      LEU  28  15.508   2.780   0.321
  204   HD13  LEU  28          3HD1      LEU  28  14.696   4.297  -0.059
  205   HD21  LEU  28          1HD2      LEU  28  12.720   0.627   0.460
  206   HD22  LEU  28          2HD2      LEU  28  13.826   1.379   1.611
  207   HD23  LEU  28          3HD2      LEU  28  14.447   0.700   0.106
  208    H    ASP  29           H        ASP  29  12.226   4.113  -2.610
  209    HA   ASP  29           HA       ASP  29   9.525   3.696  -3.422
  210    HB2  ASP  29          2HB       ASP  29  12.118   2.698  -4.643
  211    HB3  ASP  29          1HB       ASP  29  10.546   2.607  -5.436
  212    H    LEU  30           H        LEU  30   8.223   2.008  -2.902
  213    HA   LEU  30           HA       LEU  30   9.249  -0.264  -1.454
  214    HB2  LEU  30          2HB       LEU  30   6.840  -1.133  -1.881
  215    HB3  LEU  30          1HB       LEU  30   7.038   0.318  -0.897
  216    HG   LEU  30           HG       LEU  30   6.876   0.886  -3.770
  217   HD11  LEU  30          1HD1      LEU  30   4.416   0.472  -3.873
  218   HD12  LEU  30          2HD1      LEU  30   4.523  -0.377  -2.331
  219   HD13  LEU  30          3HD1      LEU  30   5.348  -1.019  -3.752
  220   HD21  LEU  30          1HD2      LEU  30   5.363   1.819  -1.309
  221   HD22  LEU  30          2HD2      LEU  30   5.229   2.548  -2.908
  222   HD23  LEU  30          3HD2      LEU  30   6.760   2.613  -2.036
  223    H    VAL  31           H        VAL  31   9.738   0.360  -4.591
  224    HA   VAL  31           HA       VAL  31   8.823  -1.898  -6.027
  225    HB   VAL  31           HB       VAL  31  11.431  -0.367  -6.277
  226   HG11  VAL  31          1HG1      VAL  31  10.203  -2.538  -7.983
  227   HG12  VAL  31          2HG1      VAL  31  11.844  -2.449  -7.341
  228   HG13  VAL  31          3HG1      VAL  31  11.347  -1.372  -8.645
  229   HG21  VAL  31          1HG2      VAL  31  10.066   1.194  -7.156
  230   HG22  VAL  31          2HG2      VAL  31   8.678   0.112  -7.075
  231   HG23  VAL  31          3HG2      VAL  31   9.746   0.071  -8.477
  232    H    ASP  32           H        ASP  32  11.719  -1.480  -4.027
  233    HA   ASP  32           HA       ASP  32  12.858  -4.053  -4.418
  234    HB2  ASP  32          2HB       ASP  32  12.807  -2.300  -1.937
  235    HB3  ASP  32          1HB       ASP  32  13.818  -3.735  -2.110
  236    H    ASN  33           H        ASN  33  10.227  -2.910  -2.402
  237    HA   ASN  33           HA       ASN  33   9.792  -5.533  -1.163
  238    HB2  ASN  33          2HB       ASN  33   8.078  -3.041  -1.116
  239    HB3  ASN  33          1HB       ASN  33   7.877  -4.454  -0.083
  240   HD21  ASN  33          1HD2      ASN  33   8.878  -1.439   0.246
  241   HD22  ASN  33          2HD2      ASN  33  10.204  -1.626   1.288
  242    H    GLY  34           H        GLY  34   9.541  -4.759  -4.174
  243    HA2  GLY  34          2HA       GLY  34   6.979  -4.865  -5.180
  244    HA3  GLY  34          1HA       GLY  34   8.308  -5.755  -5.924
  245    H    VAL  35           H        VAL  35   8.429  -7.179  -3.127
  246    HA   VAL  35           HA       VAL  35   7.205  -9.606  -3.864
  247    HB   VAL  35           HB       VAL  35   7.728  -8.414  -1.123
  248   HG11  VAL  35          1HG1      VAL  35   7.621 -11.155  -0.803
  249   HG12  VAL  35          2HG1      VAL  35   6.276 -10.847  -1.902
  250   HG13  VAL  35          3HG1      VAL  35   6.345 -10.029  -0.340
  251   HG21  VAL  35          1HG2      VAL  35   9.136 -10.694  -2.526
  252   HG22  VAL  35          2HG2      VAL  35   9.698  -9.754  -1.143
  253   HG23  VAL  35          3HG2      VAL  35   9.631  -9.014  -2.743
  254    H    ILE  36           H        ILE  36   5.880  -6.814  -2.143
  255    HA   ILE  36           HA       ILE  36   3.306  -7.999  -1.587
  256    HB   ILE  36           HB       ILE  36   4.430  -5.853  -0.587
  257   HG12  ILE  36          2HG1      ILE  36   1.515  -6.141  -1.344
  258   HG13  ILE  36          1HG1      ILE  36   2.284  -6.542   0.188
  259   HG21  ILE  36          1HG2      ILE  36   2.825  -4.540  -2.775
  260   HG22  ILE  36          2HG2      ILE  36   4.536  -4.904  -3.009
  261   HG23  ILE  36          3HG2      ILE  36   4.033  -3.818  -1.712
  262   HD11  ILE  36          1HD1      ILE  36   2.926  -3.899  -0.024
  263   HD12  ILE  36          2HD1      ILE  36   1.511  -4.499   0.837
  264   HD13  ILE  36          3HD1      ILE  36   1.356  -3.926  -0.823
  265    H    ASP  37           H        ASP  37   4.744  -6.451  -4.330
  266    HA   ASP  37           HA       ASP  37   2.461  -5.538  -5.710
  267    HB2  ASP  37          2HB       ASP  37   4.872  -5.143  -6.342
  268    HB3  ASP  37          1HB       ASP  37   4.893  -6.777  -7.008
  269    H    SER  38           H        SER  38   3.778  -8.826  -5.500
  270    HA   SER  38           HA       SER  38   1.631  -9.718  -7.360
  271    HB2  SER  38          2HB       SER  38   4.369 -10.533  -6.921
  272    HB3  SER  38          1HB       SER  38   3.277 -11.902  -6.747
  273    H    LEU  39           H        LEU  39   3.202 -11.113  -4.457
  274    HA   LEU  39           HA       LEU  39   0.878 -12.701  -3.859
  275    HB2  LEU  39          2HB       LEU  39   3.400 -12.058  -2.364
  276    HB3  LEU  39          1HB       LEU  39   2.114 -12.993  -1.606
  277    HG   LEU  39           HG       LEU  39   3.935 -14.349  -2.772
  278   HD11  LEU  39          1HD1      LEU  39   1.091 -14.670  -2.735
  279   HD12  LEU  39          2HD1      LEU  39   2.331 -15.922  -2.737
  280   HD13  LEU  39          3HD1      LEU  39   1.696 -15.309  -4.263
  281   HD21  LEU  39          1HD2      LEU  39   3.945 -14.449  -5.165
  282   HD22  LEU  39          2HD2      LEU  39   4.008 -12.737  -4.747
  283   HD23  LEU  39          3HD2      LEU  39   2.489 -13.460  -5.279
  284    H    GLY  40           H        GLY  40   2.263  -9.851  -2.210
  285    HA2  GLY  40          2HA       GLY  40   0.117  -9.619  -0.327
  286    HA3  GLY  40          1HA       GLY  40   1.237  -8.329  -0.745
  287    H    LEU  41           H        LEU  41   0.626  -8.242  -3.546
  288    HA   LEU  41           HA       LEU  41  -1.543  -6.415  -3.549
  289    HB2  LEU  41          2HB       LEU  41   0.250  -6.620  -5.313
  290    HB3  LEU  41          1HB       LEU  41  -0.580  -8.054  -5.911
  291    HG   LEU  41           HG       LEU  41  -2.250  -5.612  -5.548
  292   HD11  LEU  41          1HD1      LEU  41  -0.321  -5.913  -7.869
  293   HD12  LEU  41          2HD1      LEU  41  -0.123  -4.756  -6.554
  294   HD13  LEU  41          3HD1      LEU  41  -1.501  -4.623  -7.645
  295   HD21  LEU  41          1HD2      LEU  41  -3.243  -7.658  -6.438
  296   HD22  LEU  41          2HD2      LEU  41  -1.990  -7.769  -7.673
  297   HD23  LEU  41          3HD2      LEU  41  -3.169  -6.461  -7.725
  298    H    LEU  42           H        LEU  42  -1.423  -9.878  -4.325
  299    HA   LEU  42           HA       LEU  42  -4.145 -10.110  -5.172
  300    HB2  LEU  42          2HB       LEU  42  -2.403 -11.894  -5.467
  301    HB3  LEU  42          1HB       LEU  42  -2.476 -12.193  -3.738
  302    HG   LEU  42           HG       LEU  42  -4.954 -12.609  -3.993
  303   HD11  LEU  42          1HD1      LEU  42  -5.864 -12.012  -5.962
  304   HD12  LEU  42          2HD1      LEU  42  -5.034 -13.390  -6.682
  305   HD13  LEU  42          3HD1      LEU  42  -4.277 -11.800  -6.697
  306   HD21  LEU  42          1HD2      LEU  42  -3.351 -14.461  -3.803
  307   HD22  LEU  42          2HD2      LEU  42  -3.045 -14.392  -5.538
  308   HD23  LEU  42          3HD2      LEU  42  -4.630 -14.881  -4.941
  309    H    LYS  43           H        LYS  43  -2.614 -10.442  -1.973
  310    HA   LYS  43           HA       LYS  43  -5.057 -11.034  -0.575
  311    HB2  LYS  43          2HB       LYS  43  -2.448  -9.853   0.391
  312    HB3  LYS  43          1HB       LYS  43  -3.741 -10.414   1.445
  313    HG2  LYS  43          2HG       LYS  43  -3.568 -12.671   0.389
  314    HG3  LYS  43          1HG       LYS  43  -2.188 -12.091  -0.545
  315    HD2  LYS  43          2HD       LYS  43  -1.032 -11.527   1.601
  316    HD3  LYS  43          1HD       LYS  43  -2.378 -12.254   2.477
  317    HE2  LYS  43          2HE       LYS  43  -1.479 -14.069   0.429
  318    HE3  LYS  43          1HE       LYS  43  -0.106 -13.571   1.417
  319    HZ1  LYS  43          1HZ       LYS  43  -2.492 -14.155   2.923
  320    HZ2  LYS  43          2HZ       LYS  43  -0.888 -14.655   3.187
  321    HZ3  LYS  43          3HZ       LYS  43  -1.873 -15.493   2.083
  322    H    VAL  44           H        VAL  44  -3.309  -8.028  -1.280
  323    HA   VAL  44           HA       VAL  44  -4.940  -6.302   0.315
  324    HB   VAL  44           HB       VAL  44  -3.338  -5.758  -2.195
  325   HG11  VAL  44          1HG1      VAL  44  -4.718  -3.899  -0.243
  326   HG12  VAL  44          2HG1      VAL  44  -4.973  -4.005  -1.984
  327   HG13  VAL  44          3HG1      VAL  44  -3.453  -3.369  -1.353
  328   HG21  VAL  44          1HG2      VAL  44  -2.494  -6.461   0.335
  329   HG22  VAL  44          2HG2      VAL  44  -2.474  -4.699   0.410
  330   HG23  VAL  44          3HG2      VAL  44  -1.538  -5.540  -0.826
  331    H    ILE  45           H        ILE  45  -5.154  -7.205  -3.128
  332    HA   ILE  45           HA       ILE  45  -7.403  -5.576  -3.750
  333    HB   ILE  45           HB       ILE  45  -6.057  -7.943  -4.936
  334   HG12  ILE  45          2HG1      ILE  45  -5.998  -6.526  -6.880
  335   HG13  ILE  45          1HG1      ILE  45  -7.226  -5.455  -6.208
  336   HG21  ILE  45          1HG2      ILE  45  -8.945  -7.230  -5.469
  337   HG22  ILE  45          2HG2      ILE  45  -8.265  -8.815  -5.096
  338   HG23  ILE  45          3HG2      ILE  45  -7.946  -8.063  -6.658
  339   HD11  ILE  45          1HD1      ILE  45  -4.766  -5.862  -4.581
  340   HD12  ILE  45          2HD1      ILE  45  -5.743  -4.411  -4.797
  341   HD13  ILE  45          3HD1      ILE  45  -4.602  -4.900  -6.048
  342    H    ALA  46           H        ALA  46  -7.233  -8.987  -2.708
  343    HA   ALA  46           HA       ALA  46 -10.065  -9.411  -2.663
  344    HB1  ALA  46          1HB       ALA  46  -7.694 -10.740  -1.378
  345    HB2  ALA  46          2HB       ALA  46  -8.809 -11.384  -2.584
  346    HB3  ALA  46          3HB       ALA  46  -9.325 -11.217  -0.906
  347    H    TRP  47           H        TRP  47  -7.774  -8.373  -0.143
  348    HA   TRP  47           HA       TRP  47  -9.783  -8.221   1.931
  349    HB2  TRP  47          2HB       TRP  47  -7.662  -8.369   2.843
  350    HB3  TRP  47          1HB       TRP  47  -6.944  -7.339   1.606
  351    HD1  TRP  47           HD       TRP  47  -8.937  -7.172   4.864
  352    HE1  TRP  47          1HE       TRP  47  -8.762  -4.778   5.810
  353    HE3  TRP  47          3HE       TRP  47  -6.559  -4.867   0.984
  354    HZ2  TRP  47          2HZ       TRP  47  -7.739  -2.221   5.017
  355    HZ3  TRP  47          3HZ       TRP  47  -5.992  -2.461   1.102
  356    HH2  TRP  47           HH       TRP  47  -6.579  -1.139   3.109
  357    H    LEU  48           H        LEU  48  -8.367  -5.873  -0.324
  358    HA   LEU  48           HA       LEU  48  -9.557  -3.540   0.757
  359    HB2  LEU  48          2HB       LEU  48  -7.808  -3.620  -1.058
  360    HB3  LEU  48          1HB       LEU  48  -9.065  -4.125  -2.174
  361    HG   LEU  48           HG       LEU  48 -10.326  -2.010  -1.331
  362   HD11  LEU  48          1HD1      LEU  48  -8.121  -1.847   0.300
  363   HD12  LEU  48          2HD1      LEU  48  -9.184  -0.495  -0.089
  364   HD13  LEU  48          3HD1      LEU  48  -7.697  -0.741  -1.004
  365   HD21  LEU  48          1HD2      LEU  48  -9.792  -1.766  -3.540
  366   HD22  LEU  48          2HD2      LEU  48  -8.146  -2.355  -3.303
  367   HD23  LEU  48          3HD2      LEU  48  -8.549  -0.680  -2.916
  368    H    GLU  49           H        GLU  49 -10.771  -5.778  -1.749
  369    HA   GLU  49           HA       GLU  49 -13.272  -4.407  -2.112
  370    HB2  GLU  49          2HB       GLU  49 -12.511  -5.962  -3.802
  371    HB3  GLU  49          1HB       GLU  49 -12.444  -7.276  -2.642
  372    HG2  GLU  49          2HG       GLU  49 -14.888  -7.136  -2.348
  373    HG3  GLU  49          1HG       GLU  49 -14.952  -5.828  -3.518
  374    H    ASP  50           H        ASP  50 -12.217  -7.022   0.019
  375    HA   ASP  50           HA       ASP  50 -14.797  -7.622   1.109
  376    HB2  ASP  50          2HB       ASP  50 -12.736  -9.051   1.300
  377    HB3  ASP  50          1HB       ASP  50 -12.123  -7.896   2.482
  378    H    ARG  51           H        ARG  51 -12.313  -5.269   2.014
  379    HA   ARG  51           HA       ARG  51 -13.759  -4.509   4.445
  380    HB2  ARG  51          2HB       ARG  51 -11.279  -4.476   4.320
  381    HB3  ARG  51          1HB       ARG  51 -11.381  -3.176   3.132
  382    HG2  ARG  51          2HG       ARG  51 -12.601  -1.780   4.776
  383    HG3  ARG  51          1HG       ARG  51 -12.451  -3.072   5.967
  384    HD2  ARG  51          2HD       ARG  51  -9.968  -2.934   5.748
  385    HD3  ARG  51          1HD       ARG  51 -10.170  -1.564   4.657
  386    HE   ARG  51           HE       ARG  51 -10.551  -0.222   6.550
  387   HH11  ARG  51          1HH1      ARG  51 -10.963   0.123   8.746
  388   HH12  ARG  51          2HH1      ARG  51 -11.369  -1.222   9.759
  389   HH21  ARG  51          1HH2      ARG  51 -11.166  -3.552   7.198
  390   HH22  ARG  51          2HH2      ARG  51 -11.483  -3.303   8.882
  391    H    PHE  52           H        PHE  52 -12.938  -2.749   1.400
  392    HA   PHE  52           HA       PHE  52 -14.887  -0.676   2.197
  393    HB2  PHE  52          2HB       PHE  52 -12.942  -0.841  -0.116
  394    HB3  PHE  52          1HB       PHE  52 -13.982   0.538   0.226
  395    HD1  PHE  52          1HD       PHE  52 -13.694   1.837   2.341
  396    HD2  PHE  52          2HD       PHE  52 -10.966  -1.270   1.179
  397    HE1  PHE  52          1HE       PHE  52 -12.030   2.688   3.971
  398    HE2  PHE  52          2HE       PHE  52  -9.301  -0.419   2.808
  399    HZ   PHE  52           HZ       PHE  52  -9.834   1.560   4.204
  400    H    GLY  53           H        GLY  53 -15.001  -3.539   0.424
  401    HA2  GLY  53          2HA       GLY  53 -16.739  -4.383  -0.938
  402    HA3  GLY  53          1HA       GLY  53 -17.637  -2.904  -0.593
  403    H    ILE  54           H        ILE  54 -14.406  -2.671  -1.857
  404    HA   ILE  54           HA       ILE  54 -15.509  -1.430  -4.314
  405    HB   ILE  54           HB       ILE  54 -12.656  -1.586  -3.293
  406   HG12  ILE  54          2HG1      ILE  54 -14.581   0.754  -3.244
  407   HG13  ILE  54          1HG1      ILE  54 -14.322  -0.312  -1.864
  408   HG21  ILE  54          1HG2      ILE  54 -13.979  -0.324  -5.669
  409   HG22  ILE  54          2HG2      ILE  54 -12.413  -1.128  -5.559
  410   HG23  ILE  54          3HG2      ILE  54 -12.613   0.503  -4.918
  411   HD11  ILE  54          1HD1      ILE  54 -12.898   1.712  -1.729
  412   HD12  ILE  54          2HD1      ILE  54 -12.157   1.278  -3.270
  413   HD13  ILE  54          3HD1      ILE  54 -11.930   0.243  -1.859
  414    H    ALA  55           H        ALA  55 -15.014  -2.206  -6.397
  415    HA   ALA  55           HA       ALA  55 -14.723  -5.020  -6.702
  416    HB1  ALA  55          1HB       ALA  55 -15.724  -3.508  -8.416
  417    HB2  ALA  55          2HB       ALA  55 -14.479  -4.560  -9.090
  418    HB3  ALA  55          3HB       ALA  55 -14.116  -2.868  -8.752
  419    H    ALA  56           H        ALA  56 -12.925  -6.260  -7.426
  420    HA   ALA  56           HA       ALA  56 -10.437  -5.679  -6.233
  421    HB1  ALA  56          1HB       ALA  56  -9.611  -7.393  -8.070
  422    HB2  ALA  56          2HB       ALA  56 -11.337  -7.577  -8.376
  423    HB3  ALA  56          3HB       ALA  56 -10.683  -7.930  -6.776
  424    H    ASP  57           H        ASP  57 -11.698  -4.818  -9.400
  425    HA   ASP  57           HA       ASP  57 -10.803  -3.474 -11.102
  426    HB2  ASP  57          2HB       ASP  57  -9.247  -2.403  -8.740
  427    HB3  ASP  57          1HB       ASP  57  -9.306  -1.635 -10.323
  428    H    ASP  58           H        ASP  58  -9.695  -6.006 -11.027
  429    HA   ASP  58           HA       ASP  58  -6.757  -5.660 -11.204
  430    HB2  ASP  58          2HB       ASP  58  -8.526  -8.103 -11.379
  431    HB3  ASP  58          1HB       ASP  58  -6.773  -8.144 -11.544
  432    H    VAL  59           H        VAL  59  -8.987  -4.743 -13.209
  433    HA   VAL  59           HA       VAL  59  -8.739  -6.218 -15.606
  434    HB   VAL  59           HB       VAL  59  -9.041  -3.228 -15.283
  435   HG11  VAL  59          1HG1      VAL  59  -8.707  -4.839 -17.609
  436   HG12  VAL  59          2HG1      VAL  59  -9.106  -3.124 -17.529
  437   HG13  VAL  59          3HG1      VAL  59 -10.394  -4.327 -17.558
  438   HG21  VAL  59          1HG2      VAL  59 -10.913  -4.023 -14.189
  439   HG22  VAL  59          2HG2      VAL  59 -10.903  -5.551 -15.070
  440   HG23  VAL  59          3HG2      VAL  59 -11.510  -4.089 -15.847
  441    H    GLU  60           H        GLU  60  -6.708  -3.567 -14.366
  442    HA   GLU  60           HA       GLU  60  -4.554  -4.527 -16.185
  443    HB2  GLU  60          2HB       GLU  60  -5.373  -1.630 -15.834
  444    HB3  GLU  60          1HB       GLU  60  -3.966  -2.184 -16.735
  445    HG2  GLU  60          2HG       GLU  60  -5.459  -3.493 -18.212
  446    HG3  GLU  60          1HG       GLU  60  -6.847  -2.852 -17.343
  447    H    LEU  61           H        LEU  61  -2.619  -4.687 -15.129
  448    HA   LEU  61           HA       LEU  61  -2.280  -3.162 -12.590
  449    HB2  LEU  61          2HB       LEU  61  -1.524  -6.060 -13.053
  450    HB3  LEU  61          1HB       LEU  61  -1.224  -5.142 -11.578
  451    HG   LEU  61           HG       LEU  61  -3.871  -4.701 -11.845
  452   HD11  LEU  61          1HD1      LEU  61  -3.344  -7.438 -13.040
  453   HD12  LEU  61          2HD1      LEU  61  -4.107  -6.070 -13.851
  454   HD13  LEU  61          3HD1      LEU  61  -4.924  -6.865 -12.506
  455   HD21  LEU  61          1HD2      LEU  61  -2.352  -6.953 -10.535
  456   HD22  LEU  61          2HD2      LEU  61  -4.099  -6.809 -10.339
  457   HD23  LEU  61          3HD2      LEU  61  -3.041  -5.509  -9.793
  458    H    SER  62           H        SER  62  -0.213  -2.317 -12.290
  459    HA   SER  62           HA       SER  62   1.974  -3.253 -14.024
  460    HB2  SER  62          2HB       SER  62   0.437  -0.926 -14.659
  461    HB3  SER  62          1HB       SER  62   2.042  -0.402 -14.161
  462    HG   SER  62           HG       SER  62   1.647  -1.058 -16.466
  463    HA   PRO  63           HA       PRO  63   4.262  -2.391 -10.321
  464    HB2  PRO  63          2HB       PRO  63   6.731  -1.799 -11.436
  465    HB3  PRO  63          1HB       PRO  63   6.118  -3.437 -11.153
  466    HG2  PRO  63          2HG       PRO  63   6.201  -1.851 -13.660
  467    HG3  PRO  63          1HG       PRO  63   6.420  -3.592 -13.411
  468    HD2  PRO  63          2HD       PRO  63   4.113  -2.538 -14.399
  469    HD3  PRO  63          1HD       PRO  63   4.145  -4.020 -13.418
  470    H    GLU  64           H        GLU  64   4.126  -0.046 -12.899
  471    HA   GLU  64           HA       GLU  64   5.498   2.116 -11.649
  472    HB2  GLU  64          2HB       GLU  64   3.186   2.144 -13.591
  473    HB3  GLU  64          1HB       GLU  64   4.147   3.554 -13.169
  474    HG2  GLU  64          2HG       GLU  64   6.175   2.374 -13.962
  475    HG3  GLU  64          1HG       GLU  64   5.166   1.018 -14.455
  476    H    HIS  65           H        HIS  65   2.226   0.882 -11.257
  477    HA   HIS  65           HA       HIS  65   1.190   3.163  -9.836
  478    HB2  HIS  65          2HB       HIS  65  -0.243   1.392 -10.842
  479    HB3  HIS  65          1HB       HIS  65   0.346   0.256  -9.628
  480    HD1  HIS  65          1HD       HIS  65  -0.581   0.461  -7.246
  481    HD2  HIS  65          2HD       HIS  65  -1.944   3.474  -9.790
  482    HE1  HIS  65          1HE       HIS  65  -2.435   1.665  -6.006
  483    HE2  HIS  65          2HE       HIS  65  -3.271   3.499  -7.544
  484    H    PHE  66           H        PHE  66   3.158   0.433  -8.899
  485    HA   PHE  66           HA       PHE  66   2.881   1.202  -6.032
  486    HB2  PHE  66          2HB       PHE  66   4.066  -1.279  -7.315
  487    HB3  PHE  66          1HB       PHE  66   3.968  -0.985  -5.578
  488    HD1  PHE  66          1HD       PHE  66   1.800  -0.937  -4.420
  489    HD2  PHE  66          2HD       PHE  66   2.076  -1.786  -8.622
  490    HE1  PHE  66          1HE       PHE  66  -0.534  -1.777  -4.403
  491    HE2  PHE  66          2HE       PHE  66  -0.257  -2.627  -8.605
  492    HZ   PHE  66           HZ       PHE  66  -1.562  -2.621  -6.496
  493    H    ARG  67           H        ARG  67   4.667   2.252  -8.454
  494    HA   ARG  67           HA       ARG  67   7.376   1.817  -7.836
  495    HB2  ARG  67          2HB       ARG  67   6.568   3.066  -9.829
  496    HB3  ARG  67          1HB       ARG  67   6.112   4.408  -8.786
  497    HG2  ARG  67          2HG       ARG  67   8.233   5.029  -9.615
  498    HG3  ARG  67          1HG       ARG  67   8.584   4.381  -8.019
  499    HD2  ARG  67          2HD       ARG  67   9.239   2.236  -8.983
  500    HD3  ARG  67          1HD       ARG  67   8.772   2.788 -10.590
  501    HE   ARG  67           HE       ARG  67  10.792   4.020 -10.696
  502   HH11  ARG  67          1HH1      ARG  67  12.801   4.634  -9.858
  503   HH12  ARG  67          2HH1      ARG  67  13.148   4.359  -8.184
  504   HH21  ARG  67          1HH2      ARG  67  10.063   2.926  -7.510
  505   HH22  ARG  67          2HH2      ARG  67  11.597   3.391  -6.854
  506    H    SER  68           H        SER  68   5.075   4.084  -6.363
  507    HA   SER  68           HA       SER  68   6.888   4.296  -4.036
  508    HB2  SER  68          2HB       SER  68   6.914   6.713  -4.034
  509    HB3  SER  68          1HB       SER  68   7.472   6.173  -5.614
  510    HG   SER  68           HG       SER  68   5.953   7.647  -6.086
  511    H    ILE  69           H        ILE  69   5.774   5.127  -2.126
  512    HA   ILE  69           HA       ILE  69   3.083   4.225  -1.876
  513    HB   ILE  69           HB       ILE  69   4.633   6.167  -0.137
  514   HG12  ILE  69          2HG1      ILE  69   4.246   3.184   0.144
  515   HG13  ILE  69          1HG1      ILE  69   5.697   3.932  -0.504
  516   HG21  ILE  69          1HG2      ILE  69   3.068   5.346   1.616
  517   HG22  ILE  69          2HG2      ILE  69   2.175   4.489   0.363
  518   HG23  ILE  69          3HG2      ILE  69   2.259   6.251   0.338
  519   HD11  ILE  69          1HD1      ILE  69   6.082   5.115   1.588
  520   HD12  ILE  69          2HD1      ILE  69   5.903   3.394   1.925
  521   HD13  ILE  69          3HD1      ILE  69   4.566   4.499   2.244
  522    H    ARG  70           H        ARG  70   4.465   7.431  -2.490
  523    HA   ARG  70           HA       ARG  70   2.097   8.958  -2.113
  524    HB2  ARG  70          2HB       ARG  70   4.382   9.918  -2.414
  525    HB3  ARG  70          1HB       ARG  70   4.312   9.471  -4.119
  526    HG2  ARG  70          2HG       ARG  70   2.331  10.888  -4.431
  527    HG3  ARG  70          1HG       ARG  70   2.352  11.313  -2.719
  528    HD2  ARG  70          2HD       ARG  70   3.426  13.109  -3.925
  529    HD3  ARG  70          1HD       ARG  70   4.682  12.223  -3.059
  530    HE   ARG  70           HE       ARG  70   4.567  11.021  -5.573
  531   HH11  ARG  70          1HH1      ARG  70   5.902  11.695  -7.268
  532   HH12  ARG  70          2HH1      ARG  70   6.547  13.303  -7.259
  533   HH21  ARG  70          1HH2      ARG  70   5.026  14.178  -4.268
  534   HH22  ARG  70          2HH2      ARG  70   6.050  14.709  -5.559
  535    H    SER  71           H        SER  71   3.312   7.246  -4.995
  536    HA   SER  71           HA       SER  71   1.322   8.184  -6.807
  537    HB2  SER  71          2HB       SER  71   3.385   6.877  -7.432
  538    HB3  SER  71          1HB       SER  71   2.599   5.434  -6.797
  539    HG   SER  71           HG       SER  71   1.770   7.097  -8.942
  540    H    ILE  72           H        ILE  72   1.356   5.352  -4.642
  541    HA   ILE  72           HA       ILE  72  -1.218   4.367  -5.422
  542    HB   ILE  72           HB       ILE  72   0.266   4.049  -2.796
  543   HG12  ILE  72          2HG1      ILE  72   0.209   2.265  -5.252
  544   HG13  ILE  72          1HG1      ILE  72   1.545   3.334  -4.824
  545   HG21  ILE  72          1HG2      ILE  72  -1.567   2.930  -2.145
  546   HG22  ILE  72          2HG2      ILE  72  -1.274   1.780  -3.449
  547   HG23  ILE  72          3HG2      ILE  72  -2.319   3.173  -3.721
  548   HD11  ILE  72          1HD1      ILE  72   1.362   2.064  -2.496
  549   HD12  ILE  72          2HD1      ILE  72   2.277   1.372  -3.834
  550   HD13  ILE  72          3HD1      ILE  72   0.640   0.808  -3.500
  551    H    ASP  73           H        ASP  73  -0.148   6.636  -2.911
  552    HA   ASP  73           HA       ASP  73  -2.580   6.895  -1.499
  553    HB2  ASP  73          2HB       ASP  73  -0.424   8.944  -2.077
  554    HB3  ASP  73          1HB       ASP  73  -1.715   9.169  -0.899
  555    H    ALA  74           H        ALA  74  -1.467   8.579  -4.441
  556    HA   ALA  74           HA       ALA  74  -3.730  10.341  -4.599
  557    HB1  ALA  74          1HB       ALA  74  -2.195   9.312  -6.988
  558    HB2  ALA  74          2HB       ALA  74  -1.496  10.491  -5.877
  559    HB3  ALA  74          3HB       ALA  74  -2.960  10.887  -6.778
  560    H    PHE  75           H        PHE  75  -3.058   7.187  -6.116
  561    HA   PHE  75           HA       PHE  75  -5.539   7.024  -7.534
  562    HB2  PHE  75          2HB       PHE  75  -3.547   5.567  -7.962
  563    HB3  PHE  75          1HB       PHE  75  -3.888   4.736  -6.447
  564    HD1  PHE  75          1HD       PHE  75  -5.165   5.450  -9.848
  565    HD2  PHE  75          2HD       PHE  75  -5.718   3.183  -6.242
  566    HE1  PHE  75          1HE       PHE  75  -6.828   4.017 -11.004
  567    HE2  PHE  75          2HE       PHE  75  -7.381   1.750  -7.398
  568    HZ   PHE  75           HZ       PHE  75  -7.936   2.167  -9.778
  569    H    VAL  76           H        VAL  76  -4.546   5.777  -4.345
  570    HA   VAL  76           HA       VAL  76  -7.061   4.585  -3.704
  571    HB   VAL  76           HB       VAL  76  -4.812   5.645  -1.974
  572   HG11  VAL  76          1HG1      VAL  76  -6.668   5.666  -0.529
  573   HG12  VAL  76          2HG1      VAL  76  -5.962   4.071  -0.268
  574   HG13  VAL  76          3HG1      VAL  76  -7.390   4.249  -1.288
  575   HG21  VAL  76          1HG2      VAL  76  -4.787   3.515  -3.634
  576   HG22  VAL  76          2HG2      VAL  76  -5.513   2.760  -2.215
  577   HG23  VAL  76          3HG2      VAL  76  -3.929   3.525  -2.093
  578    H    VAL  77           H        VAL  77  -5.728   7.836  -3.072
  579    HA   VAL  77           HA       VAL  77  -7.886   8.773  -1.468
  580    HB   VAL  77           HB       VAL  77  -5.960  10.212  -3.307
  581   HG11  VAL  77          1HG1      VAL  77  -7.588  11.827  -3.151
  582   HG12  VAL  77          2HG1      VAL  77  -6.754  12.133  -1.628
  583   HG13  VAL  77          3HG1      VAL  77  -8.235  11.177  -1.645
  584   HG21  VAL  77          1HG2      VAL  77  -4.570  10.345  -1.495
  585   HG22  VAL  77          2HG2      VAL  77  -5.472   8.930  -0.951
  586   HG23  VAL  77          3HG2      VAL  77  -5.907  10.534  -0.361
  587    H    GLY  78           H        GLY  78  -7.370   8.810  -4.984
  588    HA2  GLY  78          2HA       GLY  78  -9.615  10.376  -5.704
  589    HA3  GLY  78          1HA       GLY  78  -8.889   9.144  -6.734
  590    H    ALA  79           H        ALA  79  -9.409   6.929  -4.888
  591    HA   ALA  79           HA       ALA  79 -12.316   6.667  -5.443
  592    HB1  ALA  79          1HB       ALA  79 -10.032   4.770  -5.255
  593    HB2  ALA  79          2HB       ALA  79 -11.385   4.794  -6.388
  594    HB3  ALA  79          3HB       ALA  79 -11.614   4.175  -4.752
  595    H    THR  80           H        THR  80  -9.971   5.980  -2.843
  596    HA   THR  80           HA       THR  80 -12.224   6.285  -0.903
  597    HB   THR  80           HB       THR  80  -9.937   4.324  -0.664
  598    HG1  THR  80          1HG       THR  80 -11.185   2.947  -1.621
  599   HG21  THR  80          1HG2      THR  80 -10.579   4.748   1.524
  600   HG22  THR  80          2HG2      THR  80 -11.695   3.449   1.104
  601   HG23  THR  80          3HG2      THR  80 -12.242   5.125   1.069
  602    H    THR  81           H        THR  81 -11.768   7.562   0.864
  603    HA   THR  81           HA       THR  81  -8.943   8.468   1.203
  604    HB   THR  81           HB       THR  81 -10.316  10.215   0.093
  605    HG1  THR  81          1HG       THR  81 -10.118  11.406   2.500
  606   HG21  THR  81          1HG2      THR  81 -12.347   9.278   1.680
  607   HG22  THR  81          2HG2      THR  81 -12.376  10.821   0.824
  608   HG23  THR  81          3HG2      THR  81 -11.893  10.761   2.520
  609    HA   PRO  82           HA       PRO  82 -10.482   6.691   5.178
  610    HB2  PRO  82          2HB       PRO  82  -7.613   6.323   5.704
  611    HB3  PRO  82          1HB       PRO  82  -8.913   5.121   5.690
  612    HG2  PRO  82          2HG       PRO  82  -7.002   5.264   3.784
  613    HG3  PRO  82          1HG       PRO  82  -8.637   4.654   3.485
  614    HD2  PRO  82          2HD       PRO  82  -7.442   7.289   2.734
  615    HD3  PRO  82          1HD       PRO  82  -8.671   6.319   1.890
  616    HA   PRO  83           HA       PRO  83  -9.650   9.916   8.094
  617    HB2  PRO  83          2HB       PRO  83  -8.110   8.190   9.941
  618    HB3  PRO  83          1HB       PRO  83  -9.628   9.061  10.215
  619    HG2  PRO  83          2HG       PRO  83  -9.515   6.390   9.944
  620    HG3  PRO  83          1HG       PRO  83 -10.908   7.350   9.425
  621    HD2  PRO  83          2HD       PRO  83  -8.782   6.070   7.767
  622    HD3  PRO  83          1HD       PRO  83 -10.490   6.373   7.385
  623    H    VAL  84           H        VAL  84  -8.032  11.454   8.698
  624    HA   VAL  84           HA       VAL  84  -5.334  10.865   7.570
  625    HB   VAL  84           HB       VAL  84  -6.534  13.540   8.347
  626   HG11  VAL  84          1HG1      VAL  84  -3.980  12.632   7.065
  627   HG12  VAL  84          2HG1      VAL  84  -4.242  13.907   8.255
  628   HG13  VAL  84          3HG1      VAL  84  -4.679  14.172   6.568
  629   HG21  VAL  84          1HG2      VAL  84  -7.705  13.478   6.426
  630   HG22  VAL  84          2HG2      VAL  84  -7.137  11.834   6.135
  631   HG23  VAL  84          3HG2      VAL  84  -6.214  13.207   5.523
  632    H    GLU  85           H        GLU  85  -3.628  10.657   8.943
  633    HA   GLU  85           HA       GLU  85  -3.856  11.801  11.680
  634    HB2  GLU  85          2HB       GLU  85  -2.922   8.992  11.018
  635    HB3  GLU  85          1HB       GLU  85  -2.887   9.730  12.620
  636    HG2  GLU  85          2HG       GLU  85  -5.357  10.029  12.503
  637    HG3  GLU  85          1HG       GLU  85  -5.360   9.198  10.947
  638    H    ALA  86           H        ALA  86  -1.722  12.110  12.704
  639    HA   ALA  86           HA       ALA  86   0.217  13.204  10.922
  640    HB1  ALA  86          1HB       ALA  86  -0.016  13.781  13.361
  641    HB2  ALA  86          2HB       ALA  86   1.642  13.429  12.874
  642    HB3  ALA  86          3HB       ALA  86   0.706  12.219  13.749
  643    H    LYS  87           H        LYS  87   2.180  12.354  10.144
  644    HA   LYS  87           HA       LYS  87   2.634   9.437  10.625
  645    HB2  LYS  87          2HB       LYS  87   1.565   9.888   8.388
  646    HB3  LYS  87          1HB       LYS  87   2.982  10.849   7.966
  647    HG2  LYS  87          2HG       LYS  87   4.424   8.865   8.376
  648    HG3  LYS  87          1HG       LYS  87   2.977   7.912   8.715
  649    HD2  LYS  87          2HD       LYS  87   2.128   8.460   6.432
  650    HD3  LYS  87          1HD       LYS  87   3.643   9.297   6.100
  651    HE2  LYS  87          2HE       LYS  87   3.100   6.526   5.810
  652    HE3  LYS  87          1HE       LYS  87   4.640   7.350   5.574
  653    HZ1  LYS  87          1HZ       LYS  87   5.057   7.135   7.957
  654    HZ2  LYS  87          2HZ       LYS  87   4.859   5.619   7.218
  655    HZ3  LYS  87          3HZ       LYS  87   3.601   6.287   8.145
  656    H    LEU  88           H        LEU  88   4.738   8.944  11.109
  657    HA   LEU  88           HA       LEU  88   6.674  11.181  11.166
  658    HB2  LEU  88          2HB       LEU  88   6.974   8.346  12.202
  659    HB3  LEU  88          1HB       LEU  88   8.032   9.711  12.560
  660    HG   LEU  88           HG       LEU  88   5.109   9.451  13.328
  661   HD11  LEU  88          1HD1      LEU  88   5.822   8.882  15.418
  662   HD12  LEU  88          2HD1      LEU  88   7.223   9.950  15.338
  663   HD13  LEU  88          3HD1      LEU  88   7.279   8.363  14.571
  664   HD21  LEU  88          1HD2      LEU  88   5.326  11.744  12.980
  665   HD22  LEU  88          2HD2      LEU  88   7.049  11.742  13.358
  666   HD23  LEU  88          3HD2      LEU  88   5.861  11.614  14.656
  667    H    GLN  89           H        GLN  89   8.591  11.179   9.971
  668    HA   GLN  89           HA       GLN  89   8.716  10.129   7.424
  669    HB2  GLN  89          2HB       GLN  89  11.044  10.508   9.334
  670    HB3  GLN  89          1HB       GLN  89  11.198  10.315   7.587
  671    HG2  GLN  89          2HG       GLN  89   9.851  12.334   7.223
  672    HG3  GLN  89          1HG       GLN  89   9.632  12.518   8.964
  673   HE21  GLN  89          1HE2      GLN  89  10.886  14.584   7.463
  674   HE22  GLN  89          2HE2      GLN  89  12.526  14.657   7.895
  675    H1   PN7 101          3HO       SAT 101   2.716  -9.104 -13.632
  676    H2   PN7 101          1H1       SAT 101   4.083  -8.244 -11.764
  677    H3   PN7 101          2H1       SAT 101   4.017  -7.444 -10.195
  678    H5   PN7 101          1HE1      SAT 101   3.762  -5.554 -11.559
  679    H6   PN7 101          2HE1      SAT 101   2.480  -5.241 -10.388
  680    H7   PN7 101          3HE1      SAT 101   2.155  -5.082 -12.114
  681    H8   PN7 101          2HE2      SAT 101   1.383  -7.608  -9.543
  682    H9   PN7 101          3HE2      SAT 101   0.455  -8.122 -10.951
  683    H10  PN7 101          1HE2      SAT 101   0.485  -6.421 -10.489
  684    H11  PN7 101          3H        SAT 101   0.949  -7.140 -13.101
  685    H12  PN7 101          5H        SAT 101   2.639  -4.875 -13.797
  686    H13  PN7 101          1H6       SAT 101   1.711  -6.407 -16.112
  687    H14  PN7 101          2H6       SAT 101   1.859  -4.652 -16.022
  688    H15  PN7 101          1H7       SAT 101   4.468  -5.283 -15.955
  689    H16  PN7 101          2H7       SAT 101   3.597  -5.066 -17.474
  690    H17  PN7 101          9H        SAT 101   5.802  -7.028 -16.198
  691    H18  PN7 101          1H10      SAT 101   6.389  -9.288 -16.666
  692    H19  PN7 101          2H10      SAT 101   4.751  -9.561 -17.262
  693    H20  PN7 101          1H11      SAT 101   5.393  -8.075 -19.251
  694    H21  PN7 101          2H11      SAT 101   6.149  -9.667 -19.192
  695    H22  PN7 101          2HS1      SAT 101   7.676  -7.132 -19.232
  Start of MODEL   10
    1    H1   MET   1          1HT       MET   1   0.941  13.011   0.577
    2    H2   MET   1          2HT       MET   1  -0.610  13.319   1.197
    3    H3   MET   1          3HT       MET   1  -0.393  12.146  -0.013
    4    HA   MET   1           HA       MET   1   0.303  10.572   1.410
    5    HB2  MET   1          2HB       MET   1   1.520  12.845   3.003
    6    HB3  MET   1          1HB       MET   1   1.643  11.143   3.451
    7    HG2  MET   1          2HG       MET   1   2.655  10.700   1.192
    8    HG3  MET   1          1HG       MET   1   2.691  12.442   0.924
    9    HE1  MET   1          1HE       MET   1   4.986  13.902   3.444
   10    HE2  MET   1          2HE       MET   1   3.460  13.400   4.167
   11    HE3  MET   1          3HE       MET   1   3.481  14.040   2.525
   12    H    GLN   2           H        GLN   2  -2.199  12.119   1.439
   13    HA   GLN   2           HA       GLN   2  -3.119  12.672   4.065
   14    HB2  GLN   2          2HB       GLN   2  -4.308  13.184   1.876
   15    HB3  GLN   2          1HB       GLN   2  -4.808  11.493   1.846
   16    HG2  GLN   2          2HG       GLN   2  -6.609  12.644   2.888
   17    HG3  GLN   2          1HG       GLN   2  -5.722  11.891   4.213
   18   HE21  GLN   2          1HE2      GLN   2  -5.065  13.280   5.872
   19   HE22  GLN   2          2HE2      GLN   2  -4.995  14.971   5.747
   20    H    HIS   3           H        HIS   3  -3.075   9.623   2.230
   21    HA   HIS   3           HA       HIS   3  -3.667   8.199   4.797
   22    HB2  HIS   3          2HB       HIS   3  -4.512   7.273   2.039
   23    HB3  HIS   3          1HB       HIS   3  -4.955   6.555   3.587
   24    HD1  HIS   3          1HD       HIS   3  -5.962   8.756   5.258
   25    HD2  HIS   3          2HD       HIS   3  -6.696   8.696   1.153
   26    HE1  HIS   3          1HE       HIS   3  -7.975  10.246   4.865
   27    HE2  HIS   3          2HE       HIS   3  -8.422  10.222   2.369
   28    H    ALA   4           H        ALA   4  -1.223   8.889   2.892
   29    HA   ALA   4           HA       ALA   4  -0.166   6.435   1.933
   30    HB1  ALA   4          1HB       ALA   4   1.117   9.002   2.857
   31    HB2  ALA   4          2HB       ALA   4   0.946   8.389   1.213
   32    HB3  ALA   4          3HB       ALA   4   2.092   7.635   2.319
   33    H    SER   5           H        SER   5  -0.157   7.835   5.178
   34    HA   SER   5           HA       SER   5   1.842   6.189   6.336
   35    HB2  SER   5          2HB       SER   5   0.819   6.708   8.471
   36    HB3  SER   5          1HB       SER   5   0.719   8.143   7.454
   37    HG   SER   5           HG       SER   5  -1.351   8.018   7.732
   38    H    VAL   6           H        VAL   6  -1.585   5.556   5.708
   39    HA   VAL   6           HA       VAL   6  -1.653   3.031   7.105
   40    HB   VAL   6           HB       VAL   6  -3.360   4.125   4.860
   41   HG11  VAL   6          1HG1      VAL   6  -4.962   2.315   5.596
   42   HG12  VAL   6          2HG1      VAL   6  -3.648   1.627   6.550
   43   HG13  VAL   6          3HG1      VAL   6  -3.510   1.714   4.794
   44   HG21  VAL   6          1HG2      VAL   6  -3.588   4.028   7.870
   45   HG22  VAL   6          2HG2      VAL   6  -5.009   4.239   6.846
   46   HG23  VAL   6          3HG2      VAL   6  -3.710   5.432   6.810
   47    H    ILE   7           H        ILE   7  -0.885   4.000   3.799
   48    HA   ILE   7           HA       ILE   7  -0.770   1.408   2.635
   49    HB   ILE   7           HB       ILE   7   0.909   3.849   1.993
   50   HG12  ILE   7          2HG1      ILE   7  -1.708   2.907   0.779
   51   HG13  ILE   7          1HG1      ILE   7  -1.586   4.191   1.980
   52   HG21  ILE   7          1HG2      ILE   7   1.896   2.022   0.858
   53   HG22  ILE   7          2HG2      ILE   7   0.798   2.715  -0.334
   54   HG23  ILE   7          3HG2      ILE   7   0.335   1.261   0.548
   55   HD11  ILE   7          1HD1      ILE   7   0.266   5.029   0.165
   56   HD12  ILE   7          2HD1      ILE   7  -1.420   5.539   0.149
   57   HD13  ILE   7          3HD1      ILE   7  -0.888   4.224  -0.896
   58    H    ALA   8           H        ALA   8   1.846   3.368   4.088
   59    HA   ALA   8           HA       ALA   8   3.856   1.338   3.834
   60    HB1  ALA   8          1HB       ALA   8   5.098   3.084   4.528
   61    HB2  ALA   8          2HB       ALA   8   4.418   2.887   6.145
   62    HB3  ALA   8          3HB       ALA   8   3.641   3.968   4.987
   63    H    GLN   9           H        GLN   9   1.737   2.257   6.532
   64    HA   GLN   9           HA       GLN   9   2.650   0.265   8.365
   65    HB2  GLN   9          2HB       GLN   9   1.241   2.221   8.997
   66    HB3  GLN   9          1HB       GLN   9  -0.113   1.500   8.127
   67    HG2  GLN   9          2HG       GLN   9   0.759  -0.557   9.779
   68    HG3  GLN   9          1HG       GLN   9   0.920   0.878  10.788
   69   HE21  GLN   9          1HE2      GLN   9  -1.458  -0.628   8.531
   70   HE22  GLN   9          2HE2      GLN   9  -2.825  -0.135   9.411
   71    H    PHE  10           H        PHE  10   0.009   0.281   6.007
   72    HA   PHE  10           HA       PHE  10  -0.950  -2.357   6.591
   73    HB2  PHE  10          2HB       PHE  10  -2.205  -0.588   5.320
   74    HB3  PHE  10          1HB       PHE  10  -1.112  -0.855   3.963
   75    HD1  PHE  10          1HD       PHE  10  -3.713  -2.412   6.094
   76    HD2  PHE  10          2HD       PHE  10  -1.309  -2.790   2.556
   77    HE1  PHE  10          1HE       PHE  10  -5.109  -4.322   5.352
   78    HE2  PHE  10          2HE       PHE  10  -2.704  -4.702   1.813
   79    HZ   PHE  10           HZ       PHE  10  -4.605  -5.465   3.210
   80    H    VAL  11           H        VAL  11   1.317  -1.118   4.153
   81    HA   VAL  11           HA       VAL  11   1.827  -3.656   2.913
   82    HB   VAL  11           HB       VAL  11   3.426  -1.092   3.049
   83   HG11  VAL  11          1HG1      VAL  11   4.348  -2.442   0.853
   84   HG12  VAL  11          2HG1      VAL  11   4.123  -3.760   2.002
   85   HG13  VAL  11          3HG1      VAL  11   5.171  -2.404   2.412
   86   HG21  VAL  11          1HG2      VAL  11   1.131  -1.911   1.604
   87   HG22  VAL  11          2HG2      VAL  11   2.468  -1.902   0.454
   88   HG23  VAL  11          3HG2      VAL  11   2.079  -0.443   1.366
   89    H    VAL  12           H        VAL  12   3.694  -1.827   5.353
   90    HA   VAL  12           HA       VAL  12   5.725  -3.810   5.699
   91    HB   VAL  12           HB       VAL  12   4.700  -1.648   7.532
   92   HG11  VAL  12          1HG1      VAL  12   7.258  -2.204   8.346
   93   HG12  VAL  12          2HG1      VAL  12   6.654  -3.816   7.964
   94   HG13  VAL  12          3HG1      VAL  12   5.809  -2.813   9.145
   95   HG21  VAL  12          1HG2      VAL  12   6.089  -0.276   6.393
   96   HG22  VAL  12          2HG2      VAL  12   6.209  -1.556   5.186
   97   HG23  VAL  12          3HG2      VAL  12   7.408  -1.443   6.473
   98    H    GLU  13           H        GLU  13   2.579  -3.361   7.216
   99    HA   GLU  13           HA       GLU  13   2.844  -5.149   9.382
  100    HB2  GLU  13          2HB       GLU  13   0.884  -3.667   9.004
  101    HB3  GLU  13          1HB       GLU  13   0.388  -4.709   7.678
  102    HG2  GLU  13          2HG       GLU  13   0.286  -6.625   9.278
  103    HG3  GLU  13          1HG       GLU  13   0.642  -5.494  10.581
  104    H    GLU  14           H        GLU  14   2.210  -5.790   5.977
  105    HA   GLU  14           HA       GLU  14   1.504  -8.550   6.290
  106    HB2  GLU  14          2HB       GLU  14   2.714  -7.073   3.938
  107    HB3  GLU  14          1HB       GLU  14   2.072  -8.715   3.862
  108    HG2  GLU  14          2HG       GLU  14  -0.131  -7.866   4.637
  109    HG3  GLU  14          1HG       GLU  14   0.517  -6.226   4.625
  110    H    PHE  15           H        PHE  15   4.623  -6.906   6.070
  111    HA   PHE  15           HA       PHE  15   5.959  -9.580   6.083
  112    HB2  PHE  15          2HB       PHE  15   7.223  -6.899   5.489
  113    HB3  PHE  15          1HB       PHE  15   7.905  -8.498   5.188
  114    HD1  PHE  15          1HD       PHE  15   5.477  -5.993   4.098
  115    HD2  PHE  15          2HD       PHE  15   7.034  -9.923   3.374
  116    HE1  PHE  15          1HE       PHE  15   4.342  -6.028   1.899
  117    HE2  PHE  15          2HE       PHE  15   5.907  -9.963   1.164
  118    HZ   PHE  15           HZ       PHE  15   4.560  -8.017   0.425
  119    H    LEU  16           H        LEU  16   6.531  -6.311   7.498
  120    HA   LEU  16           HA       LEU  16   7.587  -7.734   9.919
  121    HB2  LEU  16          2HB       LEU  16   8.763  -5.697   8.205
  122    HB3  LEU  16          1HB       LEU  16   8.743  -5.203   9.895
  123    HG   LEU  16           HG       LEU  16  10.806  -6.468   9.296
  124   HD11  LEU  16          1HD1      LEU  16   9.611  -8.435  11.069
  125   HD12  LEU  16          2HD1      LEU  16   9.126  -6.800  11.515
  126   HD13  LEU  16          3HD1      LEU  16  10.838  -7.217  11.421
  127   HD21  LEU  16          1HD2      LEU  16   9.327  -9.033   9.209
  128   HD22  LEU  16          2HD2      LEU  16  10.755  -8.527   8.307
  129   HD23  LEU  16          3HD2      LEU  16   9.152  -8.015   7.779
  130    HA   PRO  17           HA       PRO  17   4.354  -4.919  11.547
  131    HB2  PRO  17          2HB       PRO  17   3.008  -6.917  12.930
  132    HB3  PRO  17          1HB       PRO  17   2.611  -6.368  11.296
  133    HG2  PRO  17          2HG       PRO  17   3.668  -8.889  12.105
  134    HG3  PRO  17          1HG       PRO  17   3.233  -8.343  10.483
  135    HD2  PRO  17          2HD       PRO  17   5.904  -8.526  11.719
  136    HD3  PRO  17          1HD       PRO  17   5.457  -8.420  10.001
  137    H    ASP  18           H        ASP  18   6.497  -7.249  13.004
  138    HA   ASP  18           HA       ASP  18   5.975  -6.487  15.760
  139    HB2  ASP  18          2HB       ASP  18   8.259  -7.972  14.451
  140    HB3  ASP  18          1HB       ASP  18   8.101  -7.752  16.190
  141    H    VAL  19           H        VAL  19   7.385  -4.909  13.217
  142    HA   VAL  19           HA       VAL  19   9.205  -3.340  14.999
  143    HB   VAL  19           HB       VAL  19   9.231  -3.524  11.968
  144   HG11  VAL  19          1HG1      VAL  19  10.117  -1.414  12.955
  145   HG12  VAL  19          2HG1      VAL  19  11.376  -2.365  12.166
  146   HG13  VAL  19          3HG1      VAL  19  11.240  -2.368  13.924
  147   HG21  VAL  19          1HG2      VAL  19  11.275  -4.700  13.854
  148   HG22  VAL  19          2HG2      VAL  19  11.031  -5.052  12.143
  149   HG23  VAL  19          3HG2      VAL  19   9.868  -5.629  13.338
  150    H    ALA  20           H        ALA  20   8.864  -1.057  15.040
  151    HA   ALA  20           HA       ALA  20   6.213  -0.165  14.561
  152    HB1  ALA  20          1HB       ALA  20   8.478   1.788  14.488
  153    HB2  ALA  20          2HB       ALA  20   8.209   0.867  15.968
  154    HB3  ALA  20          3HB       ALA  20   6.932   1.902  15.327
  155    HA   PRO  21           HA       PRO  21   6.768   0.093  10.066
  156    HB2  PRO  21          2HB       PRO  21   4.175   1.249   9.745
  157    HB3  PRO  21          1HB       PRO  21   4.669  -0.418   9.426
  158    HG2  PRO  21          2HG       PRO  21   3.049   0.570  11.544
  159    HG3  PRO  21          1HG       PRO  21   3.516  -1.098  11.193
  160    HD2  PRO  21          2HD       PRO  21   4.451   0.593  13.323
  161    HD3  PRO  21          1HD       PRO  21   4.897  -1.089  12.976
  162    H    ALA  22           H        ALA  22   5.765   2.675  12.201
  163    HA   ALA  22           HA       ALA  22   6.009   4.820  10.273
  164    HB1  ALA  22          1HB       ALA  22   4.738   5.320  12.218
  165    HB2  ALA  22          2HB       ALA  22   6.239   6.224  12.421
  166    HB3  ALA  22          3HB       ALA  22   5.997   4.710  13.293
  167    H    ASP  23           H        ASP  23   8.269   2.859  11.908
  168    HA   ASP  23           HA       ASP  23  10.433   4.860  11.823
  169    HB2  ASP  23          2HB       ASP  23  10.378   1.941  12.642
  170    HB3  ASP  23          1HB       ASP  23  11.824   2.950  12.689
  171    H    VAL  24           H        VAL  24   8.924   3.253   9.500
  172    HA   VAL  24           HA       VAL  24  11.324   2.226   8.100
  173    HB   VAL  24           HB       VAL  24   8.424   2.289   7.204
  174   HG11  VAL  24          1HG1      VAL  24   9.347   0.385   5.722
  175   HG12  VAL  24          2HG1      VAL  24  10.943   1.016   6.130
  176   HG13  VAL  24          3HG1      VAL  24   9.784   2.036   5.279
  177   HG21  VAL  24          1HG2      VAL  24   9.930  -0.134   8.183
  178   HG22  VAL  24          2HG2      VAL  24   8.186   0.104   8.053
  179   HG23  VAL  24          3HG2      VAL  24   9.095   0.924   9.323
  180    H    ASP  25           H        ASP  25  12.257   3.323   6.387
  181    HA   ASP  25           HA       ASP  25  11.760   6.127   6.118
  182    HB2  ASP  25          2HB       ASP  25  13.238   4.191   4.310
  183    HB3  ASP  25          1HB       ASP  25  13.263   5.944   4.114
  184    H    VAL  26           H        VAL  26   9.455   6.245   5.683
  185    HA   VAL  26           HA       VAL  26   8.153   4.981   3.496
  186    HB   VAL  26           HB       VAL  26   6.846   6.065   5.196
  187   HG11  VAL  26          1HG1      VAL  26   8.684   8.328   4.596
  188   HG12  VAL  26          2HG1      VAL  26   8.023   7.796   6.143
  189   HG13  VAL  26          3HG1      VAL  26   7.029   8.747   5.040
  190   HG21  VAL  26          1HG2      VAL  26   6.514   7.990   2.928
  191   HG22  VAL  26          2HG2      VAL  26   5.283   7.125   3.846
  192   HG23  VAL  26          3HG2      VAL  26   6.239   6.274   2.635
  193    H    ASP  27           H        ASP  27  10.803   6.851   3.237
  194    HA   ASP  27           HA       ASP  27   9.894   8.280   0.786
  195    HB2  ASP  27          2HB       ASP  27  12.440   8.504   2.425
  196    HB3  ASP  27          1HB       ASP  27  12.134   9.404   0.938
  197    H    LEU  28           H        LEU  28  10.904   5.313   1.526
  198    HA   LEU  28           HA       LEU  28  12.882   5.058  -0.679
  199    HB2  LEU  28          2HB       LEU  28  13.375   4.022   1.548
  200    HB3  LEU  28          1HB       LEU  28  11.966   2.988   1.337
  201    HG   LEU  28           HG       LEU  28  13.064   2.300  -0.914
  202   HD11  LEU  28          1HD1      LEU  28  14.807   3.924  -1.106
  203   HD12  LEU  28          2HD1      LEU  28  15.607   2.404  -0.713
  204   HD13  LEU  28          3HD1      LEU  28  15.367   3.622   0.539
  205   HD21  LEU  28          1HD2      LEU  28  13.784   1.502   1.867
  206   HD22  LEU  28          2HD2      LEU  28  14.770   0.844   0.562
  207   HD23  LEU  28          3HD2      LEU  28  13.030   0.553   0.584
  208    H    ASP  29           H        ASP  29  12.322   4.089  -2.589
  209    HA   ASP  29           HA       ASP  29   9.551   3.559  -3.158
  210    HB2  ASP  29          2HB       ASP  29  12.081   2.817  -4.665
  211    HB3  ASP  29          1HB       ASP  29  10.451   2.609  -5.306
  212    H    LEU  30           H        LEU  30   8.442   1.754  -2.565
  213    HA   LEU  30           HA       LEU  30   9.783  -0.472  -1.325
  214    HB2  LEU  30          2HB       LEU  30   7.186  -1.298  -2.116
  215    HB3  LEU  30          1HB       LEU  30   7.709  -0.771  -0.518
  216    HG   LEU  30           HG       LEU  30   7.309   1.596  -1.217
  217   HD11  LEU  30          1HD1      LEU  30   6.715   2.153  -3.340
  218   HD12  LEU  30          2HD1      LEU  30   5.603   0.792  -3.476
  219   HD13  LEU  30          3HD1      LEU  30   7.325   0.556  -3.773
  220   HD21  LEU  30          1HD2      LEU  30   4.701   1.151  -1.524
  221   HD22  LEU  30          2HD2      LEU  30   5.506   0.802   0.008
  222   HD23  LEU  30          3HD2      LEU  30   5.175  -0.501  -1.132
  223    H    VAL  31           H        VAL  31  10.058   0.284  -4.412
  224    HA   VAL  31           HA       VAL  31   9.163  -1.884  -5.957
  225    HB   VAL  31           HB       VAL  31  11.079  -1.406  -7.440
  226   HG11  VAL  31          1HG1      VAL  31  10.717   1.227  -7.375
  227   HG12  VAL  31          2HG1      VAL  31   9.444   0.783  -6.237
  228   HG13  VAL  31          3HG1      VAL  31   9.421   0.141  -7.879
  229   HG21  VAL  31          1HG2      VAL  31  12.922  -1.083  -6.015
  230   HG22  VAL  31          2HG2      VAL  31  12.040   0.040  -4.981
  231   HG23  VAL  31          3HG2      VAL  31  12.576   0.551  -6.582
  232    H    ASP  32           H        ASP  32  12.098  -1.585  -3.992
  233    HA   ASP  32           HA       ASP  32  13.218  -4.137  -4.568
  234    HB2  ASP  32          2HB       ASP  32  13.260  -2.520  -1.996
  235    HB3  ASP  32          1HB       ASP  32  14.260  -3.945  -2.284
  236    H    ASN  33           H        ASN  33  10.660  -3.089  -2.414
  237    HA   ASN  33           HA       ASN  33  10.249  -5.763  -1.283
  238    HB2  ASN  33          2HB       ASN  33   8.552  -3.268  -1.080
  239    HB3  ASN  33          1HB       ASN  33   8.372  -4.723  -0.101
  240   HD21  ASN  33          1HD2      ASN  33   9.453  -1.713   0.265
  241   HD22  ASN  33          2HD2      ASN  33  10.788  -1.960   1.283
  242    H    GLY  34           H        GLY  34   9.915  -4.855  -4.245
  243    HA2  GLY  34          2HA       GLY  34   7.331  -4.914  -5.191
  244    HA3  GLY  34          1HA       GLY  34   8.642  -5.768  -6.008
  245    H    VAL  35           H        VAL  35   8.797  -7.320  -3.267
  246    HA   VAL  35           HA       VAL  35   7.589  -9.713  -4.115
  247    HB   VAL  35           HB       VAL  35   8.069  -8.650  -1.317
  248   HG11  VAL  35          1HG1      VAL  35   7.124 -11.373  -2.250
  249   HG12  VAL  35          2HG1      VAL  35   6.333 -10.296  -1.098
  250   HG13  VAL  35          3HG1      VAL  35   7.844 -11.094  -0.663
  251   HG21  VAL  35          1HG2      VAL  35  10.139  -9.617  -1.474
  252   HG22  VAL  35          2HG2      VAL  35   9.871  -9.400  -3.205
  253   HG23  VAL  35          3HG2      VAL  35   9.547 -10.961  -2.450
  254    H    ILE  36           H        ILE  36   6.203  -6.995  -2.331
  255    HA   ILE  36           HA       ILE  36   3.645  -8.237  -1.818
  256    HB   ILE  36           HB       ILE  36   4.750  -6.087  -0.781
  257   HG12  ILE  36          2HG1      ILE  36   1.808  -6.268  -1.497
  258   HG13  ILE  36          1HG1      ILE  36   2.588  -6.978  -0.086
  259   HG21  ILE  36          1HG2      ILE  36   4.255  -4.039  -1.842
  260   HG22  ILE  36          2HG2      ILE  36   3.050  -4.777  -2.898
  261   HG23  ILE  36          3HG2      ILE  36   4.767  -5.072  -3.176
  262   HD11  ILE  36          1HD1      ILE  36   1.591  -4.294  -0.430
  263   HD12  ILE  36          2HD1      ILE  36   3.317  -4.255  -0.073
  264   HD13  ILE  36          3HD1      ILE  36   2.207  -5.065   1.031
  265    H    ASP  37           H        ASP  37   5.055  -6.614  -4.553
  266    HA   ASP  37           HA       ASP  37   2.692  -5.748  -5.867
  267    HB2  ASP  37          2HB       ASP  37   5.312  -6.682  -7.067
  268    HB3  ASP  37          1HB       ASP  37   4.048  -5.833  -7.950
  269    H    SER  38           H        SER  38   4.166  -8.965  -5.734
  270    HA   SER  38           HA       SER  38   2.107  -9.905  -7.670
  271    HB2  SER  38          2HB       SER  38   4.598 -11.290  -6.655
  272    HB3  SER  38          1HB       SER  38   3.493 -11.929  -7.868
  273    H    LEU  39           H        LEU  39   3.667 -11.336  -4.779
  274    HA   LEU  39           HA       LEU  39   1.385 -13.016  -4.287
  275    HB2  LEU  39          2HB       LEU  39   3.737 -13.564  -3.615
  276    HB3  LEU  39          1HB       LEU  39   3.608 -12.325  -2.372
  277    HG   LEU  39           HG       LEU  39   1.393 -14.281  -2.409
  278   HD11  LEU  39          1HD1      LEU  39   3.045 -15.917  -2.821
  279   HD12  LEU  39          2HD1      LEU  39   2.932 -15.876  -1.062
  280   HD13  LEU  39          3HD1      LEU  39   4.260 -15.052  -1.880
  281   HD21  LEU  39          1HD2      LEU  39   3.214 -13.128  -0.272
  282   HD22  LEU  39          2HD2      LEU  39   1.828 -14.169   0.048
  283   HD23  LEU  39          3HD2      LEU  39   1.587 -12.574  -0.664
  284    H    GLY  40           H        GLY  40   2.670 -10.214  -2.491
  285    HA2  GLY  40          2HA       GLY  40   0.479 -10.116  -0.643
  286    HA3  GLY  40          1HA       GLY  40   1.596  -8.794  -0.965
  287    H    LEU  41           H        LEU  41   1.062  -8.593  -3.772
  288    HA   LEU  41           HA       LEU  41  -1.105  -6.767  -3.773
  289    HB2  LEU  41          2HB       LEU  41   0.707  -6.866  -5.491
  290    HB3  LEU  41          1HB       LEU  41  -0.024  -8.336  -6.132
  291    HG   LEU  41           HG       LEU  41  -2.199  -6.787  -6.185
  292   HD11  LEU  41          1HD1      LEU  41  -1.117  -4.843  -5.179
  293   HD12  LEU  41          2HD1      LEU  41  -1.541  -4.485  -6.854
  294   HD13  LEU  41          3HD1      LEU  41   0.128  -4.864  -6.428
  295   HD21  LEU  41          1HD2      LEU  41  -1.145  -7.924  -8.118
  296   HD22  LEU  41          2HD2      LEU  41   0.041  -6.622  -8.225
  297   HD23  LEU  41          3HD2      LEU  41  -1.663  -6.290  -8.534
  298    H    LEU  42           H        LEU  42  -0.962 -10.186  -4.751
  299    HA   LEU  42           HA       LEU  42  -3.650 -10.373  -5.672
  300    HB2  LEU  42          2HB       LEU  42  -1.900 -12.153  -5.967
  301    HB3  LEU  42          1HB       LEU  42  -2.055 -12.530  -4.259
  302    HG   LEU  42           HG       LEU  42  -4.570 -12.836  -4.723
  303   HD11  LEU  42          1HD1      LEU  42  -3.419 -12.739  -7.509
  304   HD12  LEU  42          2HD1      LEU  42  -4.828 -11.892  -6.877
  305   HD13  LEU  42          3HD1      LEU  42  -4.896 -13.631  -7.151
  306   HD21  LEU  42          1HD2      LEU  42  -3.554 -14.852  -4.264
  307   HD22  LEU  42          2HD2      LEU  42  -2.301 -14.617  -5.482
  308   HD23  LEU  42          3HD2      LEU  42  -3.918 -15.127  -5.967
  309    H    LYS  43           H        LYS  43  -2.241 -10.806  -2.437
  310    HA   LYS  43           HA       LYS  43  -4.723 -11.456  -1.141
  311    HB2  LYS  43          2HB       LYS  43  -2.172 -10.243  -0.062
  312    HB3  LYS  43          1HB       LYS  43  -3.493 -10.834   0.937
  313    HG2  LYS  43          2HG       LYS  43  -3.245 -13.077  -0.131
  314    HG3  LYS  43          1HG       LYS  43  -1.842 -12.466  -1.009
  315    HD2  LYS  43          2HD       LYS  43  -0.770 -11.908   1.178
  316    HD3  LYS  43          1HD       LYS  43  -2.138 -12.655   2.003
  317    HE2  LYS  43          2HE       LYS  43  -0.480 -14.130  -0.052
  318    HE3  LYS  43          1HE       LYS  43  -0.097 -14.151   1.669
  319    HZ1  LYS  43          1HZ       LYS  43  -1.490 -15.889   1.687
  320    HZ2  LYS  43          2HZ       LYS  43  -2.255 -15.443   0.237
  321    HZ3  LYS  43          3HZ       LYS  43  -2.708 -14.710   1.702
  322    H    VAL  44           H        VAL  44  -3.047  -8.416  -1.832
  323    HA   VAL  44           HA       VAL  44  -4.721  -6.731  -0.233
  324    HB   VAL  44           HB       VAL  44  -3.107  -6.137  -2.723
  325   HG11  VAL  44          1HG1      VAL  44  -4.977  -4.509  -1.164
  326   HG12  VAL  44          2HG1      VAL  44  -4.244  -4.181  -2.735
  327   HG13  VAL  44          3HG1      VAL  44  -3.365  -3.799  -1.254
  328   HG21  VAL  44          1HG2      VAL  44  -1.365  -6.267  -1.297
  329   HG22  VAL  44          2HG2      VAL  44  -2.455  -6.608   0.047
  330   HG23  VAL  44          3HG2      VAL  44  -2.065  -4.939  -0.373
  331    H    ILE  45           H        ILE  45  -4.875  -7.485  -3.736
  332    HA   ILE  45           HA       ILE  45  -7.212  -5.935  -4.232
  333    HB   ILE  45           HB       ILE  45  -6.307  -8.461  -5.644
  334   HG12  ILE  45          2HG1      ILE  45  -4.484  -6.868  -5.667
  335   HG13  ILE  45          1HG1      ILE  45  -5.257  -6.812  -7.247
  336   HG21  ILE  45          1HG2      ILE  45  -8.584  -7.824  -6.202
  337   HG22  ILE  45          2HG2      ILE  45  -7.524  -7.441  -7.558
  338   HG23  ILE  45          3HG2      ILE  45  -8.080  -6.159  -6.483
  339   HD11  ILE  45          1HD1      ILE  45  -5.387  -4.810  -5.007
  340   HD12  ILE  45          2HD1      ILE  45  -6.689  -4.895  -6.195
  341   HD13  ILE  45          3HD1      ILE  45  -5.043  -4.543  -6.715
  342    H    ALA  46           H        ALA  46  -6.807  -9.335  -3.274
  343    HA   ALA  46           HA       ALA  46  -9.590 -10.012  -3.422
  344    HB1  ALA  46          1HB       ALA  46  -8.127 -11.852  -3.283
  345    HB2  ALA  46          2HB       ALA  46  -8.845 -11.792  -1.673
  346    HB3  ALA  46          3HB       ALA  46  -7.224 -11.148  -1.941
  347    H    TRP  47           H        TRP  47  -7.560  -8.810  -0.755
  348    HA   TRP  47           HA       TRP  47  -9.745  -8.810   1.158
  349    HB2  TRP  47          2HB       TRP  47  -7.749  -8.877   2.299
  350    HB3  TRP  47          1HB       TRP  47  -6.912  -7.890   1.102
  351    HD1  TRP  47           HD       TRP  47  -9.223  -7.612   4.137
  352    HE1  TRP  47          1HE       TRP  47  -9.133  -5.190   5.017
  353    HE3  TRP  47          3HE       TRP  47  -6.440  -5.436   0.457
  354    HZ2  TRP  47          2HZ       TRP  47  -8.021  -2.662   4.256
  355    HZ3  TRP  47          3HZ       TRP  47  -5.877  -3.030   0.555
  356    HH2  TRP  47           HH       TRP  47  -6.662  -1.641   2.447
  357    H    LEU  48           H        LEU  48  -8.216  -6.366  -0.915
  358    HA   LEU  48           HA       LEU  48  -9.558  -4.089   0.095
  359    HB2  LEU  48          2HB       LEU  48  -7.678  -4.100  -1.587
  360    HB3  LEU  48          1HB       LEU  48  -8.841  -4.608  -2.802
  361    HG   LEU  48           HG       LEU  48 -10.202  -2.532  -1.975
  362   HD11  LEU  48          1HD1      LEU  48  -9.112  -0.969  -0.723
  363   HD12  LEU  48          2HD1      LEU  48  -7.564  -1.287  -1.506
  364   HD13  LEU  48          3HD1      LEU  48  -8.133  -2.347  -0.221
  365   HD21  LEU  48          1HD2      LEU  48  -8.404  -1.144  -3.472
  366   HD22  LEU  48          2HD2      LEU  48  -9.580  -2.263  -4.162
  367   HD23  LEU  48          3HD2      LEU  48  -7.927  -2.797  -3.857
  368    H    GLU  49           H        GLU  49 -10.568  -6.429  -2.394
  369    HA   GLU  49           HA       GLU  49 -12.993  -5.090  -3.102
  370    HB2  GLU  49          2HB       GLU  49 -12.259  -6.796  -4.577
  371    HB3  GLU  49          1HB       GLU  49 -12.086  -7.965  -3.281
  372    HG2  GLU  49          2HG       GLU  49 -14.512  -8.048  -2.994
  373    HG3  GLU  49          1HG       GLU  49 -14.721  -6.812  -4.224
  374    H    ASP  50           H        ASP  50 -12.257  -7.499  -0.600
  375    HA   ASP  50           HA       ASP  50 -14.973  -7.829   0.267
  376    HB2  ASP  50          2HB       ASP  50 -13.086  -9.387   0.794
  377    HB3  ASP  50          1HB       ASP  50 -12.460  -8.168   1.901
  378    H    ARG  51           H        ARG  51 -12.324  -5.798   1.516
  379    HA   ARG  51           HA       ARG  51 -13.880  -4.655   3.634
  380    HB2  ARG  51          2HB       ARG  51 -11.402  -4.656   3.592
  381    HB3  ARG  51          1HB       ARG  51 -11.443  -3.491   2.267
  382    HG2  ARG  51          2HG       ARG  51 -12.658  -1.894   3.690
  383    HG3  ARG  51          1HG       ARG  51 -12.650  -3.057   5.016
  384    HD2  ARG  51          2HD       ARG  51 -10.166  -3.034   4.989
  385    HD3  ARG  51          1HD       ARG  51 -10.208  -1.810   3.720
  386    HE   ARG  51           HE       ARG  51 -11.688  -0.583   5.613
  387   HH11  ARG  51          1HH1      ARG  51 -10.918   0.551   7.405
  388   HH12  ARG  51          2HH1      ARG  51  -9.387   0.126   8.092
  389   HH21  ARG  51          1HH2      ARG  51  -8.768  -2.418   5.823
  390   HH22  ARG  51          2HH2      ARG  51  -8.172  -1.552   7.198
  391    H    PHE  52           H        PHE  52 -13.162  -3.407   0.338
  392    HA   PHE  52           HA       PHE  52 -15.016  -1.155   0.917
  393    HB2  PHE  52          2HB       PHE  52 -13.029  -1.596  -1.322
  394    HB3  PHE  52          1HB       PHE  52 -14.050  -0.173  -1.148
  395    HD1  PHE  52          1HD       PHE  52 -11.081  -1.911   0.045
  396    HD2  PHE  52          2HD       PHE  52 -13.789   1.328   0.836
  397    HE1  PHE  52          1HE       PHE  52  -9.439  -0.922   1.617
  398    HE2  PHE  52          2HE       PHE  52 -12.146   2.318   2.408
  399    HZ   PHE  52           HZ       PHE  52  -9.971   1.193   2.799
  400    H    GLY  53           H        GLY  53 -15.114  -4.190  -0.569
  401    HA2  GLY  53          2HA       GLY  53 -16.822  -5.157  -1.885
  402    HA3  GLY  53          1HA       GLY  53 -17.735  -3.663  -1.670
  403    H    ILE  54           H        ILE  54 -14.486  -3.590  -2.956
  404    HA   ILE  54           HA       ILE  54 -15.602  -2.570  -5.518
  405    HB   ILE  54           HB       ILE  54 -12.758  -2.506  -4.465
  406   HG12  ILE  54          2HG1      ILE  54 -14.789  -0.260  -4.584
  407   HG13  ILE  54          1HG1      ILE  54 -14.494  -1.216  -3.131
  408   HG21  ILE  54          1HG2      ILE  54 -12.280  -1.916  -6.591
  409   HG22  ILE  54          2HG2      ILE  54 -13.207  -0.443  -6.305
  410   HG23  ILE  54          3HG2      ILE  54 -13.989  -1.852  -7.020
  411   HD11  ILE  54          1HD1      ILE  54 -13.163   0.872  -3.129
  412   HD12  ILE  54          2HD1      ILE  54 -12.391   0.370  -4.633
  413   HD13  ILE  54          3HD1      ILE  54 -12.130  -0.557  -3.155
  414    H    ALA  55           H        ALA  55 -15.128  -3.579  -7.490
  415    HA   ALA  55           HA       ALA  55 -14.624  -6.378  -7.476
  416    HB1  ALA  55          1HB       ALA  55 -14.707  -4.255  -9.588
  417    HB2  ALA  55          2HB       ALA  55 -15.708  -5.698  -9.412
  418    HB3  ALA  55          3HB       ALA  55 -14.055  -5.839 -10.010
  419    H    ALA  56           H        ALA  56 -12.762  -7.573  -7.900
  420    HA   ALA  56           HA       ALA  56 -10.274  -6.520  -7.020
  421    HB1  ALA  56          1HB       ALA  56 -11.051  -8.998  -8.552
  422    HB2  ALA  56          2HB       ALA  56 -10.504  -8.865  -6.881
  423    HB3  ALA  56          3HB       ALA  56  -9.360  -8.641  -8.203
  424    H    ASP  57           H        ASP  57 -11.677  -6.816 -10.247
  425    HA   ASP  57           HA       ASP  57  -9.189  -5.886 -11.521
  426    HB2  ASP  57          2HB       ASP  57 -10.417  -6.195 -13.611
  427    HB3  ASP  57          1HB       ASP  57 -10.603  -7.625 -12.599
  428    H    ASP  58           H        ASP  58 -11.258  -4.291  -9.714
  429    HA   ASP  58           HA       ASP  58 -12.428  -2.231 -11.221
  430    HB2  ASP  58          2HB       ASP  58 -12.674  -2.585  -8.744
  431    HB3  ASP  58          1HB       ASP  58 -11.078  -1.867  -8.544
  432    H    VAL  59           H        VAL  59  -9.064  -2.622 -10.213
  433    HA   VAL  59           HA       VAL  59  -8.381  -0.286 -11.953
  434    HB   VAL  59           HB       VAL  59  -8.157   0.283  -9.532
  435   HG11  VAL  59          1HG1      VAL  59  -5.926  -1.757  -9.485
  436   HG12  VAL  59          2HG1      VAL  59  -7.555  -2.137  -8.928
  437   HG13  VAL  59          3HG1      VAL  59  -6.621  -0.874  -8.125
  438   HG21  VAL  59          1HG2      VAL  59  -5.344   0.069 -10.496
  439   HG22  VAL  59          2HG2      VAL  59  -6.222   1.477  -9.896
  440   HG23  VAL  59          3HG2      VAL  59  -6.482   0.912 -11.547
  441    H    GLU  60           H        GLU  60  -6.530  -0.552 -13.232
  442    HA   GLU  60           HA       GLU  60  -5.744  -3.279 -13.805
  443    HB2  GLU  60          2HB       GLU  60  -5.798  -1.453 -15.515
  444    HB3  GLU  60          1HB       GLU  60  -4.420  -0.709 -14.713
  445    HG2  GLU  60          2HG       GLU  60  -3.131  -2.798 -15.054
  446    HG3  GLU  60          1HG       GLU  60  -4.495  -3.466 -15.941
  447    H    LEU  61           H        LEU  61  -3.796  -4.317 -13.295
  448    HA   LEU  61           HA       LEU  61  -2.316  -3.126 -11.021
  449    HB2  LEU  61          2HB       LEU  61  -2.099  -5.919 -12.179
  450    HB3  LEU  61          1HB       LEU  61  -1.500  -5.367 -10.617
  451    HG   LEU  61           HG       LEU  61  -4.394  -5.510 -11.469
  452   HD11  LEU  61          1HD1      LEU  61  -4.347  -7.581 -10.599
  453   HD12  LEU  61          2HD1      LEU  61  -3.796  -6.919  -9.060
  454   HD13  LEU  61          3HD1      LEU  61  -2.622  -7.409 -10.282
  455   HD21  LEU  61          1HD2      LEU  61  -4.644  -4.963  -8.923
  456   HD22  LEU  61          2HD2      LEU  61  -4.320  -3.645 -10.048
  457   HD23  LEU  61          3HD2      LEU  61  -3.009  -4.319  -9.079
  458    H    SER  62           H        SER  62  -0.175  -2.515 -11.191
  459    HA   SER  62           HA       SER  62   1.495  -3.471 -13.383
  460    HB2  SER  62          2HB       SER  62  -0.035  -1.143 -13.818
  461    HB3  SER  62          1HB       SER  62   1.601  -0.580 -13.487
  462    HG   SER  62           HG       SER  62   0.614  -2.155 -15.567
  463    HA   PRO  63           HA       PRO  63   4.479  -2.739 -10.170
  464    HB2  PRO  63          2HB       PRO  63   6.744  -2.408 -11.733
  465    HB3  PRO  63          1HB       PRO  63   6.057  -3.974 -11.272
  466    HG2  PRO  63          2HG       PRO  63   5.823  -2.479 -13.822
  467    HG3  PRO  63          1HG       PRO  63   5.928  -4.224 -13.537
  468    HD2  PRO  63          2HD       PRO  63   3.582  -2.974 -14.147
  469    HD3  PRO  63          1HD       PRO  63   3.658  -4.431 -13.135
  470    H    GLU  64           H        GLU  64   4.153  -0.497 -12.832
  471    HA   GLU  64           HA       GLU  64   5.848   1.585 -11.838
  472    HB2  GLU  64          2HB       GLU  64   3.407   1.717 -13.610
  473    HB3  GLU  64          1HB       GLU  64   4.510   3.057 -13.340
  474    HG2  GLU  64          2HG       GLU  64   6.368   1.667 -14.203
  475    HG3  GLU  64          1HG       GLU  64   5.220   0.377 -14.538
  476    H    HIS  65           H        HIS  65   2.543   0.653 -11.139
  477    HA   HIS  65           HA       HIS  65   1.765   3.080  -9.807
  478    HB2  HIS  65          2HB       HIS  65   0.155   1.378 -10.623
  479    HB3  HIS  65          1HB       HIS  65   0.736   0.261  -9.388
  480    HD1  HIS  65          1HD       HIS  65  -0.560   3.859  -9.465
  481    HD2  HIS  65          2HD       HIS  65  -0.788   0.430  -7.101
  482    HE1  HIS  65          1HE       HIS  65  -2.096   4.421  -7.532
  483    HE2  HIS  65          2HE       HIS  65  -2.246   2.341  -6.088
  484    H    PHE  66           H        PHE  66   3.605   0.284  -8.769
  485    HA   PHE  66           HA       PHE  66   3.402   1.173  -5.943
  486    HB2  PHE  66          2HB       PHE  66   4.534  -1.328  -7.213
  487    HB3  PHE  66          1HB       PHE  66   4.631  -0.979  -5.485
  488    HD1  PHE  66          1HD       PHE  66   2.403  -1.853  -8.276
  489    HD2  PHE  66          2HD       PHE  66   2.614  -0.887  -4.095
  490    HE1  PHE  66          1HE       PHE  66   0.079  -2.668  -7.968
  491    HE2  PHE  66          2HE       PHE  66   0.294  -1.703  -3.787
  492    HZ   PHE  66           HZ       PHE  66  -0.975  -2.589  -5.722
  493    H    ARG  67           H        ARG  67   5.223   2.209  -8.379
  494    HA   ARG  67           HA       ARG  67   7.915   1.828  -7.560
  495    HB2  ARG  67          2HB       ARG  67   6.556   4.103  -9.010
  496    HB3  ARG  67          1HB       ARG  67   8.290   4.092  -8.696
  497    HG2  ARG  67          2HG       ARG  67   7.051   1.664  -9.912
  498    HG3  ARG  67          1HG       ARG  67   7.334   3.070 -10.941
  499    HD2  ARG  67          2HD       ARG  67   9.517   2.030  -9.143
  500    HD3  ARG  67          1HD       ARG  67   9.231   1.291 -10.718
  501    HE   ARG  67           HE       ARG  67   9.430   4.171 -10.928
  502   HH11  ARG  67          1HH1      ARG  67  11.306   4.982 -11.893
  503   HH12  ARG  67          2HH1      ARG  67  12.695   3.959 -12.048
  504   HH21  ARG  67          1HH2      ARG  67  11.178   1.223 -10.553
  505   HH22  ARG  67          2HH2      ARG  67  12.623   1.831 -11.290
  506    H    SER  68           H        SER  68   5.461   4.104  -6.423
  507    HA   SER  68           HA       SER  68   7.222   4.671  -4.097
  508    HB2  SER  68          2HB       SER  68   6.877   7.064  -4.258
  509    HB3  SER  68          1HB       SER  68   7.517   6.500  -5.799
  510    HG   SER  68           HG       SER  68   4.793   6.366  -5.642
  511    H    ILE  69           H        ILE  69   6.056   5.177  -2.188
  512    HA   ILE  69           HA       ILE  69   3.411   4.100  -1.995
  513    HB   ILE  69           HB       ILE  69   4.945   5.886  -0.087
  514   HG12  ILE  69          2HG1      ILE  69   4.602   2.891  -0.059
  515   HG13  ILE  69          1HG1      ILE  69   6.003   3.689  -0.757
  516   HG21  ILE  69          1HG2      ILE  69   2.708   5.941   0.630
  517   HG22  ILE  69          2HG2      ILE  69   3.415   4.618   1.556
  518   HG23  ILE  69          3HG2      ILE  69   2.426   4.272   0.141
  519   HD11  ILE  69          1HD1      ILE  69   5.150   4.353   2.043
  520   HD12  ILE  69          2HD1      ILE  69   6.751   4.482   1.312
  521   HD13  ILE  69          3HD1      ILE  69   6.101   2.899   1.738
  522    H    ARG  70           H        ARG  70   4.653   7.406  -2.275
  523    HA   ARG  70           HA       ARG  70   2.242   8.786  -1.675
  524    HB2  ARG  70          2HB       ARG  70   4.502   9.552  -3.545
  525    HB3  ARG  70          1HB       ARG  70   3.247  10.655  -2.982
  526    HG2  ARG  70          2HG       ARG  70   3.927  10.161  -0.629
  527    HG3  ARG  70          1HG       ARG  70   5.254   9.179  -1.254
  528    HD2  ARG  70          2HD       ARG  70   4.826  12.139  -1.762
  529    HD3  ARG  70          1HD       ARG  70   6.069  11.428  -0.734
  530    HE   ARG  70           HE       ARG  70   6.269  10.338  -3.382
  531   HH11  ARG  70          1HH1      ARG  70   7.944  11.092  -4.699
  532   HH12  ARG  70          2HH1      ARG  70   8.722  12.590  -4.314
  533   HH21  ARG  70          1HH2      ARG  70   6.777  13.187  -1.507
  534   HH22  ARG  70          2HH2      ARG  70   8.061  13.777  -2.507
  535    H    SER  71           H        SER  71   3.409   7.422  -4.753
  536    HA   SER  71           HA       SER  71   1.394   8.577  -6.406
  537    HB2  SER  71          2HB       SER  71   2.004   6.886  -8.021
  538    HB3  SER  71          1HB       SER  71   3.472   7.399  -7.199
  539    HG   SER  71           HG       SER  71   3.677   5.451  -6.450
  540    H    ILE  72           H        ILE  72   1.429   5.564  -4.514
  541    HA   ILE  72           HA       ILE  72  -1.094   4.602  -5.481
  542    HB   ILE  72           HB       ILE  72   0.292   4.040  -2.844
  543   HG12  ILE  72          2HG1      ILE  72   0.443   2.562  -5.493
  544   HG13  ILE  72          1HG1      ILE  72   1.709   3.615  -4.860
  545   HG21  ILE  72          1HG2      ILE  72  -1.192   1.864  -4.014
  546   HG22  ILE  72          2HG2      ILE  72  -2.236   3.274  -3.847
  547   HG23  ILE  72          3HG2      ILE  72  -1.403   2.621  -2.436
  548   HD11  ILE  72          1HD1      ILE  72   0.986   0.868  -4.076
  549   HD12  ILE  72          2HD1      ILE  72   1.238   1.963  -2.716
  550   HD13  ILE  72          3HD1      ILE  72   2.520   1.721  -3.903
  551    H    ASP  73           H        ASP  73  -0.159   6.567  -2.668
  552    HA   ASP  73           HA       ASP  73  -2.692   6.646  -1.393
  553    HB2  ASP  73          2HB       ASP  73  -0.486   7.523  -0.484
  554    HB3  ASP  73          1HB       ASP  73  -0.731   8.948  -1.493
  555    H    ALA  74           H        ALA  74  -1.383   8.665  -4.016
  556    HA   ALA  74           HA       ALA  74  -3.552  10.527  -4.069
  557    HB1  ALA  74          1HB       ALA  74  -1.180  10.351  -5.381
  558    HB2  ALA  74          2HB       ALA  74  -2.491  11.418  -5.885
  559    HB3  ALA  74          3HB       ALA  74  -2.286   9.845  -6.659
  560    H    PHE  75           H        PHE  75  -3.017   7.506  -5.886
  561    HA   PHE  75           HA       PHE  75  -5.455   7.664  -7.385
  562    HB2  PHE  75          2HB       PHE  75  -3.558   6.129  -7.921
  563    HB3  PHE  75          1HB       PHE  75  -3.992   5.170  -6.508
  564    HD1  PHE  75          1HD       PHE  75  -5.130   6.315  -9.841
  565    HD2  PHE  75          2HD       PHE  75  -5.918   3.725  -6.506
  566    HE1  PHE  75          1HE       PHE  75  -6.847   5.122 -11.174
  567    HE2  PHE  75          2HE       PHE  75  -7.636   2.531  -7.840
  568    HZ   PHE  75           HZ       PHE  75  -8.100   3.230 -10.173
  569    H    VAL  76           H        VAL  76  -4.661   6.005  -4.330
  570    HA   VAL  76           HA       VAL  76  -7.273   4.939  -3.893
  571    HB   VAL  76           HB       VAL  76  -5.016   5.635  -2.000
  572   HG11  VAL  76          1HG1      VAL  76  -6.522   3.781  -0.698
  573   HG12  VAL  76          2HG1      VAL  76  -7.779   4.708  -1.518
  574   HG13  VAL  76          3HG1      VAL  76  -6.655   5.518  -0.427
  575   HG21  VAL  76          1HG2      VAL  76  -6.036   2.953  -2.978
  576   HG22  VAL  76          2HG2      VAL  76  -4.562   3.262  -2.060
  577   HG23  VAL  76          3HG2      VAL  76  -4.694   3.815  -3.729
  578    H    VAL  77           H        VAL  77  -5.744   7.998  -2.871
  579    HA   VAL  77           HA       VAL  77  -7.852   8.913  -1.207
  580    HB   VAL  77           HB       VAL  77  -5.862  10.424  -2.920
  581   HG11  VAL  77          1HG1      VAL  77  -8.136  11.322  -1.310
  582   HG12  VAL  77          2HG1      VAL  77  -7.176  12.209  -2.493
  583   HG13  VAL  77          3HG1      VAL  77  -6.611  12.064  -0.829
  584   HG21  VAL  77          1HG2      VAL  77  -5.413   8.855  -0.726
  585   HG22  VAL  77          2HG2      VAL  77  -5.705  10.419   0.034
  586   HG23  VAL  77          3HG2      VAL  77  -4.420  10.246  -1.161
  587    H    GLY  78           H        GLY  78  -7.318   9.269  -4.702
  588    HA2  GLY  78          2HA       GLY  78  -9.495  11.013  -5.237
  589    HA3  GLY  78          1HA       GLY  78  -8.785   9.907  -6.410
  590    H    ALA  79           H        ALA  79  -9.425   7.494  -4.817
  591    HA   ALA  79           HA       ALA  79 -12.325   7.410  -5.483
  592    HB1  ALA  79          1HB       ALA  79 -11.303   4.811  -4.926
  593    HB2  ALA  79          2HB       ALA  79 -10.140   5.635  -5.965
  594    HB3  ALA  79          3HB       ALA  79 -11.818   5.467  -6.481
  595    H    THR  80           H        THR  80 -10.067   6.257  -2.967
  596    HA   THR  80           HA       THR  80 -12.369   6.323  -1.058
  597    HB   THR  80           HB       THR  80 -10.101   4.328  -1.033
  598    HG1  THR  80          1HG       THR  80 -11.881   4.287  -2.734
  599   HG21  THR  80          1HG2      THR  80 -10.795   3.973   1.075
  600   HG22  THR  80          2HG2      THR  80 -12.337   3.429   0.416
  601   HG23  THR  80          3HG2      THR  80 -12.122   5.117   0.876
  602    H    THR  81           H        THR  81 -11.950   7.319   0.894
  603    HA   THR  81           HA       THR  81  -9.126   8.136   1.423
  604    HB   THR  81           HB       THR  81 -10.220  10.104   0.619
  605    HG1  THR  81          1HG       THR  81 -10.117  11.375   2.442
  606   HG21  THR  81          1HG2      THR  81 -12.387  10.532   2.363
  607   HG22  THR  81          2HG2      THR  81 -12.527   8.854   1.838
  608   HG23  THR  81          3HG2      THR  81 -12.468  10.150   0.643
  609    HA   PRO  82           HA       PRO  82 -10.801   5.919   5.118
  610    HB2  PRO  82          2HB       PRO  82  -8.012   5.135   5.534
  611    HB3  PRO  82          1HB       PRO  82  -9.434   4.109   5.289
  612    HG2  PRO  82          2HG       PRO  82  -7.455   4.396   3.460
  613    HG3  PRO  82          1HG       PRO  82  -9.131   4.005   3.044
  614    HD2  PRO  82          2HD       PRO  82  -7.690   6.617   2.805
  615    HD3  PRO  82          1HD       PRO  82  -8.949   5.916   1.762
  616    HA   PRO  83           HA       PRO  83  -9.511   8.536   8.456
  617    HB2  PRO  83          2HB       PRO  83  -8.080   6.392   9.917
  618    HB3  PRO  83          1HB       PRO  83  -9.475   7.361  10.421
  619    HG2  PRO  83          2HG       PRO  83  -9.689   4.775   9.744
  620    HG3  PRO  83          1HG       PRO  83 -10.980   5.950   9.446
  621    HD2  PRO  83          2HD       PRO  83  -9.067   4.722   7.509
  622    HD3  PRO  83          1HD       PRO  83 -10.747   5.247   7.264
  623    H    VAL  84           H        VAL  84  -7.717   9.801   9.178
  624    HA   VAL  84           HA       VAL  84  -5.125   9.090   7.869
  625    HB   VAL  84           HB       VAL  84  -6.097  11.795   8.831
  626   HG11  VAL  84          1HG1      VAL  84  -3.739  11.866   8.777
  627   HG12  VAL  84          2HG1      VAL  84  -4.204  12.474   7.188
  628   HG13  VAL  84          3HG1      VAL  84  -3.651  10.809   7.367
  629   HG21  VAL  84          1HG2      VAL  84  -6.395  12.258   6.401
  630   HG22  VAL  84          2HG2      VAL  84  -7.469  10.982   6.969
  631   HG23  VAL  84          3HG2      VAL  84  -6.018  10.571   6.055
  632    H    GLU  85           H        GLU  85  -3.365   8.739   9.138
  633    HA   GLU  85           HA       GLU  85  -3.519   9.538  12.009
  634    HB2  GLU  85          2HB       GLU  85  -2.359   6.973  10.877
  635    HB3  GLU  85          1HB       GLU  85  -2.322   7.451  12.575
  636    HG2  GLU  85          2HG       GLU  85  -4.809   7.511  12.585
  637    HG3  GLU  85          1HG       GLU  85  -4.809   6.945  10.914
  638    H    ALA  86           H        ALA  86  -1.496  10.182  12.932
  639    HA   ALA  86           HA       ALA  86   0.370  11.328  11.017
  640    HB1  ALA  86          1HB       ALA  86   0.765  12.665  12.783
  641    HB2  ALA  86          2HB       ALA  86   1.500  11.306  13.634
  642    HB3  ALA  86          3HB       ALA  86  -0.227  11.626  13.806
  643    H    LYS  87           H        LYS  87   2.305  10.475  10.333
  644    HA   LYS  87           HA       LYS  87   3.006   7.767  11.355
  645    HB2  LYS  87          2HB       LYS  87   2.679   8.220   8.859
  646    HB3  LYS  87          1HB       LYS  87   4.168   9.162   8.933
  647    HG2  LYS  87          2HG       LYS  87   5.367   7.180   9.816
  648    HG3  LYS  87          1HG       LYS  87   3.880   6.240   9.694
  649    HD2  LYS  87          2HD       LYS  87   3.834   6.842   7.225
  650    HD3  LYS  87          1HD       LYS  87   5.462   7.486   7.432
  651    HE2  LYS  87          2HE       LYS  87   5.357   5.083   6.614
  652    HE3  LYS  87          1HE       LYS  87   6.325   5.334   8.067
  653    HZ1  LYS  87          1HZ       LYS  87   4.484   4.606   9.411
  654    HZ2  LYS  87          2HZ       LYS  87   4.824   3.420   8.243
  655    HZ3  LYS  87          3HZ       LYS  87   3.489   4.452   8.047
  656    H    LEU  88           H        LEU  88   4.876   7.464  12.512
  657    HA   LEU  88           HA       LEU  88   6.698   8.145  13.852
  658    HB2  LEU  88          2HB       LEU  88   7.689   7.770  11.559
  659    HB3  LEU  88          1HB       LEU  88   7.519   9.500  11.269
  660    HG   LEU  88           HG       LEU  88   8.885   9.910  13.346
  661   HD11  LEU  88          1HD1      LEU  88  10.313   7.533  13.576
  662   HD12  LEU  88          2HD1      LEU  88   8.638   6.997  13.466
  663   HD13  LEU  88          3HD1      LEU  88   9.118   8.133  14.725
  664   HD21  LEU  88          1HD2      LEU  88   9.925   8.498  10.910
  665   HD22  LEU  88          2HD2      LEU  88  11.045   8.893  12.214
  666   HD23  LEU  88          3HD2      LEU  88  10.146  10.176  11.404
  667    H    GLN  89           H        GLN  89   4.921   9.687  14.821
  668    HA   GLN  89           HA       GLN  89   4.924  12.467  14.187
  669    HB2  GLN  89          2HB       GLN  89   3.234  11.332  15.643
  670    HB3  GLN  89          1HB       GLN  89   4.459  11.203  16.905
  671    HG2  GLN  89          2HG       GLN  89   4.722  13.694  16.829
  672    HG3  GLN  89          1HG       GLN  89   3.376  13.760  15.690
  673   HE21  GLN  89          1HE2      GLN  89   1.478  14.311  16.759
  674   HE22  GLN  89          2HE2      GLN  89   1.046  13.791  18.316
  675    H1   PN7 101          3HO       SAT 101   3.379  -9.135 -13.343
  676    H2   PN7 101          1H1       SAT 101   4.451  -8.010  -9.395
  677    H3   PN7 101          2H1       SAT 101   2.828  -8.544  -9.831
  678    H5   PN7 101          1HE1      SAT 101   5.848  -6.947 -11.084
  679    H6   PN7 101          2HE1      SAT 101   5.109  -6.032 -12.397
  680    H7   PN7 101          3HE1      SAT 101   5.329  -7.776 -12.552
  681    H8   PN7 101          2HE2      SAT 101   4.103  -5.341 -10.241
  682    H9   PN7 101          3HE2      SAT 101   2.631  -6.159  -9.718
  683    H10  PN7 101          1HE2      SAT 101   2.673  -5.326 -11.273
  684    H11  PN7 101          3H        SAT 101   1.725  -7.352 -12.017
  685    H12  PN7 101          5H        SAT 101   2.052  -5.135 -13.596
  686    H13  PN7 101          1H6       SAT 101   1.034  -5.312 -15.711
  687    H14  PN7 101          2H6       SAT 101   2.132  -6.645 -16.068
  688    H15  PN7 101          1H7       SAT 101  -0.446  -7.114 -15.867
  689    H16  PN7 101          2H7       SAT 101  -0.130  -7.062 -14.133
  690    H17  PN7 101          9H        SAT 101   0.509 -10.209 -13.968
  691    H18  PN7 101          1H10      SAT 101  -1.930  -9.159 -14.549
  692    H19  PN7 101          2H10      SAT 101  -1.345  -9.577 -16.159
  693    H20  PN7 101          1H11      SAT 101  -2.307 -11.597 -15.700
  694    H21  PN7 101          2H11      SAT 101  -2.242 -11.343 -13.956
  695    H22  PN7 101          2HS1      SAT 101  -0.411 -13.058 -14.224
  Start of MODEL   11
    1    H1   MET   1          1HT       MET   1  -0.589  12.766   0.072
    2    H2   MET   1          2HT       MET   1   1.012  13.334   0.061
    3    H3   MET   1          3HT       MET   1  -0.106  13.957   1.178
    4    HA   MET   1           HA       MET   1   0.698  11.108   1.116
    5    HB2  MET   1          2HB       MET   1   1.813  13.420   2.730
    6    HB3  MET   1          1HB       MET   1   2.117  11.722   3.099
    7    HG2  MET   1          2HG       MET   1   2.999  11.454   0.755
    8    HG3  MET   1          1HG       MET   1   2.865  13.200   0.565
    9    HE1  MET   1          1HE       MET   1   4.634  11.116   3.967
   10    HE2  MET   1          2HE       MET   1   5.634  10.519   2.646
   11    HE3  MET   1          3HE       MET   1   3.881  10.377   2.547
   12    H    GLN   2           H        GLN   2  -1.903  12.555   1.439
   13    HA   GLN   2           HA       GLN   2  -2.656  12.772   4.165
   14    HB2  GLN   2          2HB       GLN   2  -4.045  13.496   2.204
   15    HB3  GLN   2          1HB       GLN   2  -4.393  11.799   1.876
   16    HG2  GLN   2          2HG       GLN   2  -6.233  12.611   3.169
   17    HG3  GLN   2          1HG       GLN   2  -5.255  11.643   4.271
   18   HE21  GLN   2          1HE2      GLN   2  -4.828  12.665   6.227
   19   HE22  GLN   2          2HE2      GLN   2  -4.771  14.345   6.461
   20    H    HIS   3           H        HIS   3  -2.642   9.946   1.999
   21    HA   HIS   3           HA       HIS   3  -3.126   8.229   4.405
   22    HB2  HIS   3          2HB       HIS   3  -3.781   7.636   1.504
   23    HB3  HIS   3          1HB       HIS   3  -4.118   6.583   2.878
   24    HD1  HIS   3          1HD       HIS   3  -5.196   9.824   1.294
   25    HD2  HIS   3          2HD       HIS   3  -6.333   7.364   4.464
   26    HE1  HIS   3          1HE       HIS   3  -7.438  10.686   2.102
   27    HE2  HIS   3          2HE       HIS   3  -8.141   9.195   4.029
   28    H    ALA   4           H        ALA   4  -0.705   9.257   2.468
   29    HA   ALA   4           HA       ALA   4   0.586   6.918   1.533
   30    HB1  ALA   4          1HB       ALA   4   1.510   8.992   0.847
   31    HB2  ALA   4          2HB       ALA   4   2.723   8.298   1.923
   32    HB3  ALA   4          3HB       ALA   4   1.650   9.569   2.508
   33    H    SER   5           H        SER   5   0.597   8.402   4.763
   34    HA   SER   5           HA       SER   5   2.624   6.741   5.886
   35    HB2  SER   5          2HB       SER   5   0.207   7.896   7.302
   36    HB3  SER   5          1HB       SER   5   1.713   7.380   8.055
   37    HG   SER   5           HG       SER   5   2.732   9.092   7.220
   38    H    VAL   6           H        VAL   6  -0.904   6.299   5.689
   39    HA   VAL   6           HA       VAL   6  -0.941   3.807   7.120
   40    HB   VAL   6           HB       VAL   6  -2.820   4.926   5.028
   41   HG11  VAL   6          1HG1      VAL   6  -3.033   2.486   6.808
   42   HG12  VAL   6          2HG1      VAL   6  -3.114   2.536   5.047
   43   HG13  VAL   6          3HG1      VAL   6  -4.422   3.223   6.010
   44   HG21  VAL   6          1HG2      VAL   6  -2.399   5.398   7.861
   45   HG22  VAL   6          2HG2      VAL   6  -4.023   4.782   7.565
   46   HG23  VAL   6          3HG2      VAL   6  -3.472   6.240   6.743
   47    H    ILE   7           H        ILE   7  -0.561   4.627   3.695
   48    HA   ILE   7           HA       ILE   7  -0.648   1.985   2.658
   49    HB   ILE   7           HB       ILE   7   0.944   4.389   1.720
   50   HG12  ILE   7          2HG1      ILE   7  -1.675   3.270   0.684
   51   HG13  ILE   7          1HG1      ILE   7  -1.592   4.559   1.883
   52   HG21  ILE   7          1HG2      ILE   7   0.922   3.185  -0.479
   53   HG22  ILE   7          2HG2      ILE   7   0.250   1.775   0.340
   54   HG23  ILE   7          3HG2      ILE   7   1.865   2.348   0.754
   55   HD11  ILE   7          1HD1      ILE   7   0.181   5.146  -0.321
   56   HD12  ILE   7          2HD1      ILE   7  -1.179   6.088   0.290
   57   HD13  ILE   7          3HD1      ILE   7  -1.449   4.834  -0.921
   58    H    ALA   8           H        ALA   8   2.157   3.921   3.734
   59    HA   ALA   8           HA       ALA   8   4.094   1.847   3.343
   60    HB1  ALA   8          1HB       ALA   8   4.467   4.371   3.817
   61    HB2  ALA   8          2HB       ALA   8   5.589   3.227   4.553
   62    HB3  ALA   8          3HB       ALA   8   4.291   3.932   5.515
   63    H    GLN   9           H        GLN   9   2.296   2.884   6.227
   64    HA   GLN   9           HA       GLN   9   3.334   0.893   7.991
   65    HB2  GLN   9          2HB       GLN   9   2.089   2.910   8.740
   66    HB3  GLN   9          1HB       GLN   9   0.618   2.246   8.034
   67    HG2  GLN   9          2HG       GLN   9   1.649   0.187   9.636
   68    HG3  GLN   9          1HG       GLN   9   1.840   1.654  10.594
   69   HE21  GLN   9          1HE2      GLN   9  -0.646   0.068   8.509
   70   HE22  GLN   9          2HE2      GLN   9  -1.963   0.538   9.473
   71    H    PHE  10           H        PHE  10   0.544   0.924   5.821
   72    HA   PHE  10           HA       PHE  10  -0.557  -1.584   6.654
   73    HB2  PHE  10          2HB       PHE  10  -1.758   0.169   5.331
   74    HB3  PHE  10          1HB       PHE  10  -0.768  -0.260   3.939
   75    HD1  PHE  10          1HD       PHE  10  -3.356  -1.466   6.293
   76    HD2  PHE  10          2HD       PHE  10  -1.168  -2.274   2.687
   77    HE1  PHE  10          1HE       PHE  10  -4.933  -3.298   5.749
   78    HE2  PHE  10          2HE       PHE  10  -2.745  -4.110   2.143
   79    HZ   PHE  10           HZ       PHE  10  -4.629  -4.616   3.673
   80    H    VAL  11           H        VAL  11   1.480  -0.781   3.821
   81    HA   VAL  11           HA       VAL  11   1.781  -3.560   3.074
   82    HB   VAL  11           HB       VAL  11   3.409  -2.730   1.455
   83   HG11  VAL  11          1HG1      VAL  11   1.385  -0.540   1.475
   84   HG12  VAL  11          2HG1      VAL  11   0.791  -2.199   1.417
   85   HG13  VAL  11          3HG1      VAL  11   1.873  -1.605   0.158
   86   HG21  VAL  11          1HG2      VAL  11   4.753  -1.119   2.402
   87   HG22  VAL  11          2HG2      VAL  11   3.428  -0.411   3.323
   88   HG23  VAL  11          3HG2      VAL  11   3.595  -0.054   1.605
   89    H    VAL  12           H        VAL  12   3.817  -1.250   4.860
   90    HA   VAL  12           HA       VAL  12   6.092  -2.966   5.090
   91    HB   VAL  12           HB       VAL  12   5.155  -0.766   6.938
   92   HG11  VAL  12          1HG1      VAL  12   7.531  -0.686   7.636
   93   HG12  VAL  12          2HG1      VAL  12   7.865  -2.089   6.619
   94   HG13  VAL  12          3HG1      VAL  12   6.797  -2.243   8.011
   95   HG21  VAL  12          1HG2      VAL  12   6.228   0.737   5.557
   96   HG22  VAL  12          2HG2      VAL  12   5.765  -0.455   4.343
   97   HG23  VAL  12          3HG2      VAL  12   7.401  -0.457   5.001
   98    H    GLU  13           H        GLU  13   3.186  -2.611   7.080
   99    HA   GLU  13           HA       GLU  13   3.991  -4.132   9.317
  100    HB2  GLU  13          2HB       GLU  13   1.851  -2.872   9.160
  101    HB3  GLU  13          1HB       GLU  13   1.245  -4.109   8.065
  102    HG2  GLU  13          2HG       GLU  13   1.634  -5.822   9.826
  103    HG3  GLU  13          1HG       GLU  13   2.126  -4.533  10.922
  104    H    GLU  14           H        GLU  14   2.871  -5.197   6.148
  105    HA   GLU  14           HA       GLU  14   2.529  -7.962   6.842
  106    HB2  GLU  14          2HB       GLU  14   3.173  -6.643   4.191
  107    HB3  GLU  14          1HB       GLU  14   2.740  -8.344   4.374
  108    HG2  GLU  14          2HG       GLU  14   0.592  -7.660   5.420
  109    HG3  GLU  14          1HG       GLU  14   1.020  -5.970   5.154
  110    H    PHE  15           H        PHE  15   5.345  -6.045   5.936
  111    HA   PHE  15           HA       PHE  15   7.034  -8.428   6.541
  112    HB2  PHE  15          2HB       PHE  15   8.091  -6.658   4.428
  113    HB3  PHE  15          1HB       PHE  15   8.090  -8.420   4.527
  114    HD1  PHE  15          1HD       PHE  15   6.318  -5.457   3.342
  115    HD2  PHE  15          2HD       PHE  15   6.079  -9.715   3.852
  116    HE1  PHE  15          1HE       PHE  15   4.396  -5.534   1.783
  117    HE2  PHE  15          2HE       PHE  15   4.155  -9.794   2.289
  118    HZ   PHE  15           HZ       PHE  15   3.313  -7.704   1.254
  119    H    LEU  16           H        LEU  16   6.489  -6.299   8.340
  120    HA   LEU  16           HA       LEU  16   8.638  -4.354   8.130
  121    HB2  LEU  16          2HB       LEU  16   7.632  -3.247   9.850
  122    HB3  LEU  16          1HB       LEU  16   6.266  -4.230   9.370
  123    HG   LEU  16           HG       LEU  16   8.212  -4.876  11.612
  124   HD11  LEU  16          1HD1      LEU  16   6.795  -3.102  12.314
  125   HD12  LEU  16          2HD1      LEU  16   6.077  -4.573  12.971
  126   HD13  LEU  16          3HD1      LEU  16   5.386  -3.821  11.534
  127   HD21  LEU  16          1HD2      LEU  16   5.654  -6.312  11.483
  128   HD22  LEU  16          2HD2      LEU  16   7.277  -6.946  11.748
  129   HD23  LEU  16          3HD2      LEU  16   6.698  -6.664  10.110
  130    HA   PRO  17           HA       PRO  17  11.596  -6.974  10.237
  131    HB2  PRO  17          2HB       PRO  17  13.612  -5.182  10.506
  132    HB3  PRO  17          1HB       PRO  17  13.170  -5.850   8.924
  133    HG2  PRO  17          2HG       PRO  17  12.466  -3.214  10.121
  134    HG3  PRO  17          1HG       PRO  17  12.970  -3.600   8.469
  135    HD2  PRO  17          2HD       PRO  17  10.352  -3.210   9.199
  136    HD3  PRO  17          1HD       PRO  17  10.858  -4.225   7.831
  137    H    ASP  18           H        ASP  18  13.411  -5.671  12.170
  138    HA   ASP  18           HA       ASP  18  11.618  -5.635  14.467
  139    HB2  ASP  18          2HB       ASP  18  14.592  -5.170  14.185
  140    HB3  ASP  18          1HB       ASP  18  13.746  -5.199  15.727
  141    H    VAL  19           H        VAL  19  11.923  -3.448  12.189
  142    HA   VAL  19           HA       VAL  19  12.112  -1.104  14.043
  143    HB   VAL  19           HB       VAL  19  12.406  -1.129  11.027
  144   HG11  VAL  19          1HG1      VAL  19  11.860   1.061  11.637
  145   HG12  VAL  19          2HG1      VAL  19  13.621   1.090  11.713
  146   HG13  VAL  19          3HG1      VAL  19  12.677   0.939  13.195
  147   HG21  VAL  19          1HG2      VAL  19  14.233  -2.412  11.994
  148   HG22  VAL  19          2HG2      VAL  19  14.498  -1.179  13.226
  149   HG23  VAL  19          3HG2      VAL  19  14.851  -0.826  11.535
  150    H    ALA  20           H        ALA  20  10.333   0.236  14.201
  151    HA   ALA  20           HA       ALA  20   7.830  -0.662  13.034
  152    HB1  ALA  20          1HB       ALA  20   8.539   0.884  15.230
  153    HB2  ALA  20          2HB       ALA  20   6.897   0.635  14.637
  154    HB3  ALA  20          3HB       ALA  20   7.815   2.051  14.123
  155    HA   PRO  21           HA       PRO  21   8.091   1.480   9.111
  156    HB2  PRO  21          2HB       PRO  21   5.288   2.341   9.660
  157    HB3  PRO  21          1HB       PRO  21   5.962   1.538   8.229
  158    HG2  PRO  21          2HG       PRO  21   4.482   0.237  10.048
  159    HG3  PRO  21          1HG       PRO  21   5.794  -0.539   9.148
  160    HD2  PRO  21          2HD       PRO  21   5.697   0.234  12.007
  161    HD3  PRO  21          1HD       PRO  21   6.693  -0.991  11.189
  162    H    ALA  22           H        ALA  22   6.833   3.095  11.975
  163    HA   ALA  22           HA       ALA  22   6.879   5.780  10.961
  164    HB1  ALA  22          1HB       ALA  22   6.084   6.235  13.023
  165    HB2  ALA  22          2HB       ALA  22   7.563   5.635  13.775
  166    HB3  ALA  22          3HB       ALA  22   6.249   4.520  13.400
  167    H    ASP  23           H        ASP  23   9.359   3.614  12.058
  168    HA   ASP  23           HA       ASP  23  11.348   5.823  12.155
  169    HB2  ASP  23          2HB       ASP  23  11.525   2.901  12.950
  170    HB3  ASP  23          1HB       ASP  23  12.879   4.028  13.025
  171    H    VAL  24           H        VAL  24   9.976   4.027   9.855
  172    HA   VAL  24           HA       VAL  24  12.509   3.446   8.394
  173    HB   VAL  24           HB       VAL  24   9.665   2.632   7.711
  174   HG11  VAL  24          1HG1      VAL  24  12.348   1.687   6.652
  175   HG12  VAL  24          2HG1      VAL  24  11.231   2.748   5.791
  176   HG13  VAL  24          3HG1      VAL  24  10.767   1.084   6.151
  177   HG21  VAL  24          1HG2      VAL  24  10.242   0.445   8.594
  178   HG22  VAL  24          2HG2      VAL  24  10.557   1.644   9.849
  179   HG23  VAL  24          3HG2      VAL  24  11.896   0.968   8.920
  180    H    ASP  25           H        ASP  25  13.000   4.620   6.555
  181    HA   ASP  25           HA       ASP  25  11.665   7.127   6.139
  182    HB2  ASP  25          2HB       ASP  25  13.637   5.606   4.408
  183    HB3  ASP  25          1HB       ASP  25  13.114   7.260   4.091
  184    H    VAL  26           H        VAL  26   9.477   6.813   5.635
  185    HA   VAL  26           HA       VAL  26   8.472   4.906   3.762
  186    HB   VAL  26           HB       VAL  26   6.440   6.247   3.749
  187   HG11  VAL  26          1HG1      VAL  26   7.714   5.277   6.048
  188   HG12  VAL  26          2HG1      VAL  26   6.001   5.661   5.883
  189   HG13  VAL  26          3HG1      VAL  26   7.120   6.873   6.508
  190   HG21  VAL  26          1HG2      VAL  26   6.863   8.469   5.288
  191   HG22  VAL  26          2HG2      VAL  26   6.844   8.481   3.525
  192   HG23  VAL  26          3HG2      VAL  26   8.378   8.388   4.389
  193    H    ASP  27           H        ASP  27  10.688   7.177   3.093
  194    HA   ASP  27           HA       ASP  27   9.543   8.040   0.497
  195    HB2  ASP  27          2HB       ASP  27  12.154   8.711   1.895
  196    HB3  ASP  27          1HB       ASP  27  11.679   9.347   0.319
  197    H    LEU  28           H        LEU  28  10.794   5.302   1.568
  198    HA   LEU  28           HA       LEU  28  12.819   4.833  -0.525
  199    HB2  LEU  28          2HB       LEU  28  13.056   3.889   1.786
  200    HB3  LEU  28          1HB       LEU  28  11.635   2.895   1.481
  201    HG   LEU  28           HG       LEU  28  12.974   2.154  -0.666
  202   HD11  LEU  28          1HD1      LEU  28  15.142   3.154   1.200
  203   HD12  LEU  28          2HD1      LEU  28  14.816   3.721  -0.437
  204   HD13  LEU  28          3HD1      LEU  28  15.428   2.088  -0.174
  205   HD21  LEU  28          1HD2      LEU  28  14.132   0.397   0.791
  206   HD22  LEU  28          2HD2      LEU  28  12.387   0.554   1.004
  207   HD23  LEU  28          3HD2      LEU  28  13.488   1.272   2.181
  208    H    ASP  29           H        ASP  29  12.449   3.633  -2.371
  209    HA   ASP  29           HA       ASP  29   9.761   3.337  -3.296
  210    HB2  ASP  29          2HB       ASP  29  12.334   2.045  -4.257
  211    HB3  ASP  29          1HB       ASP  29  10.800   1.964  -5.125
  212    H    LEU  30           H        LEU  30   8.324   1.821  -2.665
  213    HA   LEU  30           HA       LEU  30   9.079  -0.358  -0.937
  214    HB2  LEU  30          2HB       LEU  30   6.680  -1.063  -1.258
  215    HB3  LEU  30          1HB       LEU  30   6.860   0.615  -0.745
  216    HG   LEU  30           HG       LEU  30   6.949   0.285  -3.650
  217   HD11  LEU  30          1HD1      LEU  30   5.350  -1.438  -3.448
  218   HD12  LEU  30          2HD1      LEU  30   4.370   0.011  -3.673
  219   HD13  LEU  30          3HD1      LEU  30   4.575  -0.674  -2.060
  220   HD21  LEU  30          1HD2      LEU  30   5.578   2.233  -3.593
  221   HD22  LEU  30          2HD2      LEU  30   6.697   2.407  -2.241
  222   HD23  LEU  30          3HD2      LEU  30   5.036   1.890  -1.951
  223    H    VAL  31           H        VAL  31   9.670  -0.010  -4.128
  224    HA   VAL  31           HA       VAL  31   8.741  -2.338  -5.402
  225    HB   VAL  31           HB       VAL  31  10.110  -0.406  -6.397
  226   HG11  VAL  31          1HG1      VAL  31  12.456  -2.165  -5.679
  227   HG12  VAL  31          2HG1      VAL  31  11.969  -0.818  -4.652
  228   HG13  VAL  31          3HG1      VAL  31  12.476  -0.521  -6.316
  229   HG21  VAL  31          1HG2      VAL  31  10.106  -3.268  -7.049
  230   HG22  VAL  31          2HG2      VAL  31  11.473  -2.402  -7.751
  231   HG23  VAL  31          3HG2      VAL  31   9.825  -1.879  -8.099
  232    H    ASP  32           H        ASP  32  11.455  -1.935  -3.168
  233    HA   ASP  32           HA       ASP  32  12.673  -4.477  -3.519
  234    HB2  ASP  32          2HB       ASP  32  12.369  -2.786  -1.017
  235    HB3  ASP  32          1HB       ASP  32  13.413  -4.203  -1.129
  236    H    ASN  33           H        ASN  33   9.916  -3.460  -1.560
  237    HA   ASN  33           HA       ASN  33   9.439  -6.242  -0.691
  238    HB2  ASN  33          2HB       ASN  33   7.680  -5.300   0.715
  239    HB3  ASN  33          1HB       ASN  33   9.160  -4.368   0.931
  240   HD21  ASN  33          1HD2      ASN  33   8.337  -2.289   1.341
  241   HD22  ASN  33          2HD2      ASN  33   7.305  -1.452   0.288
  242    H    GLY  34           H        GLY  34   9.122  -4.956  -3.487
  243    HA2  GLY  34          2HA       GLY  34   6.540  -4.732  -4.408
  244    HA3  GLY  34          1HA       GLY  34   7.791  -5.557  -5.336
  245    H    VAL  35           H        VAL  35   7.827  -7.481  -2.829
  246    HA   VAL  35           HA       VAL  35   6.467  -9.644  -3.976
  247    HB   VAL  35           HB       VAL  35   6.963  -8.985  -1.057
  248   HG11  VAL  35          1HG1      VAL  35   5.476 -10.636  -0.618
  249   HG12  VAL  35          2HG1      VAL  35   6.712 -11.728  -1.241
  250   HG13  VAL  35          3HG1      VAL  35   5.426 -11.156  -2.304
  251   HG21  VAL  35          1HG2      VAL  35   8.939 -10.179  -1.281
  252   HG22  VAL  35          2HG2      VAL  35   8.812  -9.490  -2.899
  253   HG23  VAL  35          3HG2      VAL  35   8.318 -11.159  -2.609
  254    H    ILE  36           H        ILE  36   5.244  -7.021  -1.980
  255    HA   ILE  36           HA       ILE  36   2.621  -8.130  -1.526
  256    HB   ILE  36           HB       ILE  36   3.801  -6.144  -0.336
  257   HG12  ILE  36          2HG1      ILE  36   0.911  -5.948  -1.240
  258   HG13  ILE  36          1HG1      ILE  36   1.501  -6.853   0.152
  259   HG21  ILE  36          1HG2      ILE  36   4.088  -5.006  -2.649
  260   HG22  ILE  36          2HG2      ILE  36   3.573  -3.998  -1.296
  261   HG23  ILE  36          3HG2      ILE  36   2.390  -4.558  -2.478
  262   HD11  ILE  36          1HD1      ILE  36   1.678  -3.851  -0.230
  263   HD12  ILE  36          2HD1      ILE  36   2.356  -4.736   1.137
  264   HD13  ILE  36          3HD1      ILE  36   0.611  -4.696   0.892
  265    H    ASP  37           H        ASP  37   4.113  -6.441  -4.175
  266    HA   ASP  37           HA       ASP  37   1.804  -5.374  -5.434
  267    HB2  ASP  37          2HB       ASP  37   4.389  -6.372  -6.652
  268    HB3  ASP  37          1HB       ASP  37   3.172  -5.438  -7.521
  269    H    SER  38           H        SER  38   3.145  -8.658  -5.547
  270    HA   SER  38           HA       SER  38   1.011  -9.380  -7.495
  271    HB2  SER  38          2HB       SER  38   2.772 -11.563  -6.945
  272    HB3  SER  38          1HB       SER  38   2.573 -10.665  -8.447
  273    H    LEU  39           H        LEU  39   2.581 -11.065  -4.757
  274    HA   LEU  39           HA       LEU  39   0.271 -12.720  -4.335
  275    HB2  LEU  39          2HB       LEU  39   2.613 -13.366  -3.747
  276    HB3  LEU  39          1HB       LEU  39   2.545 -12.207  -2.424
  277    HG   LEU  39           HG       LEU  39   0.274 -14.091  -2.529
  278   HD11  LEU  39          1HD1      LEU  39   3.112 -15.002  -1.995
  279   HD12  LEU  39          2HD1      LEU  39   1.973 -15.673  -3.164
  280   HD13  LEU  39          3HD1      LEU  39   1.691 -15.887  -1.437
  281   HD21  LEU  39          1HD2      LEU  39   0.782 -14.164  -0.084
  282   HD22  LEU  39          2HD2      LEU  39   0.578 -12.517  -0.678
  283   HD23  LEU  39          3HD2      LEU  39   2.195 -13.151  -0.376
  284    H    GLY  40           H        GLY  40   1.600 -10.022  -2.418
  285    HA2  GLY  40          2HA       GLY  40  -0.535 -10.078  -0.496
  286    HA3  GLY  40          1HA       GLY  40   0.588  -8.746  -0.730
  287    H    LEU  41           H        LEU  41  -0.002  -8.141  -3.428
  288    HA   LEU  41           HA       LEU  41  -2.266  -6.444  -3.092
  289    HB2  LEU  41          2HB       LEU  41  -0.405  -6.079  -4.739
  290    HB3  LEU  41          1HB       LEU  41  -1.078  -7.385  -5.712
  291    HG   LEU  41           HG       LEU  41  -3.010  -5.289  -4.899
  292   HD11  LEU  41          1HD1      LEU  41  -1.383  -3.696  -5.402
  293   HD12  LEU  41          2HD1      LEU  41  -2.113  -3.959  -6.986
  294   HD13  LEU  41          3HD1      LEU  41  -0.584  -4.737  -6.579
  295   HD21  LEU  41          1HD2      LEU  41  -2.330  -6.715  -7.493
  296   HD22  LEU  41          2HD2      LEU  41  -3.669  -5.585  -7.298
  297   HD23  LEU  41          3HD2      LEU  41  -3.660  -7.104  -6.404
  298    H    LEU  42           H        LEU  42  -1.933  -9.566  -4.786
  299    HA   LEU  42           HA       LEU  42  -4.559  -9.633  -5.860
  300    HB2  LEU  42          2HB       LEU  42  -2.753 -11.269  -6.421
  301    HB3  LEU  42          1HB       LEU  42  -2.960 -11.992  -4.833
  302    HG   LEU  42           HG       LEU  42  -5.372 -12.397  -5.387
  303   HD11  LEU  42          1HD1      LEU  42  -4.427 -11.130  -7.924
  304   HD12  LEU  42          2HD1      LEU  42  -5.969 -10.949  -7.090
  305   HD13  LEU  42          3HD1      LEU  42  -5.639 -12.405  -8.027
  306   HD21  LEU  42          1HD2      LEU  42  -4.883 -14.270  -6.987
  307   HD22  LEU  42          2HD2      LEU  42  -3.769 -14.215  -5.621
  308   HD23  LEU  42          3HD2      LEU  42  -3.261 -13.611  -7.198
  309    H    LYS  43           H        LYS  43  -3.364 -10.754  -2.689
  310    HA   LYS  43           HA       LYS  43  -5.942 -11.671  -1.794
  311    HB2  LYS  43          2HB       LYS  43  -3.480 -10.821  -0.262
  312    HB3  LYS  43          1HB       LYS  43  -4.881 -11.598   0.463
  313    HG2  LYS  43          2HG       LYS  43  -4.571 -13.523  -1.099
  314    HG3  LYS  43          1HG       LYS  43  -3.095 -12.759  -1.691
  315    HD2  LYS  43          2HD       LYS  43  -2.197 -12.782   0.638
  316    HD3  LYS  43          1HD       LYS  43  -3.638 -13.660   1.153
  317    HE2  LYS  43          2HE       LYS  43  -3.000 -15.315  -0.776
  318    HE3  LYS  43          1HE       LYS  43  -1.401 -14.585  -0.631
  319    HZ1  LYS  43          1HZ       LYS  43  -2.939 -15.827   1.585
  320    HZ2  LYS  43          2HZ       LYS  43  -1.395 -15.131   1.718
  321    HZ3  LYS  43          3HZ       LYS  43  -1.621 -16.532   0.784
  322    H    VAL  44           H        VAL  44  -4.208  -8.596  -1.575
  323    HA   VAL  44           HA       VAL  44  -6.016  -7.322   0.249
  324    HB   VAL  44           HB       VAL  44  -4.164  -6.163  -1.844
  325   HG11  VAL  44          1HG1      VAL  44  -5.833  -4.502  -1.328
  326   HG12  VAL  44          2HG1      VAL  44  -4.383  -4.086  -0.413
  327   HG13  VAL  44          3HG1      VAL  44  -5.743  -4.869   0.394
  328   HG21  VAL  44          1HG2      VAL  44  -3.634  -5.926   1.060
  329   HG22  VAL  44          2HG2      VAL  44  -2.522  -6.284  -0.261
  330   HG23  VAL  44          3HG2      VAL  44  -3.534  -7.562   0.410
  331    H    ILE  45           H        ILE  45  -5.880  -7.194  -3.336
  332    HA   ILE  45           HA       ILE  45  -8.061  -5.414  -3.637
  333    HB   ILE  45           HB       ILE  45  -7.197  -7.672  -5.467
  334   HG12  ILE  45          2HG1      ILE  45  -5.345  -6.147  -5.113
  335   HG13  ILE  45          1HG1      ILE  45  -6.030  -5.800  -6.693
  336   HG21  ILE  45          1HG2      ILE  45  -9.405  -6.924  -6.053
  337   HG22  ILE  45          2HG2      ILE  45  -8.275  -6.225  -7.211
  338   HG23  ILE  45          3HG2      ILE  45  -8.925  -5.234  -5.905
  339   HD11  ILE  45          1HD1      ILE  45  -7.482  -4.059  -5.370
  340   HD12  ILE  45          2HD1      ILE  45  -5.815  -3.665  -5.789
  341   HD13  ILE  45          3HD1      ILE  45  -6.208  -4.205  -4.157
  342    H    ALA  46           H        ALA  46  -8.055  -8.982  -3.517
  343    HA   ALA  46           HA       ALA  46 -10.895  -9.230  -3.879
  344    HB1  ALA  46          1HB       ALA  46  -8.729 -11.019  -2.807
  345    HB2  ALA  46          2HB       ALA  46  -9.686 -11.199  -4.278
  346    HB3  ALA  46          3HB       ALA  46 -10.420 -11.512  -2.706
  347    H    TRP  47           H        TRP  47  -8.866  -9.203  -0.941
  348    HA   TRP  47           HA       TRP  47 -11.165  -9.435   0.823
  349    HB2  TRP  47          2HB       TRP  47  -9.265 -10.299   1.811
  350    HB3  TRP  47          1HB       TRP  47  -8.226  -9.034   1.157
  351    HD1  TRP  47           HD       TRP  47 -11.438  -8.665   3.290
  352    HE1  TRP  47          1HE       TRP  47 -10.834  -7.247   5.360
  353    HE3  TRP  47          3HE       TRP  47  -6.456  -8.090   2.508
  354    HZ2  TRP  47          2HZ       TRP  47  -8.512  -6.024   6.529
  355    HZ3  TRP  47          3HZ       TRP  47  -5.054  -6.806   4.101
  356    HH2  TRP  47           HH       TRP  47  -6.077  -5.770   6.107
  357    H    LEU  48           H        LEU  48  -8.976  -6.778  -0.079
  358    HA   LEU  48           HA       LEU  48 -10.103  -4.774   1.558
  359    HB2  LEU  48          2HB       LEU  48  -8.000  -4.569   0.192
  360    HB3  LEU  48          1HB       LEU  48  -9.004  -4.396  -1.238
  361    HG   LEU  48           HG       LEU  48 -10.165  -2.495   0.116
  362   HD11  LEU  48          1HD1      LEU  48  -8.410  -3.347   2.043
  363   HD12  LEU  48          2HD1      LEU  48  -9.154  -1.749   2.008
  364   HD13  LEU  48          3HD1      LEU  48  -7.539  -1.986   1.341
  365   HD21  LEU  48          1HD2      LEU  48  -9.108  -1.613  -1.708
  366   HD22  LEU  48          2HD2      LEU  48  -7.647  -2.566  -1.439
  367   HD23  LEU  48          3HD2      LEU  48  -7.917  -1.085  -0.518
  368    H    GLU  49           H        GLU  49 -11.053  -5.861  -1.706
  369    HA   GLU  49           HA       GLU  49 -13.085  -3.885  -2.095
  370    HB2  GLU  49          2HB       GLU  49 -12.520  -5.035  -4.051
  371    HB3  GLU  49          1HB       GLU  49 -12.565  -6.607  -3.264
  372    HG2  GLU  49          2HG       GLU  49 -14.957  -6.580  -3.164
  373    HG3  GLU  49          1HG       GLU  49 -15.020  -4.894  -3.660
  374    H    ASP  50           H        ASP  50 -13.125  -7.045  -0.493
  375    HA   ASP  50           HA       ASP  50 -15.939  -7.256  -0.164
  376    HB2  ASP  50          2HB       ASP  50 -14.232  -9.044   0.345
  377    HB3  ASP  50          1HB       ASP  50 -13.861  -8.165   1.826
  378    H    ARG  51           H        ARG  51 -13.501  -5.581   1.808
  379    HA   ARG  51           HA       ARG  51 -15.431  -4.815   3.837
  380    HB2  ARG  51          2HB       ARG  51 -12.608  -3.917   3.249
  381    HB3  ARG  51          1HB       ARG  51 -13.554  -3.306   4.603
  382    HG2  ARG  51          2HG       ARG  51 -13.887  -5.686   5.355
  383    HG3  ARG  51          1HG       ARG  51 -12.756  -6.182   4.095
  384    HD2  ARG  51          2HD       ARG  51 -12.148  -4.258   6.358
  385    HD3  ARG  51          1HD       ARG  51 -11.588  -5.925   6.248
  386    HE   ARG  51           HE       ARG  51 -10.701  -4.736   3.893
  387   HH11  ARG  51          1HH1      ARG  51  -8.659  -3.776   3.737
  388   HH12  ARG  51          2HH1      ARG  51  -7.874  -3.202   5.170
  389   HH21  ARG  51          1HH2      ARG  51 -10.455  -4.152   7.283
  390   HH22  ARG  51          2HH2      ARG  51  -8.891  -3.415   7.177
  391    H    PHE  52           H        PHE  52 -13.899  -3.052   1.105
  392    HA   PHE  52           HA       PHE  52 -15.670  -0.751   1.741
  393    HB2  PHE  52          2HB       PHE  52 -13.247  -1.026  -0.049
  394    HB3  PHE  52          1HB       PHE  52 -14.203   0.446   0.094
  395    HD1  PHE  52          1HD       PHE  52 -11.753  -1.730   1.701
  396    HD2  PHE  52          2HD       PHE  52 -14.327   1.663   2.262
  397    HE1  PHE  52          1HE       PHE  52 -10.497  -1.116   3.749
  398    HE2  PHE  52          2HE       PHE  52 -13.071   2.277   4.310
  399    HZ   PHE  52           HZ       PHE  52 -11.157   0.888   5.054
  400    H    GLY  53           H        GLY  53 -15.643  -3.441  -0.280
  401    HA2  GLY  53          2HA       GLY  53 -17.040  -4.011  -2.084
  402    HA3  GLY  53          1HA       GLY  53 -17.955  -2.544  -1.734
  403    H    ILE  54           H        ILE  54 -14.506  -2.488  -2.423
  404    HA   ILE  54           HA       ILE  54 -15.031  -0.681  -4.688
  405    HB   ILE  54           HB       ILE  54 -12.429  -1.693  -3.505
  406   HG12  ILE  54          2HG1      ILE  54 -13.736   1.031  -3.274
  407   HG13  ILE  54          1HG1      ILE  54 -13.929  -0.235  -2.064
  408   HG21  ILE  54          1HG2      ILE  54 -11.641   0.466  -4.767
  409   HG22  ILE  54          2HG2      ILE  54 -13.095   0.215  -5.734
  410   HG23  ILE  54          3HG2      ILE  54 -11.847  -1.031  -5.676
  411   HD11  ILE  54          1HD1      ILE  54 -12.100   1.312  -1.450
  412   HD12  ILE  54          2HD1      ILE  54 -11.282   0.938  -2.968
  413   HD13  ILE  54          3HD1      ILE  54 -11.487  -0.316  -1.745
  414    H    ALA  55           H        ALA  55 -14.453  -1.111  -6.853
  415    HA   ALA  55           HA       ALA  55 -14.803  -3.789  -7.762
  416    HB1  ALA  55          1HB       ALA  55 -15.231  -2.428  -9.537
  417    HB2  ALA  55          2HB       ALA  55 -13.502  -2.581  -9.850
  418    HB3  ALA  55          3HB       ALA  55 -14.119  -1.183  -8.969
  419    H    ALA  56           H        ALA  56 -13.277  -5.305  -8.549
  420    HA   ALA  56           HA       ALA  56 -10.843  -5.511  -7.114
  421    HB1  ALA  56          1HB       ALA  56 -11.906  -6.852  -9.591
  422    HB2  ALA  56          2HB       ALA  56 -11.651  -7.537  -7.987
  423    HB3  ALA  56          3HB       ALA  56 -10.271  -7.189  -9.026
  424    H    ASP  57           H        ASP  57 -11.564  -4.041 -10.234
  425    HA   ASP  57           HA       ASP  57 -10.198  -2.815 -11.700
  426    HB2  ASP  57          2HB       ASP  57 -10.062  -1.444  -9.586
  427    HB3  ASP  57          1HB       ASP  57  -8.567  -2.297  -9.211
  428    H    ASP  58           H        ASP  58  -9.637  -5.567 -11.649
  429    HA   ASP  58           HA       ASP  58  -6.688  -5.802 -11.533
  430    HB2  ASP  58          2HB       ASP  58  -7.065  -8.193 -11.879
  431    HB3  ASP  58          1HB       ASP  58  -8.109  -7.611 -10.581
  432    H    VAL  59           H        VAL  59  -8.463  -4.360 -13.669
  433    HA   VAL  59           HA       VAL  59  -8.309  -5.699 -16.132
  434    HB   VAL  59           HB       VAL  59  -8.018  -2.768 -15.484
  435   HG11  VAL  59          1HG1      VAL  59  -7.730  -4.230 -18.030
  436   HG12  VAL  59          2HG1      VAL  59  -7.199  -2.604 -17.600
  437   HG13  VAL  59          3HG1      VAL  59  -8.871  -2.886 -18.084
  438   HG21  VAL  59          1HG2      VAL  59 -10.361  -3.777 -16.950
  439   HG22  VAL  59          2HG2      VAL  59 -10.289  -2.704 -15.552
  440   HG23  VAL  59          3HG2      VAL  59 -10.195  -4.452 -15.329
  441    H    GLU  60           H        GLU  60  -5.806  -3.705 -14.552
  442    HA   GLU  60           HA       GLU  60  -3.678  -5.266 -15.698
  443    HB2  GLU  60          2HB       GLU  60  -4.428  -4.037 -17.742
  444    HB3  GLU  60          1HB       GLU  60  -4.066  -2.522 -16.923
  445    HG2  GLU  60          2HG       GLU  60  -1.722  -3.289 -16.624
  446    HG3  GLU  60          1HG       GLU  60  -2.106  -4.731 -17.557
  447    H    LEU  61           H        LEU  61  -2.205  -5.123 -14.089
  448    HA   LEU  61           HA       LEU  61  -1.922  -2.525 -12.647
  449    HB2  LEU  61          2HB       LEU  61  -1.071  -5.293 -11.749
  450    HB3  LEU  61          1HB       LEU  61  -1.025  -3.818 -10.782
  451    HG   LEU  61           HG       LEU  61  -3.647  -3.905 -11.681
  452   HD11  LEU  61          1HD1      LEU  61  -4.448  -6.156 -11.257
  453   HD12  LEU  61          2HD1      LEU  61  -2.827  -6.692 -10.813
  454   HD13  LEU  61          3HD1      LEU  61  -3.181  -6.242 -12.481
  455   HD21  LEU  61          1HD2      LEU  61  -4.133  -4.571  -9.316
  456   HD22  LEU  61          2HD2      LEU  61  -2.940  -3.278  -9.430
  457   HD23  LEU  61          3HD2      LEU  61  -2.420  -4.930  -9.101
  458    H    SER  62           H        SER  62   0.102  -1.534 -12.635
  459    HA   SER  62           HA       SER  62   2.297  -2.998 -14.023
  460    HB2  SER  62          2HB       SER  62   2.911  -0.367 -14.426
  461    HB3  SER  62          1HB       SER  62   2.037  -1.366 -15.584
  462    HG   SER  62           HG       SER  62   0.719  -0.010 -13.485
  463    HA   PRO  63           HA       PRO  63   4.568  -2.302 -10.259
  464    HB2  PRO  63          2HB       PRO  63   7.134  -2.280 -11.307
  465    HB3  PRO  63          1HB       PRO  63   6.212  -3.744 -10.919
  466    HG2  PRO  63          2HG       PRO  63   6.684  -2.438 -13.537
  467    HG3  PRO  63          1HG       PRO  63   6.536  -4.157 -13.137
  468    HD2  PRO  63          2HD       PRO  63   4.529  -2.732 -14.319
  469    HD3  PRO  63          1HD       PRO  63   4.229  -4.126 -13.259
  470    H    GLU  64           H        GLU  64   4.914  -0.190 -13.009
  471    HA   GLU  64           HA       GLU  64   6.675   1.757 -11.930
  472    HB2  GLU  64          2HB       GLU  64   4.377   2.083 -13.856
  473    HB3  GLU  64          1HB       GLU  64   5.596   3.310 -13.548
  474    HG2  GLU  64          2HG       GLU  64   7.348   1.707 -14.252
  475    HG3  GLU  64          1HG       GLU  64   6.092   0.535 -14.631
  476    H    HIS  65           H        HIS  65   3.219   1.255 -11.454
  477    HA   HIS  65           HA       HIS  65   2.778   3.803 -10.143
  478    HB2  HIS  65          2HB       HIS  65   0.956   2.507 -11.220
  479    HB3  HIS  65          1HB       HIS  65   1.136   1.262  -9.984
  480    HD1  HIS  65          1HD       HIS  65   0.752   5.069  -9.952
  481    HD2  HIS  65          2HD       HIS  65  -0.664   1.699  -7.944
  482    HE1  HIS  65          1HE       HIS  65  -0.856   5.911  -8.186
  483    HE2  HIS  65          2HE       HIS  65  -1.728   3.868  -6.960
  484    H    PHE  66           H        PHE  66   3.871   0.656  -9.055
  485    HA   PHE  66           HA       PHE  66   3.460   1.426  -6.225
  486    HB2  PHE  66          2HB       PHE  66   4.452  -1.125  -7.520
  487    HB3  PHE  66          1HB       PHE  66   4.337  -0.891  -5.775
  488    HD1  PHE  66          1HD       PHE  66   2.187  -0.785  -4.650
  489    HD2  PHE  66          2HD       PHE  66   2.424  -1.186  -8.921
  490    HE1  PHE  66          1HE       PHE  66  -0.228  -1.344  -4.733
  491    HE2  PHE  66          2HE       PHE  66   0.010  -1.747  -9.002
  492    HZ   PHE  66           HZ       PHE  66  -1.316  -1.824  -6.909
  493    H    ARG  67           H        ARG  67   5.724   2.278  -8.372
  494    HA   ARG  67           HA       ARG  67   8.204   1.506  -7.223
  495    HB2  ARG  67          2HB       ARG  67   7.445   4.064  -8.658
  496    HB3  ARG  67          1HB       ARG  67   9.100   3.591  -8.283
  497    HG2  ARG  67          2HG       ARG  67   7.288   1.716  -9.761
  498    HG3  ARG  67          1HG       ARG  67   8.135   2.992 -10.630
  499    HD2  ARG  67          2HD       ARG  67  10.281   2.133  -9.580
  500    HD3  ARG  67          1HD       ARG  67   9.358   0.749  -8.994
  501    HE   ARG  67           HE       ARG  67   9.123   1.228 -11.879
  502   HH11  ARG  67          1HH1      ARG  67   9.952  -0.429 -13.173
  503   HH12  ARG  67          2HH1      ARG  67  10.946  -1.654 -12.459
  504   HH21  ARG  67          1HH2      ARG  67  10.767  -0.310  -9.267
  505   HH22  ARG  67          2HH2      ARG  67  11.409  -1.586 -10.247
  506    H    SER  68           H        SER  68   5.948   4.070  -6.293
  507    HA   SER  68           HA       SER  68   7.596   4.449  -3.831
  508    HB2  SER  68          2HB       SER  68   7.281   6.857  -3.937
  509    HB3  SER  68          1HB       SER  68   8.011   6.316  -5.446
  510    HG   SER  68           HG       SER  68   6.153   6.654  -6.481
  511    H    ILE  69           H        ILE  69   6.382   5.001  -1.957
  512    HA   ILE  69           HA       ILE  69   3.744   3.920  -1.807
  513    HB   ILE  69           HB       ILE  69   5.130   5.845   0.080
  514   HG12  ILE  69          2HG1      ILE  69   5.052   2.824   0.124
  515   HG13  ILE  69          1HG1      ILE  69   6.418   3.767  -0.452
  516   HG21  ILE  69          1HG2      ILE  69   2.529   4.718   0.066
  517   HG22  ILE  69          2HG2      ILE  69   3.295   5.654   1.348
  518   HG23  ILE  69          3HG2      ILE  69   3.453   3.897   1.321
  519   HD11  ILE  69          1HD1      ILE  69   5.794   4.883   2.034
  520   HD12  ILE  69          2HD1      ILE  69   7.159   3.828   1.673
  521   HD13  ILE  69          3HD1      ILE  69   5.650   3.141   2.273
  522    H    ARG  70           H        ARG  70   4.947   7.235  -2.163
  523    HA   ARG  70           HA       ARG  70   2.498   8.600  -1.697
  524    HB2  ARG  70          2HB       ARG  70   4.816   9.337  -3.505
  525    HB3  ARG  70          1HB       ARG  70   3.526  10.441  -3.025
  526    HG2  ARG  70          2HG       ARG  70   4.122  10.026  -0.632
  527    HG3  ARG  70          1HG       ARG  70   5.484   9.047  -1.177
  528    HD2  ARG  70          2HD       ARG  70   5.036  11.983  -1.792
  529    HD3  ARG  70          1HD       ARG  70   6.249  11.323  -0.695
  530    HE   ARG  70           HE       ARG  70   6.735  10.074  -3.146
  531   HH11  ARG  70          1HH1      ARG  70   8.227  10.917  -4.619
  532   HH12  ARG  70          2HH1      ARG  70   8.624  12.602  -4.561
  533   HH21  ARG  70          1HH2      ARG  70   6.509  13.281  -1.899
  534   HH22  ARG  70          2HH2      ARG  70   7.652  13.940  -3.021
  535    H    SER  71           H        SER  71   3.774   7.123  -4.673
  536    HA   SER  71           HA       SER  71   1.888   8.213  -6.483
  537    HB2  SER  71          2HB       SER  71   3.076   5.427  -6.556
  538    HB3  SER  71          1HB       SER  71   2.432   6.331  -7.920
  539    HG   SER  71           HG       SER  71   4.870   6.468  -6.727
  540    H    ILE  72           H        ILE  72   1.695   5.267  -4.479
  541    HA   ILE  72           HA       ILE  72  -0.867   4.432  -5.428
  542    HB   ILE  72           HB       ILE  72   0.448   3.961  -2.736
  543   HG12  ILE  72          2HG1      ILE  72   0.463   2.271  -5.257
  544   HG13  ILE  72          1HG1      ILE  72   1.811   3.270  -4.716
  545   HG21  ILE  72          1HG2      ILE  72  -1.910   3.422  -2.663
  546   HG22  ILE  72          2HG2      ILE  72  -1.002   1.914  -2.767
  547   HG23  ILE  72          3HG2      ILE  72  -1.802   2.563  -4.198
  548   HD11  ILE  72          1HD1      ILE  72   1.387   1.900  -2.445
  549   HD12  ILE  72          2HD1      ILE  72   2.440   1.292  -3.722
  550   HD13  ILE  72          3HD1      ILE  72   0.781   0.708  -3.595
  551    H    ASP  73           H        ASP  73   0.141   6.564  -2.782
  552    HA   ASP  73           HA       ASP  73  -2.354   6.884  -1.496
  553    HB2  ASP  73          2HB       ASP  73  -0.098   7.797  -0.751
  554    HB3  ASP  73          1HB       ASP  73  -0.334   9.099  -1.915
  555    H    ALA  74           H        ALA  74  -1.032   8.594  -4.333
  556    HA   ALA  74           HA       ALA  74  -3.217  10.441  -4.554
  557    HB1  ALA  74          1HB       ALA  74  -2.104   9.813  -7.135
  558    HB2  ALA  74          2HB       ALA  74  -0.809   9.921  -5.945
  559    HB3  ALA  74          3HB       ALA  74  -1.907  11.281  -6.177
  560    H    PHE  75           H        PHE  75  -2.609   7.309  -6.155
  561    HA   PHE  75           HA       PHE  75  -5.004   7.343  -7.718
  562    HB2  PHE  75          2HB       PHE  75  -3.115   5.773  -8.103
  563    HB3  PHE  75          1HB       PHE  75  -3.552   4.929  -6.621
  564    HD1  PHE  75          1HD       PHE  75  -4.670   5.797 -10.044
  565    HD2  PHE  75          2HD       PHE  75  -5.465   3.469  -6.523
  566    HE1  PHE  75          1HE       PHE  75  -6.363   4.485 -11.294
  567    HE2  PHE  75          2HE       PHE  75  -7.159   2.156  -7.773
  568    HZ   PHE  75           HZ       PHE  75  -7.608   2.665 -10.158
  569    H    VAL  76           H        VAL  76  -4.316   5.935  -4.515
  570    HA   VAL  76           HA       VAL  76  -6.948   4.893  -4.114
  571    HB   VAL  76           HB       VAL  76  -4.760   5.697  -2.183
  572   HG11  VAL  76          1HG1      VAL  76  -6.801   5.836  -0.946
  573   HG12  VAL  76          2HG1      VAL  76  -6.106   4.258  -0.574
  574   HG13  VAL  76          3HG1      VAL  76  -7.443   4.386  -1.716
  575   HG21  VAL  76          1HG2      VAL  76  -5.742   2.914  -2.768
  576   HG22  VAL  76          2HG2      VAL  76  -4.153   3.436  -2.209
  577   HG23  VAL  76          3HG2      VAL  76  -4.625   3.696  -3.887
  578    H    VAL  77           H        VAL  77  -5.449   7.998  -3.123
  579    HA   VAL  77           HA       VAL  77  -7.719   8.965  -1.691
  580    HB   VAL  77           HB       VAL  77  -5.441  10.358  -3.110
  581   HG11  VAL  77          1HG1      VAL  77  -6.950  12.097  -3.134
  582   HG12  VAL  77          2HG1      VAL  77  -6.361  12.263  -1.480
  583   HG13  VAL  77          3HG1      VAL  77  -7.889  11.441  -1.795
  584   HG21  VAL  77          1HG2      VAL  77  -5.938  10.467  -0.170
  585   HG22  VAL  77          2HG2      VAL  77  -4.411  10.376  -1.048
  586   HG23  VAL  77          3HG2      VAL  77  -5.390   8.925  -0.832
  587    H    GLY  78           H        GLY  78  -6.779   9.277  -5.104
  588    HA2  GLY  78          2HA       GLY  78  -8.810  11.078  -5.905
  589    HA3  GLY  78          1HA       GLY  78  -8.046   9.902  -6.971
  590    H    ALA  79           H        ALA  79  -8.952   7.583  -5.368
  591    HA   ALA  79           HA       ALA  79 -11.776   7.600  -6.309
  592    HB1  ALA  79          1HB       ALA  79  -9.676   5.762  -6.653
  593    HB2  ALA  79          2HB       ALA  79 -11.363   5.548  -7.117
  594    HB3  ALA  79          3HB       ALA  79 -10.805   4.994  -5.538
  595    H    THR  80           H        THR  80  -9.815   6.438  -3.558
  596    HA   THR  80           HA       THR  80 -12.270   6.701  -1.872
  597    HB   THR  80           HB       THR  80 -10.182   4.533  -1.620
  598    HG1  THR  80          1HG       THR  80 -12.826   4.493  -2.639
  599   HG21  THR  80          1HG2      THR  80 -11.090   4.826   0.516
  600   HG22  THR  80          2HG2      THR  80 -12.139   3.588  -0.175
  601   HG23  THR  80          3HG2      THR  80 -12.676   5.267  -0.117
  602    H    THR  81           H        THR  81 -11.956   7.686   0.101
  603    HA   THR  81           HA       THR  81  -9.142   8.324   0.869
  604    HB   THR  81           HB       THR  81 -10.294  10.298  -0.103
  605    HG1  THR  81          1HG       THR  81  -9.631  10.187   2.626
  606   HG21  THR  81          1HG2      THR  81 -12.529   9.279   1.126
  607   HG22  THR  81          2HG2      THR  81 -12.392  10.920   0.493
  608   HG23  THR  81          3HG2      THR  81 -12.097  10.607   2.204
  609    HA   PRO  82           HA       PRO  82 -11.236   6.388   4.471
  610    HB2  PRO  82          2HB       PRO  82  -9.289   4.625   5.098
  611    HB3  PRO  82          1HB       PRO  82 -10.433   4.326   3.775
  612    HG2  PRO  82          2HG       PRO  82  -7.595   5.177   3.667
  613    HG3  PRO  82          1HG       PRO  82  -8.516   4.157   2.551
  614    HD2  PRO  82          2HD       PRO  82  -7.933   6.892   2.185
  615    HD3  PRO  82          1HD       PRO  82  -9.128   5.948   1.271
  616    HA   PRO  83           HA       PRO  83  -9.303   8.703   7.711
  617    HB2  PRO  83          2HB       PRO  83  -9.428   6.859   9.801
  618    HB3  PRO  83          1HB       PRO  83 -10.747   7.935   9.307
  619    HG2  PRO  83          2HG       PRO  83 -10.320   5.064   8.702
  620    HG3  PRO  83          1HG       PRO  83 -11.827   5.954   8.972
  621    HD2  PRO  83          2HD       PRO  83 -11.008   5.206   6.488
  622    HD3  PRO  83          1HD       PRO  83 -11.949   6.687   6.774
  623    H    VAL  84           H        VAL  84  -7.261   8.919   8.798
  624    HA   VAL  84           HA       VAL  84  -5.280   6.839   8.010
  625    HB   VAL  84           HB       VAL  84  -4.816   9.655   9.039
  626   HG11  VAL  84          1HG1      VAL  84  -2.648   9.063   9.133
  627   HG12  VAL  84          2HG1      VAL  84  -2.698   8.574   7.439
  628   HG13  VAL  84          3HG1      VAL  84  -3.089   7.410   8.705
  629   HG21  VAL  84          1HG2      VAL  84  -4.468   8.699   6.197
  630   HG22  VAL  84          2HG2      VAL  84  -4.590  10.354   6.792
  631   HG23  VAL  84          3HG2      VAL  84  -6.018   9.322   6.761
  632    H    GLU  85           H        GLU  85  -4.477   5.504   9.543
  633    HA   GLU  85           HA       GLU  85  -5.324   5.671  12.292
  634    HB2  GLU  85          2HB       GLU  85  -3.135   4.030  10.981
  635    HB3  GLU  85          1HB       GLU  85  -3.701   3.801  12.636
  636    HG2  GLU  85          2HG       GLU  85  -5.994   3.389  11.774
  637    HG3  GLU  85          1HG       GLU  85  -5.383   3.546  10.127
  638    H    ALA  86           H        ALA  86  -2.441   6.705  10.554
  639    HA   ALA  86           HA       ALA  86  -0.826   8.288  11.245
  640    HB1  ALA  86          1HB       ALA  86  -2.869   8.915  12.894
  641    HB2  ALA  86          2HB       ALA  86  -1.266   9.633  13.056
  642    HB3  ALA  86          3HB       ALA  86  -1.732   8.275  14.081
  643    H    LYS  87           H        LYS  87   1.123   7.274  11.330
  644    HA   LYS  87           HA       LYS  87   1.649   4.842  12.690
  645    HB2  LYS  87          2HB       LYS  87   3.579   7.042  11.887
  646    HB3  LYS  87          1HB       LYS  87   4.052   5.412  12.368
  647    HG2  LYS  87          2HG       LYS  87   2.633   4.511  10.505
  648    HG3  LYS  87          1HG       LYS  87   2.347   6.171   9.979
  649    HD2  LYS  87          2HD       LYS  87   4.838   6.472   9.799
  650    HD3  LYS  87          1HD       LYS  87   5.019   4.751  10.141
  651    HE2  LYS  87          2HE       LYS  87   4.776   4.383   7.930
  652    HE3  LYS  87          1HE       LYS  87   3.091   4.867   8.115
  653    HZ1  LYS  87          1HZ       LYS  87   5.303   6.789   7.666
  654    HZ2  LYS  87          2HZ       LYS  87   3.634   7.100   7.603
  655    HZ3  LYS  87          3HZ       LYS  87   4.366   6.135   6.412
  656    H    LEU  88           H        LEU  88   1.950   8.200  13.761
  657    HA   LEU  88           HA       LEU  88   3.058   7.300  16.360
  658    HB2  LEU  88          2HB       LEU  88   2.410  10.108  15.409
  659    HB3  LEU  88          1HB       LEU  88   3.351   9.674  16.836
  660    HG   LEU  88           HG       LEU  88   4.092   9.098  13.953
  661   HD11  LEU  88          1HD1      LEU  88   6.131  10.491  15.267
  662   HD12  LEU  88          2HD1      LEU  88   4.645  11.272  15.809
  663   HD13  LEU  88          3HD1      LEU  88   5.003  11.158  14.087
  664   HD21  LEU  88          1HD2      LEU  88   6.300   8.438  15.252
  665   HD22  LEU  88          2HD2      LEU  88   4.994   7.266  15.079
  666   HD23  LEU  88          3HD2      LEU  88   5.183   8.158  16.589
  667    H    GLN  89           H        GLN  89   1.885   7.412  18.279
  668    HA   GLN  89           HA       GLN  89  -1.037   7.920  17.960
  669    HB2  GLN  89          2HB       GLN  89   0.502   6.388  20.080
  670    HB3  GLN  89          1HB       GLN  89  -1.247   6.616  20.079
  671    HG2  GLN  89          2HG       GLN  89  -1.417   5.468  17.915
  672    HG3  GLN  89          1HG       GLN  89   0.336   5.273  17.868
  673   HE21  GLN  89          1HE2      GLN  89  -1.369   2.987  17.822
  674   HE22  GLN  89          2HE2      GLN  89  -1.184   2.142  19.282
  675    H1   PN7 101          3HO       SAT 101   4.242  -6.563 -13.343
  676    H2   PN7 101          1H1       SAT 101   4.884  -7.707 -10.340
  677    H3   PN7 101          2H1       SAT 101   4.400  -6.741  -8.946
  678    H5   PN7 101          1HE1      SAT 101   2.673  -4.635 -11.247
  679    H6   PN7 101          2HE1      SAT 101   4.378  -5.084 -11.186
  680    H7   PN7 101          3HE1      SAT 101   3.498  -4.761  -9.692
  681    H8   PN7 101          2HE2      SAT 101   1.670  -6.426  -8.955
  682    H9   PN7 101          3HE2      SAT 101   1.323  -7.803 -10.000
  683    H10  PN7 101          1HE2      SAT 101   0.941  -6.168 -10.540
  684    H11  PN7 101          3H        SAT 101   2.743  -8.304 -11.935
  685    H12  PN7 101          5H        SAT 101   2.556  -4.689 -13.403
  686    H13  PN7 101          1H6       SAT 101   3.185  -5.129 -15.620
  687    H14  PN7 101          2H6       SAT 101   3.525  -6.781 -15.104
  688    H15  PN7 101          1H7       SAT 101   1.274  -5.793 -16.612
  689    H16  PN7 101          2H7       SAT 101   0.705  -6.505 -15.101
  690    H17  PN7 101          9H        SAT 101   0.407  -8.742 -15.215
  691    H18  PN7 101          1H10      SAT 101   1.123  -9.758 -17.927
  692    H19  PN7 101          2H10      SAT 101   1.175 -10.846 -16.539
  693    H20  PN7 101          1H11      SAT 101  -1.064 -10.247 -18.154
  694    H21  PN7 101          2H11      SAT 101  -1.357  -9.455 -16.607
  695    H22  PN7 101          2HS1      SAT 101  -1.875 -12.257 -16.916
  Start of MODEL   12
    1    H1   MET   1          1HT       MET   1  -2.683  14.673   0.025
    2    H2   MET   1          2HT       MET   1  -1.839  13.731  -1.110
    3    H3   MET   1          3HT       MET   1  -1.175  15.192  -0.552
    4    HA   MET   1           HA       MET   1  -1.057  12.574   0.601
    5    HB2  MET   1          2HB       MET   1   0.365  15.207   1.097
    6    HB3  MET   1          1HB       MET   1   0.836  13.666   1.814
    7    HG2  MET   1          2HG       MET   1   1.092  12.720  -0.481
    8    HG3  MET   1          1HG       MET   1   0.738  14.315  -1.144
    9    HE1  MET   1          1HE       MET   1   3.135  12.842  -2.008
   10    HE2  MET   1          2HE       MET   1   4.521  13.914  -1.810
   11    HE3  MET   1          3HE       MET   1   3.012  14.547  -2.465
   12    H    GLN   2           H        GLN   2  -3.560  13.409   1.287
   13    HA   GLN   2           HA       GLN   2  -3.817  14.937   3.670
   14    HB2  GLN   2          2HB       GLN   2  -5.479  12.566   2.760
   15    HB3  GLN   2          1HB       GLN   2  -5.964  13.756   3.969
   16    HG2  GLN   2          2HG       GLN   2  -5.328  14.352   1.064
   17    HG3  GLN   2          1HG       GLN   2  -6.943  14.295   1.771
   18   HE21  GLN   2          1HE2      GLN   2  -4.884  16.545   0.717
   19   HE22  GLN   2          2HE2      GLN   2  -5.117  17.772   1.866
   20    H    HIS   3           H        HIS   3  -3.040  11.527   3.155
   21    HA   HIS   3           HA       HIS   3  -2.026  11.380   5.924
   22    HB2  HIS   3          2HB       HIS   3  -4.153   9.505   4.846
   23    HB3  HIS   3          1HB       HIS   3  -3.274   9.268   6.356
   24    HD1  HIS   3          1HD       HIS   3  -3.481  11.432   8.076
   25    HD2  HIS   3          2HD       HIS   3  -6.443  11.024   5.166
   26    HE1  HIS   3          1HE       HIS   3  -5.440  12.849   8.840
   27    HE2  HIS   3          2HE       HIS   3  -7.247  12.608   7.076
   28    H    ALA   4           H        ALA   4  -0.580  11.430   3.543
   29    HA   ALA   4           HA       ALA   4  -0.026   8.887   2.396
   30    HB1  ALA   4          1HB       ALA   4   0.823  10.780   1.246
   31    HB2  ALA   4          2HB       ALA   4   2.253   9.971   1.887
   32    HB3  ALA   4          3HB       ALA   4   1.615  11.403   2.694
   33    H    SER   5           H        SER   5   1.149  10.416   5.347
   34    HA   SER   5           HA       SER   5   3.367   8.729   5.861
   35    HB2  SER   5          2HB       SER   5   1.459   9.883   7.911
   36    HB3  SER   5          1HB       SER   5   3.121   9.375   8.197
   37    HG   SER   5           HG       SER   5   3.739  11.245   7.486
   38    H    VAL   6           H        VAL   6  -0.088   8.227   6.493
   39    HA   VAL   6           HA       VAL   6   0.220   5.830   8.033
   40    HB   VAL   6           HB       VAL   6  -2.050   6.798   6.293
   41   HG11  VAL   6          1HG1      VAL   6  -1.602   4.239   7.661
   42   HG12  VAL   6          2HG1      VAL   6  -2.800   4.662   6.437
   43   HG13  VAL   6          3HG1      VAL   6  -3.104   5.031   8.135
   44   HG21  VAL   6          1HG2      VAL   6  -2.340   6.598   9.218
   45   HG22  VAL   6          2HG2      VAL   6  -2.786   7.915   8.135
   46   HG23  VAL   6          3HG2      VAL   6  -1.121   7.760   8.696
   47    H    ILE   7           H        ILE   7  -0.085   6.419   4.559
   48    HA   ILE   7           HA       ILE   7  -0.311   3.712   3.735
   49    HB   ILE   7           HB       ILE   7   1.010   6.045   2.323
   50   HG12  ILE   7          2HG1      ILE   7  -1.791   4.912   2.052
   51   HG13  ILE   7          1HG1      ILE   7  -1.396   6.323   3.035
   52   HG21  ILE   7          1HG2      ILE   7   0.151   3.293   1.416
   53   HG22  ILE   7          2HG2      ILE   7   1.713   4.080   1.187
   54   HG23  ILE   7          3HG2      ILE   7   0.304   4.636   0.282
   55   HD11  ILE   7          1HD1      ILE   7  -1.265   6.016   0.045
   56   HD12  ILE   7          2HD1      ILE   7  -0.288   7.232   0.863
   57   HD13  ILE   7          3HD1      ILE   7  -2.044   7.281   0.995
   58    H    ALA   8           H        ALA   8   2.557   5.697   4.419
   59    HA   ALA   8           HA       ALA   8   4.492   3.764   3.569
   60    HB1  ALA   8          1HB       ALA   8   4.905   5.680   5.867
   61    HB2  ALA   8          2HB       ALA   8   4.867   6.240   4.195
   62    HB3  ALA   8          3HB       ALA   8   6.099   5.088   4.712
   63    H    GLN   9           H        GLN   9   3.103   4.449   6.775
   64    HA   GLN   9           HA       GLN   9   4.457   2.252   8.054
   65    HB2  GLN   9          2HB       GLN   9   3.502   3.010   9.976
   66    HB3  GLN   9          1HB       GLN   9   3.140   4.427   8.996
   67    HG2  GLN   9          2HG       GLN   9   1.076   3.881   9.996
   68    HG3  GLN   9          1HG       GLN   9   0.954   3.193   8.384
   69   HE21  GLN   9          1HE2      GLN   9  -0.328   1.341   8.786
   70   HE22  GLN   9          2HE2      GLN   9   0.101   0.117   9.881
   71    H    PHE  10           H        PHE  10   1.403   2.595   6.376
   72    HA   PHE  10           HA       PHE  10   0.128   0.224   7.246
   73    HB2  PHE  10          2HB       PHE  10  -0.846   2.062   5.798
   74    HB3  PHE  10          1HB       PHE  10   0.033   1.363   4.442
   75    HD1  PHE  10          1HD       PHE  10  -2.603   0.727   6.973
   76    HD2  PHE  10          2HD       PHE  10  -0.723  -0.641   3.361
   77    HE1  PHE  10          1HE       PHE  10  -4.443  -0.899   6.631
   78    HE2  PHE  10          2HE       PHE  10  -2.564  -2.268   3.020
   79    HZ   PHE  10           HZ       PHE  10  -4.423  -2.394   4.655
   80    H    VAL  11           H        VAL  11   2.243   0.689   4.388
   81    HA   VAL  11           HA       VAL  11   2.287  -2.145   3.795
   82    HB   VAL  11           HB       VAL  11   4.039  -1.532   2.169
   83   HG11  VAL  11          1HG1      VAL  11   2.400  -0.801   0.809
   84   HG12  VAL  11          2HG1      VAL  11   2.295   0.732   1.676
   85   HG13  VAL  11          3HG1      VAL  11   1.373  -0.663   2.236
   86   HG21  VAL  11          1HG2      VAL  11   4.576   0.951   1.996
   87   HG22  VAL  11          2HG2      VAL  11   5.298   0.121   3.374
   88   HG23  VAL  11          3HG2      VAL  11   3.868   1.128   3.600
   89    H    VAL  12           H        VAL  12   4.627   0.080   5.324
   90    HA   VAL  12           HA       VAL  12   6.687  -1.861   5.713
   91    HB   VAL  12           HB       VAL  12   6.048   0.673   7.220
   92   HG11  VAL  12          1HG1      VAL  12   7.414  -0.469   8.737
   93   HG12  VAL  12          2HG1      VAL  12   8.602   0.394   7.761
   94   HG13  VAL  12          3HG1      VAL  12   8.288  -1.315   7.459
   95   HG21  VAL  12          1HG2      VAL  12   7.222   0.089   4.656
   96   HG22  VAL  12          2HG2      VAL  12   8.443   0.809   5.705
   97   HG23  VAL  12          3HG2      VAL  12   6.930   1.662   5.398
   98    H    GLU  13           H        GLU  13   3.910  -0.990   7.721
   99    HA   GLU  13           HA       GLU  13   4.694  -2.311  10.098
  100    HB2  GLU  13          2HB       GLU  13   2.704  -0.835   9.912
  101    HB3  GLU  13          1HB       GLU  13   1.895  -2.089   8.982
  102    HG2  GLU  13          2HG       GLU  13   2.186  -3.651  10.907
  103    HG3  GLU  13          1HG       GLU  13   2.864  -2.314  11.832
  104    H    GLU  14           H        GLU  14   3.318  -3.584   7.130
  105    HA   GLU  14           HA       GLU  14   2.644  -6.178   8.135
  106    HB2  GLU  14          2HB       GLU  14   1.845  -5.237   5.964
  107    HB3  GLU  14          1HB       GLU  14   3.474  -5.438   5.319
  108    HG2  GLU  14          2HG       GLU  14   3.344  -7.870   5.841
  109    HG3  GLU  14          1HG       GLU  14   1.678  -7.640   6.372
  110    H    PHE  15           H        PHE  15   5.687  -4.819   6.960
  111    HA   PHE  15           HA       PHE  15   6.932  -7.520   7.269
  112    HB2  PHE  15          2HB       PHE  15   8.104  -5.109   5.872
  113    HB3  PHE  15          1HB       PHE  15   8.652  -6.783   5.772
  114    HD1  PHE  15          1HD       PHE  15   7.331  -8.477   4.552
  115    HD2  PHE  15          2HD       PHE  15   6.140  -4.357   4.698
  116    HE1  PHE  15          1HE       PHE  15   5.731  -8.874   2.698
  117    HE2  PHE  15          2HE       PHE  15   4.539  -4.746   2.851
  118    HZ   PHE  15           HZ       PHE  15   4.334  -7.010   1.847
  119    H    LEU  16           H        LEU  16   7.821  -4.072   7.844
  120    HA   LEU  16           HA       LEU  16   9.376  -5.053  10.213
  121    HB2  LEU  16          2HB       LEU  16  10.198  -3.513   7.904
  122    HB3  LEU  16          1HB       LEU  16  10.505  -2.625   9.393
  123    HG   LEU  16           HG       LEU  16  11.323  -5.508   8.947
  124   HD11  LEU  16          1HD1      LEU  16  12.952  -2.954   8.769
  125   HD12  LEU  16          2HD1      LEU  16  12.561  -4.030   7.428
  126   HD13  LEU  16          3HD1      LEU  16  13.619  -4.586   8.725
  127   HD21  LEU  16          1HD2      LEU  16  11.088  -3.899  11.271
  128   HD22  LEU  16          2HD2      LEU  16  12.813  -4.028  10.926
  129   HD23  LEU  16          3HD2      LEU  16  11.845  -5.488  11.140
  130    HA   PRO  17           HA       PRO  17   6.640  -1.799  11.903
  131    HB2  PRO  17          2HB       PRO  17   5.466  -3.326  13.827
  132    HB3  PRO  17          1HB       PRO  17   4.891  -3.281  12.153
  133    HG2  PRO  17          2HG       PRO  17   6.253  -5.418  13.581
  134    HG3  PRO  17          1HG       PRO  17   5.331  -5.474  12.073
  135    HD2  PRO  17          2HD       PRO  17   8.220  -5.393  12.410
  136    HD3  PRO  17          1HD       PRO  17   7.284  -5.596  10.912
  137    H    ASP  18           H        ASP  18   9.079  -3.857  13.219
  138    HA   ASP  18           HA       ASP  18   9.118  -2.720  15.893
  139    HB2  ASP  18          2HB       ASP  18  11.132  -4.347  14.337
  140    HB3  ASP  18          1HB       ASP  18  11.343  -3.879  16.020
  141    H    VAL  19           H        VAL  19   9.901  -1.482  12.920
  142    HA   VAL  19           HA       VAL  19  11.980   0.342  14.070
  143    HB   VAL  19           HB       VAL  19  12.647  -1.055  12.054
  144   HG11  VAL  19          1HG1      VAL  19  10.849   0.785  10.486
  145   HG12  VAL  19          2HG1      VAL  19  10.257  -0.769  11.077
  146   HG13  VAL  19          3HG1      VAL  19  11.623  -0.712   9.963
  147   HG21  VAL  19          1HG2      VAL  19  13.808   1.036  12.549
  148   HG22  VAL  19          2HG2      VAL  19  12.535   1.963  11.756
  149   HG23  VAL  19          3HG2      VAL  19  13.577   0.904  10.806
  150    H    ALA  20           H        ALA  20  11.583   2.623  13.784
  151    HA   ALA  20           HA       ALA  20   8.848   3.391  13.772
  152    HB1  ALA  20          1HB       ALA  20  10.163   5.677  12.989
  153    HB2  ALA  20          2HB       ALA  20  11.454   4.754  13.759
  154    HB3  ALA  20          3HB       ALA  20   9.989   5.142  14.660
  155    HA   PRO  21           HA       PRO  21   8.444   2.890   9.289
  156    HB2  PRO  21          2HB       PRO  21   5.765   3.775   9.259
  157    HB3  PRO  21          1HB       PRO  21   6.336   2.101   9.303
  158    HG2  PRO  21          2HG       PRO  21   5.126   3.672  11.402
  159    HG3  PRO  21          1HG       PRO  21   5.449   1.934  11.340
  160    HD2  PRO  21          2HD       PRO  21   6.840   3.894  12.859
  161    HD3  PRO  21          1HD       PRO  21   7.255   2.180  12.678
  162    H    ALA  22           H        ALA  22   7.448   5.760  11.080
  163    HA   ALA  22           HA       ALA  22   7.334   7.492   8.753
  164    HB1  ALA  22          1HB       ALA  22   6.486   7.753  11.327
  165    HB2  ALA  22          2HB       ALA  22   6.713   9.120  10.237
  166    HB3  ALA  22          3HB       ALA  22   7.978   8.691  11.388
  167    H    ASP  23           H        ASP  23   9.848   6.095  10.571
  168    HA   ASP  23           HA       ASP  23  11.811   8.197   9.879
  169    HB2  ASP  23          2HB       ASP  23  12.065   5.592  11.415
  170    HB3  ASP  23          1HB       ASP  23  13.405   6.702  11.121
  171    H    VAL  24           H        VAL  24  10.355   5.884   8.186
  172    HA   VAL  24           HA       VAL  24  12.792   4.782   6.902
  173    HB   VAL  24           HB       VAL  24   9.866   4.211   6.330
  174   HG11  VAL  24          1HG1      VAL  24  12.461   2.915   5.460
  175   HG12  VAL  24          2HG1      VAL  24  11.228   3.641   4.430
  176   HG13  VAL  24          3HG1      VAL  24  10.888   2.136   5.286
  177   HG21  VAL  24          1HG2      VAL  24  10.620   3.588   8.646
  178   HG22  VAL  24          2HG2      VAL  24  11.871   2.579   7.919
  179   HG23  VAL  24          3HG2      VAL  24  10.169   2.197   7.661
  180    H    ASP  25           H        ASP  25  13.440   5.451   4.871
  181    HA   ASP  25           HA       ASP  25  12.549   7.971   3.887
  182    HB2  ASP  25          2HB       ASP  25  14.072   5.743   2.507
  183    HB3  ASP  25          1HB       ASP  25  13.852   7.355   1.827
  184    H    VAL  26           H        VAL  26  10.257   7.874   3.639
  185    HA   VAL  26           HA       VAL  26   8.843   5.885   2.186
  186    HB   VAL  26           HB       VAL  26   8.049   7.978   3.624
  187   HG11  VAL  26          1HG1      VAL  26   7.373   9.858   2.352
  188   HG12  VAL  26          2HG1      VAL  26   7.582   9.004   0.824
  189   HG13  VAL  26          3HG1      VAL  26   8.994   9.497   1.758
  190   HG21  VAL  26          1HG2      VAL  26   6.642   6.116   2.746
  191   HG22  VAL  26          2HG2      VAL  26   6.499   6.981   1.217
  192   HG23  VAL  26          3HG2      VAL  26   5.815   7.672   2.688
  193    H    ASP  27           H        ASP  27  11.319   7.613   0.989
  194    HA   ASP  27           HA       ASP  27  10.088   8.142  -1.662
  195    HB2  ASP  27          2HB       ASP  27  12.830   8.790  -0.532
  196    HB3  ASP  27          1HB       ASP  27  12.321   9.168  -2.179
  197    H    LEU  28           H        LEU  28  11.061   5.492  -0.211
  198    HA   LEU  28           HA       LEU  28  12.961   4.487  -2.232
  199    HB2  LEU  28          2HB       LEU  28  13.181   3.882   0.186
  200    HB3  LEU  28          1HB       LEU  28  11.650   3.019   0.068
  201    HG   LEU  28           HG       LEU  28  12.645   1.651  -1.796
  202   HD11  LEU  28          1HD1      LEU  28  15.369   1.862  -1.309
  203   HD12  LEU  28          2HD1      LEU  28  14.835   3.542  -1.327
  204   HD13  LEU  28          3HD1      LEU  28  14.527   2.505  -2.718
  205   HD21  LEU  28          1HD2      LEU  28  14.525   0.766   0.050
  206   HD22  LEU  28          2HD2      LEU  28  12.831   0.276  -0.008
  207   HD23  LEU  28          3HD2      LEU  28  13.333   1.597   1.049
  208    H    ASP  29           H        ASP  29  12.391   3.223  -3.932
  209    HA   ASP  29           HA       ASP  29   9.638   2.988  -4.687
  210    HB2  ASP  29          2HB       ASP  29  12.126   1.576  -5.693
  211    HB3  ASP  29          1HB       ASP  29  10.543   1.428  -6.457
  212    H    LEU  30           H        LEU  30   8.171   1.554  -3.902
  213    HA   LEU  30           HA       LEU  30   8.865  -0.481  -2.029
  214    HB2  LEU  30          2HB       LEU  30   6.364  -0.327  -3.749
  215    HB3  LEU  30          1HB       LEU  30   6.546  -1.259  -2.263
  216    HG   LEU  30           HG       LEU  30   6.692   1.758  -2.515
  217   HD11  LEU  30          1HD1      LEU  30   4.763   1.028  -0.649
  218   HD12  LEU  30          2HD1      LEU  30   4.565  -0.166  -1.933
  219   HD13  LEU  30          3HD1      LEU  30   4.448   1.556  -2.302
  220   HD21  LEU  30          1HD2      LEU  30   7.374  -0.166  -0.319
  221   HD22  LEU  30          2HD2      LEU  30   6.627   1.371   0.114
  222   HD23  LEU  30          3HD2      LEU  30   8.159   1.350  -0.759
  223    H    VAL  31           H        VAL  31   9.354  -0.379  -5.348
  224    HA   VAL  31           HA       VAL  31   8.719  -2.929  -6.296
  225    HB   VAL  31           HB       VAL  31   9.870  -1.006  -7.552
  226   HG11  VAL  31          1HG1      VAL  31  12.262  -0.917  -7.530
  227   HG12  VAL  31          2HG1      VAL  31  12.376  -2.399  -6.582
  228   HG13  VAL  31          3HG1      VAL  31  11.762  -0.922  -5.839
  229   HG21  VAL  31          1HG2      VAL  31   9.436  -3.238  -8.542
  230   HG22  VAL  31          2HG2      VAL  31  10.967  -3.818  -7.886
  231   HG23  VAL  31          3HG2      VAL  31  10.957  -2.561  -9.123
  232    H    ASP  32           H        ASP  32  11.499  -1.944  -4.319
  233    HA   ASP  32           HA       ASP  32  12.832  -4.469  -4.275
  234    HB2  ASP  32          2HB       ASP  32  12.647  -2.304  -2.149
  235    HB3  ASP  32          1HB       ASP  32  13.753  -3.676  -2.070
  236    H    ASN  33           H        ASN  33  10.142  -3.132  -2.470
  237    HA   ASN  33           HA       ASN  33   9.828  -5.531  -0.809
  238    HB2  ASN  33          2HB       ASN  33   8.084  -3.082  -1.117
  239    HB3  ASN  33          1HB       ASN  33   7.845  -4.354   0.080
  240   HD21  ASN  33          1HD2      ASN  33   8.494  -1.490   0.570
  241   HD22  ASN  33          2HD2      ASN  33   9.949  -1.486   1.443
  242    H    GLY  34           H        GLY  34   9.523  -5.301  -3.887
  243    HA2  GLY  34          2HA       GLY  34   6.968  -5.596  -4.841
  244    HA3  GLY  34          1HA       GLY  34   8.288  -6.616  -5.414
  245    H    VAL  35           H        VAL  35   8.409  -7.524  -2.403
  246    HA   VAL  35           HA       VAL  35   7.080 -10.007  -2.733
  247    HB   VAL  35           HB       VAL  35   7.743  -8.447  -0.216
  248   HG11  VAL  35          1HG1      VAL  35   7.477 -10.704   0.903
  249   HG12  VAL  35          2HG1      VAL  35   6.700 -11.269  -0.576
  250   HG13  VAL  35          3HG1      VAL  35   5.967  -9.969   0.364
  251   HG21  VAL  35          1HG2      VAL  35   9.745  -9.624  -0.191
  252   HG22  VAL  35          2HG2      VAL  35   9.494  -9.475  -1.931
  253   HG23  VAL  35          3HG2      VAL  35   9.080 -10.977  -1.106
  254    H    ILE  36           H        ILE  36   5.964  -6.920  -1.425
  255    HA   ILE  36           HA       ILE  36   3.353  -7.853  -0.607
  256    HB   ILE  36           HB       ILE  36   4.642  -5.668   0.038
  257   HG12  ILE  36          2HG1      ILE  36   1.680  -5.699  -0.622
  258   HG13  ILE  36          1HG1      ILE  36   2.423  -6.202   0.894
  259   HG21  ILE  36          1HG2      ILE  36   3.031  -4.572  -2.260
  260   HG22  ILE  36          2HG2      ILE  36   4.709  -5.066  -2.487
  261   HG23  ILE  36          3HG2      ILE  36   4.315  -3.785  -1.342
  262   HD11  ILE  36          1HD1      ILE  36   1.695  -4.007   1.349
  263   HD12  ILE  36          2HD1      ILE  36   2.185  -3.423  -0.241
  264   HD13  ILE  36          3HD1      ILE  36   3.406  -3.806   0.973
  265    H    ASP  37           H        ASP  37   4.730  -6.793  -3.627
  266    HA   ASP  37           HA       ASP  37   2.352  -5.984  -4.958
  267    HB2  ASP  37          2HB       ASP  37   4.884  -7.207  -6.079
  268    HB3  ASP  37          1HB       ASP  37   3.608  -6.495  -7.062
  269    H    SER  38           H        SER  38   3.644  -9.228  -4.385
  270    HA   SER  38           HA       SER  38   1.462 -10.321  -6.092
  271    HB2  SER  38          2HB       SER  38   4.167 -11.225  -5.376
  272    HB3  SER  38          1HB       SER  38   2.943 -12.489  -5.327
  273    H    LEU  39           H        LEU  39   3.023 -11.353  -3.036
  274    HA   LEU  39           HA       LEU  39   0.638 -12.761  -2.219
  275    HB2  LEU  39          2HB       LEU  39   2.982 -11.956  -0.510
  276    HB3  LEU  39          1HB       LEU  39   1.834 -13.249  -0.187
  277    HG   LEU  39           HG       LEU  39   3.893 -13.118  -2.387
  278   HD11  LEU  39          1HD1      LEU  39   3.920 -14.156   0.197
  279   HD12  LEU  39          2HD1      LEU  39   5.053 -14.550  -1.095
  280   HD13  LEU  39          3HD1      LEU  39   3.629 -15.557  -0.831
  281   HD21  LEU  39          1HD2      LEU  39   1.460 -14.877  -2.075
  282   HD22  LEU  39          2HD2      LEU  39   2.888 -15.444  -2.942
  283   HD23  LEU  39          3HD2      LEU  39   2.018 -14.020  -3.513
  284    H    GLY  40           H        GLY  40   2.214  -9.834  -0.927
  285    HA2  GLY  40          2HA       GLY  40   0.126  -9.265   0.949
  286    HA3  GLY  40          1HA       GLY  40   1.306  -8.095   0.364
  287    H    LEU  41           H        LEU  41   0.635  -8.351  -2.420
  288    HA   LEU  41           HA       LEU  41  -1.433  -6.403  -2.615
  289    HB2  LEU  41          2HB       LEU  41   0.352  -6.899  -4.334
  290    HB3  LEU  41          1HB       LEU  41  -0.569  -8.329  -4.789
  291    HG   LEU  41           HG       LEU  41  -2.099  -5.782  -4.681
  292   HD11  LEU  41          1HD1      LEU  41  -1.266  -4.983  -6.808
  293   HD12  LEU  41          2HD1      LEU  41  -0.188  -6.369  -6.960
  294   HD13  LEU  41          3HD1      LEU  41   0.110  -5.151  -5.721
  295   HD21  LEU  41          1HD2      LEU  41  -2.737  -8.238  -5.489
  296   HD22  LEU  41          2HD2      LEU  41  -1.994  -7.691  -6.989
  297   HD23  LEU  41          3HD2      LEU  41  -3.374  -6.822  -6.322
  298    H    LEU  42           H        LEU  42  -1.475  -9.924  -2.986
  299    HA   LEU  42           HA       LEU  42  -4.188 -10.147  -3.852
  300    HB2  LEU  42          2HB       LEU  42  -2.519 -12.022  -3.874
  301    HB3  LEU  42          1HB       LEU  42  -2.643 -12.097  -2.123
  302    HG   LEU  42           HG       LEU  42  -5.128 -12.444  -2.386
  303   HD11  LEU  42          1HD1      LEU  42  -5.968 -12.039  -4.436
  304   HD12  LEU  42          2HD1      LEU  42  -5.207 -13.541  -4.957
  305   HD13  LEU  42          3HD1      LEU  42  -4.360 -12.009  -5.155
  306   HD21  LEU  42          1HD2      LEU  42  -3.171 -14.435  -3.565
  307   HD22  LEU  42          2HD2      LEU  42  -4.847 -14.836  -3.189
  308   HD23  LEU  42          3HD2      LEU  42  -3.744 -14.355  -1.899
  309    H    LYS  43           H        LYS  43  -2.737 -10.135  -0.600
  310    HA   LYS  43           HA       LYS  43  -5.255 -10.419   0.781
  311    HB2  LYS  43          2HB       LYS  43  -2.578  -9.356   1.695
  312    HB3  LYS  43          1HB       LYS  43  -3.934  -9.690   2.765
  313    HG2  LYS  43          2HG       LYS  43  -3.936 -12.054   1.966
  314    HG3  LYS  43          1HG       LYS  43  -2.499 -11.698   1.007
  315    HD2  LYS  43          2HD       LYS  43  -1.321 -11.010   3.098
  316    HD3  LYS  43          1HD       LYS  43  -2.740 -11.503   4.022
  317    HE2  LYS  43          2HE       LYS  43  -1.487 -13.450   4.135
  318    HE3  LYS  43          1HE       LYS  43  -2.421 -13.764   2.672
  319    HZ1  LYS  43          1HZ       LYS  43   0.358 -13.559   2.947
  320    HZ2  LYS  43          2HZ       LYS  43  -0.165 -12.278   1.962
  321    HZ3  LYS  43          3HZ       LYS  43  -0.538 -13.882   1.544
  322    H    VAL  44           H        VAL  44  -3.259  -7.639  -0.162
  323    HA   VAL  44           HA       VAL  44  -4.807  -5.656   1.206
  324    HB   VAL  44           HB       VAL  44  -3.034  -5.476  -1.240
  325   HG11  VAL  44          1HG1      VAL  44  -3.011  -2.999  -0.579
  326   HG12  VAL  44          2HG1      VAL  44  -4.443  -3.353   0.387
  327   HG13  VAL  44          3HG1      VAL  44  -4.480  -3.584  -1.361
  328   HG21  VAL  44          1HG2      VAL  44  -2.418  -5.955   1.413
  329   HG22  VAL  44          2HG2      VAL  44  -2.240  -4.205   1.287
  330   HG23  VAL  44          3HG2      VAL  44  -1.313  -5.263   0.224
  331    H    ILE  45           H        ILE  45  -4.956  -6.831  -2.164
  332    HA   ILE  45           HA       ILE  45  -7.049  -5.074  -2.987
  333    HB   ILE  45           HB       ILE  45  -5.837  -7.598  -3.985
  334   HG12  ILE  45          2HG1      ILE  45  -5.570  -6.281  -5.989
  335   HG13  ILE  45          1HG1      ILE  45  -6.715  -5.072  -5.409
  336   HG21  ILE  45          1HG2      ILE  45  -8.100  -8.286  -4.232
  337   HG22  ILE  45          2HG2      ILE  45  -7.642  -7.632  -5.804
  338   HG23  ILE  45          3HG2      ILE  45  -8.622  -6.668  -4.700
  339   HD11  ILE  45          1HD1      ILE  45  -4.355  -5.663  -3.683
  340   HD12  ILE  45          2HD1      ILE  45  -5.202  -4.138  -3.944
  341   HD13  ILE  45          3HD1      ILE  45  -4.073  -4.737  -5.158
  342    H    ALA  46           H        ALA  46  -7.145  -8.374  -1.645
  343    HA   ALA  46           HA       ALA  46  -9.983  -8.686  -1.799
  344    HB1  ALA  46          1HB       ALA  46  -8.884 -10.688  -1.358
  345    HB2  ALA  46          2HB       ALA  46  -9.459 -10.267   0.256
  346    HB3  ALA  46          3HB       ALA  46  -7.785  -9.944  -0.196
  347    H    TRP  47           H        TRP  47  -7.883  -7.432   0.790
  348    HA   TRP  47           HA       TRP  47 -10.115  -6.918   2.586
  349    HB2  TRP  47          2HB       TRP  47  -8.174  -7.169   3.802
  350    HB3  TRP  47          1HB       TRP  47  -7.175  -6.400   2.570
  351    HD1  TRP  47           HD       TRP  47  -9.560  -5.567   5.447
  352    HE1  TRP  47          1HE       TRP  47  -9.167  -3.118   6.148
  353    HE3  TRP  47          3HE       TRP  47  -6.329  -4.104   1.781
  354    HZ2  TRP  47          2HZ       TRP  47  -7.673  -0.839   5.272
  355    HZ3  TRP  47          3HZ       TRP  47  -5.433  -1.797   1.737
  356    HH2  TRP  47           HH       TRP  47  -6.100  -0.165   3.473
  357    H    LEU  48           H        LEU  48  -8.092  -4.917   0.440
  358    HA   LEU  48           HA       LEU  48  -9.176  -2.398   1.118
  359    HB2  LEU  48          2HB       LEU  48  -7.172  -2.807  -0.340
  360    HB3  LEU  48          1HB       LEU  48  -8.261  -3.296  -1.626
  361    HG   LEU  48           HG       LEU  48  -9.404  -0.988  -1.181
  362   HD11  LEU  48          1HD1      LEU  48  -7.528  -0.875   0.794
  363   HD12  LEU  48          2HD1      LEU  48  -8.273   0.545   0.064
  364   HD13  LEU  48          3HD1      LEU  48  -6.701  -0.019  -0.503
  365   HD21  LEU  48          1HD2      LEU  48  -8.343  -1.457  -3.282
  366   HD22  LEU  48          2HD2      LEU  48  -6.739  -1.412  -2.551
  367   HD23  LEU  48          3HD2      LEU  48  -7.672   0.074  -2.723
  368    H    GLU  49           H        GLU  49 -10.227  -4.679  -1.434
  369    HA   GLU  49           HA       GLU  49 -12.456  -3.044  -2.256
  370    HB2  GLU  49          2HB       GLU  49 -11.952  -4.598  -3.893
  371    HB3  GLU  49          1HB       GLU  49 -11.571  -5.860  -2.734
  372    HG2  GLU  49          2HG       GLU  49 -13.890  -6.265  -2.287
  373    HG3  GLU  49          1HG       GLU  49 -14.376  -4.839  -3.196
  374    H    ASP  50           H        ASP  50 -12.061  -5.689   0.047
  375    HA   ASP  50           HA       ASP  50 -14.817  -5.984   0.740
  376    HB2  ASP  50          2HB       ASP  50 -12.254  -6.533   2.207
  377    HB3  ASP  50          1HB       ASP  50 -13.816  -6.963   2.867
  378    H    ARG  51           H        ARG  51 -12.232  -3.945   2.057
  379    HA   ARG  51           HA       ARG  51 -13.660  -2.940   4.297
  380    HB2  ARG  51          2HB       ARG  51 -11.209  -2.681   3.927
  381    HB3  ARG  51          1HB       ARG  51 -11.556  -1.490   2.672
  382    HG2  ARG  51          2HG       ARG  51 -12.759  -0.104   4.332
  383    HG3  ARG  51          1HG       ARG  51 -12.375  -1.284   5.585
  384    HD2  ARG  51          2HD       ARG  51  -9.952  -0.922   5.139
  385    HD3  ARG  51          1HD       ARG  51 -10.379   0.326   3.969
  386    HE   ARG  51           HE       ARG  51 -11.581   0.825   6.561
  387   HH11  ARG  51          1HH1      ARG  51 -10.742   2.566   7.731
  388   HH12  ARG  51          2HH1      ARG  51  -9.207   3.233   7.284
  389   HH21  ARG  51          1HH2      ARG  51  -8.715   1.027   4.653
  390   HH22  ARG  51          2HH2      ARG  51  -8.060   2.361   5.542
  391    H    PHE  52           H        PHE  52 -13.429  -1.596   0.973
  392    HA   PHE  52           HA       PHE  52 -15.640   0.267   1.737
  393    HB2  PHE  52          2HB       PHE  52 -13.336   0.521  -0.176
  394    HB3  PHE  52          1HB       PHE  52 -14.783   1.504  -0.380
  395    HD1  PHE  52          1HD       PHE  52 -11.794   0.926   1.629
  396    HD2  PHE  52          2HD       PHE  52 -15.531   3.036   1.438
  397    HE1  PHE  52          1HE       PHE  52 -11.027   2.453   3.430
  398    HE2  PHE  52          2HE       PHE  52 -14.763   4.561   3.235
  399    HZ   PHE  52           HZ       PHE  52 -12.514   4.270   4.232
  400    H    GLY  53           H        GLY  53 -15.132  -2.564   0.071
  401    HA2  GLY  53          2HA       GLY  53 -16.551  -3.729  -1.404
  402    HA3  GLY  53          1HA       GLY  53 -17.723  -2.428  -1.194
  403    H    ILE  54           H        ILE  54 -14.398  -2.080  -2.379
  404    HA   ILE  54           HA       ILE  54 -15.501  -0.822  -4.833
  405    HB   ILE  54           HB       ILE  54 -12.645  -0.948  -3.815
  406   HG12  ILE  54          2HG1      ILE  54 -14.610   1.357  -3.687
  407   HG13  ILE  54          1HG1      ILE  54 -14.308   0.265  -2.334
  408   HG21  ILE  54          1HG2      ILE  54 -12.805  -0.559  -6.232
  409   HG22  ILE  54          2HG2      ILE  54 -12.316   0.925  -5.415
  410   HG23  ILE  54          3HG2      ILE  54 -13.980   0.728  -5.964
  411   HD11  ILE  54          1HD1      ILE  54 -11.923   0.862  -2.369
  412   HD12  ILE  54          2HD1      ILE  54 -12.919   2.302  -2.164
  413   HD13  ILE  54          3HD1      ILE  54 -12.205   1.941  -3.735
  414    H    ALA  55           H        ALA  55 -15.057  -1.656  -6.899
  415    HA   ALA  55           HA       ALA  55 -14.634  -4.468  -7.126
  416    HB1  ALA  55          1HB       ALA  55 -14.368  -3.995  -9.572
  417    HB2  ALA  55          2HB       ALA  55 -14.361  -2.271  -9.200
  418    HB3  ALA  55          3HB       ALA  55 -15.800  -3.236  -8.875
  419    H    ALA  56           H        ALA  56 -12.784  -5.663  -7.496
  420    HA   ALA  56           HA       ALA  56 -10.255  -4.591  -6.713
  421    HB1  ALA  56          1HB       ALA  56 -10.872  -7.013  -6.607
  422    HB2  ALA  56          2HB       ALA  56  -9.332  -6.736  -7.419
  423    HB3  ALA  56          3HB       ALA  56 -10.779  -7.080  -8.366
  424    H    ASP  57           H        ASP  57 -11.805  -4.977  -9.852
  425    HA   ASP  57           HA       ASP  57  -9.561  -4.605 -11.536
  426    HB2  ASP  57          2HB       ASP  57 -12.439  -3.755 -11.890
  427    HB3  ASP  57          1HB       ASP  57 -11.234  -3.677 -13.174
  428    H    ASP  58           H        ASP  58 -11.572  -2.220  -9.842
  429    HA   ASP  58           HA       ASP  58 -10.601   0.128 -11.065
  430    HB2  ASP  58          2HB       ASP  58 -12.444  -0.028  -9.337
  431    HB3  ASP  58          1HB       ASP  58 -11.180  -0.163  -8.117
  432    H    VAL  59           H        VAL  59  -9.182  -1.848  -8.501
  433    HA   VAL  59           HA       VAL  59  -7.032  -0.084  -7.844
  434    HB   VAL  59           HB       VAL  59  -7.241  -3.092  -7.679
  435   HG11  VAL  59          1HG1      VAL  59  -5.030  -1.221  -7.108
  436   HG12  VAL  59          2HG1      VAL  59  -4.985  -2.961  -7.397
  437   HG13  VAL  59          3HG1      VAL  59  -5.404  -2.343  -5.799
  438   HG21  VAL  59          1HG2      VAL  59  -7.510  -2.500  -5.213
  439   HG22  VAL  59          2HG2      VAL  59  -8.859  -2.040  -6.253
  440   HG23  VAL  59          3HG2      VAL  59  -7.694  -0.824  -5.729
  441    H    GLU  60           H        GLU  60  -7.387  -2.581 -10.319
  442    HA   GLU  60           HA       GLU  60  -6.067  -3.095 -12.182
  443    HB2  GLU  60          2HB       GLU  60  -6.432  -0.675 -12.656
  444    HB3  GLU  60          1HB       GLU  60  -4.965  -0.304 -11.759
  445    HG2  GLU  60          2HG       GLU  60  -3.681  -1.748 -13.295
  446    HG3  GLU  60          1HG       GLU  60  -5.149  -2.047 -14.216
  447    H    LEU  61           H        LEU  61  -4.303  -4.394 -12.237
  448    HA   LEU  61           HA       LEU  61  -2.209  -3.962 -10.170
  449    HB2  LEU  61          2HB       LEU  61  -2.645  -6.420 -11.880
  450    HB3  LEU  61          1HB       LEU  61  -1.693  -6.295 -10.403
  451    HG   LEU  61           HG       LEU  61  -4.690  -6.081 -10.672
  452   HD11  LEU  61          1HD1      LEU  61  -2.810  -7.983  -9.261
  453   HD12  LEU  61          2HD1      LEU  61  -3.948  -8.360 -10.555
  454   HD13  LEU  61          3HD1      LEU  61  -4.545  -7.937  -8.951
  455   HD21  LEU  61          1HD2      LEU  61  -4.206  -4.417  -9.081
  456   HD22  LEU  61          2HD2      LEU  61  -2.829  -5.310  -8.434
  457   HD23  LEU  61          3HD2      LEU  61  -4.471  -5.850  -8.087
  458    H    SER  62           H        SER  62  -0.131  -3.472 -10.772
  459    HA   SER  62           HA       SER  62   1.002  -4.184 -13.306
  460    HB2  SER  62          2HB       SER  62  -0.648  -1.950 -13.448
  461    HB3  SER  62          1HB       SER  62   0.963  -1.261 -13.277
  462    HG   SER  62           HG       SER  62   0.800  -1.629 -15.405
  463    HA   PRO  63           HA       PRO  63   4.482  -3.462 -10.611
  464    HB2  PRO  63          2HB       PRO  63   6.467  -3.236 -12.535
  465    HB3  PRO  63          1HB       PRO  63   5.841  -4.770 -11.907
  466    HG2  PRO  63          2HG       PRO  63   5.220  -3.367 -14.444
  467    HG3  PRO  63          1HG       PRO  63   5.336  -5.102 -14.106
  468    HD2  PRO  63          2HD       PRO  63   2.951  -3.807 -14.382
  469    HD3  PRO  63          1HD       PRO  63   3.154  -5.237 -13.346
  470    H    GLU  64           H        GLU  64   3.771  -1.328 -13.287
  471    HA   GLU  64           HA       GLU  64   5.611   0.773 -12.621
  472    HB2  GLU  64          2HB       GLU  64   2.972   0.850 -14.085
  473    HB3  GLU  64          1HB       GLU  64   4.104   2.192 -14.012
  474    HG2  GLU  64          2HG       GLU  64   5.839   0.751 -15.033
  475    HG3  GLU  64          1HG       GLU  64   4.655  -0.543 -15.169
  476    H    HIS  65           H        HIS  65   2.421  -0.098 -11.494
  477    HA   HIS  65           HA       HIS  65   1.798   2.383 -10.181
  478    HB2  HIS  65          2HB       HIS  65   0.126   0.631 -10.760
  479    HB3  HIS  65          1HB       HIS  65   0.826  -0.411  -9.524
  480    HD1  HIS  65          1HD       HIS  65  -0.572   3.144  -9.720
  481    HD2  HIS  65          2HD       HIS  65  -0.417  -0.088  -7.087
  482    HE1  HIS  65          1HE       HIS  65  -1.933   3.806  -7.688
  483    HE2  HIS  65          2HE       HIS  65  -1.841   1.849  -6.079
  484    H    PHE  66           H        PHE  66   3.748  -0.374  -9.232
  485    HA   PHE  66           HA       PHE  66   3.845   0.641  -6.439
  486    HB2  PHE  66          2HB       PHE  66   4.798  -1.946  -7.684
  487    HB3  PHE  66          1HB       PHE  66   5.011  -1.528  -5.982
  488    HD1  PHE  66          1HD       PHE  66   2.593  -2.441  -8.593
  489    HD2  PHE  66          2HD       PHE  66   3.084  -1.328  -4.474
  490    HE1  PHE  66          1HE       PHE  66   0.269  -3.169  -8.119
  491    HE2  PHE  66          2HE       PHE  66   0.763  -2.058  -3.999
  492    HZ   PHE  66           HZ       PHE  66  -0.645  -2.978  -5.822
  493    H    ARG  67           H        ARG  67   5.508   1.383  -9.150
  494    HA   ARG  67           HA       ARG  67   8.240   0.993  -8.438
  495    HB2  ARG  67          2HB       ARG  67   6.930   3.189 -10.062
  496    HB3  ARG  67          1HB       ARG  67   8.673   2.983  -9.924
  497    HG2  ARG  67          2HG       ARG  67   6.927   0.698 -10.785
  498    HG3  ARG  67          1HG       ARG  67   7.472   1.899 -11.953
  499    HD2  ARG  67          2HD       ARG  67   9.839   1.447 -11.144
  500    HD3  ARG  67          1HD       ARG  67   9.189   0.079 -10.244
  501    HE   ARG  67           HE       ARG  67   8.374  -0.037 -13.009
  502   HH11  ARG  67          1HH1      ARG  67   9.368  -1.613 -14.290
  503   HH12  ARG  67          2HH1      ARG  67  10.843  -2.343 -13.753
  504   HH21  ARG  67          1HH2      ARG  67  10.986  -0.511 -10.810
  505   HH22  ARG  67          2HH2      ARG  67  11.760  -1.720 -11.782
  506    H    SER  68           H        SER  68   5.923   3.475  -7.443
  507    HA   SER  68           HA       SER  68   7.881   4.290  -5.363
  508    HB2  SER  68          2HB       SER  68   7.611   6.649  -5.833
  509    HB3  SER  68          1HB       SER  68   8.105   5.850  -7.323
  510    HG   SER  68           HG       SER  68   6.278   6.423  -8.175
  511    H    ILE  69           H        ILE  69   6.901   5.088  -3.465
  512    HA   ILE  69           HA       ILE  69   4.233   4.198  -2.923
  513    HB   ILE  69           HB       ILE  69   5.970   6.150  -1.383
  514   HG12  ILE  69          2HG1      ILE  69   5.627   3.168  -1.039
  515   HG13  ILE  69          1HG1      ILE  69   7.005   3.917  -1.829
  516   HG21  ILE  69          1HG2      ILE  69   4.266   6.264   0.063
  517   HG22  ILE  69          2HG2      ILE  69   4.283   4.508   0.220
  518   HG23  ILE  69          3HG2      ILE  69   3.291   5.272  -1.020
  519   HD11  ILE  69          1HD1      ILE  69   7.505   5.174   0.239
  520   HD12  ILE  69          2HD1      ILE  69   7.525   3.435   0.526
  521   HD13  ILE  69          3HD1      ILE  69   6.136   4.397   1.032
  522    H    ARG  70           H        ARG  70   5.617   7.357  -3.732
  523    HA   ARG  70           HA       ARG  70   3.336   8.950  -3.149
  524    HB2  ARG  70          2HB       ARG  70   5.479   9.322  -5.261
  525    HB3  ARG  70          1HB       ARG  70   4.327  10.565  -4.774
  526    HG2  ARG  70          2HG       ARG  70   5.159  10.358  -2.427
  527    HG3  ARG  70          1HG       ARG  70   6.380   9.218  -2.995
  528    HD2  ARG  70          2HD       ARG  70   6.074  12.098  -3.894
  529    HD3  ARG  70          1HD       ARG  70   7.349  11.463  -2.854
  530    HE   ARG  70           HE       ARG  70   7.416   9.942  -5.229
  531   HH11  ARG  70          1HH1      ARG  70   8.881  10.472  -6.867
  532   HH12  ARG  70          2HH1      ARG  70   9.528  12.077  -6.946
  533   HH21  ARG  70          1HH2      ARG  70   7.783  13.203  -4.168
  534   HH22  ARG  70          2HH2      ARG  70   8.906  13.623  -5.418
  535    H    SER  71           H        SER  71   4.205   7.164  -6.113
  536    HA   SER  71           HA       SER  71   2.107   8.177  -7.744
  537    HB2  SER  71          2HB       SER  71   3.285   5.385  -7.797
  538    HB3  SER  71          1HB       SER  71   2.466   6.205  -9.120
  539    HG   SER  71           HG       SER  71   4.665   6.453  -9.397
  540    H    ILE  72           H        ILE  72   2.204   5.371  -5.549
  541    HA   ILE  72           HA       ILE  72  -0.486   4.523  -6.079
  542    HB   ILE  72           HB       ILE  72   1.244   4.089  -3.628
  543   HG12  ILE  72          2HG1      ILE  72   0.842   2.339  -6.074
  544   HG13  ILE  72          1HG1      ILE  72   2.257   3.356  -5.804
  545   HG21  ILE  72          1HG2      ILE  72  -1.034   3.546  -3.120
  546   HG22  ILE  72          2HG2      ILE  72  -0.213   2.021  -3.452
  547   HG23  ILE  72          3HG2      ILE  72  -1.253   2.747  -4.676
  548   HD11  ILE  72          1HD1      ILE  72   1.929   0.731  -4.919
  549   HD12  ILE  72          2HD1      ILE  72   1.653   1.709  -3.477
  550   HD13  ILE  72          3HD1      ILE  72   3.164   1.867  -4.374
  551    H    ASP  73           H        ASP  73   0.961   6.686  -3.673
  552    HA   ASP  73           HA       ASP  73  -1.287   7.040  -2.000
  553    HB2  ASP  73          2HB       ASP  73   0.880   9.014  -2.779
  554    HB3  ASP  73          1HB       ASP  73  -0.230   9.223  -1.426
  555    H    ALA  74           H        ALA  74  -0.394   8.770  -4.992
  556    HA   ALA  74           HA       ALA  74  -2.559  10.648  -4.861
  557    HB1  ALA  74          1HB       ALA  74  -1.732   9.912  -7.572
  558    HB2  ALA  74          2HB       ALA  74  -0.369  10.269  -6.512
  559    HB3  ALA  74          3HB       ALA  74  -1.636  11.471  -6.754
  560    H    PHE  75           H        PHE  75  -2.271   7.453  -6.387
  561    HA   PHE  75           HA       PHE  75  -4.762   7.511  -7.764
  562    HB2  PHE  75          2HB       PHE  75  -2.983   5.790  -8.094
  563    HB3  PHE  75          1HB       PHE  75  -3.422   5.101  -6.533
  564    HD1  PHE  75          1HD       PHE  75  -4.602   5.760  -9.977
  565    HD2  PHE  75          2HD       PHE  75  -5.444   3.818  -6.240
  566    HE1  PHE  75          1HE       PHE  75  -6.438   4.486 -11.054
  567    HE2  PHE  75          2HE       PHE  75  -7.279   2.543  -7.315
  568    HZ   PHE  75           HZ       PHE  75  -7.775   2.878  -9.722
  569    H    VAL  76           H        VAL  76  -3.989   6.162  -4.535
  570    HA   VAL  76           HA       VAL  76  -6.717   5.522  -3.924
  571    HB   VAL  76           HB       VAL  76  -4.296   5.978  -2.162
  572   HG11  VAL  76          1HG1      VAL  76  -5.803   4.590  -0.549
  573   HG12  VAL  76          2HG1      VAL  76  -7.130   5.186  -1.546
  574   HG13  VAL  76          3HG1      VAL  76  -6.088   6.324  -0.694
  575   HG21  VAL  76          1HG2      VAL  76  -5.729   3.437  -3.000
  576   HG22  VAL  76          2HG2      VAL  76  -4.235   3.545  -2.069
  577   HG23  VAL  76          3HG2      VAL  76  -4.256   4.041  -3.761
  578    H    VAL  77           H        VAL  77  -4.659   8.339  -3.130
  579    HA   VAL  77           HA       VAL  77  -6.599   9.688  -1.533
  580    HB   VAL  77           HB       VAL  77  -4.285  10.689  -3.208
  581   HG11  VAL  77          1HG1      VAL  77  -6.376  12.126  -1.657
  582   HG12  VAL  77          2HG1      VAL  77  -5.449  12.659  -3.058
  583   HG13  VAL  77          3HG1      VAL  77  -4.714  12.680  -1.455
  584   HG21  VAL  77          1HG2      VAL  77  -3.020  10.415  -1.323
  585   HG22  VAL  77          2HG2      VAL  77  -4.276   9.257  -0.885
  586   HG23  VAL  77          3HG2      VAL  77  -4.334  10.902  -0.253
  587    H    GLY  78           H        GLY  78  -5.944   9.724  -5.017
  588    HA2  GLY  78          2HA       GLY  78  -7.684  11.832  -5.744
  589    HA3  GLY  78          1HA       GLY  78  -7.258  10.487  -6.799
  590    H    ALA  79           H        ALA  79  -8.391   8.433  -5.020
  591    HA   ALA  79           HA       ALA  79 -11.252   8.952  -5.655
  592    HB1  ALA  79          1HB       ALA  79 -11.506   6.492  -5.535
  593    HB2  ALA  79          2HB       ALA  79  -9.795   6.351  -5.130
  594    HB3  ALA  79          3HB       ALA  79 -10.279   6.967  -6.710
  595    H    THR  80           H        THR  80  -9.242   7.513  -3.071
  596    HA   THR  80           HA       THR  80 -11.055   8.644  -1.062
  597    HB   THR  80           HB       THR  80 -10.728   5.648  -1.268
  598    HG1  THR  80          1HG       THR  80 -13.058   7.209  -1.616
  599   HG21  THR  80          1HG2      THR  80 -10.978   6.149   1.014
  600   HG22  THR  80          2HG2      THR  80 -12.633   5.840   0.485
  601   HG23  THR  80          3HG2      THR  80 -12.066   7.499   0.689
  602    H    THR  81           H        THR  81  -9.975   8.992   0.857
  603    HA   THR  81           HA       THR  81  -7.261   7.765   1.121
  604    HB   THR  81           HB       THR  81  -7.165  10.189   0.629
  605    HG1  THR  81          1HG       THR  81  -6.193   8.949   2.815
  606   HG21  THR  81          1HG2      THR  81  -8.228  11.021   3.227
  607   HG22  THR  81          2HG2      THR  81  -9.455  10.303   2.184
  608   HG23  THR  81          3HG2      THR  81  -8.526  11.694   1.625
  609    HA   PRO  82           HA       PRO  82  -9.597   6.621   4.899
  610    HB2  PRO  82          2HB       PRO  82  -9.185   3.978   4.818
  611    HB3  PRO  82          1HB       PRO  82 -10.350   4.760   3.731
  612    HG2  PRO  82          2HG       PRO  82  -7.638   3.713   3.156
  613    HG3  PRO  82          1HG       PRO  82  -9.070   3.780   2.118
  614    HD2  PRO  82          2HD       PRO  82  -6.890   5.610   2.118
  615    HD3  PRO  82          1HD       PRO  82  -8.427   5.786   1.243
  616    HA   PRO  83           HA       PRO  83  -5.501   6.455   6.978
  617    HB2  PRO  83          2HB       PRO  83  -6.235   7.771   9.247
  618    HB3  PRO  83          1HB       PRO  83  -5.814   8.609   7.742
  619    HG2  PRO  83          2HG       PRO  83  -8.469   8.109   8.945
  620    HG3  PRO  83          1HG       PRO  83  -7.904   9.473   7.969
  621    HD2  PRO  83          2HD       PRO  83  -9.469   7.352   7.032
  622    HD3  PRO  83          1HD       PRO  83  -8.545   8.476   6.014
  623    H    VAL  84           H        VAL  84  -4.836   4.728   8.219
  624    HA   VAL  84           HA       VAL  84  -6.828   3.515  10.097
  625    HB   VAL  84           HB       VAL  84  -4.794   1.997   8.442
  626   HG11  VAL  84          1HG1      VAL  84  -7.188   1.023  10.023
  627   HG12  VAL  84          2HG1      VAL  84  -5.538   1.020  10.644
  628   HG13  VAL  84          3HG1      VAL  84  -5.956   0.032   9.243
  629   HG21  VAL  84          1HG2      VAL  84  -6.635   3.078   7.093
  630   HG22  VAL  84          2HG2      VAL  84  -7.797   2.164   8.053
  631   HG23  VAL  84          3HG2      VAL  84  -6.639   1.316   7.029
  632    H    GLU  85           H        GLU  85  -6.053   3.138  12.135
  633    HA   GLU  85           HA       GLU  85  -3.535   4.235  12.948
  634    HB2  GLU  85          2HB       GLU  85  -5.384   2.286  14.358
  635    HB3  GLU  85          1HB       GLU  85  -4.019   3.102  15.123
  636    HG2  GLU  85          2HG       GLU  85  -5.031   5.296  14.546
  637    HG3  GLU  85          1HG       GLU  85  -6.417   4.454  13.851
  638    H    ALA  86           H        ALA  86  -4.541   0.945  12.108
  639    HA   ALA  86           HA       ALA  86  -1.677   0.193  11.962
  640    HB1  ALA  86          1HB       ALA  86  -2.200  -0.548  14.181
  641    HB2  ALA  86          2HB       ALA  86  -2.242  -1.984  13.160
  642    HB3  ALA  86          3HB       ALA  86  -3.748  -1.216  13.663
  643    H    LYS  87           H        LYS  87  -1.350  -1.761  10.660
  644    HA   LYS  87           HA       LYS  87  -3.182  -1.910   8.426
  645    HB2  LYS  87          2HB       LYS  87  -0.653  -2.350   8.402
  646    HB3  LYS  87          1HB       LYS  87  -1.030  -3.931   9.088
  647    HG2  LYS  87          2HG       LYS  87  -2.539  -4.381   7.164
  648    HG3  LYS  87          1HG       LYS  87  -2.078  -2.828   6.466
  649    HD2  LYS  87          2HD       LYS  87   0.353  -3.676   6.673
  650    HD3  LYS  87          1HD       LYS  87  -0.363  -5.271   6.890
  651    HE2  LYS  87          2HE       LYS  87  -0.622  -3.437   4.494
  652    HE3  LYS  87          1HE       LYS  87   0.065  -5.061   4.542
  653    HZ1  LYS  87          1HZ       LYS  87  -2.032  -5.448   3.729
  654    HZ2  LYS  87          2HZ       LYS  87  -2.754  -4.234   4.673
  655    HZ3  LYS  87          3HZ       LYS  87  -2.279  -5.699   5.389
  656    H    LEU  88           H        LEU  88  -4.891  -3.292   8.143
  657    HA   LEU  88           HA       LEU  88  -5.480  -5.183  10.352
  658    HB2  LEU  88          2HB       LEU  88  -7.220  -4.391   7.997
  659    HB3  LEU  88          1HB       LEU  88  -7.735  -5.251   9.449
  660    HG   LEU  88           HG       LEU  88  -6.686  -2.409   9.313
  661   HD11  LEU  88          1HD1      LEU  88  -9.177  -2.547  10.600
  662   HD12  LEU  88          2HD1      LEU  88  -9.326  -3.614   9.204
  663   HD13  LEU  88          3HD1      LEU  88  -8.863  -1.927   8.980
  664   HD21  LEU  88          1HD2      LEU  88  -7.476  -2.555  11.813
  665   HD22  LEU  88          2HD2      LEU  88  -5.884  -3.175  11.376
  666   HD23  LEU  88          3HD2      LEU  88  -7.234  -4.288  11.598
  667    H    GLN  89           H        GLN  89  -5.655  -7.406  10.022
  668    HA   GLN  89           HA       GLN  89  -4.076  -8.701   8.128
  669    HB2  GLN  89          2HB       GLN  89  -6.642  -9.703   9.399
  670    HB3  GLN  89          1HB       GLN  89  -5.470 -10.725   8.567
  671    HG2  GLN  89          2HG       GLN  89  -3.728 -10.070  10.169
  672    HG3  GLN  89          1HG       GLN  89  -4.868  -9.000  10.988
  673   HE21  GLN  89          1HE2      GLN  89  -3.615 -11.177  12.373
  674   HE22  GLN  89          2HE2      GLN  89  -4.810 -12.320  12.762
  675    H1   PN7 101          3HO       SAT 101   5.441  -8.201 -11.204
  676    H2   PN7 101          1H1       SAT 101   4.363  -8.087  -8.695
  677    H3   PN7 101          2H1       SAT 101   2.730  -8.387  -8.099
  678    H5   PN7 101          1HE1      SAT 101   4.073  -6.250 -10.469
  679    H6   PN7 101          2HE1      SAT 101   2.811  -6.065  -9.253
  680    H7   PN7 101          3HE1      SAT 101   2.395  -6.030 -10.966
  681    H8   PN7 101          2HE2      SAT 101   1.143  -9.230  -9.768
  682    H9   PN7 101          3HE2      SAT 101   1.046  -8.390 -11.315
  683    H10  PN7 101          1HE2      SAT 101   0.786  -7.503  -9.813
  684    H11  PN7 101          3H        SAT 101   3.013  -9.504 -11.716
  685    H12  PN7 101          5H        SAT 101   4.656  -5.947 -12.481
  686    H13  PN7 101          1H6       SAT 101   6.727  -6.868 -13.190
  687    H14  PN7 101          2H6       SAT 101   6.040  -8.482 -13.014
  688    H15  PN7 101          1H7       SAT 101   6.231  -6.812 -15.391
  689    H16  PN7 101          2H7       SAT 101   4.567  -7.315 -15.089
  690    H17  PN7 101          9H        SAT 101   4.459 -10.118 -14.816
  691    H18  PN7 101          1H10      SAT 101   3.498  -9.921 -17.124
  692    H19  PN7 101          2H10      SAT 101   5.144  -9.639 -17.689
  693    H20  PN7 101          1H11      SAT 101   4.796 -11.913 -18.189
  694    H21  PN7 101          2H11      SAT 101   3.906 -12.199 -16.693
  695    H22  PN7 101          2HS1      SAT 101   6.133 -13.038 -15.926
  Start of MODEL   13
    1    H1   MET   1          1HT       MET   1  -0.685  13.663   1.005
    2    H2   MET   1          2HT       MET   1   0.095  12.687  -0.145
    3    H3   MET   1          3HT       MET   1   1.003  13.721   0.851
    4    HA   MET   1           HA       MET   1   0.310  11.060   1.313
    5    HB2  MET   1          2HB       MET   1   1.628  13.194   3.017
    6    HB3  MET   1          1HB       MET   1   1.645  11.470   3.394
    7    HG2  MET   1          2HG       MET   1   2.691  11.049   1.157
    8    HG3  MET   1          1HG       MET   1   2.798  12.793   0.924
    9    HE1  MET   1          1HE       MET   1   5.172  11.098   0.576
   10    HE2  MET   1          2HE       MET   1   6.465  11.766   1.571
   11    HE3  MET   1          3HE       MET   1   5.427  12.847   0.646
   12    H    GLN   2           H        GLN   2  -2.150  12.493   1.305
   13    HA   GLN   2           HA       GLN   2  -3.113  13.176   3.895
   14    HB2  GLN   2          2HB       GLN   2  -4.605  11.987   1.534
   15    HB3  GLN   2          1HB       GLN   2  -5.368  12.729   2.941
   16    HG2  GLN   2          2HG       GLN   2  -4.126  14.841   2.445
   17    HG3  GLN   2          1HG       GLN   2  -3.507  14.090   0.974
   18   HE21  GLN   2          1HE2      GLN   2  -6.520  12.772   1.341
   19   HE22  GLN   2          2HE2      GLN   2  -7.431  13.875   0.428
   20    H    HIS   3           H        HIS   3  -2.910  10.054   2.223
   21    HA   HIS   3           HA       HIS   3  -3.484   8.735   4.841
   22    HB2  HIS   3          2HB       HIS   3  -4.475   7.666   2.190
   23    HB3  HIS   3          1HB       HIS   3  -4.917   7.124   3.809
   24    HD1  HIS   3          1HD       HIS   3  -5.861   9.409   5.307
   25    HD2  HIS   3          2HD       HIS   3  -6.494   9.245   1.188
   26    HE1  HIS   3          1HE       HIS   3  -7.762  11.010   4.809
   27    HE2  HIS   3          2HE       HIS   3  -8.153  10.918   2.305
   28    H    ALA   4           H        ALA   4  -1.131   9.319   2.804
   29    HA   ALA   4           HA       ALA   4  -0.172   6.811   1.866
   30    HB1  ALA   4          1HB       ALA   4   0.847   8.852   1.076
   31    HB2  ALA   4          2HB       ALA   4   2.088   7.936   1.931
   32    HB3  ALA   4          3HB       ALA   4   1.312   9.313   2.714
   33    H    SER   5           H        SER   5   0.147   8.380   5.032
   34    HA   SER   5           HA       SER   5   2.120   6.620   6.096
   35    HB2  SER   5          2HB       SER   5   1.399   7.395   8.279
   36    HB3  SER   5          1HB       SER   5   1.341   8.758   7.166
   37    HG   SER   5           HG       SER   5  -0.960   7.277   7.212
   38    H    VAL   6           H        VAL   6  -1.398   6.331   5.858
   39    HA   VAL   6           HA       VAL   6  -1.625   3.965   7.475
   40    HB   VAL   6           HB       VAL   6  -3.351   5.007   5.223
   41   HG11  VAL   6          1HG1      VAL   6  -5.049   3.475   6.547
   42   HG12  VAL   6          2HG1      VAL   6  -3.582   2.618   7.019
   43   HG13  VAL   6          3HG1      VAL   6  -4.002   2.776   5.313
   44   HG21  VAL   6          1HG2      VAL   6  -3.539   6.559   6.959
   45   HG22  VAL   6          2HG2      VAL   6  -3.294   5.338   8.209
   46   HG23  VAL   6          3HG2      VAL   6  -4.834   5.429   7.353
   47    H    ILE   7           H        ILE   7  -1.003   4.529   4.055
   48    HA   ILE   7           HA       ILE   7  -1.175   1.792   3.221
   49    HB   ILE   7           HB       ILE   7   0.423   4.084   2.047
   50   HG12  ILE   7          2HG1      ILE   7  -2.327   3.024   1.317
   51   HG13  ILE   7          1HG1      ILE   7  -2.047   4.471   2.286
   52   HG21  ILE   7          1HG2      ILE   7  -0.403   1.378   0.961
   53   HG22  ILE   7          2HG2      ILE   7   1.234   2.009   1.138
   54   HG23  ILE   7          3HG2      ILE   7   0.148   2.702  -0.065
   55   HD11  ILE   7          1HD1      ILE   7  -0.466   4.502  -0.158
   56   HD12  ILE   7          2HD1      ILE   7  -1.596   5.708   0.456
   57   HD13  ILE   7          3HD1      ILE   7  -2.189   4.352  -0.503
   58    H    ALA   8           H        ALA   8   1.567   3.782   4.329
   59    HA   ALA   8           HA       ALA   8   3.582   1.820   3.833
   60    HB1  ALA   8          1HB       ALA   8   4.951   3.116   5.428
   61    HB2  ALA   8          2HB       ALA   8   3.511   3.996   5.941
   62    HB3  ALA   8          3HB       ALA   8   4.115   4.176   4.293
   63    H    GLN   9           H        GLN   9   1.829   2.581   6.859
   64    HA   GLN   9           HA       GLN   9   3.038   0.378   8.284
   65    HB2  GLN   9          2HB       GLN   9   1.093   0.784   9.910
   66    HB3  GLN   9          1HB       GLN   9   2.205   2.127   9.654
   67    HG2  GLN   9          2HG       GLN   9   0.529   3.418   8.903
   68    HG3  GLN   9          1HG       GLN   9   0.127   2.228   7.670
   69   HE21  GLN   9          1HE2      GLN   9  -1.068   0.175   8.728
   70   HE22  GLN   9          2HE2      GLN   9  -2.300   0.565   9.829
   71    H    PHE  10           H        PHE  10  -0.101   0.818   6.672
   72    HA   PHE  10           HA       PHE  10  -1.197  -1.725   7.319
   73    HB2  PHE  10          2HB       PHE  10  -2.463   0.164   6.281
   74    HB3  PHE  10          1HB       PHE  10  -1.598  -0.130   4.773
   75    HD1  PHE  10          1HD       PHE  10  -2.140  -1.993   3.354
   76    HD2  PHE  10          2HD       PHE  10  -4.026  -1.551   7.187
   77    HE1  PHE  10          1HE       PHE  10  -3.787  -3.743   2.744
   78    HE2  PHE  10          2HE       PHE  10  -5.674  -3.304   6.578
   79    HZ   PHE  10           HZ       PHE  10  -5.555  -4.398   4.355
   80    H    VAL  11           H        VAL  11   0.678  -0.686   4.479
   81    HA   VAL  11           HA       VAL  11   0.762  -3.302   3.277
   82    HB   VAL  11           HB       VAL  11   2.573  -0.894   2.936
   83   HG11  VAL  11          1HG1      VAL  11   3.880  -2.434   1.884
   84   HG12  VAL  11          2HG1      VAL  11   2.681  -2.292   0.598
   85   HG13  VAL  11          3HG1      VAL  11   2.569  -3.607   1.768
   86   HG21  VAL  11          1HG2      VAL  11   1.168  -0.277   1.138
   87   HG22  VAL  11          2HG2      VAL  11   0.040  -0.776   2.398
   88   HG23  VAL  11          3HG2      VAL  11   0.414  -1.871   1.067
   89    H    VAL  12           H        VAL  12   3.119  -1.471   5.229
   90    HA   VAL  12           HA       VAL  12   5.125  -3.507   5.253
   91    HB   VAL  12           HB       VAL  12   4.547  -1.318   7.252
   92   HG11  VAL  12          1HG1      VAL  12   6.697  -3.367   7.013
   93   HG12  VAL  12          2HG1      VAL  12   6.007  -2.625   8.455
   94   HG13  VAL  12          3HG1      VAL  12   7.179  -1.737   7.483
   95   HG21  VAL  12          1HG2      VAL  12   5.168  -0.943   4.675
   96   HG22  VAL  12          2HG2      VAL  12   6.794  -1.247   5.288
   97   HG23  VAL  12          3HG2      VAL  12   5.839   0.082   5.945
   98    H    GLU  13           H        GLU  13   2.353  -2.885   7.351
   99    HA   GLU  13           HA       GLU  13   2.968  -4.667   9.453
  100    HB2  GLU  13          2HB       GLU  13   1.055  -3.087   9.478
  101    HB3  GLU  13          1HB       GLU  13   0.239  -4.097   8.291
  102    HG2  GLU  13          2HG       GLU  13   0.352  -6.009   9.880
  103    HG3  GLU  13          1HG       GLU  13   1.072  -4.929  11.072
  104    H    GLU  14           H        GLU  14   1.820  -5.300   6.208
  105    HA   GLU  14           HA       GLU  14   0.883  -7.972   6.638
  106    HB2  GLU  14          2HB       GLU  14   0.461  -6.611   4.574
  107    HB3  GLU  14          1HB       GLU  14   2.153  -6.838   4.128
  108    HG2  GLU  14          2HG       GLU  14   1.804  -9.305   4.198
  109    HG3  GLU  14          1HG       GLU  14   0.095  -9.025   4.527
  110    H    PHE  15           H        PHE  15   4.080  -6.602   6.207
  111    HA   PHE  15           HA       PHE  15   5.280  -9.157   7.018
  112    HB2  PHE  15          2HB       PHE  15   6.906  -8.702   4.897
  113    HB3  PHE  15          1HB       PHE  15   5.513  -9.779   4.826
  114    HD1  PHE  15          1HD       PHE  15   4.442  -9.522   2.775
  115    HD2  PHE  15          2HD       PHE  15   5.807  -6.037   4.884
  116    HE1  PHE  15          1HE       PHE  15   3.387  -8.071   1.066
  117    HE2  PHE  15          2HE       PHE  15   4.755  -4.589   3.172
  118    HZ   PHE  15           HZ       PHE  15   3.542  -5.605   1.267
  119    H    LEU  16           H        LEU  16   5.329  -6.988   8.573
  120    HA   LEU  16           HA       LEU  16   7.572  -5.254   7.953
  121    HB2  LEU  16          2HB       LEU  16   7.020  -4.060   9.890
  122    HB3  LEU  16          1HB       LEU  16   5.472  -4.651   9.320
  123    HG   LEU  16           HG       LEU  16   7.140  -5.963  11.486
  124   HD11  LEU  16          1HD1      LEU  16   6.280  -3.942  12.386
  125   HD12  LEU  16          2HD1      LEU  16   5.146  -5.194  12.895
  126   HD13  LEU  16          3HD1      LEU  16   4.741  -4.133  11.545
  127   HD21  LEU  16          1HD2      LEU  16   5.026  -7.268  11.850
  128   HD22  LEU  16          2HD2      LEU  16   5.751  -7.588  10.278
  129   HD23  LEU  16          3HD2      LEU  16   4.356  -6.521  10.401
  130    HA   PRO  17           HA       PRO  17  10.605  -7.975   9.756
  131    HB2  PRO  17          2HB       PRO  17  12.686  -6.208   9.943
  132    HB3  PRO  17          1HB       PRO  17  12.165  -6.917   8.405
  133    HG2  PRO  17          2HG       PRO  17  11.591  -4.227   9.535
  134    HG3  PRO  17          1HG       PRO  17  11.959  -4.696   7.868
  135    HD2  PRO  17          2HD       PRO  17   9.421  -4.183   8.766
  136    HD3  PRO  17          1HD       PRO  17   9.780  -5.282   7.419
  137    H    ASP  18           H        ASP  18  12.607  -6.892  11.569
  138    HA   ASP  18           HA       ASP  18  10.994  -6.788  14.005
  139    HB2  ASP  18          2HB       ASP  18  13.975  -6.669  13.514
  140    HB3  ASP  18          1HB       ASP  18  13.244  -6.669  15.115
  141    H    VAL  19           H        VAL  19  11.318  -4.553  11.824
  142    HA   VAL  19           HA       VAL  19  11.998  -2.333  13.714
  143    HB   VAL  19           HB       VAL  19  11.945  -2.292  10.686
  144   HG11  VAL  19          1HG1      VAL  19  12.629  -0.313  12.840
  145   HG12  VAL  19          2HG1      VAL  19  11.705  -0.071  11.357
  146   HG13  VAL  19          3HG1      VAL  19  13.460  -0.224  11.288
  147   HG21  VAL  19          1HG2      VAL  19  14.070  -2.971  12.677
  148   HG22  VAL  19          2HG2      VAL  19  14.542  -2.027  11.264
  149   HG23  VAL  19          3HG2      VAL  19  13.806  -3.616  11.057
  150    H    ALA  20           H        ALA  20  10.429  -0.795  14.119
  151    HA   ALA  20           HA       ALA  20   7.710  -1.356  13.283
  152    HB1  ALA  20          1HB       ALA  20   8.917   0.083  15.356
  153    HB2  ALA  20          2HB       ALA  20   7.186  -0.047  15.044
  154    HB3  ALA  20          3HB       ALA  20   8.101   1.306  14.381
  155    HA   PRO  21           HA       PRO  21   7.697   0.848   9.382
  156    HB2  PRO  21          2HB       PRO  21   5.093   1.982  10.288
  157    HB3  PRO  21          1HB       PRO  21   5.490   1.130   8.785
  158    HG2  PRO  21          2HG       PRO  21   4.123  -0.019  10.794
  159    HG3  PRO  21          1HG       PRO  21   5.191  -0.922   9.710
  160    HD2  PRO  21          2HD       PRO  21   5.586  -0.230  12.559
  161    HD3  PRO  21          1HD       PRO  21   6.323  -1.523  11.587
  162    H    ALA  22           H        ALA  22   6.926   2.517  12.390
  163    HA   ALA  22           HA       ALA  22   7.190   5.200  11.370
  164    HB1  ALA  22          1HB       ALA  22   6.127   5.214  13.422
  165    HB2  ALA  22          2HB       ALA  22   7.775   5.549  13.954
  166    HB3  ALA  22          3HB       ALA  22   7.125   3.912  14.065
  167    H    ASP  23           H        ASP  23   9.462   2.740  12.057
  168    HA   ASP  23           HA       ASP  23  11.683   4.708  12.303
  169    HB2  ASP  23          2HB       ASP  23  11.574   1.715  12.778
  170    HB3  ASP  23          1HB       ASP  23  13.050   2.676  12.878
  171    H    VAL  24           H        VAL  24  10.018   3.328   9.907
  172    HA   VAL  24           HA       VAL  24  12.412   2.685   8.247
  173    HB   VAL  24           HB       VAL  24   9.477   2.173   7.666
  174   HG11  VAL  24          1HG1      VAL  24  11.818   2.134   6.030
  175   HG12  VAL  24          2HG1      VAL  24  10.179   1.646   5.596
  176   HG13  VAL  24          3HG1      VAL  24  11.302   0.465   6.272
  177   HG21  VAL  24          1HG2      VAL  24  10.252   0.855   9.592
  178   HG22  VAL  24          2HG2      VAL  24  11.660   0.319   8.676
  179   HG23  VAL  24          3HG2      VAL  24  10.043  -0.191   8.188
  180    H    ASP  25           H        ASP  25  12.909   4.008   6.511
  181    HA   ASP  25           HA       ASP  25  11.684   6.625   6.421
  182    HB2  ASP  25          2HB       ASP  25  14.078   6.152   5.824
  183    HB3  ASP  25          1HB       ASP  25  13.506   5.343   4.364
  184    H    VAL  26           H        VAL  26   9.498   6.442   5.879
  185    HA   VAL  26           HA       VAL  26   8.435   4.777   3.820
  186    HB   VAL  26           HB       VAL  26   6.454   6.199   3.933
  187   HG11  VAL  26          1HG1      VAL  26   6.541   6.472   6.629
  188   HG12  VAL  26          2HG1      VAL  26   7.896   5.371   6.392
  189   HG13  VAL  26          3HG1      VAL  26   6.288   4.924   5.825
  190   HG21  VAL  26          1HG2      VAL  26   7.387   8.398   3.841
  191   HG22  VAL  26          2HG2      VAL  26   8.366   8.119   5.280
  192   HG23  VAL  26          3HG2      VAL  26   6.616   8.276   5.422
  193    H    ASP  27           H        ASP  27  10.726   7.038   3.376
  194    HA   ASP  27           HA       ASP  27   9.591   8.185   0.885
  195    HB2  ASP  27          2HB       ASP  27  12.196   8.704   2.352
  196    HB3  ASP  27          1HB       ASP  27  11.724   9.504   0.853
  197    H    LEU  28           H        LEU  28  10.891   5.348   1.670
  198    HA   LEU  28           HA       LEU  28  12.810   5.172  -0.585
  199    HB2  LEU  28          2HB       LEU  28  13.385   4.162   1.623
  200    HB3  LEU  28          1HB       LEU  28  12.018   3.068   1.449
  201    HG   LEU  28           HG       LEU  28  13.855   3.161  -0.871
  202   HD11  LEU  28          1HD1      LEU  28  15.458   3.313   1.005
  203   HD12  LEU  28          2HD1      LEU  28  15.538   1.732   0.230
  204   HD13  LEU  28          3HD1      LEU  28  14.694   1.919   1.768
  205   HD21  LEU  28          1HD2      LEU  28  13.231   0.922  -1.072
  206   HD22  LEU  28          2HD2      LEU  28  11.813   1.587  -0.264
  207   HD23  LEU  28          3HD2      LEU  28  13.031   0.716   0.667
  208    H    ASP  29           H        ASP  29  12.323   4.104  -2.473
  209    HA   ASP  29           HA       ASP  29   9.603   3.577  -3.136
  210    HB2  ASP  29          2HB       ASP  29  12.161   2.572  -4.425
  211    HB3  ASP  29          1HB       ASP  29  10.558   2.408  -5.140
  212    H    LEU  30           H        LEU  30   8.367   1.895  -2.469
  213    HA   LEU  30           HA       LEU  30   9.485  -0.261  -0.938
  214    HB2  LEU  30          2HB       LEU  30   7.235  -1.120  -0.810
  215    HB3  LEU  30          1HB       LEU  30   7.148   0.635  -0.689
  216    HG   LEU  30           HG       LEU  30   7.027   0.064  -3.450
  217   HD11  LEU  30          1HD1      LEU  30   6.477  -2.252  -3.004
  218   HD12  LEU  30          2HD1      LEU  30   4.995  -1.428  -3.480
  219   HD13  LEU  30          3HD1      LEU  30   5.294  -1.784  -1.782
  220   HD21  LEU  30          1HD2      LEU  30   5.882   1.904  -2.322
  221   HD22  LEU  30          2HD2      LEU  30   4.872   0.763  -1.433
  222   HD23  LEU  30          3HD2      LEU  30   4.697   0.918  -3.180
  223    H    VAL  31           H        VAL  31  10.150   0.149  -3.986
  224    HA   VAL  31           HA       VAL  31   9.253  -2.097  -5.449
  225    HB   VAL  31           HB       VAL  31  11.966  -0.737  -5.480
  226   HG11  VAL  31          1HG1      VAL  31  12.605  -2.467  -6.782
  227   HG12  VAL  31          2HG1      VAL  31  11.472  -1.851  -7.985
  228   HG13  VAL  31          3HG1      VAL  31  10.964  -3.108  -6.857
  229   HG21  VAL  31          1HG2      VAL  31   9.440   0.170  -6.257
  230   HG22  VAL  31          2HG2      VAL  31  10.194  -0.361  -7.760
  231   HG23  VAL  31          3HG2      VAL  31  10.992   0.847  -6.753
  232    H    ASP  32           H        ASP  32  11.916  -1.780  -3.142
  233    HA   ASP  32           HA       ASP  32  13.024  -4.377  -3.399
  234    HB2  ASP  32          2HB       ASP  32  12.700  -2.637  -0.930
  235    HB3  ASP  32          1HB       ASP  32  13.691  -4.096  -0.986
  236    H    ASN  33           H        ASN  33  10.174  -3.201  -1.722
  237    HA   ASN  33           HA       ASN  33   9.556  -5.818  -0.556
  238    HB2  ASN  33          2HB       ASN  33   7.865  -3.319  -0.749
  239    HB3  ASN  33          1HB       ASN  33   7.523  -4.723   0.257
  240   HD21  ASN  33          1HD2      ASN  33   8.530  -1.699   0.656
  241   HD22  ASN  33          2HD2      ASN  33   9.689  -1.889   1.881
  242    H    GLY  34           H        GLY  34   9.708  -5.026  -3.576
  243    HA2  GLY  34          2HA       GLY  34   7.298  -5.146  -4.908
  244    HA3  GLY  34          1HA       GLY  34   8.725  -6.010  -5.482
  245    H    VAL  35           H        VAL  35   8.490  -7.458  -2.703
  246    HA   VAL  35           HA       VAL  35   7.431  -9.895  -3.627
  247    HB   VAL  35           HB       VAL  35   7.543  -8.730  -0.830
  248   HG11  VAL  35          1HG1      VAL  35   7.225 -11.150  -0.118
  249   HG12  VAL  35          2HG1      VAL  35   6.699 -11.482  -1.769
  250   HG13  VAL  35          3HG1      VAL  35   5.784 -10.362  -0.761
  251   HG21  VAL  35          1HG2      VAL  35   9.405 -10.386  -0.620
  252   HG22  VAL  35          2HG2      VAL  35   9.713  -9.174  -1.864
  253   HG23  VAL  35          3HG2      VAL  35   9.192 -10.796  -2.323
  254    H    ILE  36           H        ILE  36   5.798  -7.136  -2.147
  255    HA   ILE  36           HA       ILE  36   3.215  -8.396  -1.907
  256    HB   ILE  36           HB       ILE  36   4.151  -6.192  -0.834
  257   HG12  ILE  36          2HG1      ILE  36   1.328  -6.459  -1.913
  258   HG13  ILE  36          1HG1      ILE  36   1.925  -7.073  -0.375
  259   HG21  ILE  36          1HG2      ILE  36   3.784  -4.197  -2.036
  260   HG22  ILE  36          2HG2      ILE  36   2.722  -4.990  -3.200
  261   HG23  ILE  36          3HG2      ILE  36   4.461  -5.279  -3.252
  262   HD11  ILE  36          1HD1      ILE  36   2.615  -4.349  -0.397
  263   HD12  ILE  36          2HD1      ILE  36   1.343  -5.110   0.559
  264   HD13  ILE  36          3HD1      ILE  36   0.967  -4.420  -1.020
  265    H    ASP  37           H        ASP  37   4.915  -6.856  -4.515
  266    HA   ASP  37           HA       ASP  37   2.754  -6.038  -6.136
  267    HB2  ASP  37          2HB       ASP  37   5.465  -7.100  -6.961
  268    HB3  ASP  37          1HB       ASP  37   4.340  -6.286  -8.041
  269    H    SER  38           H        SER  38   4.162  -9.281  -5.774
  270    HA   SER  38           HA       SER  38   2.222 -10.248  -7.815
  271    HB2  SER  38          2HB       SER  38   4.616 -11.654  -6.623
  272    HB3  SER  38          1HB       SER  38   3.619 -12.262  -7.935
  273    H    LEU  39           H        LEU  39   3.593 -11.626  -4.806
  274    HA   LEU  39           HA       LEU  39   1.306 -13.321  -4.441
  275    HB2  LEU  39          2HB       LEU  39   3.613 -13.794  -3.573
  276    HB3  LEU  39          1HB       LEU  39   3.349 -12.539  -2.367
  277    HG   LEU  39           HG       LEU  39   1.201 -14.564  -2.557
  278   HD11  LEU  39          1HD1      LEU  39   2.529 -16.197  -1.207
  279   HD12  LEU  39          2HD1      LEU  39   3.972 -15.233  -1.523
  280   HD13  LEU  39          3HD1      LEU  39   3.130 -16.024  -2.856
  281   HD21  LEU  39          1HD2      LEU  39   2.787 -13.307  -0.294
  282   HD22  LEU  39          2HD2      LEU  39   1.413 -14.389  -0.073
  283   HD23  LEU  39          3HD2      LEU  39   1.184 -12.818  -0.840
  284    H    GLY  40           H        GLY  40   2.392 -10.451  -2.621
  285    HA2  GLY  40          2HA       GLY  40   0.045 -10.357  -0.969
  286    HA3  GLY  40          1HA       GLY  40   1.168  -9.026  -1.212
  287    H    LEU  41           H        LEU  41   0.874  -8.898  -4.076
  288    HA   LEU  41           HA       LEU  41  -1.296  -7.091  -4.292
  289    HB2  LEU  41          2HB       LEU  41   0.630  -7.219  -5.875
  290    HB3  LEU  41          1HB       LEU  41  -0.037  -8.718  -6.521
  291    HG   LEU  41           HG       LEU  41  -2.218  -7.227  -6.805
  292   HD11  LEU  41          1HD1      LEU  41   0.048  -5.217  -6.881
  293   HD12  LEU  41          2HD1      LEU  41  -1.260  -5.255  -5.697
  294   HD13  LEU  41          3HD1      LEU  41  -1.613  -4.905  -7.390
  295   HD21  LEU  41          1HD2      LEU  41  -1.453  -6.689  -9.098
  296   HD22  LEU  41          2HD2      LEU  41  -0.985  -8.326  -8.635
  297   HD23  LEU  41          3HD2      LEU  41   0.209  -7.029  -8.616
  298    H    LEU  42           H        LEU  42  -1.075 -10.544  -5.120
  299    HA   LEU  42           HA       LEU  42  -3.701 -10.781  -6.215
  300    HB2  LEU  42          2HB       LEU  42  -1.913 -12.552  -6.333
  301    HB3  LEU  42          1HB       LEU  42  -2.195 -12.882  -4.631
  302    HG   LEU  42           HG       LEU  42  -4.695 -13.146  -5.350
  303   HD11  LEU  42          1HD1      LEU  42  -5.168 -13.312  -7.564
  304   HD12  LEU  42          2HD1      LEU  42  -3.675 -14.185  -7.908
  305   HD13  LEU  42          3HD1      LEU  42  -3.657 -12.428  -7.782
  306   HD21  LEU  42          1HD2      LEU  42  -3.859 -15.140  -4.587
  307   HD22  LEU  42          2HD2      LEU  42  -2.387 -15.007  -5.549
  308   HD23  LEU  42          3HD2      LEU  42  -3.886 -15.554  -6.300
  309    H    LYS  43           H        LYS  43  -2.481 -11.125  -2.892
  310    HA   LYS  43           HA       LYS  43  -5.050 -11.714  -1.729
  311    HB2  LYS  43          2HB       LYS  43  -2.528 -10.563  -0.523
  312    HB3  LYS  43          1HB       LYS  43  -3.919 -11.106   0.408
  313    HG2  LYS  43          2HG       LYS  43  -3.679 -13.366  -0.627
  314    HG3  LYS  43          1HG       LYS  43  -2.214 -12.805  -1.433
  315    HD2  LYS  43          2HD       LYS  43  -1.244 -12.257   0.804
  316    HD3  LYS  43          1HD       LYS  43  -2.677 -12.955   1.559
  317    HE2  LYS  43          2HE       LYS  43  -1.065 -14.544  -0.429
  318    HE3  LYS  43          1HE       LYS  43  -0.584 -14.472   1.267
  319    HZ1  LYS  43          1HZ       LYS  43  -2.238 -16.291   0.400
  320    HZ2  LYS  43          2HZ       LYS  43  -3.384 -15.060   0.643
  321    HZ3  LYS  43          3HZ       LYS  43  -2.425 -15.601   1.937
  322    H    VAL  44           H        VAL  44  -3.282  -8.740  -2.410
  323    HA   VAL  44           HA       VAL  44  -4.879  -6.942  -0.886
  324    HB   VAL  44           HB       VAL  44  -3.352  -6.534  -3.469
  325   HG11  VAL  44          1HG1      VAL  44  -4.989  -4.771  -3.313
  326   HG12  VAL  44          2HG1      VAL  44  -3.446  -4.102  -2.778
  327   HG13  VAL  44          3HG1      VAL  44  -4.668  -4.558  -1.592
  328   HG21  VAL  44          1HG2      VAL  44  -2.435  -5.337  -0.936
  329   HG22  VAL  44          2HG2      VAL  44  -1.518  -6.212  -2.162
  330   HG23  VAL  44          3HG2      VAL  44  -2.429  -7.101  -0.942
  331    H    ILE  45           H        ILE  45  -5.230  -7.996  -4.288
  332    HA   ILE  45           HA       ILE  45  -7.516  -6.388  -4.844
  333    HB   ILE  45           HB       ILE  45  -6.768  -9.087  -6.009
  334   HG12  ILE  45          2HG1      ILE  45  -4.916  -7.540  -6.279
  335   HG13  ILE  45          1HG1      ILE  45  -5.745  -7.676  -7.826
  336   HG21  ILE  45          1HG2      ILE  45  -8.077  -8.297  -7.949
  337   HG22  ILE  45          2HG2      ILE  45  -8.503  -6.839  -7.053
  338   HG23  ILE  45          3HG2      ILE  45  -9.068  -8.413  -6.495
  339   HD11  ILE  45          1HD1      ILE  45  -5.739  -5.391  -5.878
  340   HD12  ILE  45          2HD1      ILE  45  -7.118  -5.610  -6.957
  341   HD13  ILE  45          3HD1      ILE  45  -5.505  -5.364  -7.625
  342    H    ALA  46           H        ALA  46  -7.207  -9.683  -3.543
  343    HA   ALA  46           HA       ALA  46 -10.027 -10.230  -3.492
  344    HB1  ALA  46          1HB       ALA  46  -9.233 -11.870  -1.606
  345    HB2  ALA  46          2HB       ALA  46  -7.617 -11.366  -2.100
  346    HB3  ALA  46          3HB       ALA  46  -8.693 -12.140  -3.264
  347    H    TRP  47           H        TRP  47  -7.789  -8.948  -1.025
  348    HA   TRP  47           HA       TRP  47  -9.902  -8.652   0.956
  349    HB2  TRP  47          2HB       TRP  47  -7.876  -8.825   2.037
  350    HB3  TRP  47          1HB       TRP  47  -7.002  -7.980   0.760
  351    HD1  TRP  47           HD       TRP  47  -9.061  -7.377   3.903
  352    HE1  TRP  47          1HE       TRP  47  -8.804  -4.909   4.605
  353    HE3  TRP  47          3HE       TRP  47  -6.530  -5.563  -0.143
  354    HZ2  TRP  47          2HZ       TRP  47  -7.672  -2.487   3.587
  355    HZ3  TRP  47          3HZ       TRP  47  -5.876  -3.176  -0.250
  356    HH2  TRP  47           HH       TRP  47  -6.442  -1.640   1.605
  357    H    LEU  48           H        LEU  48  -8.125  -6.434  -1.185
  358    HA   LEU  48           HA       LEU  48  -9.324  -4.024  -0.344
  359    HB2  LEU  48          2HB       LEU  48  -7.392  -4.243  -1.932
  360    HB3  LEU  48          1HB       LEU  48  -8.522  -4.759  -3.174
  361    HG   LEU  48           HG       LEU  48  -9.770  -2.527  -2.481
  362   HD11  LEU  48          1HD1      LEU  48  -6.872  -1.916  -1.877
  363   HD12  LEU  48          2HD1      LEU  48  -8.110  -2.125  -0.643
  364   HD13  LEU  48          3HD1      LEU  48  -8.228  -0.792  -1.791
  365   HD21  LEU  48          1HD2      LEU  48  -7.498  -3.075  -4.335
  366   HD22  LEU  48          2HD2      LEU  48  -7.983  -1.392  -4.132
  367   HD23  LEU  48          3HD2      LEU  48  -9.152  -2.583  -4.703
  368    H    GLU  49           H        GLU  49 -10.438  -6.420  -2.736
  369    HA   GLU  49           HA       GLU  49 -12.703  -4.949  -3.655
  370    HB2  GLU  49          2HB       GLU  49 -12.141  -6.859  -4.926
  371    HB3  GLU  49          1HB       GLU  49 -12.059  -7.892  -3.504
  372    HG2  GLU  49          2HG       GLU  49 -14.686  -6.605  -3.980
  373    HG3  GLU  49          1HG       GLU  49 -14.200  -7.799  -5.178
  374    H    ASP  50           H        ASP  50 -12.306  -7.223  -0.948
  375    HA   ASP  50           HA       ASP  50 -15.055  -7.091  -0.101
  376    HB2  ASP  50          2HB       ASP  50 -13.379  -8.875   0.534
  377    HB3  ASP  50          1HB       ASP  50 -12.647  -7.691   1.614
  378    H    ARG  51           H        ARG  51 -12.119  -5.372   0.910
  379    HA   ARG  51           HA       ARG  51 -13.320  -3.893   3.029
  380    HB2  ARG  51          2HB       ARG  51 -10.857  -4.164   2.652
  381    HB3  ARG  51          1HB       ARG  51 -10.984  -3.050   1.294
  382    HG2  ARG  51          2HG       ARG  51 -10.349  -1.623   3.036
  383    HG3  ARG  51          1HG       ARG  51 -12.102  -1.452   3.046
  384    HD2  ARG  51          2HD       ARG  51 -12.245  -3.161   4.844
  385    HD3  ARG  51          1HD       ARG  51 -10.487  -3.284   4.845
  386    HE   ARG  51           HE       ARG  51 -12.028  -1.202   6.119
  387   HH11  ARG  51          1HH1      ARG  51 -10.865   0.505   7.037
  388   HH12  ARG  51          2HH1      ARG  51  -9.217   0.764   6.569
  389   HH21  ARG  51          1HH2      ARG  51  -9.150  -1.906   4.357
  390   HH22  ARG  51          2HH2      ARG  51  -8.247  -0.601   5.051
  391    H    PHE  52           H        PHE  52 -12.834  -3.002  -0.412
  392    HA   PHE  52           HA       PHE  52 -14.506  -0.590   0.091
  393    HB2  PHE  52          2HB       PHE  52 -12.601  -1.310  -2.145
  394    HB3  PHE  52          1HB       PHE  52 -13.601   0.139  -2.135
  395    HD1  PHE  52          1HD       PHE  52 -10.708  -1.547  -0.643
  396    HD2  PHE  52          2HD       PHE  52 -13.230   1.926  -0.475
  397    HE1  PHE  52          1HE       PHE  52  -9.032  -0.399   0.779
  398    HE2  PHE  52          2HE       PHE  52 -11.554   3.074   0.948
  399    HZ   PHE  52           HZ       PHE  52  -9.455   1.912   1.575
  400    H    GLY  53           H        GLY  53 -14.831  -3.713  -1.122
  401    HA2  GLY  53          2HA       GLY  53 -16.673  -4.690  -2.233
  402    HA3  GLY  53          1HA       GLY  53 -17.457  -3.110  -2.196
  403    H    ILE  54           H        ILE  54 -14.259  -3.572  -3.576
  404    HA   ILE  54           HA       ILE  54 -15.351  -2.707  -6.200
  405    HB   ILE  54           HB       ILE  54 -12.473  -2.983  -5.276
  406   HG12  ILE  54          2HG1      ILE  54 -14.138  -0.468  -5.577
  407   HG13  ILE  54          1HG1      ILE  54 -13.891  -1.286  -4.034
  408   HG21  ILE  54          1HG2      ILE  54 -12.421  -3.015  -7.626
  409   HG22  ILE  54          2HG2      ILE  54 -12.245  -1.299  -7.257
  410   HG23  ILE  54          3HG2      ILE  54 -13.810  -1.937  -7.765
  411   HD11  ILE  54          1HD1      ILE  54 -11.631  -0.334  -5.812
  412   HD12  ILE  54          2HD1      ILE  54 -11.500  -0.961  -4.169
  413   HD13  ILE  54          3HD1      ILE  54 -12.273   0.597  -4.459
  414    H    ALA  55           H        ALA  55 -15.254  -4.044  -8.011
  415    HA   ALA  55           HA       ALA  55 -15.087  -6.863  -7.627
  416    HB1  ALA  55          1HB       ALA  55 -16.109  -5.372  -9.585
  417    HB2  ALA  55          2HB       ALA  55 -15.608  -7.038  -9.873
  418    HB3  ALA  55          3HB       ALA  55 -14.546  -5.707 -10.330
  419    H    ALA  56           H        ALA  56 -13.402  -8.279  -7.779
  420    HA   ALA  56           HA       ALA  56 -10.701  -7.303  -7.641
  421    HB1  ALA  56          1HB       ALA  56 -11.902 -10.055  -7.995
  422    HB2  ALA  56          2HB       ALA  56 -11.142  -9.374  -6.555
  423    HB3  ALA  56          3HB       ALA  56 -10.157  -9.797  -7.956
  424    H    ASP  57           H        ASP  57 -12.771  -8.286 -10.257
  425    HA   ASP  57           HA       ASP  57 -10.911  -9.009 -12.239
  426    HB2  ASP  57          2HB       ASP  57 -13.515  -7.501 -12.476
  427    HB3  ASP  57          1HB       ASP  57 -12.622  -8.125 -13.860
  428    H    ASP  58           H        ASP  58 -11.750  -5.809 -11.022
  429    HA   ASP  58           HA       ASP  58 -10.596  -4.275 -13.128
  430    HB2  ASP  58          2HB       ASP  58 -12.029  -3.350 -11.302
  431    HB3  ASP  58          1HB       ASP  58 -10.680  -3.570 -10.191
  432    H    VAL  59           H        VAL  59  -8.521  -4.233 -13.777
  433    HA   VAL  59           HA       VAL  59  -6.386  -4.881 -11.780
  434    HB   VAL  59           HB       VAL  59  -5.054  -5.721 -13.640
  435   HG11  VAL  59          1HG1      VAL  59  -7.750  -6.906 -14.197
  436   HG12  VAL  59          2HG1      VAL  59  -7.092  -7.041 -12.567
  437   HG13  VAL  59          3HG1      VAL  59  -6.204  -7.715 -13.934
  438   HG21  VAL  59          1HG2      VAL  59  -6.687  -5.866 -15.843
  439   HG22  VAL  59          2HG2      VAL  59  -5.445  -4.636 -15.605
  440   HG23  VAL  59          3HG2      VAL  59  -7.122  -4.289 -15.185
  441    H    GLU  60           H        GLU  60  -7.641  -2.244 -12.444
  442    HA   GLU  60           HA       GLU  60  -6.091  -0.614 -14.107
  443    HB2  GLU  60          2HB       GLU  60  -8.133   0.113 -12.859
  444    HB3  GLU  60          1HB       GLU  60  -7.169   0.175 -11.388
  445    HG2  GLU  60          2HG       GLU  60  -5.647   1.794 -12.497
  446    HG3  GLU  60          1HG       GLU  60  -6.711   1.788 -13.899
  447    H    LEU  61           H        LEU  61  -5.230  -2.016 -11.018
  448    HA   LEU  61           HA       LEU  61  -3.016  -0.233 -10.475
  449    HB2  LEU  61          2HB       LEU  61  -3.416  -3.084  -9.522
  450    HB3  LEU  61          1HB       LEU  61  -2.375  -1.867  -8.789
  451    HG   LEU  61           HG       LEU  61  -5.387  -1.749  -9.005
  452   HD11  LEU  61          1HD1      LEU  61  -4.195  -3.239  -7.244
  453   HD12  LEU  61          2HD1      LEU  61  -5.431  -2.115  -6.676
  454   HD13  LEU  61          3HD1      LEU  61  -3.723  -1.715  -6.493
  455   HD21  LEU  61          1HD2      LEU  61  -4.875   0.297  -7.426
  456   HD22  LEU  61          2HD2      LEU  61  -4.766   0.497  -9.175
  457   HD23  LEU  61          3HD2      LEU  61  -3.301   0.265  -8.221
  458    H    SER  62           H        SER  62  -0.888  -0.410 -11.097
  459    HA   SER  62           HA       SER  62  -0.128  -2.730 -12.808
  460    HB2  SER  62          2HB       SER  62   1.384  -0.598 -13.730
  461    HB3  SER  62          1HB       SER  62  -0.055  -1.244 -14.511
  462    HG   SER  62           HG       SER  62   0.319   1.105 -13.190
  463    HA   PRO  63           HA       PRO  63   3.502  -3.205 -10.363
  464    HB2  PRO  63          2HB       PRO  63   5.508  -3.105 -12.329
  465    HB3  PRO  63          1HB       PRO  63   4.625  -4.553 -11.821
  466    HG2  PRO  63          2HG       PRO  63   4.235  -2.837 -14.197
  467    HG3  PRO  63          1HG       PRO  63   3.954  -4.573 -13.993
  468    HD2  PRO  63          2HD       PRO  63   1.919  -2.771 -14.083
  469    HD3  PRO  63          1HD       PRO  63   1.825  -4.264 -13.127
  470    H    GLU  64           H        GLU  64   3.684  -0.663 -12.814
  471    HA   GLU  64           HA       GLU  64   5.817   0.821 -11.568
  472    HB2  GLU  64          2HB       GLU  64   5.090   1.107 -13.948
  473    HB3  GLU  64          1HB       GLU  64   3.624   1.873 -13.359
  474    HG2  GLU  64          2HG       GLU  64   5.016   3.559 -12.182
  475    HG3  GLU  64          1HG       GLU  64   6.450   2.825 -12.892
  476    H    HIS  65           H        HIS  65   2.390   0.577 -11.035
  477    HA   HIS  65           HA       HIS  65   2.029   3.057  -9.616
  478    HB2  HIS  65          2HB       HIS  65   0.153   1.703 -10.528
  479    HB3  HIS  65          1HB       HIS  65   0.492   0.457  -9.327
  480    HD1  HIS  65          1HD       HIS  65  -0.870   0.657  -7.262
  481    HD2  HIS  65          2HD       HIS  65  -0.296   4.368  -9.076
  482    HE1  HIS  65          1HE       HIS  65  -2.143   2.344  -5.863
  483    HE2  HIS  65          2HE       HIS  65  -1.799   4.606  -6.958
  484    H    PHE  66           H        PHE  66   3.319  -0.055  -8.710
  485    HA   PHE  66           HA       PHE  66   3.172   0.581  -5.832
  486    HB2  PHE  66          2HB       PHE  66   4.228  -1.799  -7.379
  487    HB3  PHE  66          1HB       PHE  66   4.311  -1.669  -5.624
  488    HD1  PHE  66          1HD       PHE  66   2.143  -2.235  -8.507
  489    HD2  PHE  66          2HD       PHE  66   2.227  -1.539  -4.270
  490    HE1  PHE  66          1HE       PHE  66  -0.213  -2.991  -8.335
  491    HE2  PHE  66          2HE       PHE  66  -0.128  -2.295  -4.098
  492    HZ   PHE  66           HZ       PHE  66  -1.349  -3.018  -6.131
  493    H    ARG  67           H        ARG  67   5.019   1.786  -8.141
  494    HA   ARG  67           HA       ARG  67   7.708   1.266  -7.453
  495    HB2  ARG  67          2HB       ARG  67   7.025   2.568  -9.442
  496    HB3  ARG  67          1HB       ARG  67   6.486   3.878  -8.399
  497    HG2  ARG  67          2HG       ARG  67   8.648   4.528  -9.130
  498    HG3  ARG  67          1HG       ARG  67   8.893   3.924  -7.497
  499    HD2  ARG  67          2HD       ARG  67   9.676   1.784  -8.348
  500    HD3  ARG  67          1HD       ARG  67   9.294   2.264 -10.000
  501    HE   ARG  67           HE       ARG  67  11.171   4.056  -8.650
  502   HH11  ARG  67          1HH1      ARG  67  13.254   4.089  -9.525
  503   HH12  ARG  67          2HH1      ARG  67  13.731   2.851 -10.637
  504   HH21  ARG  67          1HH2      ARG  67  10.682   1.204 -10.524
  505   HH22  ARG  67          2HH2      ARG  67  12.276   1.217 -11.203
  506    H    SER  68           H        SER  68   5.408   3.587  -6.015
  507    HA   SER  68           HA       SER  68   7.192   3.697  -3.643
  508    HB2  SER  68          2HB       SER  68   7.166   6.115  -3.554
  509    HB3  SER  68          1HB       SER  68   7.753   5.635  -5.144
  510    HG   SER  68           HG       SER  68   6.117   7.283  -5.190
  511    H    ILE  69           H        ILE  69   6.083   4.345  -1.704
  512    HA   ILE  69           HA       ILE  69   3.359   3.486  -1.532
  513    HB   ILE  69           HB       ILE  69   5.016   5.123   0.408
  514   HG12  ILE  69          2HG1      ILE  69   4.495   2.149   0.340
  515   HG13  ILE  69          1HG1      ILE  69   5.964   2.899  -0.267
  516   HG21  ILE  69          1HG2      ILE  69   3.142   3.412   1.663
  517   HG22  ILE  69          2HG2      ILE  69   2.275   4.321   0.426
  518   HG23  ILE  69          3HG2      ILE  69   3.177   5.173   1.680
  519   HD11  ILE  69          1HD1      ILE  69   5.419   3.926   2.354
  520   HD12  ILE  69          2HD1      ILE  69   6.813   2.991   1.813
  521   HD13  ILE  69          3HD1      ILE  69   5.376   2.163   2.411
  522    H    ARG  70           H        ARG  70   4.870   6.685  -1.744
  523    HA   ARG  70           HA       ARG  70   2.585   8.261  -1.132
  524    HB2  ARG  70          2HB       ARG  70   4.935   9.103  -1.365
  525    HB3  ARG  70          1HB       ARG  70   4.778   8.930  -3.113
  526    HG2  ARG  70          2HG       ARG  70   2.752  10.436  -2.991
  527    HG3  ARG  70          1HG       ARG  70   3.156  10.734  -1.299
  528    HD2  ARG  70          2HD       ARG  70   4.848  11.373  -3.727
  529    HD3  ARG  70          1HD       ARG  70   4.146  12.514  -2.580
  530    HE   ARG  70           HE       ARG  70   6.014  10.553  -1.433
  531   HH11  ARG  70          1HH1      ARG  70   7.833  11.470  -0.454
  532   HH12  ARG  70          2HH1      ARG  70   8.180  13.148  -0.703
  533   HH21  ARG  70          1HH2      ARG  70   5.434  13.690  -2.747
  534   HH22  ARG  70          2HH2      ARG  70   6.823  14.404  -2.001
  535    H    SER  71           H        SER  71   3.722   6.985  -4.261
  536    HA   SER  71           HA       SER  71   1.790   8.245  -5.901
  537    HB2  SER  71          2HB       SER  71   2.959   5.474  -6.266
  538    HB3  SER  71          1HB       SER  71   2.270   6.496  -7.522
  539    HG   SER  71           HG       SER  71   3.936   8.063  -6.821
  540    H    ILE  72           H        ILE  72   1.604   5.195  -4.078
  541    HA   ILE  72           HA       ILE  72  -0.912   4.334  -5.069
  542    HB   ILE  72           HB       ILE  72   0.292   3.913  -2.318
  543   HG12  ILE  72          2HG1      ILE  72   0.482   2.203  -4.819
  544   HG13  ILE  72          1HG1      ILE  72   1.769   3.261  -4.240
  545   HG21  ILE  72          1HG2      ILE  72  -2.215   3.177  -3.428
  546   HG22  ILE  72          2HG2      ILE  72  -1.521   2.661  -1.892
  547   HG23  ILE  72          3HG2      ILE  72  -1.233   1.716  -3.352
  548   HD11  ILE  72          1HD1      ILE  72   2.446   1.698  -2.773
  549   HD12  ILE  72          2HD1      ILE  72   1.242   0.594  -3.440
  550   HD13  ILE  72          3HD1      ILE  72   0.833   1.622  -2.066
  551    H    ASP  73           H        ASP  73  -0.061   6.459  -2.355
  552    HA   ASP  73           HA       ASP  73  -2.665   6.761  -1.267
  553    HB2  ASP  73          2HB       ASP  73  -0.494   7.580  -0.257
  554    HB3  ASP  73          1HB       ASP  73  -0.549   8.921  -1.399
  555    H    ALA  74           H        ALA  74  -1.073   8.441  -3.963
  556    HA   ALA  74           HA       ALA  74  -3.079  10.448  -4.311
  557    HB1  ALA  74          1HB       ALA  74  -1.843   9.513  -6.800
  558    HB2  ALA  74          2HB       ALA  74  -0.669   9.834  -5.524
  559    HB3  ALA  74          3HB       ALA  74  -1.776  11.105  -6.043
  560    H    PHE  75           H        PHE  75  -2.711   7.233  -5.831
  561    HA   PHE  75           HA       PHE  75  -5.127   7.486  -7.388
  562    HB2  PHE  75          2HB       PHE  75  -3.416   5.150  -6.547
  563    HB3  PHE  75          1HB       PHE  75  -4.923   4.907  -7.426
  564    HD1  PHE  75          1HD       PHE  75  -5.202   5.734  -9.721
  565    HD2  PHE  75          2HD       PHE  75  -1.495   6.219  -7.609
  566    HE1  PHE  75          1HE       PHE  75  -4.062   6.298 -11.850
  567    HE2  PHE  75          2HE       PHE  75  -0.355   6.784  -9.737
  568    HZ   PHE  75           HZ       PHE  75  -1.639   6.822 -11.858
  569    H    VAL  76           H        VAL  76  -4.402   6.095  -4.199
  570    HA   VAL  76           HA       VAL  76  -7.015   5.032  -3.723
  571    HB   VAL  76           HB       VAL  76  -4.818   5.961  -1.857
  572   HG11  VAL  76          1HG1      VAL  76  -6.840   6.114  -0.599
  573   HG12  VAL  76          2HG1      VAL  76  -6.117   4.565  -0.171
  574   HG13  VAL  76          3HG1      VAL  76  -7.470   4.625  -1.301
  575   HG21  VAL  76          1HG2      VAL  76  -4.996   3.749  -3.515
  576   HG22  VAL  76          2HG2      VAL  76  -5.584   3.128  -1.972
  577   HG23  VAL  76          3HG2      VAL  76  -3.983   3.862  -2.075
  578    H    VAL  77           H        VAL  77  -5.532   8.197  -2.991
  579    HA   VAL  77           HA       VAL  77  -7.750   9.262  -1.543
  580    HB   VAL  77           HB       VAL  77  -5.574  10.584  -3.183
  581   HG11  VAL  77          1HG1      VAL  77  -6.320  12.574  -1.648
  582   HG12  VAL  77          2HG1      VAL  77  -7.853  11.706  -1.588
  583   HG13  VAL  77          3HG1      VAL  77  -7.206  12.246  -3.136
  584   HG21  VAL  77          1HG2      VAL  77  -5.385   9.241  -0.814
  585   HG22  VAL  77          2HG2      VAL  77  -5.748  10.869  -0.239
  586   HG23  VAL  77          3HG2      VAL  77  -4.337  10.588  -1.260
  587    H    GLY  78           H        GLY  78  -6.923   9.299  -4.995
  588    HA2  GLY  78          2HA       GLY  78  -8.997  11.026  -5.873
  589    HA3  GLY  78          1HA       GLY  78  -8.226   9.797  -6.872
  590    H    ALA  79           H        ALA  79  -9.084   7.585  -5.057
  591    HA   ALA  79           HA       ALA  79 -11.892   7.462  -6.030
  592    HB1  ALA  79          1HB       ALA  79 -11.662   5.014  -5.705
  593    HB2  ALA  79          2HB       ALA  79 -10.017   5.266  -5.120
  594    HB3  ALA  79          3HB       ALA  79 -10.428   5.656  -6.790
  595    H    THR  80           H        THR  80  -9.980   6.652  -3.123
  596    HA   THR  80           HA       THR  80 -12.458   7.145  -1.524
  597    HB   THR  80           HB       THR  80 -12.042   5.236  -0.155
  598    HG1  THR  80          1HG       THR  80  -9.595   5.692  -0.616
  599   HG21  THR  80          1HG2      THR  80 -13.087   4.665  -2.285
  600   HG22  THR  80          2HG2      THR  80 -11.989   3.372  -1.806
  601   HG23  THR  80          3HG2      THR  80 -11.506   4.524  -3.052
  602    H    THR  81           H        THR  81 -12.036   7.922   0.642
  603    HA   THR  81           HA       THR  81  -9.229   8.724   1.188
  604    HB   THR  81           HB       THR  81 -10.362  10.625   0.058
  605    HG1  THR  81          1HG       THR  81 -10.127  12.065   2.008
  606   HG21  THR  81          1HG2      THR  81 -12.098  11.164   2.384
  607   HG22  THR  81          2HG2      THR  81 -12.594   9.789   1.397
  608   HG23  THR  81          3HG2      THR  81 -12.418  11.383   0.664
  609    HA   PRO  82           HA       PRO  82 -11.276   7.183   5.001
  610    HB2  PRO  82          2HB       PRO  82  -9.327   5.470   5.765
  611    HB3  PRO  82          1HB       PRO  82 -10.514   5.049   4.515
  612    HG2  PRO  82          2HG       PRO  82  -7.672   5.826   4.238
  613    HG3  PRO  82          1HG       PRO  82  -8.649   4.728   3.252
  614    HD2  PRO  82          2HD       PRO  82  -8.015   7.404   2.614
  615    HD3  PRO  82          1HD       PRO  82  -9.246   6.400   1.818
  616    HA   PRO  83           HA       PRO  83  -9.273   9.793   7.954
  617    HB2  PRO  83          2HB       PRO  83  -9.340   8.159  10.217
  618    HB3  PRO  83          1HB       PRO  83 -10.670   9.188   9.657
  619    HG2  PRO  83          2HG       PRO  83 -10.262   6.271   9.319
  620    HG3  PRO  83          1HG       PRO  83 -11.761   7.189   9.541
  621    HD2  PRO  83          2HD       PRO  83 -11.013   6.202   7.120
  622    HD3  PRO  83          1HD       PRO  83 -11.936   7.713   7.287
  623    H    VAL  84           H        VAL  84  -7.211  10.140   8.915
  624    HA   VAL  84           HA       VAL  84  -5.321   7.824   8.814
  625    HB   VAL  84           HB       VAL  84  -5.000   9.311   6.844
  626   HG11  VAL  84          1HG1      VAL  84  -5.791  11.391   7.995
  627   HG12  VAL  84          2HG1      VAL  84  -4.243  11.604   7.176
  628   HG13  VAL  84          3HG1      VAL  84  -4.295  11.401   8.926
  629   HG21  VAL  84          1HG2      VAL  84  -2.628   9.928   8.521
  630   HG22  VAL  84          2HG2      VAL  84  -2.722   9.097   6.968
  631   HG23  VAL  84          3HG2      VAL  84  -3.098   8.229   8.457
  632    H    GLU  85           H        GLU  85  -3.861   7.724  10.497
  633    HA   GLU  85           HA       GLU  85  -4.119   9.829  12.598
  634    HB2  GLU  85          2HB       GLU  85  -3.348   6.908  12.883
  635    HB3  GLU  85          1HB       GLU  85  -3.471   8.068  14.205
  636    HG2  GLU  85          2HG       GLU  85  -5.869   8.420  13.638
  637    HG3  GLU  85          1HG       GLU  85  -5.731   7.185  12.386
  638    H    ALA  86           H        ALA  86  -2.079  10.263  13.818
  639    HA   ALA  86           HA       ALA  86   0.107  10.838  12.132
  640    HB1  ALA  86          1HB       ALA  86  -0.032  11.929  14.272
  641    HB2  ALA  86          2HB       ALA  86   1.440  10.958  14.295
  642    HB3  ALA  86          3HB       ALA  86  -0.006  10.386  15.126
  643    H    LYS  87           H        LYS  87   1.844   9.641  11.419
  644    HA   LYS  87           HA       LYS  87   1.745   6.798  11.472
  645    HB2  LYS  87          2HB       LYS  87   2.992   8.208   9.790
  646    HB3  LYS  87          1HB       LYS  87   4.222   8.486  11.023
  647    HG2  LYS  87          2HG       LYS  87   4.569   6.042  11.217
  648    HG3  LYS  87          1HG       LYS  87   3.365   5.779   9.956
  649    HD2  LYS  87          2HD       LYS  87   4.772   7.223   8.432
  650    HD3  LYS  87          1HD       LYS  87   6.017   7.215   9.680
  651    HE2  LYS  87          2HE       LYS  87   5.197   5.064   7.827
  652    HE3  LYS  87          1HE       LYS  87   6.753   5.344   8.607
  653    HZ1  LYS  87          1HZ       LYS  87   4.340   4.090   9.785
  654    HZ2  LYS  87          2HZ       LYS  87   5.678   4.580  10.712
  655    HZ3  LYS  87          3HZ       LYS  87   5.857   3.377   9.526
  656    H    LEU  88           H        LEU  88   3.405   9.119  13.556
  657    HA   LEU  88           HA       LEU  88   4.803   6.985  15.018
  658    HB2  LEU  88          2HB       LEU  88   4.528   9.927  15.706
  659    HB3  LEU  88          1HB       LEU  88   5.695   8.792  16.386
  660    HG   LEU  88           HG       LEU  88   5.530   9.675  13.490
  661   HD11  LEU  88          1HD1      LEU  88   6.728  10.900  15.688
  662   HD12  LEU  88          2HD1      LEU  88   7.129  11.189  13.995
  663   HD13  LEU  88          3HD1      LEU  88   8.049  10.009  14.931
  664   HD21  LEU  88          1HD2      LEU  88   7.822   8.344  13.571
  665   HD22  LEU  88          2HD2      LEU  88   6.304   7.491  13.292
  666   HD23  LEU  88          3HD2      LEU  88   7.032   7.494  14.898
  667    H    GLN  89           H        GLN  89   4.227   6.235  17.072
  668    HA   GLN  89           HA       GLN  89   1.432   6.792  17.874
  669    HB2  GLN  89          2HB       GLN  89   3.442   4.749  18.872
  670    HB3  GLN  89          1HB       GLN  89   1.768   4.867  19.417
  671    HG2  GLN  89          2HG       GLN  89   1.019   4.541  17.057
  672    HG3  GLN  89          1HG       GLN  89   2.703   4.300  16.590
  673   HE21  GLN  89          1HE2      GLN  89   2.539   3.057  19.652
  674   HE22  GLN  89          2HE2      GLN  89   2.175   1.440  19.289
  675    H1   PN7 101          3HO       SAT 101   2.966  -5.673 -13.028
  676    H2   PN7 101          1H1       SAT 101   1.467  -8.394 -10.055
  677    H3   PN7 101          2H1       SAT 101   2.334  -9.463 -11.154
  678    H5   PN7 101          1HE1      SAT 101   4.950  -7.587 -10.904
  679    H6   PN7 101          2HE1      SAT 101   4.613  -6.759 -12.424
  680    H7   PN7 101          3HE1      SAT 101   4.424  -8.508 -12.313
  681    H8   PN7 101          2HE2      SAT 101   3.703  -5.813 -10.163
  682    H9   PN7 101          3HE2      SAT 101   2.059  -6.253  -9.711
  683    H10  PN7 101          1HE2      SAT 101   2.350  -5.307 -11.170
  684    H11  PN7 101          3H        SAT 101   1.897  -8.278 -13.057
  685    H12  PN7 101          5H        SAT 101   0.222  -4.916 -12.762
  686    H13  PN7 101          1H6       SAT 101  -1.240  -7.212 -13.935
  687    H14  PN7 101          2H6       SAT 101  -1.644  -5.511 -14.164
  688    H15  PN7 101          1H7       SAT 101   1.008  -6.224 -15.204
  689    H16  PN7 101          2H7       SAT 101  -0.298  -5.323 -15.978
  690    H17  PN7 101          9H        SAT 101   0.116  -9.166 -15.391
  691    H18  PN7 101          1H10      SAT 101   1.155  -9.577 -17.717
  692    H19  PN7 101          2H10      SAT 101   1.658  -7.890 -17.609
  693    H20  PN7 101          1H11      SAT 101   2.958 -10.218 -16.533
  694    H21  PN7 101          2H11      SAT 101   2.488  -9.158 -15.205
  695    H22  PN7 101          2HS1      SAT 101   4.464  -7.810 -15.845
  Start of MODEL   14
    1    H1   MET   1          1HT       MET   1  -1.985  13.658  -0.210
    2    H2   MET   1          2HT       MET   1  -0.457  14.318  -0.551
    3    H3   MET   1          3HT       MET   1  -1.440  15.019   0.644
    4    HA   MET   1           HA       MET   1  -0.567  12.212   0.878
    5    HB2  MET   1          2HB       MET   1   0.949  14.692   1.743
    6    HB3  MET   1          1HB       MET   1   1.343  13.048   2.243
    7    HG2  MET   1          2HG       MET   1   1.574  12.437  -0.184
    8    HG3  MET   1          1HG       MET   1   1.366  14.141  -0.581
    9    HE1  MET   1          1HE       MET   1   3.201  11.421   1.044
   10    HE2  MET   1          2HE       MET   1   3.520  12.394   2.478
   11    HE3  MET   1          3HE       MET   1   4.841  11.986   1.387
   12    H    GLN   2           H        GLN   2  -3.058  13.218   1.588
   13    HA   GLN   2           HA       GLN   2  -3.236  14.370   4.183
   14    HB2  GLN   2          2HB       GLN   2  -5.120  12.429   2.807
   15    HB3  GLN   2          1HB       GLN   2  -5.520  13.386   4.234
   16    HG2  GLN   2          2HG       GLN   2  -5.101  15.461   2.969
   17    HG3  GLN   2          1HG       GLN   2  -4.696  14.509   1.540
   18   HE21  GLN   2          1HE2      GLN   2  -6.847  16.319   1.376
   19   HE22  GLN   2          2HE2      GLN   2  -8.306  15.457   1.293
   20    H    HIS   3           H        HIS   3  -2.882  10.999   3.144
   21    HA   HIS   3           HA       HIS   3  -2.094  10.312   5.921
   22    HB2  HIS   3          2HB       HIS   3  -4.131   8.712   4.342
   23    HB3  HIS   3          1HB       HIS   3  -3.534   8.340   5.960
   24    HD1  HIS   3          1HD       HIS   3  -3.955  10.419   7.760
   25    HD2  HIS   3          2HD       HIS   3  -6.415  10.271   4.395
   26    HE1  HIS   3          1HE       HIS   3  -5.981  11.848   8.287
   27    HE2  HIS   3          2HE       HIS   3  -7.484  11.764   6.246
   28    H    ALA   4           H        ALA   4  -0.589  10.644   3.452
   29    HA   ALA   4           HA       ALA   4  -0.026   8.185   2.146
   30    HB1  ALA   4          1HB       ALA   4   2.283   9.976   2.607
   31    HB2  ALA   4          2HB       ALA   4   0.875  10.747   1.880
   32    HB3  ALA   4          3HB       ALA   4   1.623   9.358   1.093
   33    H    SER   5           H        SER   5   1.104   9.490   5.222
   34    HA   SER   5           HA       SER   5   3.292   7.743   5.660
   35    HB2  SER   5          2HB       SER   5   1.355   8.791   7.741
   36    HB3  SER   5          1HB       SER   5   2.995   8.218   8.035
   37    HG   SER   5           HG       SER   5   2.203  10.444   6.453
   38    H    VAL   6           H        VAL   6  -0.184   7.243   6.182
   39    HA   VAL   6           HA       VAL   6   0.061   4.740   7.558
   40    HB   VAL   6           HB       VAL   6  -2.144   5.862   5.824
   41   HG11  VAL   6          1HG1      VAL   6  -3.532   4.057   6.970
   42   HG12  VAL   6          2HG1      VAL   6  -2.007   3.315   7.455
   43   HG13  VAL   6          3HG1      VAL   6  -2.404   3.476   5.744
   44   HG21  VAL   6          1HG2      VAL   6  -3.240   6.275   7.972
   45   HG22  VAL   6          2HG2      VAL   6  -1.644   7.025   7.974
   46   HG23  VAL   6          3HG2      VAL   6  -1.904   5.503   8.826
   47    H    ILE   7           H        ILE   7  -0.174   5.571   4.124
   48    HA   ILE   7           HA       ILE   7  -0.338   2.920   3.110
   49    HB   ILE   7           HB       ILE   7   1.002   5.341   1.869
   50   HG12  ILE   7          2HG1      ILE   7  -1.835   4.295   1.596
   51   HG13  ILE   7          1HG1      ILE   7  -1.373   5.676   2.590
   52   HG21  ILE   7          1HG2      ILE   7  -0.178   2.851   0.592
   53   HG22  ILE   7          2HG2      ILE   7   1.548   3.156   0.788
   54   HG23  ILE   7          3HG2      ILE   7   0.581   4.198  -0.256
   55   HD11  ILE   7          1HD1      ILE   7  -1.952   5.641  -0.196
   56   HD12  ILE   7          2HD1      ILE   7  -0.240   6.026  -0.014
   57   HD13  ILE   7          3HD1      ILE   7  -1.458   7.016   0.793
   58    H    ALA   8           H        ALA   8   2.518   4.976   3.725
   59    HA   ALA   8           HA       ALA   8   4.453   3.004   2.954
   60    HB1  ALA   8          1HB       ALA   8   6.066   4.431   3.921
   61    HB2  ALA   8          2HB       ALA   8   4.934   5.034   5.131
   62    HB3  ALA   8          3HB       ALA   8   4.779   5.541   3.449
   63    H    GLN   9           H        GLN   9   2.947   3.825   6.046
   64    HA   GLN   9           HA       GLN   9   4.356   1.877   7.615
   65    HB2  GLN   9          2HB       GLN   9   3.088   3.788   8.586
   66    HB3  GLN   9          1HB       GLN   9   1.585   3.045   8.038
   67    HG2  GLN   9          2HG       GLN   9   2.932   1.011   9.421
   68    HG3  GLN   9          1HG       GLN   9   3.157   2.457  10.405
   69   HE21  GLN   9          1HE2      GLN   9   0.438   1.134   8.417
   70   HE22  GLN   9          2HE2      GLN   9  -0.735   1.344   9.627
   71    H    PHE  10           H        PHE  10   1.375   1.809   5.732
   72    HA   PHE  10           HA       PHE  10   0.382  -0.715   6.574
   73    HB2  PHE  10          2HB       PHE  10  -0.754   1.064   5.127
   74    HB3  PHE  10          1HB       PHE  10   0.166   0.411   3.775
   75    HD1  PHE  10          1HD       PHE  10  -2.591  -0.141   6.108
   76    HD2  PHE  10          2HD       PHE  10  -0.242  -1.899   2.972
   77    HE1  PHE  10          1HE       PHE  10  -4.310  -1.902   5.810
   78    HE2  PHE  10          2HE       PHE  10  -1.961  -3.664   2.677
   79    HZ   PHE  10           HZ       PHE  10  -3.996  -3.658   4.094
   80    H    VAL  11           H        VAL  11   2.386   0.063   3.714
   81    HA   VAL  11           HA       VAL  11   2.814  -2.740   3.094
   82    HB   VAL  11           HB       VAL  11   2.943  -0.720   1.486
   83   HG11  VAL  11          1HG1      VAL  11   4.612   0.468   3.006
   84   HG12  VAL  11          2HG1      VAL  11   5.041   0.406   1.297
   85   HG13  VAL  11          3HG1      VAL  11   5.810  -0.695   2.439
   86   HG21  VAL  11          1HG2      VAL  11   5.166  -1.941   0.483
   87   HG22  VAL  11          2HG2      VAL  11   3.537  -2.602   0.342
   88   HG23  VAL  11          3HG2      VAL  11   4.607  -3.160   1.627
   89    H    VAL  12           H        VAL  12   4.744  -0.223   4.690
   90    HA   VAL  12           HA       VAL  12   7.104  -1.793   5.047
   91    HB   VAL  12           HB       VAL  12   6.061   0.511   6.701
   92   HG11  VAL  12          1HG1      VAL  12   8.435   0.785   7.354
   93   HG12  VAL  12          2HG1      VAL  12   8.839  -0.680   6.460
   94   HG13  VAL  12          3HG1      VAL  12   7.798  -0.772   7.877
   95   HG21  VAL  12          1HG2      VAL  12   6.617   0.640   4.088
   96   HG22  VAL  12          2HG2      VAL  12   8.265   0.752   4.700
   97   HG23  VAL  12          3HG2      VAL  12   7.059   1.943   5.188
   98    H    GLU  13           H        GLU  13   4.186  -1.471   7.027
   99    HA   GLU  13           HA       GLU  13   5.131  -2.667   9.401
  100    HB2  GLU  13          2HB       GLU  13   2.895  -1.629   9.176
  101    HB3  GLU  13          1HB       GLU  13   2.383  -3.000   8.203
  102    HG2  GLU  13          2HG       GLU  13   2.914  -4.513  10.104
  103    HG3  GLU  13          1HG       GLU  13   3.321  -3.099  11.072
  104    H    GLU  14           H        GLU  14   4.040  -4.203   6.409
  105    HA   GLU  14           HA       GLU  14   4.003  -6.876   7.457
  106    HB2  GLU  14          2HB       GLU  14   4.384  -5.821   4.650
  107    HB3  GLU  14          1HB       GLU  14   4.224  -7.535   5.024
  108    HG2  GLU  14          2HG       GLU  14   2.187  -5.398   5.720
  109    HG3  GLU  14          1HG       GLU  14   2.056  -6.516   4.363
  110    H    PHE  15           H        PHE  15   6.591  -4.838   6.196
  111    HA   PHE  15           HA       PHE  15   8.516  -6.979   6.999
  112    HB2  PHE  15          2HB       PHE  15   9.270  -5.262   4.692
  113    HB3  PHE  15          1HB       PHE  15   9.638  -6.959   4.999
  114    HD1  PHE  15          1HD       PHE  15   8.064  -8.726   4.390
  115    HD2  PHE  15          2HD       PHE  15   7.159  -4.591   3.670
  116    HE1  PHE  15          1HE       PHE  15   6.196  -9.394   2.901
  117    HE2  PHE  15          2HE       PHE  15   5.290  -5.255   2.189
  118    HZ   PHE  15           HZ       PHE  15   4.809  -7.659   1.799
  119    H    LEU  16           H        LEU  16   7.802  -4.769   8.623
  120    HA   LEU  16           HA       LEU  16   9.751  -2.655   8.192
  121    HB2  LEU  16          2HB       LEU  16   8.662  -1.498   9.825
  122    HB3  LEU  16          1HB       LEU  16   7.395  -2.650   9.468
  123    HG   LEU  16           HG       LEU  16   9.427  -2.895  11.714
  124   HD11  LEU  16          1HD1      LEU  16   7.976  -1.378  12.601
  125   HD12  LEU  16          2HD1      LEU  16   7.006  -2.822  12.895
  126   HD13  LEU  16          3HD1      LEU  16   6.678  -1.809  11.489
  127   HD21  LEU  16          1HD2      LEU  16   8.702  -5.025  12.056
  128   HD22  LEU  16          2HD2      LEU  16   8.069  -4.950  10.414
  129   HD23  LEU  16          3HD2      LEU  16   7.021  -4.574  11.778
  130    HA   PRO  17           HA       PRO  17  12.979  -4.789  10.444
  131    HB2  PRO  17          2HB       PRO  17  14.807  -2.783  10.543
  132    HB3  PRO  17          1HB       PRO  17  14.423  -3.620   9.027
  133    HG2  PRO  17          2HG       PRO  17  13.463  -0.979  10.022
  134    HG3  PRO  17          1HG       PRO  17  13.992  -1.446   8.398
  135    HD2  PRO  17          2HD       PRO  17  11.352  -1.263   9.130
  136    HD3  PRO  17          1HD       PRO  17  11.949  -2.335   7.845
  137    H    ASP  18           H        ASP  18  14.667  -3.127  12.242
  138    HA   ASP  18           HA       ASP  18  12.888  -3.122  14.555
  139    HB2  ASP  18          2HB       ASP  18  14.905  -2.539  15.811
  140    HB3  ASP  18          1HB       ASP  18  15.266  -3.859  14.704
  141    H    VAL  19           H        VAL  19  12.964  -1.095  12.115
  142    HA   VAL  19           HA       VAL  19  12.881   1.390  13.782
  143    HB   VAL  19           HB       VAL  19  13.210   1.157  10.778
  144   HG11  VAL  19          1HG1      VAL  19  13.199   3.412  12.767
  145   HG12  VAL  19          2HG1      VAL  19  12.409   3.313  11.193
  146   HG13  VAL  19          3HG1      VAL  19  14.154   3.553  11.290
  147   HG21  VAL  19          1HG2      VAL  19  15.190   1.240  13.041
  148   HG22  VAL  19          2HG2      VAL  19  15.602   1.991  11.500
  149   HG23  VAL  19          3HG2      VAL  19  15.225   0.270  11.569
  150    H    ALA  20           H        ALA  20  10.959   2.527  13.841
  151    HA   ALA  20           HA       ALA  20   8.578   1.263  12.774
  152    HB1  ALA  20          1HB       ALA  20   7.769   3.773  13.530
  153    HB2  ALA  20          2HB       ALA  20   9.213   3.551  14.517
  154    HB3  ALA  20          3HB       ALA  20   7.886   2.393  14.622
  155    HA   PRO  21           HA       PRO  21   8.577   3.036   8.661
  156    HB2  PRO  21          2HB       PRO  21   5.700   3.628   9.173
  157    HB3  PRO  21          1HB       PRO  21   6.452   2.770   7.817
  158    HG2  PRO  21          2HG       PRO  21   5.136   1.498   9.779
  159    HG3  PRO  21          1HG       PRO  21   6.515   0.786   8.930
  160    HD2  PRO  21          2HD       PRO  21   6.360   1.806  11.705
  161    HD3  PRO  21          1HD       PRO  21   7.482   0.633  10.982
  162    H    ALA  22           H        ALA  22   7.123   4.764  11.367
  163    HA   ALA  22           HA       ALA  22   6.904   7.329  10.089
  164    HB1  ALA  22          1HB       ALA  22   7.107   6.445  12.970
  165    HB2  ALA  22          2HB       ALA  22   5.696   7.068  12.116
  166    HB3  ALA  22          3HB       ALA  22   7.022   8.151  12.534
  167    H    ASP  23           H        ASP  23   9.570   5.528  11.327
  168    HA   ASP  23           HA       ASP  23  11.313   7.946  11.301
  169    HB2  ASP  23          2HB       ASP  23  11.762   5.149  12.388
  170    HB3  ASP  23          1HB       ASP  23  12.991   6.415  12.380
  171    H    VAL  24           H        VAL  24  10.220   5.728   9.199
  172    HA   VAL  24           HA       VAL  24  12.841   5.366   7.821
  173    HB   VAL  24           HB       VAL  24  10.169   4.029   7.276
  174   HG11  VAL  24          1HG1      VAL  24  11.130   3.267   5.389
  175   HG12  VAL  24          2HG1      VAL  24  12.473   2.607   6.323
  176   HG13  VAL  24          3HG1      VAL  24  12.546   4.264   5.725
  177   HG21  VAL  24          1HG2      VAL  24  10.967   3.258   9.406
  178   HG22  VAL  24          2HG2      VAL  24  12.625   3.145   8.815
  179   HG23  VAL  24          3HG2      VAL  24  11.401   2.015   8.233
  180    H    ASP  25           H        ASP  25  13.149   6.326   5.809
  181    HA   ASP  25           HA       ASP  25  11.437   8.540   5.130
  182    HB2  ASP  25          2HB       ASP  25  13.893   8.408   4.607
  183    HB3  ASP  25          1HB       ASP  25  13.518   7.201   3.377
  184    H    VAL  26           H        VAL  26   9.364   7.997   4.552
  185    HA   VAL  26           HA       VAL  26   8.577   5.677   3.103
  186    HB   VAL  26           HB       VAL  26   6.470   6.871   2.694
  187   HG11  VAL  26          1HG1      VAL  26   5.845   7.127   4.950
  188   HG12  VAL  26          2HG1      VAL  26   7.424   7.764   5.410
  189   HG13  VAL  26          3HG1      VAL  26   7.238   6.049   5.041
  190   HG21  VAL  26          1HG2      VAL  26   7.338   9.039   2.026
  191   HG22  VAL  26          2HG2      VAL  26   8.066   9.282   3.614
  192   HG23  VAL  26          3HG2      VAL  26   6.311   9.268   3.440
  193    H    ASP  27           H        ASP  27  10.660   7.898   1.980
  194    HA   ASP  27           HA       ASP  27   9.528   8.155  -0.738
  195    HB2  ASP  27          2HB       ASP  27  12.149   9.101   0.467
  196    HB3  ASP  27          1HB       ASP  27  11.649   9.411  -1.196
  197    H    LEU  28           H        LEU  28  10.741   5.669   0.825
  198    HA   LEU  28           HA       LEU  28  12.822   4.808  -1.074
  199    HB2  LEU  28          2HB       LEU  28  12.917   4.248   1.371
  200    HB3  LEU  28          1HB       LEU  28  11.480   3.252   1.157
  201    HG   LEU  28           HG       LEU  28  12.958   2.193  -0.802
  202   HD11  LEU  28          1HD1      LEU  28  14.817   3.827  -0.346
  203   HD12  LEU  28          2HD1      LEU  28  15.309   2.136  -0.251
  204   HD13  LEU  28          3HD1      LEU  28  15.032   3.058   1.227
  205   HD21  LEU  28          1HD2      LEU  28  12.184   0.714   0.830
  206   HD22  LEU  28          2HD2      LEU  28  12.899   1.641   2.150
  207   HD23  LEU  28          3HD2      LEU  28  13.925   0.655   1.109
  208    H    ASP  29           H        ASP  29  12.453   3.475  -2.800
  209    HA   ASP  29           HA       ASP  29   9.749   2.950  -3.644
  210    HB2  ASP  29          2HB       ASP  29  12.413   1.838  -4.584
  211    HB3  ASP  29          1HB       ASP  29  10.879   1.518  -5.392
  212    H    LEU  30           H        LEU  30   8.457   1.351  -2.836
  213    HA   LEU  30           HA       LEU  30   9.541  -0.653  -1.049
  214    HB2  LEU  30          2HB       LEU  30   7.241  -1.493  -0.911
  215    HB3  LEU  30          1HB       LEU  30   7.243   0.265  -0.788
  216    HG   LEU  30           HG       LEU  30   7.093  -0.367  -3.555
  217   HD11  LEU  30          1HD1      LEU  30   6.306  -2.589  -3.017
  218   HD12  LEU  30          2HD1      LEU  30   4.908  -1.634  -3.511
  219   HD13  LEU  30          3HD1      LEU  30   5.196  -1.955  -1.803
  220   HD21  LEU  30          1HD2      LEU  30   4.866   0.742  -3.309
  221   HD22  LEU  30          2HD2      LEU  30   6.160   1.632  -2.509
  222   HD23  LEU  30          3HD2      LEU  30   5.047   0.649  -1.558
  223    H    VAL  31           H        VAL  31  10.015  -0.466  -4.202
  224    HA   VAL  31           HA       VAL  31   9.101  -2.839  -5.403
  225    HB   VAL  31           HB       VAL  31  10.509  -0.946  -6.442
  226   HG11  VAL  31          1HG1      VAL  31  12.341  -1.283  -4.683
  227   HG12  VAL  31          2HG1      VAL  31  12.886  -1.143  -6.354
  228   HG13  VAL  31          3HG1      VAL  31  12.798  -2.728  -5.585
  229   HG21  VAL  31          1HG2      VAL  31  10.156  -2.509  -8.064
  230   HG22  VAL  31          2HG2      VAL  31  10.546  -3.851  -6.988
  231   HG23  VAL  31          3HG2      VAL  31  11.840  -2.941  -7.767
  232    H    ASP  32           H        ASP  32  11.858  -2.328  -3.236
  233    HA   ASP  32           HA       ASP  32  12.969  -4.946  -3.384
  234    HB2  ASP  32          2HB       ASP  32  12.810  -3.015  -1.045
  235    HB3  ASP  32          1HB       ASP  32  13.797  -4.476  -1.054
  236    H    ASN  33           H        ASN  33  10.262  -3.600  -1.604
  237    HA   ASN  33           HA       ASN  33   9.684  -6.126  -0.226
  238    HB2  ASN  33          2HB       ASN  33   8.055  -3.583  -0.420
  239    HB3  ASN  33          1HB       ASN  33   7.764  -4.912   0.696
  240   HD21  ASN  33          1HD2      ASN  33   9.511  -1.981   0.261
  241   HD22  ASN  33          2HD2      ASN  33  10.508  -2.111   1.629
  242    H    GLY  34           H        GLY  34   9.603  -5.509  -3.289
  243    HA2  GLY  34          2HA       GLY  34   7.097  -5.597  -4.417
  244    HA3  GLY  34          1HA       GLY  34   8.434  -6.558  -5.048
  245    H    VAL  35           H        VAL  35   8.365  -7.886  -2.201
  246    HA   VAL  35           HA       VAL  35   7.076 -10.279  -2.934
  247    HB   VAL  35           HB       VAL  35   7.475  -9.048  -0.189
  248   HG11  VAL  35          1HG1      VAL  35   7.300 -11.791   0.133
  249   HG12  VAL  35          2HG1      VAL  35   6.024 -11.451  -1.036
  250   HG13  VAL  35          3HG1      VAL  35   6.029 -10.634   0.528
  251   HG21  VAL  35          1HG2      VAL  35   9.320 -10.020  -1.978
  252   HG22  VAL  35          2HG2      VAL  35   8.957 -11.458  -1.022
  253   HG23  VAL  35          3HG2      VAL  35   9.544  -9.995  -0.229
  254    H    ILE  36           H        ILE  36   5.783  -7.374  -1.393
  255    HA   ILE  36           HA       ILE  36   3.139  -8.435  -0.911
  256    HB   ILE  36           HB       ILE  36   4.339  -6.290   0.038
  257   HG12  ILE  36          2HG1      ILE  36   1.412  -6.409  -0.743
  258   HG13  ILE  36          1HG1      ILE  36   2.133  -6.999   0.752
  259   HG21  ILE  36          1HG2      ILE  36   4.470  -5.416  -2.407
  260   HG22  ILE  36          2HG2      ILE  36   3.977  -4.284  -1.146
  261   HG23  ILE  36          3HG2      ILE  36   2.764  -5.019  -2.196
  262   HD11  ILE  36          1HD1      ILE  36   1.162  -4.860   1.257
  263   HD12  ILE  36          2HD1      ILE  36   1.908  -4.125  -0.163
  264   HD13  ILE  36          3HD1      ILE  36   2.909  -4.629   1.198
  265    H    ASP  37           H        ASP  37   4.730  -7.054  -3.679
  266    HA   ASP  37           HA       ASP  37   2.476  -6.119  -5.119
  267    HB2  ASP  37          2HB       ASP  37   5.074  -7.281  -6.151
  268    HB3  ASP  37          1HB       ASP  37   3.887  -6.451  -7.154
  269    H    SER  38           H        SER  38   3.709  -9.428  -4.773
  270    HA   SER  38           HA       SER  38   1.617 -10.312  -6.702
  271    HB2  SER  38          2HB       SER  38   4.278 -11.321  -5.951
  272    HB3  SER  38          1HB       SER  38   3.045 -12.566  -6.110
  273    H    LEU  39           H        LEU  39   3.021 -11.695  -3.711
  274    HA   LEU  39           HA       LEU  39   0.620 -13.182  -3.174
  275    HB2  LEU  39          2HB       LEU  39   2.904 -13.859  -2.417
  276    HB3  LEU  39          1HB       LEU  39   2.860 -12.532  -1.262
  277    HG   LEU  39           HG       LEU  39   0.498 -14.304  -1.204
  278   HD11  LEU  39          1HD1      LEU  39   2.175 -16.012  -1.563
  279   HD12  LEU  39          2HD1      LEU  39   1.760 -16.012   0.151
  280   HD13  LEU  39          3HD1      LEU  39   3.257 -15.257  -0.394
  281   HD21  LEU  39          1HD2      LEU  39   1.287 -12.347   0.380
  282   HD22  LEU  39          2HD2      LEU  39   2.293 -13.601   1.102
  283   HD23  LEU  39          3HD2      LEU  39   0.540 -13.784   1.075
  284    H    GLY  40           H        GLY  40   2.063 -10.374  -1.511
  285    HA2  GLY  40          2HA       GLY  40  -0.153 -10.019   0.275
  286    HA3  GLY  40          1HA       GLY  40   1.055  -8.795  -0.096
  287    H    LEU  41           H        LEU  41   0.585  -8.744  -2.929
  288    HA   LEU  41           HA       LEU  41  -1.447  -6.776  -3.086
  289    HB2  LEU  41          2HB       LEU  41   0.382  -7.093  -4.749
  290    HB3  LEU  41          1HB       LEU  41  -0.428  -8.550  -5.322
  291    HG   LEU  41           HG       LEU  41  -2.498  -6.900  -5.548
  292   HD11  LEU  41          1HD1      LEU  41  -1.849  -4.643  -6.104
  293   HD12  LEU  41          2HD1      LEU  41  -0.140  -5.044  -5.939
  294   HD13  LEU  41          3HD1      LEU  41  -1.182  -5.018  -4.516
  295   HD21  LEU  41          1HD2      LEU  41  -1.346  -8.159  -7.380
  296   HD22  LEU  41          2HD2      LEU  41  -0.178  -6.843  -7.503
  297   HD23  LEU  41          3HD2      LEU  41  -1.876  -6.554  -7.883
  298    H    LEU  42           H        LEU  42  -1.543 -10.261  -3.768
  299    HA   LEU  42           HA       LEU  42  -4.232 -10.304  -4.752
  300    HB2  LEU  42          2HB       LEU  42  -2.590 -12.204  -4.929
  301    HB3  LEU  42          1HB       LEU  42  -2.816 -12.496  -3.209
  302    HG   LEU  42           HG       LEU  42  -5.373 -12.540  -3.856
  303   HD11  LEU  42          1HD1      LEU  42  -5.663 -13.530  -6.127
  304   HD12  LEU  42          2HD1      LEU  42  -3.956 -13.220  -6.445
  305   HD13  LEU  42          3HD1      LEU  42  -5.062 -11.873  -6.180
  306   HD21  LEU  42          1HD2      LEU  42  -4.484 -14.502  -2.926
  307   HD22  LEU  42          2HD2      LEU  42  -3.277 -14.674  -4.200
  308   HD23  LEU  42          3HD2      LEU  42  -4.970 -15.042  -4.532
  309    H    LYS  43           H        LYS  43  -2.886 -10.709  -1.480
  310    HA   LYS  43           HA       LYS  43  -5.468 -11.056  -0.225
  311    HB2  LYS  43          2HB       LYS  43  -2.781 -10.256   0.902
  312    HB3  LYS  43          1HB       LYS  43  -4.189 -10.650   1.878
  313    HG2  LYS  43          2HG       LYS  43  -4.273 -12.892   0.776
  314    HG3  LYS  43          1HG       LYS  43  -2.779 -12.492  -0.072
  315    HD2  LYS  43          2HD       LYS  43  -1.670 -12.134   2.138
  316    HD3  LYS  43          1HD       LYS  43  -3.151 -12.674   2.931
  317    HE2  LYS  43          2HE       LYS  43  -2.930 -14.873   2.128
  318    HE3  LYS  43          1HE       LYS  43  -1.827 -14.389   0.839
  319    HZ1  LYS  43          1HZ       LYS  43  -1.278 -14.598   3.738
  320    HZ2  LYS  43          2HZ       LYS  43  -0.267 -13.716   2.695
  321    HZ3  LYS  43          3HZ       LYS  43  -0.489 -15.384   2.458
  322    H    VAL  44           H        VAL  44  -3.334  -8.288  -0.793
  323    HA   VAL  44           HA       VAL  44  -4.780  -6.396   0.790
  324    HB   VAL  44           HB       VAL  44  -3.046  -6.009  -1.663
  325   HG11  VAL  44          1HG1      VAL  44  -4.681  -4.142  -0.159
  326   HG12  VAL  44          2HG1      VAL  44  -3.739  -3.867  -1.622
  327   HG13  VAL  44          3HG1      VAL  44  -2.975  -3.721  -0.040
  328   HG21  VAL  44          1HG2      VAL  44  -1.277  -6.183  -0.265
  329   HG22  VAL  44          2HG2      VAL  44  -2.401  -6.873   0.905
  330   HG23  VAL  44          3HG2      VAL  44  -2.039  -5.147   0.941
  331    H    ILE  45           H        ILE  45  -4.999  -7.207  -2.677
  332    HA   ILE  45           HA       ILE  45  -6.994  -5.279  -3.322
  333    HB   ILE  45           HB       ILE  45  -5.932  -7.772  -4.541
  334   HG12  ILE  45          2HG1      ILE  45  -5.592  -6.321  -6.427
  335   HG13  ILE  45          1HG1      ILE  45  -6.699  -5.115  -5.775
  336   HG21  ILE  45          1HG2      ILE  45  -7.752  -7.570  -6.332
  337   HG22  ILE  45          2HG2      ILE  45  -8.670  -6.645  -5.145
  338   HG23  ILE  45          3HG2      ILE  45  -8.232  -8.320  -4.811
  339   HD11  ILE  45          1HD1      ILE  45  -4.381  -5.886  -4.069
  340   HD12  ILE  45          2HD1      ILE  45  -5.157  -4.316  -4.265
  341   HD13  ILE  45          3HD1      ILE  45  -4.039  -4.907  -5.492
  342    H    ALA  46           H        ALA  46  -7.264  -8.649  -2.201
  343    HA   ALA  46           HA       ALA  46 -10.114  -8.808  -2.380
  344    HB1  ALA  46          1HB       ALA  46  -7.958 -10.308  -0.979
  345    HB2  ALA  46          2HB       ALA  46  -9.239 -10.904  -2.036
  346    HB3  ALA  46          3HB       ALA  46  -9.596 -10.504  -0.355
  347    H    TRP  47           H        TRP  47  -7.968  -7.825   0.291
  348    HA   TRP  47           HA       TRP  47 -10.190  -7.320   2.103
  349    HB2  TRP  47          2HB       TRP  47  -8.310  -7.707   3.357
  350    HB3  TRP  47          1HB       TRP  47  -7.233  -7.004   2.151
  351    HD1  TRP  47           HD       TRP  47  -9.566  -6.023   5.026
  352    HE1  TRP  47          1HE       TRP  47  -8.970  -3.630   5.780
  353    HE3  TRP  47          3HE       TRP  47  -6.194  -4.769   1.416
  354    HZ2  TRP  47          2HZ       TRP  47  -7.272  -1.473   4.964
  355    HZ3  TRP  47          3HZ       TRP  47  -5.099  -2.548   1.423
  356    HH2  TRP  47           HH       TRP  47  -5.636  -0.900   3.189
  357    H    LEU  48           H        LEU  48  -8.046  -5.287   0.114
  358    HA   LEU  48           HA       LEU  48  -9.070  -2.779   0.946
  359    HB2  LEU  48          2HB       LEU  48  -7.016  -3.141  -0.459
  360    HB3  LEU  48          1HB       LEU  48  -8.066  -3.504  -1.815
  361    HG   LEU  48           HG       LEU  48  -9.149  -1.262  -1.481
  362   HD11  LEU  48          1HD1      LEU  48  -7.335  -1.315   0.791
  363   HD12  LEU  48          2HD1      LEU  48  -8.686  -0.233   0.469
  364   HD13  LEU  48          3HD1      LEU  48  -7.094   0.123  -0.199
  365   HD21  LEU  48          1HD2      LEU  48  -6.527  -0.290  -1.994
  366   HD22  LEU  48          2HD2      LEU  48  -7.759  -0.739  -3.174
  367   HD23  LEU  48          3HD2      LEU  48  -6.597  -1.941  -2.613
  368    H    GLU  49           H        GLU  49 -10.141  -4.952  -1.668
  369    HA   GLU  49           HA       GLU  49 -12.203  -3.199  -2.637
  370    HB2  GLU  49          2HB       GLU  49 -11.849  -4.848  -4.195
  371    HB3  GLU  49          1HB       GLU  49 -11.475  -6.061  -2.982
  372    HG2  GLU  49          2HG       GLU  49 -13.768  -6.433  -2.492
  373    HG3  GLU  49          1HG       GLU  49 -14.267  -4.991  -3.369
  374    H    ASP  50           H        ASP  50 -12.157  -5.815  -0.250
  375    HA   ASP  50           HA       ASP  50 -14.967  -5.754   0.329
  376    HB2  ASP  50          2HB       ASP  50 -13.349  -7.591   0.947
  377    HB3  ASP  50          1HB       ASP  50 -12.729  -6.522   2.204
  378    H    ARG  51           H        ARG  51 -12.185  -4.022   1.638
  379    HA   ARG  51           HA       ARG  51 -13.419  -2.863   3.902
  380    HB2  ARG  51          2HB       ARG  51 -10.958  -2.817   3.277
  381    HB3  ARG  51          1HB       ARG  51 -11.348  -1.494   2.176
  382    HG2  ARG  51          2HG       ARG  51 -12.301  -0.219   4.085
  383    HG3  ARG  51          1HG       ARG  51 -11.830  -1.524   5.170
  384    HD2  ARG  51          2HD       ARG  51  -9.463  -1.222   4.429
  385    HD3  ARG  51          1HD       ARG  51  -9.972   0.173   3.481
  386    HE   ARG  51           HE       ARG  51  -9.777   0.054   6.420
  387   HH11  ARG  51          1HH1      ARG  51 -10.023   2.051   7.444
  388   HH12  ARG  51          2HH1      ARG  51 -10.603   3.409   6.538
  389   HH21  ARG  51          1HH2      ARG  51 -10.916   1.640   3.574
  390   HH22  ARG  51          2HH2      ARG  51 -11.107   3.176   4.350
  391    H    PHE  52           H        PHE  52 -13.338  -1.672   0.519
  392    HA   PHE  52           HA       PHE  52 -15.391   0.355   1.350
  393    HB2  PHE  52          2HB       PHE  52 -12.951   0.606  -0.249
  394    HB3  PHE  52          1HB       PHE  52 -14.377   1.254  -1.061
  395    HD1  PHE  52          1HD       PHE  52 -14.818   3.499  -0.685
  396    HD2  PHE  52          2HD       PHE  52 -12.994   1.175   2.432
  397    HE1  PHE  52          1HE       PHE  52 -14.752   5.505   0.773
  398    HE2  PHE  52          2HE       PHE  52 -12.929   3.181   3.889
  399    HZ   PHE  52           HZ       PHE  52 -13.807   5.346   3.060
  400    H    GLY  53           H        GLY  53 -14.979  -2.483  -0.356
  401    HA2  GLY  53          2HA       GLY  53 -16.528  -3.623  -1.720
  402    HA3  GLY  53          1HA       GLY  53 -17.601  -2.229  -1.585
  403    H    ILE  54           H        ILE  54 -14.259  -2.362  -2.835
  404    HA   ILE  54           HA       ILE  54 -15.272  -1.095  -5.338
  405    HB   ILE  54           HB       ILE  54 -12.426  -1.398  -4.329
  406   HG12  ILE  54          2HG1      ILE  54 -14.175   1.075  -4.330
  407   HG13  ILE  54          1HG1      ILE  54 -13.996   0.025  -2.924
  408   HG21  ILE  54          1HG2      ILE  54 -12.440   0.715  -6.037
  409   HG22  ILE  54          2HG2      ILE  54 -13.685  -0.292  -6.778
  410   HG23  ILE  54          3HG2      ILE  54 -12.059  -0.933  -6.538
  411   HD11  ILE  54          1HD1      ILE  54 -11.625   0.436  -2.825
  412   HD12  ILE  54          2HD1      ILE  54 -12.424   2.003  -2.951
  413   HD13  ILE  54          3HD1      ILE  54 -11.655   1.288  -4.369
  414    H    ALA  55           H        ALA  55 -14.977  -2.114  -7.338
  415    HA   ALA  55           HA       ALA  55 -14.710  -4.956  -7.381
  416    HB1  ALA  55          1HB       ALA  55 -15.469  -4.654  -9.481
  417    HB2  ALA  55          2HB       ALA  55 -13.986  -3.810  -9.926
  418    HB3  ALA  55          3HB       ALA  55 -15.339  -2.911  -9.239
  419    H    ALA  56           H        ALA  56 -12.927  -6.261  -7.647
  420    HA   ALA  56           HA       ALA  56 -10.320  -5.214  -7.101
  421    HB1  ALA  56          1HB       ALA  56 -11.241  -7.880  -8.204
  422    HB2  ALA  56          2HB       ALA  56 -10.780  -7.507  -6.543
  423    HB3  ALA  56          3HB       ALA  56  -9.556  -7.529  -7.814
  424    H    ASP  57           H        ASP  57 -12.015  -5.979 -10.097
  425    HA   ASP  57           HA       ASP  57  -9.594  -5.357 -11.686
  426    HB2  ASP  57          2HB       ASP  57 -12.353  -6.306 -12.478
  427    HB3  ASP  57          1HB       ASP  57 -11.055  -5.981 -13.626
  428    H    ASP  58           H        ASP  58 -11.721  -3.498 -10.142
  429    HA   ASP  58           HA       ASP  58 -12.923  -1.783 -12.017
  430    HB2  ASP  58          2HB       ASP  58 -13.179  -1.668  -9.513
  431    HB3  ASP  58          1HB       ASP  58 -11.602  -0.887  -9.453
  432    H    VAL  59           H        VAL  59  -9.585  -1.868 -10.864
  433    HA   VAL  59           HA       VAL  59  -8.866  -0.032 -13.106
  434    HB   VAL  59           HB       VAL  59  -8.845   1.193 -10.918
  435   HG11  VAL  59          1HG1      VAL  59  -7.809   0.361  -9.083
  436   HG12  VAL  59          2HG1      VAL  59  -6.393  -0.139 -10.007
  437   HG13  VAL  59          3HG1      VAL  59  -7.815  -1.180  -9.941
  438   HG21  VAL  59          1HG2      VAL  59  -7.367   1.998 -12.634
  439   HG22  VAL  59          2HG2      VAL  59  -6.221   0.688 -12.348
  440   HG23  VAL  59          3HG2      VAL  59  -6.427   1.958 -11.142
  441    H    GLU  60           H        GLU  60  -6.901  -0.568 -14.134
  442    HA   GLU  60           HA       GLU  60  -5.998  -3.312 -13.721
  443    HB2  GLU  60          2HB       GLU  60  -6.115  -2.263 -15.981
  444    HB3  GLU  60          1HB       GLU  60  -4.823  -1.165 -15.509
  445    HG2  GLU  60          2HG       GLU  60  -3.367  -3.110 -15.051
  446    HG3  GLU  60          1HG       GLU  60  -4.649  -4.178 -15.606
  447    H    LEU  61           H        LEU  61  -4.140  -3.971 -12.690
  448    HA   LEU  61           HA       LEU  61  -2.607  -1.853 -11.271
  449    HB2  LEU  61          2HB       LEU  61  -2.638  -4.834 -10.729
  450    HB3  LEU  61          1HB       LEU  61  -1.995  -3.570  -9.686
  451    HG   LEU  61           HG       LEU  61  -4.886  -4.015 -10.425
  452   HD11  LEU  61          1HD1      LEU  61  -3.805  -5.415  -8.602
  453   HD12  LEU  61          2HD1      LEU  61  -5.201  -4.465  -8.093
  454   HD13  LEU  61          3HD1      LEU  61  -3.570  -3.915  -7.705
  455   HD21  LEU  61          1HD2      LEU  61  -5.147  -2.051  -8.727
  456   HD22  LEU  61          2HD2      LEU  61  -4.714  -1.673 -10.395
  457   HD23  LEU  61          3HD2      LEU  61  -3.472  -1.689  -9.143
  458    H    SER  62           H        SER  62  -0.400  -1.653 -11.593
  459    HA   SER  62           HA       SER  62   0.937  -3.682 -13.308
  460    HB2  SER  62          2HB       SER  62   0.256  -1.024 -14.097
  461    HB3  SER  62          1HB       SER  62   2.005  -1.095 -13.909
  462    HG   SER  62           HG       SER  62   0.330  -2.746 -15.495
  463    HA   PRO  63           HA       PRO  63   4.175  -3.477 -10.332
  464    HB2  PRO  63          2HB       PRO  63   6.409  -3.598 -11.976
  465    HB3  PRO  63          1HB       PRO  63   5.446  -4.996 -11.468
  466    HG2  PRO  63          2HG       PRO  63   5.418  -3.505 -14.031
  467    HG3  PRO  63          1HG       PRO  63   5.179  -5.232 -13.722
  468    HD2  PRO  63          2HD       PRO  63   3.112  -3.542 -14.271
  469    HD3  PRO  63          1HD       PRO  63   2.931  -4.975 -13.237
  470    H    GLU  64           H        GLU  64   4.386  -1.247 -13.052
  471    HA   GLU  64           HA       GLU  64   6.432   0.447 -11.983
  472    HB2  GLU  64          2HB       GLU  64   4.178   1.059 -13.895
  473    HB3  GLU  64          1HB       GLU  64   5.530   2.135 -13.578
  474    HG2  GLU  64          2HG       GLU  64   7.085   0.354 -14.315
  475    HG3  GLU  64          1HG       GLU  64   5.703  -0.664 -14.701
  476    H    HIS  65           H        HIS  65   2.956   0.301 -11.495
  477    HA   HIS  65           HA       HIS  65   2.682   2.863 -10.220
  478    HB2  HIS  65          2HB       HIS  65   0.774   1.591 -11.153
  479    HB3  HIS  65          1HB       HIS  65   0.984   0.374  -9.894
  480    HD1  HIS  65          1HD       HIS  65   0.708   4.193  -9.925
  481    HD2  HIS  65          2HD       HIS  65  -0.737   0.899  -7.813
  482    HE1  HIS  65          1HE       HIS  65  -0.822   5.110  -8.125
  483    HE2  HIS  65          2HE       HIS  65  -1.710   3.113  -6.836
  484    H    PHE  66           H        PHE  66   3.732  -0.267  -9.034
  485    HA   PHE  66           HA       PHE  66   3.464   0.645  -6.229
  486    HB2  PHE  66          2HB       PHE  66   4.380  -1.988  -7.413
  487    HB3  PHE  66          1HB       PHE  66   4.247  -1.661  -5.686
  488    HD1  PHE  66          1HD       PHE  66   2.436  -2.372  -8.765
  489    HD2  PHE  66          2HD       PHE  66   2.025  -1.163  -4.666
  490    HE1  PHE  66          1HE       PHE  66   0.014  -2.885  -8.858
  491    HE2  PHE  66          2HE       PHE  66  -0.400  -1.677  -4.757
  492    HZ   PHE  66           HZ       PHE  66  -1.406  -2.536  -6.856
  493    H    ARG  67           H        ARG  67   5.686   1.259  -8.536
  494    HA   ARG  67           HA       ARG  67   8.171   0.503  -7.381
  495    HB2  ARG  67          2HB       ARG  67   7.447   2.935  -9.039
  496    HB3  ARG  67          1HB       ARG  67   9.098   2.471  -8.640
  497    HG2  ARG  67          2HG       ARG  67   7.284   0.440  -9.873
  498    HG3  ARG  67          1HG       ARG  67   8.018   1.669 -10.903
  499    HD2  ARG  67          2HD       ARG  67   9.567  -0.129  -9.016
  500    HD3  ARG  67          1HD       ARG  67   9.392  -0.415 -10.745
  501    HE   ARG  67           HE       ARG  67  10.379   2.183 -10.559
  502   HH11  ARG  67          1HH1      ARG  67  12.595   2.621 -10.611
  503   HH12  ARG  67          2HH1      ARG  67  13.720   1.388 -10.147
  504   HH21  ARG  67          1HH2      ARG  67  11.265  -0.964  -9.463
  505   HH22  ARG  67          2HH2      ARG  67  12.967  -0.642  -9.497
  506    H    SER  68           H        SER  68   6.141   3.363  -6.799
  507    HA   SER  68           HA       SER  68   7.794   3.875  -4.359
  508    HB2  SER  68          2HB       SER  68   6.604   5.959  -6.203
  509    HB3  SER  68          1HB       SER  68   7.474   6.292  -4.711
  510    HG   SER  68           HG       SER  68   8.399   5.403  -7.187
  511    H    ILE  69           H        ILE  69   6.649   4.514  -2.520
  512    HA   ILE  69           HA       ILE  69   3.938   3.660  -2.283
  513    HB   ILE  69           HB       ILE  69   5.532   5.529  -0.505
  514   HG12  ILE  69          2HG1      ILE  69   5.130   2.545  -0.280
  515   HG13  ILE  69          1HG1      ILE  69   6.566   3.282  -0.977
  516   HG21  ILE  69          1HG2      ILE  69   3.675   5.623   0.741
  517   HG22  ILE  69          2HG2      ILE  69   3.720   3.868   0.898
  518   HG23  ILE  69          3HG2      ILE  69   2.828   4.612  -0.428
  519   HD11  ILE  69          1HD1      ILE  69   6.316   2.677   1.666
  520   HD12  ILE  69          2HD1      ILE  69   5.767   4.354   1.656
  521   HD13  ILE  69          3HD1      ILE  69   7.372   3.947   1.047
  522    H    ARG  70           H        ARG  70   5.410   6.833  -2.827
  523    HA   ARG  70           HA       ARG  70   3.108   8.439  -2.396
  524    HB2  ARG  70          2HB       ARG  70   5.420   9.320  -2.692
  525    HB3  ARG  70          1HB       ARG  70   5.328   8.912  -4.406
  526    HG2  ARG  70          2HG       ARG  70   3.359  10.394  -4.645
  527    HG3  ARG  70          1HG       ARG  70   3.487  10.824  -2.939
  528    HD2  ARG  70          2HD       ARG  70   4.585  12.563  -4.197
  529    HD3  ARG  70          1HD       ARG  70   5.843  11.613  -3.408
  530    HE   ARG  70           HE       ARG  70   5.623  10.391  -5.855
  531   HH11  ARG  70          1HH1      ARG  70   6.741  11.053  -7.706
  532   HH12  ARG  70          2HH1      ARG  70   7.251  12.702  -7.849
  533   HH21  ARG  70          1HH2      ARG  70   5.938  13.651  -4.783
  534   HH22  ARG  70          2HH2      ARG  70   6.797  14.173  -6.194
  535    H    SER  71           H        SER  71   4.172   6.673  -5.299
  536    HA   SER  71           HA       SER  71   2.336   7.791  -7.137
  537    HB2  SER  71          2HB       SER  71   3.254   4.905  -7.028
  538    HB3  SER  71          1HB       SER  71   2.663   5.768  -8.442
  539    HG   SER  71           HG       SER  71   4.490   6.917  -8.524
  540    H    ILE  72           H        ILE  72   1.929   5.048  -4.891
  541    HA   ILE  72           HA       ILE  72  -0.749   4.430  -5.722
  542    HB   ILE  72           HB       ILE  72   0.641   3.919  -3.076
  543   HG12  ILE  72          2HG1      ILE  72   0.327   2.137  -5.514
  544   HG13  ILE  72          1HG1      ILE  72   1.808   2.996  -5.089
  545   HG21  ILE  72          1HG2      ILE  72  -1.372   3.147  -2.440
  546   HG22  ILE  72          2HG2      ILE  72  -1.204   1.897  -3.673
  547   HG23  ILE  72          3HG2      ILE  72  -2.038   3.403  -4.052
  548   HD11  ILE  72          1HD1      ILE  72   2.336   1.139  -3.903
  549   HD12  ILE  72          2HD1      ILE  72   0.678   0.541  -3.940
  550   HD13  ILE  72          3HD1      ILE  72   1.162   1.724  -2.725
  551    H    ASP  73           H        ASP  73   0.614   6.535  -3.218
  552    HA   ASP  73           HA       ASP  73  -1.776   7.178  -1.850
  553    HB2  ASP  73          2HB       ASP  73   0.589   7.820  -1.199
  554    HB3  ASP  73          1HB       ASP  73   0.485   9.112  -2.396
  555    H    ALA  74           H        ALA  74  -0.388   8.628  -4.796
  556    HA   ALA  74           HA       ALA  74  -2.342  10.723  -4.992
  557    HB1  ALA  74          1HB       ALA  74  -0.056  10.132  -6.350
  558    HB2  ALA  74          2HB       ALA  74  -1.262  11.282  -6.926
  559    HB3  ALA  74          3HB       ALA  74  -1.270   9.622  -7.523
  560    H    PHE  75           H        PHE  75  -2.185   7.474  -6.444
  561    HA   PHE  75           HA       PHE  75  -4.648   7.689  -7.885
  562    HB2  PHE  75          2HB       PHE  75  -2.959   5.903  -8.276
  563    HB3  PHE  75          1HB       PHE  75  -3.389   5.200  -6.719
  564    HD1  PHE  75          1HD       PHE  75  -4.616   5.963 -10.127
  565    HD2  PHE  75          2HD       PHE  75  -5.443   3.977  -6.409
  566    HE1  PHE  75          1HE       PHE  75  -6.515   4.771 -11.186
  567    HE2  PHE  75          2HE       PHE  75  -7.342   2.785  -7.467
  568    HZ   PHE  75           HZ       PHE  75  -7.879   3.182  -9.856
  569    H    VAL  76           H        VAL  76  -3.915   6.403  -4.642
  570    HA   VAL  76           HA       VAL  76  -6.601   5.663  -4.012
  571    HB   VAL  76           HB       VAL  76  -4.226   6.388  -2.278
  572   HG11  VAL  76          1HG1      VAL  76  -6.969   5.347  -1.562
  573   HG12  VAL  76          2HG1      VAL  76  -6.159   6.782  -0.934
  574   HG13  VAL  76          3HG1      VAL  76  -5.574   5.178  -0.496
  575   HG21  VAL  76          1HG2      VAL  76  -5.333   3.652  -2.342
  576   HG22  VAL  76          2HG2      VAL  76  -3.655   4.187  -2.420
  577   HG23  VAL  76          3HG2      VAL  76  -4.653   4.197  -3.874
  578    H    VAL  77           H        VAL  77  -4.741   8.650  -3.345
  579    HA   VAL  77           HA       VAL  77  -6.813   9.963  -1.888
  580    HB   VAL  77           HB       VAL  77  -4.497  11.010  -3.526
  581   HG11  VAL  77          1HG1      VAL  77  -5.870  12.874  -3.535
  582   HG12  VAL  77          2HG1      VAL  77  -5.055  13.090  -1.986
  583   HG13  VAL  77          3HG1      VAL  77  -6.682  12.411  -2.041
  584   HG21  VAL  77          1HG2      VAL  77  -4.631  11.421  -0.609
  585   HG22  VAL  77          2HG2      VAL  77  -3.291  10.847  -1.602
  586   HG23  VAL  77          3HG2      VAL  77  -4.550   9.725  -1.090
  587    H    GLY  78           H        GLY  78  -6.038   9.851  -5.344
  588    HA2  GLY  78          2HA       GLY  78  -7.850  11.827  -6.243
  589    HA3  GLY  78          1HA       GLY  78  -7.328  10.445  -7.206
  590    H    ALA  79           H        ALA  79  -8.430   8.446  -5.344
  591    HA   ALA  79           HA       ALA  79 -11.292   8.799  -6.092
  592    HB1  ALA  79          1HB       ALA  79  -9.797   6.762  -6.802
  593    HB2  ALA  79          2HB       ALA  79 -11.460   6.485  -6.284
  594    HB3  ALA  79          3HB       ALA  79 -10.129   6.196  -5.165
  595    H    THR  80           H        THR  80  -9.298   7.589  -3.384
  596    HA   THR  80           HA       THR  80 -11.127   8.787  -1.457
  597    HB   THR  80           HB       THR  80 -10.947   5.771  -1.570
  598    HG1  THR  80          1HG       THR  80 -12.977   7.603  -2.288
  599   HG21  THR  80          1HG2      THR  80 -13.074   6.875   0.029
  600   HG22  THR  80          2HG2      THR  80 -11.529   7.548   0.545
  601   HG23  THR  80          3HG2      THR  80 -11.765   5.801   0.522
  602    H    THR  81           H        THR  81 -10.085   9.083   0.504
  603    HA   THR  81           HA       THR  81  -7.407   7.788   0.791
  604    HB   THR  81           HB       THR  81  -7.272  10.214   0.331
  605    HG1  THR  81          1HG       THR  81  -6.286  10.691   2.533
  606   HG21  THR  81          1HG2      THR  81  -8.328  11.036   2.932
  607   HG22  THR  81          2HG2      THR  81  -9.565  10.343   1.883
  608   HG23  THR  81          3HG2      THR  81  -8.616  11.725   1.335
  609    HA   PRO  82           HA       PRO  82  -9.820   6.595   4.512
  610    HB2  PRO  82          2HB       PRO  82  -9.283   3.967   4.476
  611    HB3  PRO  82          1HB       PRO  82 -10.463   4.682   3.359
  612    HG2  PRO  82          2HG       PRO  82  -7.671   3.800   2.852
  613    HG3  PRO  82          1HG       PRO  82  -9.094   3.713   1.801
  614    HD2  PRO  82          2HD       PRO  82  -7.082   5.681   1.683
  615    HD3  PRO  82          1HD       PRO  82  -8.676   5.773   0.902
  616    HA   PRO  83           HA       PRO  83  -5.790   6.657   6.709
  617    HB2  PRO  83          2HB       PRO  83  -6.669   7.866   8.981
  618    HB3  PRO  83          1HB       PRO  83  -6.285   8.765   7.503
  619    HG2  PRO  83          2HG       PRO  83  -8.918   8.023   8.632
  620    HG3  PRO  83          1HG       PRO  83  -8.442   9.459   7.713
  621    HD2  PRO  83          2HD       PRO  83  -9.816   7.264   6.667
  622    HD3  PRO  83          1HD       PRO  83  -8.938   8.473   5.708
  623    H    VAL  84           H        VAL  84  -5.034   4.939   7.895
  624    HA   VAL  84           HA       VAL  84  -6.916   3.614   9.805
  625    HB   VAL  84           HB       VAL  84  -4.959   2.199   7.969
  626   HG11  VAL  84          1HG1      VAL  84  -5.270   0.422   9.312
  627   HG12  VAL  84          2HG1      VAL  84  -7.015   0.544   9.091
  628   HG13  VAL  84          3HG1      VAL  84  -6.227   1.427  10.400
  629   HG21  VAL  84          1HG2      VAL  84  -7.985   2.436   7.873
  630   HG22  VAL  84          2HG2      VAL  84  -7.031   1.348   6.864
  631   HG23  VAL  84          3HG2      VAL  84  -6.848   3.095   6.695
  632    H    GLU  85           H        GLU  85  -6.035   3.373  11.812
  633    HA   GLU  85           HA       GLU  85  -3.418   4.393  12.411
  634    HB2  GLU  85          2HB       GLU  85  -5.316   4.299  14.043
  635    HB3  GLU  85          1HB       GLU  85  -5.126   2.546  14.105
  636    HG2  GLU  85          2HG       GLU  85  -3.904   3.469  15.969
  637    HG3  GLU  85          1HG       GLU  85  -2.720   2.919  14.782
  638    H    ALA  86           H        ALA  86  -4.689   1.111  11.960
  639    HA   ALA  86           HA       ALA  86  -2.013   0.139  11.301
  640    HB1  ALA  86          1HB       ALA  86  -3.418  -0.824  13.812
  641    HB2  ALA  86          2HB       ALA  86  -1.863   0.003  13.728
  642    HB3  ALA  86          3HB       ALA  86  -2.030  -1.627  13.078
  643    H    LYS  87           H        LYS  87  -2.119  -2.116  10.496
  644    HA   LYS  87           HA       LYS  87  -4.393  -2.617   8.880
  645    HB2  LYS  87          2HB       LYS  87  -2.288  -4.547   9.904
  646    HB3  LYS  87          1HB       LYS  87  -3.453  -4.926   8.636
  647    HG2  LYS  87          2HG       LYS  87  -2.587  -2.961   7.337
  648    HG3  LYS  87          1HG       LYS  87  -1.335  -2.761   8.563
  649    HD2  LYS  87          2HD       LYS  87  -0.580  -5.096   8.128
  650    HD3  LYS  87          1HD       LYS  87  -1.776  -5.215   6.838
  651    HE2  LYS  87          2HE       LYS  87  -0.429  -2.842   6.271
  652    HE3  LYS  87          1HE       LYS  87   0.844  -3.933   6.816
  653    HZ1  LYS  87          1HZ       LYS  87  -1.038  -4.278   4.569
  654    HZ2  LYS  87          2HZ       LYS  87  -0.247  -5.612   5.264
  655    HZ3  LYS  87          3HZ       LYS  87   0.657  -4.359   4.556
  656    H    LEU  88           H        LEU  88  -3.635  -3.638  12.171
  657    HA   LEU  88           HA       LEU  88  -5.609  -5.650  12.484
  658    HB2  LEU  88          2HB       LEU  88  -4.694  -3.629  14.557
  659    HB3  LEU  88          1HB       LEU  88  -5.462  -5.184  14.885
  660    HG   LEU  88           HG       LEU  88  -2.780  -4.763  13.531
  661   HD11  LEU  88          1HD1      LEU  88  -3.320  -6.244  16.101
  662   HD12  LEU  88          2HD1      LEU  88  -3.077  -4.496  16.103
  663   HD13  LEU  88          3HD1      LEU  88  -1.801  -5.564  15.518
  664   HD21  LEU  88          1HD2      LEU  88  -3.574  -6.709  12.517
  665   HD22  LEU  88          2HD2      LEU  88  -4.553  -7.158  13.914
  666   HD23  LEU  88          3HD2      LEU  88  -2.803  -7.371  13.958
  667    H    GLN  89           H        GLN  89  -5.857  -2.124  12.631
  668    HA   GLN  89           HA       GLN  89  -8.784  -2.394  13.149
  669    HB2  GLN  89          2HB       GLN  89  -6.941   0.010  13.325
  670    HB3  GLN  89          1HB       GLN  89  -8.679   0.055  13.628
  671    HG2  GLN  89          2HG       GLN  89  -8.423  -1.563  15.458
  672    HG3  GLN  89          1HG       GLN  89  -6.690  -1.663  15.142
  673   HE21  GLN  89          1HE2      GLN  89  -7.657  -0.795  17.686
  674   HE22  GLN  89          2HE2      GLN  89  -7.279   0.849  17.875
  675    H1   PN7 101          3HO       SAT 101   2.726  -9.876 -11.440
  676    H2   PN7 101          1H1       SAT 101   4.624  -7.825  -8.873
  677    H3   PN7 101          2H1       SAT 101   2.979  -8.248  -8.401
  678    H5   PN7 101          1HE1      SAT 101   3.805  -7.205 -12.448
  679    H6   PN7 101          2HE1      SAT 101   4.354  -8.749 -11.798
  680    H7   PN7 101          3HE1      SAT 101   5.116  -7.250 -11.271
  681    H8   PN7 101          2HE2      SAT 101   3.782  -5.725  -9.562
  682    H9   PN7 101          3HE2      SAT 101   2.043  -6.008  -9.512
  683    H10  PN7 101          1HE2      SAT 101   2.819  -5.553 -11.029
  684    H11  PN7 101          3H        SAT 101   1.373  -8.678  -9.991
  685    H12  PN7 101          5H        SAT 101   1.420  -5.677 -12.651
  686    H13  PN7 101          1H6       SAT 101   2.305  -7.726 -14.093
  687    H14  PN7 101          2H6       SAT 101   0.715  -8.366 -13.681
  688    H15  PN7 101          1H7       SAT 101   1.436  -6.083 -15.476
  689    H16  PN7 101          2H7       SAT 101  -0.087  -5.998 -14.590
  690    H17  PN7 101          9H        SAT 101   1.715  -8.608 -16.357
  691    H18  PN7 101          1H10      SAT 101   0.244  -8.054 -18.711
  692    H19  PN7 101          2H10      SAT 101   1.139  -9.547 -18.428
  693    H20  PN7 101          1H11      SAT 101  -0.984 -10.432 -18.595
  694    H21  PN7 101          2H11      SAT 101  -1.757  -8.959 -18.010
  695    H22  PN7 101          2HS1      SAT 101  -0.477  -9.798 -15.620
  Start of MODEL   15
    1    H1   MET   1          1HT       MET   1  -2.953  13.321   7.243
    2    H2   MET   1          2HT       MET   1  -3.819  11.859   7.298
    3    H3   MET   1          3HT       MET   1  -4.340  13.122   6.287
    4    HA   MET   1           HA       MET   1  -2.509  12.872   4.838
    5    HB2  MET   1          2HB       MET   1  -0.918  10.858   5.512
    6    HB3  MET   1          1HB       MET   1  -0.634  12.475   6.151
    7    HG2  MET   1          2HG       MET   1  -1.883  11.903   8.194
    8    HG3  MET   1          1HG       MET   1  -2.201  10.290   7.555
    9    HE1  MET   1          1HE       MET   1  -1.089   9.022   9.632
   10    HE2  MET   1          2HE       MET   1  -1.143  10.668  10.258
   11    HE3  MET   1          3HE       MET   1   0.325   9.711  10.441
   12    H    GLN   2           H        GLN   2  -5.172  11.701   5.288
   13    HA   GLN   2           HA       GLN   2  -6.500   9.965   4.434
   14    HB2  GLN   2          2HB       GLN   2  -4.068   9.583   2.656
   15    HB3  GLN   2          1HB       GLN   2  -5.666   8.901   2.361
   16    HG2  GLN   2          2HG       GLN   2  -6.628  11.157   2.232
   17    HG3  GLN   2          1HG       GLN   2  -5.047  11.860   2.571
   18   HE21  GLN   2          1HE2      GLN   2  -6.393  12.486   0.142
   19   HE22  GLN   2          2HE2      GLN   2  -5.544  11.785  -1.150
   20    H    HIS   3           H        HIS   3  -5.115   9.328   6.784
   21    HA   HIS   3           HA       HIS   3  -4.247   7.515   8.013
   22    HB2  HIS   3          2HB       HIS   3  -6.022   6.126   5.986
   23    HB3  HIS   3          1HB       HIS   3  -5.316   5.319   7.385
   24    HD1  HIS   3          1HD       HIS   3  -8.358   5.493   7.220
   25    HD2  HIS   3          2HD       HIS   3  -6.028   8.398   9.103
   26    HE1  HIS   3          1HE       HIS   3  -9.875   6.673   8.871
   27    HE2  HIS   3          2HE       HIS   3  -8.467   8.440  10.022
   28    H    ALA   4           H        ALA   4  -2.536   8.457   5.911
   29    HA   ALA   4           HA       ALA   4  -1.522   6.377   4.253
   30    HB1  ALA   4          1HB       ALA   4  -0.904   8.733   3.929
   31    HB2  ALA   4          2HB       ALA   4   0.542   7.748   4.146
   32    HB3  ALA   4          3HB       ALA   4  -0.060   8.735   5.477
   33    H    SER   5           H        SER   5  -0.801   7.259   7.612
   34    HA   SER   5           HA       SER   5   1.467   5.585   7.972
   35    HB2  SER   5          2HB       SER   5  -0.682   6.216  10.017
   36    HB3  SER   5          1HB       SER   5   0.966   5.695  10.359
   37    HG   SER   5           HG       SER   5   1.123   7.843  10.470
   38    H    VAL   6           H        VAL   6  -2.003   4.891   8.193
   39    HA   VAL   6           HA       VAL   6  -1.693   2.183   9.115
   40    HB   VAL   6           HB       VAL   6  -3.931   3.517   7.581
   41   HG11  VAL   6          1HG1      VAL   6  -5.197   1.492   8.680
   42   HG12  VAL   6          2HG1      VAL   6  -3.599   0.747   8.695
   43   HG13  VAL   6          3HG1      VAL   6  -4.323   1.250   7.168
   44   HG21  VAL   6          1HG2      VAL   6  -4.412   2.696  10.338
   45   HG22  VAL   6          2HG2      VAL   6  -4.652   4.274   9.586
   46   HG23  VAL   6          3HG2      VAL   6  -3.067   3.829  10.217
   47    H    ILE   7           H        ILE   7  -1.839   3.674   5.912
   48    HA   ILE   7           HA       ILE   7  -1.999   1.283   4.380
   49    HB   ILE   7           HB       ILE   7  -0.590   3.884   3.709
   50   HG12  ILE   7          2HG1      ILE   7  -3.400   2.946   3.044
   51   HG13  ILE   7          1HG1      ILE   7  -3.013   4.080   4.339
   52   HG21  ILE   7          1HG2      ILE   7  -1.128   3.122   1.343
   53   HG22  ILE   7          2HG2      ILE   7  -1.514   1.542   2.024
   54   HG23  ILE   7          3HG2      ILE   7   0.121   2.186   2.164
   55   HD11  ILE   7          1HD1      ILE   7  -1.673   5.098   2.105
   56   HD12  ILE   7          2HD1      ILE   7  -3.167   5.724   2.802
   57   HD13  ILE   7          3HD1      ILE   7  -3.231   4.563   1.477
   58    H    ALA   8           H        ALA   8   0.864   3.167   5.389
   59    HA   ALA   8           HA       ALA   8   2.789   1.302   4.365
   60    HB1  ALA   8          1HB       ALA   8   2.804   3.746   5.912
   61    HB2  ALA   8          2HB       ALA   8   4.087   3.058   4.917
   62    HB3  ALA   8          3HB       ALA   8   3.927   2.577   6.606
   63    H    GLN   9           H        GLN   9   1.448   1.774   7.624
   64    HA   GLN   9           HA       GLN   9   2.859  -0.379   8.863
   65    HB2  GLN   9          2HB       GLN   9   1.642   1.420  10.095
   66    HB3  GLN   9          1HB       GLN   9   0.116   0.713   9.562
   67    HG2  GLN   9          2HG       GLN   9   1.483  -1.457  10.623
   68    HG3  GLN   9          1HG       GLN   9   1.904  -0.139  11.715
   69   HE21  GLN   9          1HE2      GLN   9  -1.058  -1.283   9.983
   70   HE22  GLN   9          2HE2      GLN   9  -2.091  -1.071  11.313
   71    H    PHE  10           H        PHE  10  -0.334  -0.220   7.332
   72    HA   PHE  10           HA       PHE  10  -1.053  -2.949   7.822
   73    HB2  PHE  10          2HB       PHE  10  -2.649  -1.138   7.153
   74    HB3  PHE  10          1HB       PHE  10  -1.941  -1.165   5.538
   75    HD1  PHE  10          1HD       PHE  10  -2.440  -2.919   3.979
   76    HD2  PHE  10          2HD       PHE  10  -3.841  -3.143   8.033
   77    HE1  PHE  10          1HE       PHE  10  -3.914  -4.817   3.365
   78    HE2  PHE  10          2HE       PHE  10  -5.315  -5.041   7.420
   79    HZ   PHE  10           HZ       PHE  10  -5.351  -5.877   5.085
   80    H    VAL  11           H        VAL  11   0.349  -1.347   4.970
   81    HA   VAL  11           HA       VAL  11   0.643  -3.766   3.438
   82    HB   VAL  11           HB       VAL  11   2.149  -1.139   3.265
   83   HG11  VAL  11          1HG1      VAL  11   2.510  -3.653   1.912
   84   HG12  VAL  11          2HG1      VAL  11   3.406  -2.149   1.699
   85   HG13  VAL  11          3HG1      VAL  11   1.944  -2.446   0.759
   86   HG21  VAL  11          1HG2      VAL  11  -0.459  -1.307   2.981
   87   HG22  VAL  11          2HG2      VAL  11  -0.054  -2.041   1.429
   88   HG23  VAL  11          3HG2      VAL  11   0.486  -0.403   1.797
   89    H    VAL  12           H        VAL  12   2.883  -1.921   5.493
   90    HA   VAL  12           HA       VAL  12   5.147  -3.623   5.096
   91    HB   VAL  12           HB       VAL  12   4.425  -1.864   7.444
   92   HG11  VAL  12          1HG1      VAL  12   6.159  -3.544   7.988
   93   HG12  VAL  12          2HG1      VAL  12   6.830  -1.917   7.952
   94   HG13  VAL  12          3HG1      VAL  12   7.100  -3.013   6.597
   95   HG21  VAL  12          1HG2      VAL  12   6.500  -1.094   5.472
   96   HG22  VAL  12          2HG2      VAL  12   5.288  -0.097   6.276
   97   HG23  VAL  12          3HG2      VAL  12   4.840  -1.075   4.880
   98    H    GLU  13           H        GLU  13   2.436  -3.744   7.352
   99    HA   GLU  13           HA       GLU  13   3.402  -5.682   9.159
  100    HB2  GLU  13          2HB       GLU  13   1.250  -4.459   9.410
  101    HB3  GLU  13          1HB       GLU  13   0.577  -5.447   8.120
  102    HG2  GLU  13          2HG       GLU  13   1.088  -7.486   9.452
  103    HG3  GLU  13          1HG       GLU  13   1.647  -6.448  10.761
  104    H    GLU  14           H        GLU  14   2.199  -6.067   5.879
  105    HA   GLU  14           HA       GLU  14   1.796  -8.905   5.980
  106    HB2  GLU  14          2HB       GLU  14   2.502  -7.097   3.651
  107    HB3  GLU  14          1HB       GLU  14   2.000  -8.780   3.491
  108    HG2  GLU  14          2HG       GLU  14  -0.125  -8.228   4.667
  109    HG3  GLU  14          1HG       GLU  14   0.371  -6.536   4.720
  110    H    PHE  15           H        PHE  15   4.661  -6.915   5.501
  111    HA   PHE  15           HA       PHE  15   6.297  -9.388   5.701
  112    HB2  PHE  15          2HB       PHE  15   7.712  -8.744   3.830
  113    HB3  PHE  15          1HB       PHE  15   6.041  -8.825   3.273
  114    HD1  PHE  15          1HD       PHE  15   8.946  -6.717   3.706
  115    HD2  PHE  15          2HD       PHE  15   4.690  -6.675   3.132
  116    HE1  PHE  15          1HE       PHE  15   9.066  -4.346   2.991
  117    HE2  PHE  15          2HE       PHE  15   4.809  -4.305   2.412
  118    HZ   PHE  15           HZ       PHE  15   6.998  -3.141   2.343
  119    H    LEU  16           H        LEU  16   5.866  -7.546   7.758
  120    HA   LEU  16           HA       LEU  16   8.009  -5.582   7.752
  121    HB2  LEU  16          2HB       LEU  16   7.056  -4.733   9.641
  122    HB3  LEU  16          1HB       LEU  16   5.673  -5.632   9.054
  123    HG   LEU  16           HG       LEU  16   7.666  -6.592  11.139
  124   HD11  LEU  16          1HD1      LEU  16   5.215  -5.039  11.255
  125   HD12  LEU  16          2HD1      LEU  16   6.374  -5.402  12.536
  126   HD13  LEU  16          3HD1      LEU  16   5.075  -6.538  12.173
  127   HD21  LEU  16          1HD2      LEU  16   5.107  -8.004  10.867
  128   HD22  LEU  16          2HD2      LEU  16   6.737  -8.663  11.000
  129   HD23  LEU  16          3HD2      LEU  16   6.118  -8.155   9.433
  130    HA   PRO  17           HA       PRO  17  11.024  -8.463   9.383
  131    HB2  PRO  17          2HB       PRO  17  13.041  -6.716   9.873
  132    HB3  PRO  17          1HB       PRO  17  12.567  -7.149   8.220
  133    HG2  PRO  17          2HG       PRO  17  11.881  -4.720   9.805
  134    HG3  PRO  17          1HG       PRO  17  12.351  -4.859   8.102
  135    HD2  PRO  17          2HD       PRO  17   9.747  -4.594   8.934
  136    HD3  PRO  17          1HD       PRO  17  10.225  -5.401   7.425
  137    H    ASP  18           H        ASP  18  12.881  -7.461  11.444
  138    HA   ASP  18           HA       ASP  18  11.146  -7.779  13.766
  139    HB2  ASP  18          2HB       ASP  18  14.113  -7.266  13.484
  140    HB3  ASP  18          1HB       ASP  18  13.306  -7.531  15.024
  141    H    VAL  19           H        VAL  19  11.377  -5.273  11.845
  142    HA   VAL  19           HA       VAL  19  11.627  -3.234  14.025
  143    HB   VAL  19           HB       VAL  19  11.813  -2.795  11.033
  144   HG11  VAL  19          1HG1      VAL  19  11.264  -0.747  12.069
  145   HG12  VAL  19          2HG1      VAL  19  13.022  -0.694  11.951
  146   HG13  VAL  19          3HG1      VAL  19  12.253  -1.095  13.487
  147   HG21  VAL  19          1HG2      VAL  19  13.925  -3.347  13.127
  148   HG22  VAL  19          2HG2      VAL  19  14.304  -2.483  11.638
  149   HG23  VAL  19          3HG2      VAL  19  13.702  -4.140  11.568
  150    H    ALA  20           H        ALA  20   9.860  -1.929  14.435
  151    HA   ALA  20           HA       ALA  20   7.299  -2.686  13.339
  152    HB1  ALA  20          1HB       ALA  20   8.207  -0.412  15.106
  153    HB2  ALA  20          2HB       ALA  20   7.291  -1.846  15.569
  154    HB3  ALA  20          3HB       ALA  20   6.529  -0.589  14.595
  155    HA   PRO  21           HA       PRO  21   7.318  -0.290   9.548
  156    HB2  PRO  21          2HB       PRO  21   4.552   0.496  10.342
  157    HB3  PRO  21          1HB       PRO  21   5.136  -0.186   8.813
  158    HG2  PRO  21          2HG       PRO  21   3.791  -1.648  10.609
  159    HG3  PRO  21          1HG       PRO  21   5.062  -2.331   9.582
  160    HD2  PRO  21          2HD       PRO  21   5.118  -1.762  12.491
  161    HD3  PRO  21          1HD       PRO  21   6.077  -2.914  11.533
  162    H    ALA  22           H        ALA  22   6.140   1.134  12.555
  163    HA   ALA  22           HA       ALA  22   6.190   3.875  11.686
  164    HB1  ALA  22          1HB       ALA  22   6.656   4.066  14.356
  165    HB2  ALA  22          2HB       ALA  22   6.013   2.425  14.268
  166    HB3  ALA  22          3HB       ALA  22   5.056   3.781  13.671
  167    H    ASP  23           H        ASP  23   8.661   1.637  12.631
  168    HA   ASP  23           HA       ASP  23  10.642   3.844  12.896
  169    HB2  ASP  23          2HB       ASP  23  10.800   0.896  13.585
  170    HB3  ASP  23          1HB       ASP  23  12.156   2.013  13.724
  171    H    VAL  24           H        VAL  24   9.344   2.239  10.444
  172    HA   VAL  24           HA       VAL  24  11.914   1.600   9.083
  173    HB   VAL  24           HB       VAL  24   9.060   1.062   8.199
  174   HG11  VAL  24          1HG1      VAL  24  10.579   1.218   6.305
  175   HG12  VAL  24          2HG1      VAL  24  10.207  -0.482   6.588
  176   HG13  VAL  24          3HG1      VAL  24  11.753   0.182   7.116
  177   HG21  VAL  24          1HG2      VAL  24  11.090  -0.954   9.170
  178   HG22  VAL  24          2HG2      VAL  24   9.351  -1.164   8.972
  179   HG23  VAL  24          3HG2      VAL  24   9.975  -0.160  10.280
  180    H    ASP  25           H        ASP  25  12.624   2.860   7.383
  181    HA   ASP  25           HA       ASP  25  11.484   5.484   7.058
  182    HB2  ASP  25          2HB       ASP  25  13.530   3.970   5.409
  183    HB3  ASP  25          1HB       ASP  25  13.129   5.671   5.170
  184    H    VAL  26           H        VAL  26   9.288   5.127   6.422
  185    HA   VAL  26           HA       VAL  26   8.487   3.494   4.221
  186    HB   VAL  26           HB       VAL  26   6.408   4.777   4.255
  187   HG11  VAL  26          1HG1      VAL  26   6.985   3.180   6.143
  188   HG12  VAL  26          2HG1      VAL  26   5.791   4.414   6.551
  189   HG13  VAL  26          3HG1      VAL  26   7.462   4.591   7.089
  190   HG21  VAL  26          1HG2      VAL  26   6.947   7.034   4.379
  191   HG22  VAL  26          2HG2      VAL  26   8.179   6.777   5.615
  192   HG23  VAL  26          3HG2      VAL  26   6.471   6.732   6.050
  193    H    ASP  27           H        ASP  27  10.649   5.901   4.048
  194    HA   ASP  27           HA       ASP  27   9.624   7.145   1.563
  195    HB2  ASP  27          2HB       ASP  27  12.143   7.620   3.187
  196    HB3  ASP  27          1HB       ASP  27  11.731   8.500   1.715
  197    H    LEU  28           H        LEU  28  10.893   4.283   2.216
  198    HA   LEU  28           HA       LEU  28  13.014   4.236   0.156
  199    HB2  LEU  28          2HB       LEU  28  13.238   2.956   2.301
  200    HB3  LEU  28          1HB       LEU  28  11.872   1.962   1.804
  201    HG   LEU  28           HG       LEU  28  13.354   1.695  -0.407
  202   HD11  LEU  28          1HD1      LEU  28  15.106   3.239   0.542
  203   HD12  LEU  28          2HD1      LEU  28  15.719   1.653   0.076
  204   HD13  LEU  28          3HD1      LEU  28  15.428   2.020   1.776
  205   HD21  LEU  28          1HD2      LEU  28  13.638   0.227   2.225
  206   HD22  LEU  28          2HD2      LEU  28  14.378  -0.348   0.730
  207   HD23  LEU  28          3HD2      LEU  28  12.624  -0.208   0.849
  208    H    ASP  29           H        ASP  29  12.717   3.378  -1.883
  209    HA   ASP  29           HA       ASP  29  10.063   3.057  -2.897
  210    HB2  ASP  29          2HB       ASP  29  12.726   2.104  -4.003
  211    HB3  ASP  29          1HB       ASP  29  11.209   2.071  -4.902
  212    H    LEU  30           H        LEU  30   8.723   1.359  -2.546
  213    HA   LEU  30           HA       LEU  30   9.694  -1.029  -1.217
  214    HB2  LEU  30          2HB       LEU  30   7.337  -1.786  -1.388
  215    HB3  LEU  30          1HB       LEU  30   7.455  -0.148  -0.743
  216    HG   LEU  30           HG       LEU  30   7.338  -0.059  -3.623
  217   HD11  LEU  30          1HD1      LEU  30   5.198  -1.647  -2.189
  218   HD12  LEU  30          2HD1      LEU  30   6.133  -2.128  -3.606
  219   HD13  LEU  30          3HD1      LEU  30   4.919  -0.856  -3.742
  220   HD21  LEU  30          1HD2      LEU  30   5.390   0.844  -1.482
  221   HD22  LEU  30          2HD2      LEU  30   5.458   1.439  -3.140
  222   HD23  LEU  30          3HD2      LEU  30   6.788   1.770  -2.029
  223    H    VAL  31           H        VAL  31  10.262  -0.211  -4.262
  224    HA   VAL  31           HA       VAL  31   9.244  -2.274  -5.905
  225    HB   VAL  31           HB       VAL  31  11.912  -0.838  -5.984
  226   HG11  VAL  31          1HG1      VAL  31  11.502  -1.723  -8.525
  227   HG12  VAL  31          2HG1      VAL  31  10.834  -3.071  -7.604
  228   HG13  VAL  31          3HG1      VAL  31  12.505  -2.571  -7.348
  229   HG21  VAL  31          1HG2      VAL  31  10.208   0.721  -6.453
  230   HG22  VAL  31          2HG2      VAL  31   9.219  -0.472  -7.293
  231   HG23  VAL  31          3HG2      VAL  31  10.679   0.154  -8.055
  232    H    ASP  32           H        ASP  32  12.101  -2.245  -3.799
  233    HA   ASP  32           HA       ASP  32  13.120  -4.807  -4.467
  234    HB2  ASP  32          2HB       ASP  32  14.195  -3.116  -2.904
  235    HB3  ASP  32          1HB       ASP  32  13.043  -3.630  -1.671
  236    H    ASN  33           H        ASN  33  10.474  -3.801  -2.390
  237    HA   ASN  33           HA       ASN  33   9.898  -6.546  -1.518
  238    HB2  ASN  33          2HB       ASN  33   8.311  -4.001  -1.138
  239    HB3  ASN  33          1HB       ASN  33   8.028  -5.529  -0.309
  240   HD21  ASN  33          1HD2      ASN  33   9.177  -2.642   0.430
  241   HD22  ASN  33          2HD2      ASN  33  10.478  -3.036   1.445
  242    H    GLY  34           H        GLY  34   9.712  -5.339  -4.398
  243    HA2  GLY  34          2HA       GLY  34   7.153  -5.185  -5.404
  244    HA3  GLY  34          1HA       GLY  34   8.445  -6.017  -6.272
  245    H    VAL  35           H        VAL  35   8.495  -7.839  -3.717
  246    HA   VAL  35           HA       VAL  35   7.130 -10.056  -4.817
  247    HB   VAL  35           HB       VAL  35   7.772  -9.376  -1.932
  248   HG11  VAL  35          1HG1      VAL  35   7.548 -12.122  -2.091
  249   HG12  VAL  35          2HG1      VAL  35   6.204 -11.574  -3.095
  250   HG13  VAL  35          3HG1      VAL  35   6.326 -11.044  -1.416
  251   HG21  VAL  35          1HG2      VAL  35   9.604  -9.762  -3.703
  252   HG22  VAL  35          2HG2      VAL  35   9.053 -11.437  -3.734
  253   HG23  VAL  35          3HG2      VAL  35   9.689 -10.746  -2.242
  254    H    ILE  36           H        ILE  36   5.986  -7.492  -2.677
  255    HA   ILE  36           HA       ILE  36   3.387  -8.638  -2.162
  256    HB   ILE  36           HB       ILE  36   4.684  -6.671  -0.981
  257   HG12  ILE  36          2HG1      ILE  36   1.695  -6.650  -1.501
  258   HG13  ILE  36          1HG1      ILE  36   2.532  -7.518  -0.216
  259   HG21  ILE  36          1HG2      ILE  36   4.601  -5.398  -3.244
  260   HG22  ILE  36          2HG2      ILE  36   4.222  -4.497  -1.776
  261   HG23  ILE  36          3HG2      ILE  36   2.921  -5.062  -2.826
  262   HD11  ILE  36          1HD1      ILE  36   3.410  -5.276   0.582
  263   HD12  ILE  36          2HD1      ILE  36   1.674  -5.512   0.776
  264   HD13  ILE  36          3HD1      ILE  36   2.287  -4.525  -0.551
  265    H    ASP  37           H        ASP  37   4.744  -6.794  -4.781
  266    HA   ASP  37           HA       ASP  37   2.374  -5.667  -5.861
  267    HB2  ASP  37          2HB       ASP  37   4.878  -6.606  -7.284
  268    HB3  ASP  37          1HB       ASP  37   3.621  -5.615  -8.019
  269    H    SER  38           H        SER  38   3.676  -8.945  -6.163
  270    HA   SER  38           HA       SER  38   1.456  -9.576  -8.044
  271    HB2  SER  38          2HB       SER  38   3.924 -11.186  -7.361
  272    HB3  SER  38          1HB       SER  38   2.721 -11.607  -8.578
  273    H    LEU  39           H        LEU  39   3.125 -11.359  -5.420
  274    HA   LEU  39           HA       LEU  39   0.807 -13.005  -4.957
  275    HB2  LEU  39          2HB       LEU  39   3.300 -12.572  -3.317
  276    HB3  LEU  39          1HB       LEU  39   2.083 -13.788  -2.947
  277    HG   LEU  39           HG       LEU  39   2.551 -14.298  -5.592
  278   HD11  LEU  39          1HD1      LEU  39   4.379 -12.623  -5.643
  279   HD12  LEU  39          2HD1      LEU  39   4.984 -14.254  -5.928
  280   HD13  LEU  39          3HD1      LEU  39   5.199 -13.497  -4.350
  281   HD21  LEU  39          1HD2      LEU  39   4.116 -15.406  -3.240
  282   HD22  LEU  39          2HD2      LEU  39   3.859 -16.214  -4.786
  283   HD23  LEU  39          3HD2      LEU  39   2.494 -15.919  -3.708
  284    H    GLY  40           H        GLY  40   2.297 -10.441  -2.970
  285    HA2  GLY  40          2HA       GLY  40   0.218 -10.466  -0.995
  286    HA3  GLY  40          1HA       GLY  40   1.359  -9.150  -1.252
  287    H    LEU  41           H        LEU  41   0.688  -8.655  -3.984
  288    HA   LEU  41           HA       LEU  41  -1.428  -6.788  -3.687
  289    HB2  LEU  41          2HB       LEU  41   0.322  -6.762  -5.483
  290    HB3  LEU  41          1HB       LEU  41  -0.512  -8.111  -6.254
  291    HG   LEU  41           HG       LEU  41  -2.607  -6.487  -6.016
  292   HD11  LEU  41          1HD1      LEU  41  -1.884  -4.136  -6.394
  293   HD12  LEU  41          2HD1      LEU  41  -0.215  -4.630  -6.104
  294   HD13  LEU  41          3HD1      LEU  41  -1.405  -4.738  -4.806
  295   HD21  LEU  41          1HD2      LEU  41  -0.467  -6.052  -8.125
  296   HD22  LEU  41          2HD2      LEU  41  -2.197  -5.752  -8.303
  297   HD23  LEU  41          3HD2      LEU  41  -1.603  -7.402  -8.126
  298    H    LEU  42           H        LEU  42  -1.409 -10.108  -4.946
  299    HA   LEU  42           HA       LEU  42  -4.142 -10.155  -5.788
  300    HB2  LEU  42          2HB       LEU  42  -2.416 -11.911  -6.334
  301    HB3  LEU  42          1HB       LEU  42  -2.540 -12.476  -4.674
  302    HG   LEU  42           HG       LEU  42  -5.109 -12.584  -5.182
  303   HD11  LEU  42          1HD1      LEU  42  -4.291 -11.564  -7.573
  304   HD12  LEU  42          2HD1      LEU  42  -5.774 -12.494  -7.357
  305   HD13  LEU  42          3HD1      LEU  42  -4.310 -13.289  -7.936
  306   HD21  LEU  42          1HD2      LEU  42  -4.677 -14.898  -6.270
  307   HD22  LEU  42          2HD2      LEU  42  -3.982 -14.603  -4.677
  308   HD23  LEU  42          3HD2      LEU  42  -2.967 -14.495  -6.114
  309    H    LYS  43           H        LYS  43  -2.593 -10.973  -2.688
  310    HA   LYS  43           HA       LYS  43  -5.008 -11.734  -1.344
  311    HB2  LYS  43          2HB       LYS  43  -2.406 -10.631  -0.270
  312    HB3  LYS  43          1HB       LYS  43  -3.677 -11.329   0.725
  313    HG2  LYS  43          2HG       LYS  43  -3.483 -13.447  -0.585
  314    HG3  LYS  43          1HG       LYS  43  -2.123 -12.742  -1.459
  315    HD2  LYS  43          2HD       LYS  43  -0.949 -12.412   0.722
  316    HD3  LYS  43          1HD       LYS  43  -2.277 -13.246   1.527
  317    HE2  LYS  43          2HE       LYS  43  -0.755 -14.506  -0.759
  318    HE3  LYS  43          1HE       LYS  43  -0.229 -14.671   0.916
  319    HZ1  LYS  43          1HZ       LYS  43  -2.714 -15.340   1.257
  320    HZ2  LYS  43          2HZ       LYS  43  -1.580 -16.480   0.709
  321    HZ3  LYS  43          3HZ       LYS  43  -2.631 -15.727  -0.393
  322    H    VAL  44           H        VAL  44  -3.373  -8.649  -1.839
  323    HA   VAL  44           HA       VAL  44  -4.852  -7.076   0.009
  324    HB   VAL  44           HB       VAL  44  -3.577  -6.380  -2.646
  325   HG11  VAL  44          1HG1      VAL  44  -4.815  -4.482  -2.520
  326   HG12  VAL  44          2HG1      VAL  44  -3.731  -4.043  -1.200
  327   HG13  VAL  44          3HG1      VAL  44  -5.287  -4.795  -0.851
  328   HG21  VAL  44          1HG2      VAL  44  -2.530  -5.316  -0.105
  329   HG22  VAL  44          2HG2      VAL  44  -1.668  -6.061  -1.452
  330   HG23  VAL  44          3HG2      VAL  44  -2.450  -7.073  -0.237
  331    H    ILE  45           H        ILE  45  -5.534  -7.861  -3.400
  332    HA   ILE  45           HA       ILE  45  -7.873  -6.268  -3.654
  333    HB   ILE  45           HB       ILE  45  -6.739  -8.646  -5.052
  334   HG12  ILE  45          2HG1      ILE  45  -7.120  -7.122  -7.011
  335   HG13  ILE  45          1HG1      ILE  45  -7.779  -5.923  -5.899
  336   HG21  ILE  45          1HG2      ILE  45  -8.978  -9.411  -4.978
  337   HG22  ILE  45          2HG2      ILE  45  -8.843  -8.586  -6.531
  338   HG23  ILE  45          3HG2      ILE  45  -9.628  -7.782  -5.171
  339   HD11  ILE  45          1HD1      ILE  45  -5.431  -5.422  -6.295
  340   HD12  ILE  45          2HD1      ILE  45  -4.973  -7.068  -5.864
  341   HD13  ILE  45          3HD1      ILE  45  -5.621  -5.982  -4.634
  342    H    ALA  46           H        ALA  46  -7.485  -9.658  -2.619
  343    HA   ALA  46           HA       ALA  46 -10.273 -10.190  -2.271
  344    HB1  ALA  46          1HB       ALA  46  -8.941 -12.109  -2.275
  345    HB2  ALA  46          2HB       ALA  46  -9.291 -11.920  -0.557
  346    HB3  ALA  46          3HB       ALA  46  -7.736 -11.393  -1.204
  347    H    TRP  47           H        TRP  47  -7.802  -9.002   0.010
  348    HA   TRP  47           HA       TRP  47  -9.676  -8.865   2.226
  349    HB2  TRP  47          2HB       TRP  47  -7.547  -9.007   3.071
  350    HB3  TRP  47          1HB       TRP  47  -6.843  -8.103   1.732
  351    HD1  TRP  47           HD       TRP  47  -8.622  -7.618   5.079
  352    HE1  TRP  47          1HE       TRP  47  -8.274  -5.181   5.849
  353    HE3  TRP  47          3HE       TRP  47  -6.389  -5.691   0.923
  354    HZ2  TRP  47          2HZ       TRP  47  -7.180  -2.736   4.830
  355    HZ3  TRP  47          3HZ       TRP  47  -5.701  -3.314   0.842
  356    HH2  TRP  47           HH       TRP  47  -6.095  -1.836   2.788
  357    H    LEU  48           H        LEU  48  -8.390  -6.544  -0.130
  358    HA   LEU  48           HA       LEU  48  -9.423  -4.181   1.021
  359    HB2  LEU  48          2HB       LEU  48  -7.863  -4.338  -0.948
  360    HB3  LEU  48          1HB       LEU  48  -9.239  -4.801  -1.936
  361    HG   LEU  48           HG       LEU  48 -10.306  -2.618  -0.908
  362   HD11  LEU  48          1HD1      LEU  48  -8.558  -0.885  -0.583
  363   HD12  LEU  48          2HD1      LEU  48  -7.323  -2.132  -0.747
  364   HD13  LEU  48          3HD1      LEU  48  -8.440  -2.173   0.616
  365   HD21  LEU  48          1HD2      LEU  48 -10.143  -2.528  -3.203
  366   HD22  LEU  48          2HD2      LEU  48  -8.463  -3.063  -3.204
  367   HD23  LEU  48          3HD2      LEU  48  -8.854  -1.387  -2.817
  368    H    GLU  49           H        GLU  49 -10.982  -6.462  -1.246
  369    HA   GLU  49           HA       GLU  49 -13.428  -4.961  -1.443
  370    HB2  GLU  49          2HB       GLU  49 -13.164  -6.553  -3.142
  371    HB3  GLU  49          1HB       GLU  49 -12.644  -7.807  -2.026
  372    HG2  GLU  49          2HG       GLU  49 -14.892  -8.040  -1.158
  373    HG3  GLU  49          1HG       GLU  49 -15.445  -6.668  -2.107
  374    H    ASP  50           H        ASP  50 -12.356  -7.562   0.712
  375    HA   ASP  50           HA       ASP  50 -14.852  -7.927   2.053
  376    HB2  ASP  50          2HB       ASP  50 -12.867  -9.466   2.165
  377    HB3  ASP  50          1HB       ASP  50 -12.091  -8.284   3.216
  378    H    ARG  51           H        ARG  51 -12.065  -5.851   2.811
  379    HA   ARG  51           HA       ARG  51 -13.114  -4.845   5.268
  380    HB2  ARG  51          2HB       ARG  51 -10.734  -4.660   4.572
  381    HB3  ARG  51          1HB       ARG  51 -11.208  -3.457   3.371
  382    HG2  ARG  51          2HG       ARG  51 -12.110  -2.017   5.153
  383    HG3  ARG  51          1HG       ARG  51 -11.658  -3.221   6.362
  384    HD2  ARG  51          2HD       ARG  51  -9.283  -2.991   5.658
  385    HD3  ARG  51          1HD       ARG  51  -9.760  -1.724   4.529
  386    HE   ARG  51           HE       ARG  51 -10.566  -1.245   7.313
  387   HH11  ARG  51          1HH1      ARG  51  -9.615   0.571   8.265
  388   HH12  ARG  51          2HH1      ARG  51  -8.270   1.337   7.486
  389   HH21  ARG  51          1HH2      ARG  51  -8.219  -0.874   4.815
  390   HH22  ARG  51          2HH2      ARG  51  -7.480   0.518   5.532
  391    H    PHE  52           H        PHE  52 -13.356  -3.508   1.942
  392    HA   PHE  52           HA       PHE  52 -15.213  -1.452   3.040
  393    HB2  PHE  52          2HB       PHE  52 -13.712  -1.605   0.416
  394    HB3  PHE  52          1HB       PHE  52 -14.821  -0.314   0.860
  395    HD1  PHE  52          1HD       PHE  52 -14.319   1.149   2.834
  396    HD2  PHE  52          2HD       PHE  52 -11.494  -1.710   1.316
  397    HE1  PHE  52          1HE       PHE  52 -12.498   2.288   4.074
  398    HE2  PHE  52          2HE       PHE  52  -9.675  -0.570   2.556
  399    HZ   PHE  52           HZ       PHE  52 -10.176   1.428   3.935
  400    H    GLY  53           H        GLY  53 -15.297  -4.423   1.431
  401    HA2  GLY  53          2HA       GLY  53 -17.109  -5.549   0.428
  402    HA3  GLY  53          1HA       GLY  53 -18.135  -4.220   0.970
  403    H    ILE  54           H        ILE  54 -15.289  -3.795  -1.069
  404    HA   ILE  54           HA       ILE  54 -17.110  -2.800  -3.222
  405    HB   ILE  54           HB       ILE  54 -15.191  -1.447  -3.959
  406   HG12  ILE  54          2HG1      ILE  54 -13.784  -2.711  -1.582
  407   HG13  ILE  54          1HG1      ILE  54 -13.415  -3.031  -3.277
  408   HG21  ILE  54          1HG2      ILE  54 -16.699  -0.504  -2.268
  409   HG22  ILE  54          2HG2      ILE  54 -15.045   0.020  -1.953
  410   HG23  ILE  54          3HG2      ILE  54 -15.762  -1.267  -0.984
  411   HD11  ILE  54          1HD1      ILE  54 -12.453  -0.905  -1.621
  412   HD12  ILE  54          2HD1      ILE  54 -13.413  -0.209  -2.926
  413   HD13  ILE  54          3HD1      ILE  54 -12.043  -1.256  -3.299
  414    H    ALA  55           H        ALA  55 -16.595  -3.346  -5.421
  415    HA   ALA  55           HA       ALA  55 -15.847  -6.057  -5.839
  416    HB1  ALA  55          1HB       ALA  55 -16.195  -3.682  -7.653
  417    HB2  ALA  55          2HB       ALA  55 -17.169  -5.148  -7.548
  418    HB3  ALA  55          3HB       ALA  55 -15.573  -5.202  -8.296
  419    H    ALA  56           H        ALA  56 -13.944  -6.943  -6.788
  420    HA   ALA  56           HA       ALA  56 -11.489  -5.977  -5.780
  421    HB1  ALA  56          1HB       ALA  56 -10.517  -7.511  -7.647
  422    HB2  ALA  56          2HB       ALA  56 -12.202  -7.917  -7.970
  423    HB3  ALA  56          3HB       ALA  56 -11.504  -8.250  -6.385
  424    H    ASP  57           H        ASP  57 -13.053  -5.403  -8.909
  425    HA   ASP  57           HA       ASP  57 -12.462  -3.932 -10.647
  426    HB2  ASP  57          2HB       ASP  57 -11.234  -2.493  -8.287
  427    HB3  ASP  57          1HB       ASP  57 -11.447  -1.781  -9.884
  428    H    ASP  58           H        ASP  58 -10.828  -6.119 -10.587
  429    HA   ASP  58           HA       ASP  58  -8.026  -5.412 -10.363
  430    HB2  ASP  58          2HB       ASP  58  -8.900  -7.733 -10.079
  431    HB3  ASP  58          1HB       ASP  58  -9.270  -7.759 -11.802
  432    H    VAL  59           H        VAL  59  -6.978  -4.171 -11.794
  433    HA   VAL  59           HA       VAL  59  -7.681  -4.409 -14.689
  434    HB   VAL  59           HB       VAL  59  -7.308  -2.000 -14.948
  435   HG11  VAL  59          1HG1      VAL  59  -9.124  -2.019 -12.594
  436   HG12  VAL  59          2HG1      VAL  59  -9.526  -3.135 -13.899
  437   HG13  VAL  59          3HG1      VAL  59  -9.401  -1.406 -14.224
  438   HG21  VAL  59          1HG2      VAL  59  -6.332  -2.319 -12.171
  439   HG22  VAL  59          2HG2      VAL  59  -7.297  -0.872 -12.462
  440   HG23  VAL  59          3HG2      VAL  59  -5.839  -1.165 -13.411
  441    H    GLU  60           H        GLU  60  -5.777  -3.721 -16.093
  442    HA   GLU  60           HA       GLU  60  -3.405  -5.065 -15.283
  443    HB2  GLU  60          2HB       GLU  60  -3.972  -4.574 -17.651
  444    HB3  GLU  60          1HB       GLU  60  -3.654  -2.868 -17.355
  445    HG2  GLU  60          2HG       GLU  60  -1.347  -3.414 -16.701
  446    HG3  GLU  60          1HG       GLU  60  -1.663  -5.113 -17.022
  447    H    LEU  61           H        LEU  61  -1.784  -4.436 -13.963
  448    HA   LEU  61           HA       LEU  61  -1.613  -1.545 -13.231
  449    HB2  LEU  61          2HB       LEU  61  -0.683  -3.910 -11.583
  450    HB3  LEU  61          1HB       LEU  61  -0.817  -2.232 -11.062
  451    HG   LEU  61           HG       LEU  61  -3.084  -4.073 -11.826
  452   HD11  LEU  61          1HD1      LEU  61  -3.454  -4.332  -9.603
  453   HD12  LEU  61          2HD1      LEU  61  -3.084  -2.643  -9.254
  454   HD13  LEU  61          3HD1      LEU  61  -1.778  -3.815  -9.433
  455   HD21  LEU  61          1HD2      LEU  61  -4.394  -1.964 -10.944
  456   HD22  LEU  61          2HD2      LEU  61  -3.849  -2.017 -12.620
  457   HD23  LEU  61          3HD2      LEU  61  -2.932  -1.102 -11.424
  458    H    SER  62           H        SER  62   0.457  -0.592 -13.180
  459    HA   SER  62           HA       SER  62   2.586  -2.188 -14.523
  460    HB2  SER  62          2HB       SER  62   1.569   0.412 -15.019
  461    HB3  SER  62          1HB       SER  62   3.191   0.624 -14.365
  462    HG   SER  62           HG       SER  62   2.333  -0.594 -16.720
  463    HA   PRO  63           HA       PRO  63   5.089  -2.134 -10.899
  464    HB2  PRO  63          2HB       PRO  63   7.574  -1.527 -11.984
  465    HB3  PRO  63          1HB       PRO  63   6.839  -3.139 -11.973
  466    HG2  PRO  63          2HG       PRO  63   6.988  -1.139 -14.159
  467    HG3  PRO  63          1HG       PRO  63   7.061  -2.908 -14.233
  468    HD2  PRO  63          2HD       PRO  63   4.829  -1.508 -14.923
  469    HD3  PRO  63          1HD       PRO  63   4.756  -3.140 -14.223
  470    H    GLU  64           H        GLU  64   5.183   0.660 -13.011
  471    HA   GLU  64           HA       GLU  64   6.697   2.421 -11.352
  472    HB2  GLU  64          2HB       GLU  64   4.467   3.016 -13.301
  473    HB3  GLU  64          1HB       GLU  64   5.525   4.231 -12.602
  474    HG2  GLU  64          2HG       GLU  64   7.475   3.046 -13.564
  475    HG3  GLU  64          1HG       GLU  64   6.377   1.898 -14.321
  476    H    HIS  65           H        HIS  65   3.353   1.372 -11.242
  477    HA   HIS  65           HA       HIS  65   2.396   3.428  -9.471
  478    HB2  HIS  65          2HB       HIS  65   0.871   1.987 -10.765
  479    HB3  HIS  65          1HB       HIS  65   1.415   0.582  -9.847
  480    HD1  HIS  65          1HD       HIS  65  -0.065   4.028  -9.088
  481    HD2  HIS  65          2HD       HIS  65  -0.153   0.121  -7.628
  482    HE1  HIS  65          1HE       HIS  65  -1.696   4.023  -7.148
  483    HE2  HIS  65          2HE       HIS  65  -1.757   1.649  -6.254
  484    H    PHE  66           H        PHE  66   4.207   0.481  -8.967
  485    HA   PHE  66           HA       PHE  66   3.806   0.696  -6.029
  486    HB2  PHE  66          2HB       PHE  66   5.204  -1.435  -7.676
  487    HB3  PHE  66          1HB       PHE  66   4.916  -1.504  -5.936
  488    HD1  PHE  66          1HD       PHE  66   2.580  -1.605  -5.054
  489    HD2  PHE  66          2HD       PHE  66   3.452  -1.883  -9.251
  490    HE1  PHE  66          1HE       PHE  66   0.305  -2.499  -5.467
  491    HE2  PHE  66          2HE       PHE  66   1.178  -2.780  -9.665
  492    HZ   PHE  66           HZ       PHE  66  -0.395  -3.086  -7.774
  493    H    ARG  67           H        ARG  67   5.702   2.205  -8.138
  494    HA   ARG  67           HA       ARG  67   8.373   1.740  -7.365
  495    HB2  ARG  67          2HB       ARG  67   7.715   3.218  -9.240
  496    HB3  ARG  67          1HB       ARG  67   7.083   4.391  -8.091
  497    HG2  ARG  67          2HG       ARG  67   9.246   5.189  -8.644
  498    HG3  ARG  67          1HG       ARG  67   9.448   4.413  -7.079
  499    HD2  ARG  67          2HD       ARG  67  10.351   2.411  -8.125
  500    HD3  ARG  67          1HD       ARG  67  10.008   3.056  -9.731
  501    HE   ARG  67           HE       ARG  67  11.651   4.973  -8.649
  502   HH11  ARG  67          1HH1      ARG  67  13.908   4.895  -8.736
  503   HH12  ARG  67          2HH1      ARG  67  14.703   3.362  -8.873
  504   HH21  ARG  67          1HH2      ARG  67  11.756   1.536  -8.896
  505   HH22  ARG  67          2HH2      ARG  67  13.485   1.461  -8.964
  506    H    SER  68           H        SER  68   5.875   3.727  -5.791
  507    HA   SER  68           HA       SER  68   7.605   3.761  -3.372
  508    HB2  SER  68          2HB       SER  68   7.239   6.129  -3.012
  509    HB3  SER  68          1HB       SER  68   7.910   5.914  -4.627
  510    HG   SER  68           HG       SER  68   5.124   5.933  -4.198
  511    H    ILE  69           H        ILE  69   6.389   4.138  -1.392
  512    HA   ILE  69           HA       ILE  69   3.882   2.800  -1.294
  513    HB   ILE  69           HB       ILE  69   5.115   4.724   0.697
  514   HG12  ILE  69          2HG1      ILE  69   5.197   1.706   0.624
  515   HG13  ILE  69          1HG1      ILE  69   6.499   2.727   0.030
  516   HG21  ILE  69          1HG2      ILE  69   2.594   3.377   0.624
  517   HG22  ILE  69          2HG2      ILE  69   3.255   4.397   1.901
  518   HG23  ILE  69          3HG2      ILE  69   3.587   2.665   1.893
  519   HD11  ILE  69          1HD1      ILE  69   7.129   3.395   2.137
  520   HD12  ILE  69          2HD1      ILE  69   6.436   1.830   2.560
  521   HD13  ILE  69          3HD1      ILE  69   5.485   3.301   2.768
  522    H    ARG  70           H        ARG  70   4.715   6.236  -1.510
  523    HA   ARG  70           HA       ARG  70   2.149   7.314  -0.950
  524    HB2  ARG  70          2HB       ARG  70   4.239   8.658  -1.163
  525    HB3  ARG  70          1HB       ARG  70   4.202   8.387  -2.905
  526    HG2  ARG  70          2HG       ARG  70   2.018   9.496  -3.054
  527    HG3  ARG  70          1HG       ARG  70   2.003   9.728  -1.305
  528    HD2  ARG  70          2HD       ARG  70   2.752  11.794  -2.310
  529    HD3  ARG  70          1HD       ARG  70   4.146  11.036  -1.539
  530    HE   ARG  70           HE       ARG  70   5.097  10.726  -3.681
  531   HH11  ARG  70          1HH1      ARG  70   5.096  10.976  -5.928
  532   HH12  ARG  70          2HH1      ARG  70   3.624  11.396  -6.738
  533   HH21  ARG  70          1HH2      ARG  70   1.740  11.495  -3.828
  534   HH22  ARG  70          2HH2      ARG  70   1.724  11.690  -5.549
  535    H    SER  71           H        SER  71   3.522   6.085  -3.997
  536    HA   SER  71           HA       SER  71   1.414   6.907  -5.717
  537    HB2  SER  71          2HB       SER  71   3.574   5.898  -6.482
  538    HB3  SER  71          1HB       SER  71   3.019   4.337  -5.886
  539    HG   SER  71           HG       SER  71   1.120   4.766  -7.291
  540    H    ILE  72           H        ILE  72   1.752   4.046  -3.642
  541    HA   ILE  72           HA       ILE  72  -0.599   2.688  -4.479
  542    HB   ILE  72           HB       ILE  72   0.703   2.764  -1.739
  543   HG12  ILE  72          2HG1      ILE  72   1.083   0.809  -4.030
  544   HG13  ILE  72          1HG1      ILE  72   2.204   2.119  -3.655
  545   HG21  ILE  72          1HG2      ILE  72  -1.006   1.439  -1.134
  546   HG22  ILE  72          2HG2      ILE  72  -0.437   0.254  -2.309
  547   HG23  ILE  72          3HG2      ILE  72  -1.648   1.447  -2.775
  548   HD11  ILE  72          1HD1      ILE  72   1.751   0.800  -1.210
  549   HD12  ILE  72          2HD1      ILE  72   3.215   0.741  -2.190
  550   HD13  ILE  72          3HD1      ILE  72   1.961  -0.481  -2.403
  551    H    ASP  73           H        ASP  73  -0.049   5.244  -2.086
  552    HA   ASP  73           HA       ASP  73  -2.613   5.290  -0.891
  553    HB2  ASP  73          2HB       ASP  73  -0.599   6.655  -0.190
  554    HB3  ASP  73          1HB       ASP  73  -0.938   7.730  -1.547
  555    H    ALA  74           H        ALA  74  -1.464   6.674  -3.945
  556    HA   ALA  74           HA       ALA  74  -3.779   8.217  -4.556
  557    HB1  ALA  74          1HB       ALA  74  -3.026   8.095  -6.884
  558    HB2  ALA  74          2HB       ALA  74  -1.964   6.743  -6.490
  559    HB3  ALA  74          3HB       ALA  74  -1.637   8.344  -5.826
  560    H    PHE  75           H        PHE  75  -2.989   4.804  -5.132
  561    HA   PHE  75           HA       PHE  75  -5.320   4.155  -6.649
  562    HB2  PHE  75          2HB       PHE  75  -3.345   2.648  -6.352
  563    HB3  PHE  75          1HB       PHE  75  -3.862   2.370  -4.691
  564    HD1  PHE  75          1HD       PHE  75  -5.740   0.955  -4.174
  565    HD2  PHE  75          2HD       PHE  75  -4.773   1.903  -8.251
  566    HE1  PHE  75          1HE       PHE  75  -7.317  -0.792  -4.953
  567    HE2  PHE  75          2HE       PHE  75  -6.351   0.155  -9.031
  568    HZ   PHE  75           HZ       PHE  75  -7.623  -1.192  -7.382
  569    H    VAL  76           H        VAL  76  -4.700   4.050  -3.140
  570    HA   VAL  76           HA       VAL  76  -7.312   3.156  -2.399
  571    HB   VAL  76           HB       VAL  76  -5.211   4.760  -0.916
  572   HG11  VAL  76          1HG1      VAL  76  -7.311   5.273   0.119
  573   HG12  VAL  76          2HG1      VAL  76  -6.542   4.038   1.116
  574   HG13  VAL  76          3HG1      VAL  76  -7.842   3.596   0.009
  575   HG21  VAL  76          1HG2      VAL  76  -4.321   2.753  -0.346
  576   HG22  VAL  76          2HG2      VAL  76  -5.273   2.097  -1.679
  577   HG23  VAL  76          3HG2      VAL  76  -5.907   2.049  -0.034
  578    H    VAL  77           H        VAL  77  -5.894   6.382  -2.848
  579    HA   VAL  77           HA       VAL  77  -8.070   7.938  -1.933
  580    HB   VAL  77           HB       VAL  77  -6.028   8.427  -4.111
  581   HG11  VAL  77          1HG1      VAL  77  -6.863  10.892  -3.298
  582   HG12  VAL  77          2HG1      VAL  77  -8.373   9.985  -3.231
  583   HG13  VAL  77          3HG1      VAL  77  -7.464  10.072  -4.738
  584   HG21  VAL  77          1HG2      VAL  77  -6.155   9.829  -1.463
  585   HG22  VAL  77          2HG2      VAL  77  -4.751   9.457  -2.462
  586   HG23  VAL  77          3HG2      VAL  77  -5.522   8.183  -1.518
  587    H    GLY  78           H        GLY  78  -7.419   6.482  -5.099
  588    HA2  GLY  78          2HA       GLY  78  -9.603   7.633  -6.509
  589    HA3  GLY  78          1HA       GLY  78  -8.828   6.109  -6.931
  590    H    ALA  79           H        ALA  79  -9.483   4.788  -4.379
  591    HA   ALA  79           HA       ALA  79 -12.343   4.261  -4.994
  592    HB1  ALA  79          1HB       ALA  79 -10.342   2.663  -3.376
  593    HB2  ALA  79          2HB       ALA  79 -10.847   2.322  -5.032
  594    HB3  ALA  79          3HB       ALA  79 -12.003   2.170  -3.708
  595    H    THR  80           H        THR  80 -10.240   4.746  -2.153
  596    HA   THR  80           HA       THR  80 -12.638   5.812  -0.714
  597    HB   THR  80           HB       THR  80 -11.984   4.712   1.298
  598    HG1  THR  80          1HG       THR  80  -9.745   3.496   0.230
  599   HG21  THR  80          1HG2      THR  80 -12.531   2.587   0.697
  600   HG22  THR  80          2HG2      THR  80 -11.210   2.473  -0.466
  601   HG23  THR  80          3HG2      THR  80 -12.709   3.289  -0.911
  602    H    THR  81           H        THR  81 -12.124   7.537   0.799
  603    HA   THR  81           HA       THR  81  -9.347   8.587   0.591
  604    HB   THR  81           HB       THR  81 -10.760   9.728  -1.096
  605    HG1  THR  81          1HG       THR  81 -10.460  11.698   0.805
  606   HG21  THR  81          1HG2      THR  81 -12.294  11.225   0.916
  607   HG22  THR  81          2HG2      THR  81 -12.739   9.521   0.807
  608   HG23  THR  81          3HG2      THR  81 -12.819  10.547  -0.626
  609    HA   PRO  82           HA       PRO  82 -10.744   8.596   4.995
  610    HB2  PRO  82          2HB       PRO  82  -7.847   8.468   5.497
  611    HB3  PRO  82          1HB       PRO  82  -9.128   7.377   6.049
  612    HG2  PRO  82          2HG       PRO  82  -7.307   6.688   4.179
  613    HG3  PRO  82          1HG       PRO  82  -8.952   6.032   4.225
  614    HD2  PRO  82          2HD       PRO  82  -7.804   8.107   2.406
  615    HD3  PRO  82          1HD       PRO  82  -9.052   6.884   2.082
  616    HA   PRO  83           HA       PRO  83  -9.808  12.732   6.268
  617    HB2  PRO  83          2HB       PRO  83  -8.008  11.948   8.486
  618    HB3  PRO  83          1HB       PRO  83  -9.535  12.847   8.538
  619    HG2  PRO  83          2HG       PRO  83  -9.332  10.311   9.389
  620    HG3  PRO  83          1HG       PRO  83 -10.806  10.955   8.645
  621    HD2  PRO  83          2HD       PRO  83  -8.756   9.122   7.480
  622    HD3  PRO  83          1HD       PRO  83 -10.504   9.203   7.173
  623    H    VAL  84           H        VAL  84  -8.260  14.396   5.954
  624    HA   VAL  84           HA       VAL  84  -5.568  13.445   5.057
  625    HB   VAL  84           HB       VAL  84  -7.054  15.963   4.256
  626   HG11  VAL  84          1HG1      VAL  84  -5.108  16.614   3.333
  627   HG12  VAL  84          2HG1      VAL  84  -4.990  15.091   2.452
  628   HG13  VAL  84          3HG1      VAL  84  -4.318  15.224   4.077
  629   HG21  VAL  84          1HG2      VAL  84  -7.738  14.869   2.304
  630   HG22  VAL  84          2HG2      VAL  84  -7.904  13.588   3.504
  631   HG23  VAL  84          3HG2      VAL  84  -6.493  13.629   2.445
  632    H    GLU  85           H        GLU  85  -3.773  14.321   6.020
  633    HA   GLU  85           HA       GLU  85  -4.060  16.769   7.656
  634    HB2  GLU  85          2HB       GLU  85  -4.491  14.838   9.180
  635    HB3  GLU  85          1HB       GLU  85  -2.900  14.197   8.772
  636    HG2  GLU  85          2HG       GLU  85  -1.875  16.321   9.588
  637    HG3  GLU  85          1HG       GLU  85  -3.477  16.866  10.088
  638    H    ALA  86           H        ALA  86  -1.397  14.488   7.940
  639    HA   ALA  86           HA       ALA  86   0.217  15.774   5.880
  640    HB1  ALA  86          1HB       ALA  86   1.723  16.161   8.291
  641    HB2  ALA  86          2HB       ALA  86   0.159  16.955   8.472
  642    HB3  ALA  86          3HB       ALA  86   1.208  17.372   7.117
  643    H    LYS  87           H        LYS  87   1.465  14.128   5.137
  644    HA   LYS  87           HA       LYS  87   1.704  11.611   6.435
  645    HB2  LYS  87          2HB       LYS  87   2.091  12.035   3.986
  646    HB3  LYS  87          1HB       LYS  87   3.637  12.774   4.409
  647    HG2  LYS  87          2HG       LYS  87   4.335  10.661   5.503
  648    HG3  LYS  87          1HG       LYS  87   2.804   9.924   5.028
  649    HD2  LYS  87          2HD       LYS  87   3.385  10.451   2.630
  650    HD3  LYS  87          1HD       LYS  87   4.980  10.956   3.188
  651    HE2  LYS  87          2HE       LYS  87   4.850   8.555   2.379
  652    HE3  LYS  87          1HE       LYS  87   5.479   8.753   4.015
  653    HZ1  LYS  87          1HZ       LYS  87   3.791   6.984   3.813
  654    HZ2  LYS  87          2HZ       LYS  87   2.643   8.156   3.373
  655    HZ3  LYS  87          3HZ       LYS  87   3.352   8.195   4.917
  656    H    LEU  88           H        LEU  88   3.783  14.472   6.503
  657    HA   LEU  88           HA       LEU  88   5.677  13.054   8.302
  658    HB2  LEU  88          2HB       LEU  88   6.563  14.440   6.410
  659    HB3  LEU  88          1HB       LEU  88   5.840  15.860   7.161
  660    HG   LEU  88           HG       LEU  88   7.170  15.339   9.243
  661   HD11  LEU  88          1HD1      LEU  88   8.092  13.281   9.337
  662   HD12  LEU  88          2HD1      LEU  88   9.289  13.866   8.182
  663   HD13  LEU  88          3HD1      LEU  88   7.854  13.018   7.610
  664   HD21  LEU  88          1HD2      LEU  88   9.309  16.178   8.293
  665   HD22  LEU  88          2HD2      LEU  88   7.917  17.051   7.651
  666   HD23  LEU  88          3HD2      LEU  88   8.712  15.818   6.673
  667    H    GLN  89           H        GLN  89   5.644  13.407  10.478
  668    HA   GLN  89           HA       GLN  89   4.208  15.815  11.499
  669    HB2  GLN  89          2HB       GLN  89   3.860  12.964  12.476
  670    HB3  GLN  89          1HB       GLN  89   3.199  14.389  13.280
  671    HG2  GLN  89          2HG       GLN  89   1.892  14.940  11.279
  672    HG3  GLN  89          1HG       GLN  89   2.580  13.555  10.431
  673   HE21  GLN  89          1HE2      GLN  89  -0.241  13.758  10.829
  674   HE22  GLN  89          2HE2      GLN  89  -0.722  12.544  11.914
  675    H1   PN7 101          3HO       SAT 101   4.893  -7.810 -13.129
  676    H2   PN7 101          1H1       SAT 101   3.151  -7.688  -9.721
  677    H3   PN7 101          2H1       SAT 101   1.899  -7.937 -10.938
  678    H5   PN7 101          1HE1      SAT 101   5.076  -5.178 -11.333
  679    H6   PN7 101          2HE1      SAT 101   5.517  -6.830 -11.769
  680    H7   PN7 101          3HE1      SAT 101   5.041  -6.453 -10.114
  681    H8   PN7 101          2HE2      SAT 101   1.522  -5.498 -11.430
  682    H9   PN7 101          3HE2      SAT 101   2.922  -4.428 -11.501
  683    H10  PN7 101          1HE2      SAT 101   2.530  -5.268 -10.001
  684    H11  PN7 101          3H        SAT 101   2.235  -6.817 -13.278
  685    H12  PN7 101          5H        SAT 101   2.835  -3.885 -14.088
  686    H13  PN7 101          1H6       SAT 101   1.936  -6.214 -15.473
  687    H14  PN7 101          2H6       SAT 101   1.726  -4.558 -16.042
  688    H15  PN7 101          1H7       SAT 101   4.489  -5.540 -16.270
  689    H16  PN7 101          2H7       SAT 101   3.492  -4.701 -17.460
  690    H17  PN7 101          9H        SAT 101   3.533  -7.959 -15.842
  691    H18  PN7 101          1H10      SAT 101   4.836  -8.883 -18.220
  692    H19  PN7 101          2H10      SAT 101   4.302  -9.914 -16.892
  693    H20  PN7 101          1H11      SAT 101   2.942  -9.261 -19.445
  694    H21  PN7 101          2H11      SAT 101   1.906  -9.302 -18.018
  695    H22  PN7 101          2HS1      SAT 101   3.255 -11.728 -19.309
  Start of MODEL   16
    1    H1   MET   1          1HT       MET   1   1.517  11.675   4.937
    2    H2   MET   1          2HT       MET   1   0.315  10.588   5.448
    3    H3   MET   1          3HT       MET   1   0.398  12.147   6.121
    4    HA   MET   1           HA       MET   1  -0.262  13.161   4.088
    5    HB2  MET   1          2HB       MET   1  -0.197  10.340   2.967
    6    HB3  MET   1          1HB       MET   1  -0.686  11.789   2.090
    7    HG2  MET   1          2HG       MET   1   1.584  12.747   2.481
    8    HG3  MET   1          1HG       MET   1   2.060  11.228   3.242
    9    HE1  MET   1          1HE       MET   1   3.778  11.993   0.038
   10    HE2  MET   1          2HE       MET   1   4.103  10.417   0.755
   11    HE3  MET   1          3HE       MET   1   3.825  11.811   1.797
   12    H    GLN   2           H        GLN   2  -2.421  11.840   2.691
   13    HA   GLN   2           HA       GLN   2  -4.522  12.120   4.591
   14    HB2  GLN   2          2HB       GLN   2  -4.508  10.587   1.971
   15    HB3  GLN   2          1HB       GLN   2  -5.954  11.057   2.865
   16    HG2  GLN   2          2HG       GLN   2  -3.880  12.970   1.748
   17    HG3  GLN   2          1HG       GLN   2  -5.470  12.662   1.048
   18   HE21  GLN   2          1HE2      GLN   2  -4.004  15.009   2.718
   19   HE22  GLN   2          2HE2      GLN   2  -5.262  15.523   3.736
   20    H    HIS   3           H        HIS   3  -2.654   9.335   3.530
   21    HA   HIS   3           HA       HIS   3  -3.231   7.856   5.929
   22    HB2  HIS   3          2HB       HIS   3  -4.348   5.927   4.523
   23    HB3  HIS   3          1HB       HIS   3  -5.342   7.246   5.140
   24    HD1  HIS   3          1HD       HIS   3  -6.034   9.127   3.418
   25    HD2  HIS   3          2HD       HIS   3  -4.128   5.829   1.715
   26    HE1  HIS   3          1HE       HIS   3  -6.437   9.275   0.921
   27    HE2  HIS   3          2HE       HIS   3  -5.280   7.274  -0.126
   28    H    ALA   4           H        ALA   4  -1.052   8.693   4.040
   29    HA   ALA   4           HA       ALA   4  -0.022   6.444   2.630
   30    HB1  ALA   4          1HB       ALA   4   2.225   7.635   3.008
   31    HB2  ALA   4          2HB       ALA   4   1.297   8.862   3.870
   32    HB3  ALA   4          3HB       ALA   4   0.976   8.550   2.163
   33    H    SER   5           H        SER   5   0.243   7.413   6.024
   34    HA   SER   5           HA       SER   5   2.292   5.607   6.799
   35    HB2  SER   5          2HB       SER   5   1.317   7.430   8.239
   36    HB3  SER   5          1HB       SER   5  -0.107   6.417   8.466
   37    HG   SER   5           HG       SER   5   1.680   6.286  10.076
   38    H    VAL   6           H        VAL   6  -1.225   5.144   6.549
   39    HA   VAL   6           HA       VAL   6  -1.229   2.460   7.566
   40    HB   VAL   6           HB       VAL   6  -3.116   3.881   5.680
   41   HG11  VAL   6          1HG1      VAL   6  -3.362   1.516   5.275
   42   HG12  VAL   6          2HG1      VAL   6  -4.692   2.004   6.324
   43   HG13  VAL   6          3HG1      VAL   6  -3.298   1.161   7.001
   44   HG21  VAL   6          1HG2      VAL   6  -4.556   3.928   7.723
   45   HG22  VAL   6          2HG2      VAL   6  -3.054   4.825   7.931
   46   HG23  VAL   6          3HG2      VAL   6  -3.227   3.219   8.637
   47    H    ILE   7           H        ILE   7  -0.864   3.816   4.320
   48    HA   ILE   7           HA       ILE   7  -0.904   1.381   2.862
   49    HB   ILE   7           HB       ILE   7   0.696   3.900   2.319
   50   HG12  ILE   7          2HG1      ILE   7  -2.029   3.051   1.285
   51   HG13  ILE   7          1HG1      ILE   7  -1.787   4.195   2.606
   52   HG21  ILE   7          1HG2      ILE   7   1.549   2.159   0.919
   53   HG22  ILE   7          2HG2      ILE   7   0.417   3.066  -0.085
   54   HG23  ILE   7          3HG2      ILE   7  -0.065   1.519   0.611
   55   HD11  ILE   7          1HD1      ILE   7  -0.103   5.081   0.530
   56   HD12  ILE   7          2HD1      ILE   7  -1.607   5.828   1.069
   57   HD13  ILE   7          3HD1      ILE   7  -1.629   4.654  -0.247
   58    H    ALA   8           H        ALA   8   1.882   3.173   4.210
   59    HA   ALA   8           HA       ALA   8   3.832   1.192   3.500
   60    HB1  ALA   8          1HB       ALA   8   3.909   3.711   4.645
   61    HB2  ALA   8          2HB       ALA   8   5.294   2.635   4.465
   62    HB3  ALA   8          3HB       ALA   8   4.391   2.663   5.979
   63    H    GLN   9           H        GLN   9   1.904   1.736   6.418
   64    HA   GLN   9           HA       GLN   9   3.035  -0.409   7.954
   65    HB2  GLN   9          2HB       GLN   9   1.668   1.437   8.922
   66    HB3  GLN   9          1HB       GLN   9   0.247   0.780   8.110
   67    HG2  GLN   9          2HG       GLN   9   1.387  -1.404   9.456
   68    HG3  GLN   9          1HG       GLN   9   1.483  -0.062  10.596
   69   HE21  GLN   9          1HE2      GLN   9  -0.911  -1.420   8.251
   70   HE22  GLN   9          2HE2      GLN   9  -2.251  -1.189   9.267
   71    H    PHE  10           H        PHE  10   0.289  -0.214   5.730
   72    HA   PHE  10           HA       PHE  10  -0.774  -2.812   6.183
   73    HB2  PHE  10          2HB       PHE  10  -1.790  -0.883   4.846
   74    HB3  PHE  10          1HB       PHE  10  -0.742  -1.383   3.520
   75    HD1  PHE  10          1HD       PHE  10  -3.602  -2.316   5.637
   76    HD2  PHE  10          2HD       PHE  10  -1.122  -3.475   2.330
   77    HE1  PHE  10          1HE       PHE  10  -5.252  -4.059   5.013
   78    HE2  PHE  10          2HE       PHE  10  -2.772  -5.219   1.704
   79    HZ   PHE  10           HZ       PHE  10  -4.837  -5.507   3.046
   80    H    VAL  11           H        VAL  11   1.496  -1.708   3.658
   81    HA   VAL  11           HA       VAL  11   1.995  -4.403   2.713
   82    HB   VAL  11           HB       VAL  11   2.320  -2.558   1.179
   83   HG11  VAL  11          1HG1      VAL  11   4.725  -1.516   2.570
   84   HG12  VAL  11          2HG1      VAL  11   3.176  -1.118   3.309
   85   HG13  VAL  11          3HG1      VAL  11   3.501  -0.653   1.641
   86   HG21  VAL  11          1HG2      VAL  11   3.925  -4.602   1.228
   87   HG22  VAL  11          2HG2      VAL  11   5.116  -3.462   1.853
   88   HG23  VAL  11          3HG2      VAL  11   4.397  -3.202   0.265
   89    H    VAL  12           H        VAL  12   3.752  -2.160   4.843
   90    HA   VAL  12           HA       VAL  12   6.038  -3.832   5.236
   91    HB   VAL  12           HB       VAL  12   4.825  -1.749   7.057
   92   HG11  VAL  12          1HG1      VAL  12   7.457  -1.746   7.637
   93   HG12  VAL  12          2HG1      VAL  12   7.257  -3.448   7.218
   94   HG13  VAL  12          3HG1      VAL  12   6.294  -2.740   8.512
   95   HG21  VAL  12          1HG2      VAL  12   7.304  -1.290   5.477
   96   HG22  VAL  12          2HG2      VAL  12   6.004  -0.167   5.879
   97   HG23  VAL  12          3HG2      VAL  12   5.791  -1.332   4.574
   98    H    GLU  13           H        GLU  13   2.939  -3.639   6.945
   99    HA   GLU  13           HA       GLU  13   3.558  -5.289   9.151
  100    HB2  GLU  13          2HB       GLU  13   1.429  -4.038   8.908
  101    HB3  GLU  13          1HB       GLU  13   0.930  -5.179   7.665
  102    HG2  GLU  13          2HG       GLU  13   1.162  -7.031   9.312
  103    HG3  GLU  13          1HG       GLU  13   1.555  -5.837  10.546
  104    H    GLU  14           H        GLU  14   2.952  -6.151   5.807
  105    HA   GLU  14           HA       GLU  14   2.401  -8.932   6.237
  106    HB2  GLU  14          2HB       GLU  14   3.684  -7.529   3.872
  107    HB3  GLU  14          1HB       GLU  14   3.126  -9.203   3.861
  108    HG2  GLU  14          2HG       GLU  14   0.839  -8.413   4.449
  109    HG3  GLU  14          1HG       GLU  14   1.414  -6.748   4.349
  110    H    PHE  15           H        PHE  15   5.369  -7.065   6.127
  111    HA   PHE  15           HA       PHE  15   6.831  -9.370   7.212
  112    HB2  PHE  15          2HB       PHE  15   8.657  -8.719   5.330
  113    HB3  PHE  15          1HB       PHE  15   7.461  -9.990   5.097
  114    HD1  PHE  15          1HD       PHE  15   6.771  -9.928   2.869
  115    HD2  PHE  15          2HD       PHE  15   7.133  -6.250   5.060
  116    HE1  PHE  15          1HE       PHE  15   5.814  -8.688   0.948
  117    HE2  PHE  15          2HE       PHE  15   6.178  -5.014   3.140
  118    HZ   PHE  15           HZ       PHE  15   5.518  -6.230   1.082
  119    H    LEU  16           H        LEU  16   6.315  -7.195   8.664
  120    HA   LEU  16           HA       LEU  16   8.332  -5.138   8.304
  121    HB2  LEU  16          2HB       LEU  16   7.320  -4.017  10.102
  122    HB3  LEU  16          1HB       LEU  16   5.986  -4.840   9.317
  123    HG   LEU  16           HG       LEU  16   7.466  -5.867  11.756
  124   HD11  LEU  16          1HD1      LEU  16   5.155  -4.086  11.376
  125   HD12  LEU  16          2HD1      LEU  16   6.182  -4.315  12.791
  126   HD13  LEU  16          3HD1      LEU  16   4.857  -5.436  12.472
  127   HD21  LEU  16          1HD2      LEU  16   5.511  -7.463  11.818
  128   HD22  LEU  16          2HD2      LEU  16   6.565  -7.708  10.428
  129   HD23  LEU  16          3HD2      LEU  16   5.033  -6.861  10.232
  130    HA   PRO  17           HA       PRO  17  11.451  -7.312  10.623
  131    HB2  PRO  17          2HB       PRO  17  13.170  -5.229  11.066
  132    HB3  PRO  17          1HB       PRO  17  13.008  -6.024   9.490
  133    HG2  PRO  17          2HG       PRO  17  11.845  -3.456  10.440
  134    HG3  PRO  17          1HG       PRO  17  12.536  -3.868   8.863
  135    HD2  PRO  17          2HD       PRO  17   9.844  -3.770   9.344
  136    HD3  PRO  17          1HD       PRO  17  10.578  -4.813   8.108
  137    H    ASP  18           H        ASP  18  12.960  -5.912  12.677
  138    HA   ASP  18           HA       ASP  18  11.004  -6.064  14.848
  139    HB2  ASP  18          2HB       ASP  18  12.950  -5.783  16.304
  140    HB3  ASP  18          1HB       ASP  18  13.304  -6.996  15.079
  141    H    VAL  19           H        VAL  19  11.273  -3.804  12.702
  142    HA   VAL  19           HA       VAL  19  11.366  -1.509  14.621
  143    HB   VAL  19           HB       VAL  19  11.702  -1.497  11.610
  144   HG11  VAL  19          1HG1      VAL  19  12.790   0.809  12.464
  145   HG12  VAL  19          2HG1      VAL  19  11.591   0.589  13.738
  146   HG13  VAL  19          3HG1      VAL  19  11.081   0.675  12.052
  147   HG21  VAL  19          1HG2      VAL  19  13.610  -1.790  13.888
  148   HG22  VAL  19          2HG2      VAL  19  14.108  -0.759  12.546
  149   HG23  VAL  19          3HG2      VAL  19  13.701  -2.451  12.255
  150    H    ALA  20           H        ALA  20   9.548  -0.225  14.803
  151    HA   ALA  20           HA       ALA  20   7.048  -1.205  13.768
  152    HB1  ALA  20          1HB       ALA  20   7.304   1.614  14.725
  153    HB2  ALA  20          2HB       ALA  20   7.632   0.317  15.873
  154    HB3  ALA  20          3HB       ALA  20   6.059   0.418  15.084
  155    HA   PRO  21           HA       PRO  21   7.141   0.580   9.651
  156    HB2  PRO  21          2HB       PRO  21   4.293   1.285  10.156
  157    HB3  PRO  21          1HB       PRO  21   5.010   0.381   8.810
  158    HG2  PRO  21          2HG       PRO  21   3.632  -0.797  10.802
  159    HG3  PRO  21          1HG       PRO  21   4.949  -1.592   9.930
  160    HD2  PRO  21          2HD       PRO  21   4.899  -0.582  12.706
  161    HD3  PRO  21          1HD       PRO  21   5.957  -1.798  11.955
  162    H    ALA  22           H        ALA  22   5.711   2.347  12.352
  163    HA   ALA  22           HA       ALA  22   5.625   4.924  11.072
  164    HB1  ALA  22          1HB       ALA  22   5.897   5.566  13.686
  165    HB2  ALA  22          2HB       ALA  22   5.411   3.878  13.846
  166    HB3  ALA  22          3HB       ALA  22   4.372   5.018  12.990
  167    H    ASP  23           H        ASP  23   8.196   3.008  12.255
  168    HA   ASP  23           HA       ASP  23  10.003   5.363  12.473
  169    HB2  ASP  23          2HB       ASP  23  10.360   2.463  13.282
  170    HB3  ASP  23          1HB       ASP  23  11.624   3.686  13.413
  171    H    VAL  24           H        VAL  24   8.875   3.575  10.074
  172    HA   VAL  24           HA       VAL  24  11.500   3.031   8.784
  173    HB   VAL  24           HB       VAL  24   8.697   2.345   7.841
  174   HG11  VAL  24          1HG1      VAL  24   9.735   1.859   5.902
  175   HG12  VAL  24          2HG1      VAL  24  10.658   0.626   6.761
  176   HG13  VAL  24          3HG1      VAL  24  11.306   2.258   6.597
  177   HG21  VAL  24          1HG2      VAL  24   9.354   1.207   9.965
  178   HG22  VAL  24          2HG2      VAL  24  10.795   0.589   9.157
  179   HG23  VAL  24          3HG2      VAL  24   9.195   0.079   8.618
  180    H    ASP  25           H        ASP  25  12.192   4.276   7.068
  181    HA   ASP  25           HA       ASP  25  10.928   6.830   6.637
  182    HB2  ASP  25          2HB       ASP  25  13.111   5.387   5.104
  183    HB3  ASP  25          1HB       ASP  25  12.628   7.057   4.802
  184    H    VAL  26           H        VAL  26   8.779   6.368   5.920
  185    HA   VAL  26           HA       VAL  26   8.097   4.635   3.782
  186    HB   VAL  26           HB       VAL  26   6.547   5.832   5.432
  187   HG11  VAL  26          1HG1      VAL  26   5.883   8.047   5.016
  188   HG12  VAL  26          2HG1      VAL  26   6.499   8.019   3.364
  189   HG13  VAL  26          3HG1      VAL  26   7.621   8.102   4.722
  190   HG21  VAL  26          1HG2      VAL  26   5.726   6.106   2.538
  191   HG22  VAL  26          2HG2      VAL  26   4.704   5.728   3.923
  192   HG23  VAL  26          3HG2      VAL  26   5.867   4.542   3.337
  193    H    ASP  27           H        ASP  27  10.247   7.063   3.540
  194    HA   ASP  27           HA       ASP  27   9.298   8.175   0.972
  195    HB2  ASP  27          2HB       ASP  27  11.816   8.656   2.597
  196    HB3  ASP  27          1HB       ASP  27  11.445   9.473   1.078
  197    H    LEU  28           H        LEU  28  10.549   5.329   1.830
  198    HA   LEU  28           HA       LEU  28  12.595   5.128  -0.306
  199    HB2  LEU  28          2HB       LEU  28  12.981   4.080   1.934
  200    HB3  LEU  28          1HB       LEU  28  11.606   3.020   1.636
  201    HG   LEU  28           HG       LEU  28  13.049   2.660  -0.659
  202   HD11  LEU  28          1HD1      LEU  28  14.901   4.047   0.182
  203   HD12  LEU  28          2HD1      LEU  28  15.404   2.364   0.016
  204   HD13  LEU  28          3HD1      LEU  28  15.027   3.019   1.610
  205   HD21  LEU  28          1HD2      LEU  28  13.883   0.560   0.508
  206   HD22  LEU  28          2HD2      LEU  28  12.143   0.833   0.613
  207   HD23  LEU  28          3HD2      LEU  28  13.180   1.202   1.992
  208    H    ASP  29           H        ASP  29  12.204   4.075  -2.233
  209    HA   ASP  29           HA       ASP  29   9.506   3.583  -3.042
  210    HB2  ASP  29          2HB       ASP  29  12.127   2.608  -4.225
  211    HB3  ASP  29          1HB       ASP  29  10.560   2.447  -5.017
  212    H    LEU  30           H        LEU  30   8.251   1.885  -2.451
  213    HA   LEU  30           HA       LEU  30   9.304  -0.291  -0.899
  214    HB2  LEU  30          2HB       LEU  30   7.030  -1.215  -1.027
  215    HB3  LEU  30          1HB       LEU  30   6.978   0.511  -0.667
  216    HG   LEU  30           HG       LEU  30   7.017   0.199  -3.512
  217   HD11  LEU  30          1HD1      LEU  30   4.775  -0.986  -3.694
  218   HD12  LEU  30          2HD1      LEU  30   5.021  -1.537  -2.038
  219   HD13  LEU  30          3HD1      LEU  30   6.145  -2.026  -3.307
  220   HD21  LEU  30          1HD2      LEU  30   5.009   1.504  -3.386
  221   HD22  LEU  30          2HD2      LEU  30   6.031   2.040  -2.054
  222   HD23  LEU  30          3HD2      LEU  30   4.678   0.950  -1.746
  223    H    VAL  31           H        VAL  31  10.081   0.184  -3.929
  224    HA   VAL  31           HA       VAL  31   9.265  -2.067  -5.436
  225    HB   VAL  31           HB       VAL  31  11.930  -0.618  -5.404
  226   HG11  VAL  31          1HG1      VAL  31  12.344  -2.744  -6.412
  227   HG12  VAL  31          2HG1      VAL  31  12.098  -1.621  -7.749
  228   HG13  VAL  31          3HG1      VAL  31  10.803  -2.716  -7.269
  229   HG21  VAL  31          1HG2      VAL  31  10.923   0.934  -6.694
  230   HG22  VAL  31          2HG2      VAL  31   9.388   0.196  -6.238
  231   HG23  VAL  31          3HG2      VAL  31  10.198  -0.300  -7.725
  232    H    ASP  32           H        ASP  32  11.900  -1.711  -3.099
  233    HA   ASP  32           HA       ASP  32  13.043  -4.295  -3.367
  234    HB2  ASP  32          2HB       ASP  32  12.703  -2.559  -0.897
  235    HB3  ASP  32          1HB       ASP  32  13.706  -4.010  -0.951
  236    H    ASN  33           H        ASN  33  10.183  -3.154  -1.677
  237    HA   ASN  33           HA       ASN  33   9.599  -5.792  -0.533
  238    HB2  ASN  33          2HB       ASN  33   7.894  -3.298  -0.655
  239    HB3  ASN  33          1HB       ASN  33   7.580  -4.719   0.338
  240   HD21  ASN  33          1HD2      ASN  33   8.551  -1.703   0.787
  241   HD22  ASN  33          2HD2      ASN  33   9.746  -1.900   1.975
  242    H    GLY  34           H        GLY  34   9.687  -4.951  -3.546
  243    HA2  GLY  34          2HA       GLY  34   7.247  -5.063  -4.825
  244    HA3  GLY  34          1HA       GLY  34   8.666  -5.908  -5.445
  245    H    VAL  35           H        VAL  35   8.504  -7.402  -2.686
  246    HA   VAL  35           HA       VAL  35   7.440  -9.833  -3.623
  247    HB   VAL  35           HB       VAL  35   7.587  -8.728  -0.803
  248   HG11  VAL  35          1HG1      VAL  35   7.482 -11.306  -0.310
  249   HG12  VAL  35          2HG1      VAL  35   6.653 -11.380  -1.865
  250   HG13  VAL  35          3HG1      VAL  35   5.984 -10.409  -0.553
  251   HG21  VAL  35          1HG2      VAL  35   9.592 -10.044  -0.633
  252   HG22  VAL  35          2HG2      VAL  35   9.709  -9.145  -2.147
  253   HG23  VAL  35          3HG2      VAL  35   9.265 -10.852  -2.167
  254    H    ILE  36           H        ILE  36   5.819  -7.084  -2.131
  255    HA   ILE  36           HA       ILE  36   3.261  -8.363  -1.764
  256    HB   ILE  36           HB       ILE  36   4.163  -6.128  -0.772
  257   HG12  ILE  36          2HG1      ILE  36   1.377  -6.619  -1.828
  258   HG13  ILE  36          1HG1      ILE  36   1.979  -6.813  -0.186
  259   HG21  ILE  36          1HG2      ILE  36   3.824  -4.164  -2.038
  260   HG22  ILE  36          2HG2      ILE  36   2.792  -4.991  -3.205
  261   HG23  ILE  36          3HG2      ILE  36   4.530  -5.285  -3.203
  262   HD11  ILE  36          1HD1      ILE  36   0.947  -4.779   0.091
  263   HD12  ILE  36          2HD1      ILE  36   1.130  -4.343  -1.609
  264   HD13  ILE  36          3HD1      ILE  36   2.500  -4.195  -0.509
  265    H    ASP  37           H        ASP  37   4.859  -6.914  -4.480
  266    HA   ASP  37           HA       ASP  37   2.667  -6.165  -6.082
  267    HB2  ASP  37          2HB       ASP  37   5.330  -7.330  -6.929
  268    HB3  ASP  37          1HB       ASP  37   4.184  -6.556  -8.022
  269    H    SER  38           H        SER  38   4.031  -9.409  -5.582
  270    HA   SER  38           HA       SER  38   2.016 -10.454  -7.510
  271    HB2  SER  38          2HB       SER  38   4.730 -11.233  -6.775
  272    HB3  SER  38          1HB       SER  38   3.608 -12.589  -6.754
  273    H    LEU  39           H        LEU  39   3.435 -11.665  -4.452
  274    HA   LEU  39           HA       LEU  39   1.125 -13.280  -3.911
  275    HB2  LEU  39          2HB       LEU  39   3.430 -13.752  -3.057
  276    HB3  LEU  39          1HB       LEU  39   3.244 -12.389  -1.960
  277    HG   LEU  39           HG       LEU  39   1.020 -14.332  -1.905
  278   HD11  LEU  39          1HD1      LEU  39   2.300 -15.940  -0.519
  279   HD12  LEU  39          2HD1      LEU  39   3.779 -15.045  -0.867
  280   HD13  LEU  39          3HD1      LEU  39   2.921 -15.869  -2.168
  281   HD21  LEU  39          1HD2      LEU  39   1.152 -12.451  -0.339
  282   HD22  LEU  39          2HD2      LEU  39   2.749 -12.977   0.191
  283   HD23  LEU  39          3HD2      LEU  39   1.333 -13.966   0.544
  284    H    GLY  40           H        GLY  40   2.310 -10.302  -2.342
  285    HA2  GLY  40          2HA       GLY  40   0.019 -10.033  -0.636
  286    HA3  GLY  40          1HA       GLY  40   1.154  -8.746  -1.021
  287    H    LEU  41           H        LEU  41   0.759  -8.821  -3.871
  288    HA   LEU  41           HA       LEU  41  -1.401  -7.008  -4.140
  289    HB2  LEU  41          2HB       LEU  41   0.480  -7.237  -5.745
  290    HB3  LEU  41          1HB       LEU  41  -0.194  -8.768  -6.294
  291    HG   LEU  41           HG       LEU  41  -1.811  -6.212  -6.304
  292   HD11  LEU  41          1HD1      LEU  41   0.339  -6.004  -7.646
  293   HD12  LEU  41          2HD1      LEU  41  -1.148  -5.792  -8.570
  294   HD13  LEU  41          3HD1      LEU  41  -0.264  -7.315  -8.658
  295   HD21  LEU  41          1HD2      LEU  41  -3.394  -7.738  -6.867
  296   HD22  LEU  41          2HD2      LEU  41  -2.202  -8.996  -7.189
  297   HD23  LEU  41          3HD2      LEU  41  -2.583  -7.805  -8.427
  298    H    LEU  42           H        LEU  42  -1.244 -10.508  -4.741
  299    HA   LEU  42           HA       LEU  42  -3.906 -10.765  -5.756
  300    HB2  LEU  42          2HB       LEU  42  -2.147 -12.560  -5.846
  301    HB3  LEU  42          1HB       LEU  42  -2.366 -12.800  -4.118
  302    HG   LEU  42           HG       LEU  42  -4.907 -13.050  -4.769
  303   HD11  LEU  42          1HD1      LEU  42  -3.439 -13.706  -7.333
  304   HD12  LEU  42          2HD1      LEU  42  -4.645 -12.440  -7.112
  305   HD13  LEU  42          3HD1      LEU  42  -5.117 -14.136  -7.006
  306   HD21  LEU  42          1HD2      LEU  42  -2.676 -15.053  -5.074
  307   HD22  LEU  42          2HD2      LEU  42  -4.351 -15.536  -5.338
  308   HD23  LEU  42          3HD2      LEU  42  -3.851 -14.903  -3.769
  309    H    LYS  43           H        LYS  43  -2.589 -10.961  -2.454
  310    HA   LYS  43           HA       LYS  43  -5.141 -11.457  -1.205
  311    HB2  LYS  43          2HB       LYS  43  -2.555 -10.347  -0.102
  312    HB3  LYS  43          1HB       LYS  43  -3.935 -10.819   0.882
  313    HG2  LYS  43          2HG       LYS  43  -3.794 -13.115  -0.090
  314    HG3  LYS  43          1HG       LYS  43  -2.335 -12.623  -0.952
  315    HD2  LYS  43          2HD       LYS  43  -1.287 -12.040   1.240
  316    HD3  LYS  43          1HD       LYS  43  -2.718 -12.673   2.055
  317    HE2  LYS  43          2HE       LYS  43  -0.805 -14.317   1.876
  318    HE3  LYS  43          1HE       LYS  43  -2.326 -14.886   1.187
  319    HZ1  LYS  43          1HZ       LYS  43  -1.580 -14.450  -0.977
  320    HZ2  LYS  43          2HZ       LYS  43  -0.268 -15.208  -0.208
  321    HZ3  LYS  43          3HZ       LYS  43  -0.264 -13.525  -0.440
  322    H    VAL  44           H        VAL  44  -3.268  -8.531  -1.906
  323    HA   VAL  44           HA       VAL  44  -4.896  -6.705  -0.432
  324    HB   VAL  44           HB       VAL  44  -3.174  -6.307  -2.888
  325   HG11  VAL  44          1HG1      VAL  44  -4.211  -4.302  -3.049
  326   HG12  VAL  44          2HG1      VAL  44  -3.362  -3.883  -1.562
  327   HG13  VAL  44          3HG1      VAL  44  -5.011  -4.500  -1.491
  328   HG21  VAL  44          1HG2      VAL  44  -2.212  -5.050  -0.510
  329   HG22  VAL  44          2HG2      VAL  44  -1.480  -6.379  -1.408
  330   HG23  VAL  44          3HG2      VAL  44  -2.627  -6.717  -0.111
  331    H    ILE  45           H        ILE  45  -5.036  -7.718  -3.848
  332    HA   ILE  45           HA       ILE  45  -7.190  -6.025  -4.607
  333    HB   ILE  45           HB       ILE  45  -5.921  -8.499  -5.650
  334   HG12  ILE  45          2HG1      ILE  45  -5.720  -7.166  -7.642
  335   HG13  ILE  45          1HG1      ILE  45  -6.915  -6.009  -7.059
  336   HG21  ILE  45          1HG2      ILE  45  -8.166  -9.263  -5.861
  337   HG22  ILE  45          2HG2      ILE  45  -7.750  -8.594  -7.437
  338   HG23  ILE  45          3HG2      ILE  45  -8.747  -7.662  -6.321
  339   HD11  ILE  45          1HD1      ILE  45  -5.432  -4.989  -5.626
  340   HD12  ILE  45          2HD1      ILE  45  -4.277  -5.572  -6.823
  341   HD13  ILE  45          3HD1      ILE  45  -4.532  -6.476  -5.333
  342    H    ALA  46           H        ALA  46  -7.195  -9.350  -3.324
  343    HA   ALA  46           HA       ALA  46 -10.030  -9.711  -3.438
  344    HB1  ALA  46          1HB       ALA  46  -9.481 -11.390  -1.510
  345    HB2  ALA  46          2HB       ALA  46  -7.803 -10.971  -1.858
  346    HB3  ALA  46          3HB       ALA  46  -8.811 -11.688  -3.115
  347    H    TRP  47           H        TRP  47  -7.905  -8.469  -0.864
  348    HA   TRP  47           HA       TRP  47 -10.108  -8.109   1.003
  349    HB2  TRP  47          2HB       TRP  47  -8.155  -8.308   2.193
  350    HB3  TRP  47          1HB       TRP  47  -7.192  -7.512   0.949
  351    HD1  TRP  47           HD       TRP  47  -9.481  -6.757   3.917
  352    HE1  TRP  47          1HE       TRP  47  -9.129  -4.299   4.618
  353    HE3  TRP  47          3HE       TRP  47  -6.469  -5.183   0.120
  354    HZ2  TRP  47          2HZ       TRP  47  -7.743  -1.972   3.683
  355    HZ3  TRP  47          3HZ       TRP  47  -5.641  -2.851   0.044
  356    HH2  TRP  47           HH       TRP  47  -6.275  -1.246   1.819
  357    H    LEU  48           H        LEU  48  -8.232  -5.938  -1.115
  358    HA   LEU  48           HA       LEU  48  -9.426  -3.508  -0.303
  359    HB2  LEU  48          2HB       LEU  48  -7.451  -3.741  -1.838
  360    HB3  LEU  48          1HB       LEU  48  -8.554  -4.245  -3.108
  361    HG   LEU  48           HG       LEU  48  -9.807  -2.024  -2.530
  362   HD11  LEU  48          1HD1      LEU  48  -8.701  -0.461  -1.292
  363   HD12  LEU  48          2HD1      LEU  48  -7.123  -0.955  -1.908
  364   HD13  LEU  48          3HD1      LEU  48  -7.890  -1.872  -0.615
  365   HD21  LEU  48          1HD2      LEU  48  -7.418  -2.585  -4.189
  366   HD22  LEU  48          2HD2      LEU  48  -7.785  -0.877  -3.943
  367   HD23  LEU  48          3HD2      LEU  48  -8.990  -1.942  -4.665
  368    H    GLU  49           H        GLU  49 -10.458  -5.820  -2.819
  369    HA   GLU  49           HA       GLU  49 -12.735  -4.290  -3.654
  370    HB2  GLU  49          2HB       GLU  49 -12.208  -5.955  -5.184
  371    HB3  GLU  49          1HB       GLU  49 -11.851  -7.138  -3.941
  372    HG2  GLU  49          2HG       GLU  49 -14.209  -7.438  -3.472
  373    HG3  GLU  49          1HG       GLU  49 -14.634  -6.131  -4.569
  374    H    ASP  50           H        ASP  50 -12.262  -6.730  -1.142
  375    HA   ASP  50           HA       ASP  50 -15.046  -6.909  -0.411
  376    HB2  ASP  50          2HB       ASP  50 -13.290  -8.622   0.119
  377    HB3  ASP  50          1HB       ASP  50 -12.632  -7.494   1.300
  378    H    ARG  51           H        ARG  51 -12.286  -5.183   1.043
  379    HA   ARG  51           HA       ARG  51 -13.762  -3.983   3.159
  380    HB2  ARG  51          2HB       ARG  51 -11.285  -4.082   3.072
  381    HB3  ARG  51          1HB       ARG  51 -11.301  -2.888   1.773
  382    HG2  ARG  51          2HG       ARG  51 -12.428  -1.275   3.256
  383    HG3  ARG  51          1HG       ARG  51 -12.431  -2.467   4.556
  384    HD2  ARG  51          2HD       ARG  51  -9.949  -2.539   4.465
  385    HD3  ARG  51          1HD       ARG  51  -9.976  -1.285   3.224
  386    HE   ARG  51           HE       ARG  51 -11.360  -0.050   5.187
  387   HH11  ARG  51          1HH1      ARG  51 -10.494   1.017   6.976
  388   HH12  ARG  51          2HH1      ARG  51  -8.958   0.524   7.606
  389   HH21  ARG  51          1HH2      ARG  51  -8.503  -1.991   5.266
  390   HH22  ARG  51          2HH2      ARG  51  -7.834  -1.177   6.638
  391    H    PHE  52           H        PHE  52 -13.064  -2.735  -0.128
  392    HA   PHE  52           HA       PHE  52 -14.782  -0.393   0.500
  393    HB2  PHE  52          2HB       PHE  52 -12.938  -0.975  -1.832
  394    HB3  PHE  52          1HB       PHE  52 -13.879   0.500  -1.638
  395    HD1  PHE  52          1HD       PHE  52 -13.419   2.057   0.245
  396    HD2  PHE  52          2HD       PHE  52 -10.960  -1.382  -0.516
  397    HE1  PHE  52          1HE       PHE  52 -11.649   3.000   1.705
  398    HE2  PHE  52          2HE       PHE  52  -9.191  -0.439   0.944
  399    HZ   PHE  52           HZ       PHE  52  -9.535   1.751   2.053
  400    H    GLY  53           H        GLY  53 -15.063  -3.446  -0.890
  401    HA2  GLY  53          2HA       GLY  53 -16.833  -4.411  -2.102
  402    HA3  GLY  53          1HA       GLY  53 -17.730  -2.913  -1.837
  403    H    ILE  54           H        ILE  54 -14.574  -2.891  -3.347
  404    HA   ILE  54           HA       ILE  54 -15.866  -1.914  -5.850
  405    HB   ILE  54           HB       ILE  54 -12.961  -1.765  -4.987
  406   HG12  ILE  54          2HG1      ILE  54 -15.030   0.448  -4.961
  407   HG13  ILE  54          1HG1      ILE  54 -14.643  -0.515  -3.534
  408   HG21  ILE  54          1HG2      ILE  54 -14.115  -1.431  -7.498
  409   HG22  ILE  54          2HG2      ILE  54 -12.549  -0.801  -6.990
  410   HG23  ILE  54          3HG2      ILE  54 -13.986   0.214  -6.878
  411   HD11  ILE  54          1HD1      ILE  54 -12.654   1.111  -5.144
  412   HD12  ILE  54          2HD1      ILE  54 -12.281   0.157  -3.709
  413   HD13  ILE  54          3HD1      ILE  54 -13.324   1.575  -3.580
  414    H    ALA  55           H        ALA  55 -15.614  -3.053  -7.767
  415    HA   ALA  55           HA       ALA  55 -14.855  -5.801  -7.677
  416    HB1  ALA  55          1HB       ALA  55 -15.818  -5.785  -9.713
  417    HB2  ALA  55          2HB       ALA  55 -14.553  -4.727 -10.339
  418    HB3  ALA  55          3HB       ALA  55 -15.985  -4.035  -9.577
  419    H    ALA  56           H        ALA  56 -12.923  -6.831  -8.214
  420    HA   ALA  56           HA       ALA  56 -10.484  -5.432  -7.791
  421    HB1  ALA  56          1HB       ALA  56 -10.708  -7.869  -7.482
  422    HB2  ALA  56          2HB       ALA  56  -9.390  -7.497  -8.595
  423    HB3  ALA  56          3HB       ALA  56 -10.937  -8.071  -9.219
  424    H    ASP  57           H        ASP  57 -12.216  -6.297 -10.749
  425    HA   ASP  57           HA       ASP  57 -10.194  -5.607 -12.629
  426    HB2  ASP  57          2HB       ASP  57 -13.205  -5.502 -12.845
  427    HB3  ASP  57          1HB       ASP  57 -12.116  -5.288 -14.213
  428    H    ASP  58           H        ASP  58 -12.532  -3.626 -10.884
  429    HA   ASP  58           HA       ASP  58 -12.444  -1.253 -12.356
  430    HB2  ASP  58          2HB       ASP  58 -12.498  -1.649  -9.363
  431    HB3  ASP  58          1HB       ASP  58 -12.758  -0.089 -10.140
  432    H    VAL  59           H        VAL  59 -10.001  -2.568 -10.172
  433    HA   VAL  59           HA       VAL  59  -8.301  -0.177 -10.676
  434    HB   VAL  59           HB       VAL  59  -7.856  -2.482  -8.772
  435   HG11  VAL  59          1HG1      VAL  59  -6.151  -1.025  -7.793
  436   HG12  VAL  59          2HG1      VAL  59  -6.536   0.240  -8.959
  437   HG13  VAL  59          3HG1      VAL  59  -5.809  -1.271  -9.506
  438   HG21  VAL  59          1HG2      VAL  59  -9.015   0.288  -8.364
  439   HG22  VAL  59          2HG2      VAL  59  -8.484  -0.752  -7.042
  440   HG23  VAL  59          3HG2      VAL  59  -9.821  -1.253  -8.076
  441    H    GLU  60           H        GLU  60  -6.474  -0.331 -11.935
  442    HA   GLU  60           HA       GLU  60  -6.060  -2.873 -13.379
  443    HB2  GLU  60          2HB       GLU  60  -6.097  -0.689 -14.598
  444    HB3  GLU  60          1HB       GLU  60  -4.645  -0.215 -13.724
  445    HG2  GLU  60          2HG       GLU  60  -3.484  -2.209 -14.632
  446    HG3  GLU  60          1HG       GLU  60  -4.924  -2.590 -15.568
  447    H    LEU  61           H        LEU  61  -4.192  -4.118 -13.209
  448    HA   LEU  61           HA       LEU  61  -2.491  -3.524 -10.855
  449    HB2  LEU  61          2HB       LEU  61  -2.566  -6.035 -12.547
  450    HB3  LEU  61          1HB       LEU  61  -1.858  -5.849 -10.944
  451    HG   LEU  61           HG       LEU  61  -4.788  -5.619 -11.643
  452   HD11  LEU  61          1HD1      LEU  61  -3.055  -7.777 -10.663
  453   HD12  LEU  61          2HD1      LEU  61  -4.663  -7.866 -11.380
  454   HD13  LEU  61          3HD1      LEU  61  -4.483  -7.511  -9.662
  455   HD21  LEU  61          1HD2      LEU  61  -3.220  -5.016  -9.147
  456   HD22  LEU  61          2HD2      LEU  61  -4.895  -5.551  -9.034
  457   HD23  LEU  61          3HD2      LEU  61  -4.501  -4.069  -9.904
  458    H    SER  62           H        SER  62  -0.349  -2.978 -11.077
  459    HA   SER  62           HA       SER  62   1.199  -3.666 -13.428
  460    HB2  SER  62          2HB       SER  62  -0.366  -1.354 -13.662
  461    HB3  SER  62          1HB       SER  62   1.247  -0.761 -13.275
  462    HG   SER  62           HG       SER  62   0.671  -1.229 -15.580
  463    HA   PRO  63           HA       PRO  63   4.443  -3.128 -10.482
  464    HB2  PRO  63          2HB       PRO  63   6.479  -2.215 -12.135
  465    HB3  PRO  63          1HB       PRO  63   6.019  -3.915 -11.940
  466    HG2  PRO  63          2HG       PRO  63   5.342  -2.007 -14.108
  467    HG3  PRO  63          1HG       PRO  63   5.665  -3.747 -14.189
  468    HD2  PRO  63          2HD       PRO  63   3.146  -2.724 -14.331
  469    HD3  PRO  63          1HD       PRO  63   3.492  -4.316 -13.620
  470    H    GLU  64           H        GLU  64   3.698  -0.448 -12.629
  471    HA   GLU  64           HA       GLU  64   5.229   1.569 -11.288
  472    HB2  GLU  64          2HB       GLU  64   2.688   1.782 -12.908
  473    HB3  GLU  64          1HB       GLU  64   3.662   3.156 -12.407
  474    HG2  GLU  64          2HG       GLU  64   5.600   2.180 -13.601
  475    HG3  GLU  64          1HG       GLU  64   4.569   0.869 -14.158
  476    H    HIS  65           H        HIS  65   2.107   0.117 -10.646
  477    HA   HIS  65           HA       HIS  65   1.141   2.125  -8.825
  478    HB2  HIS  65          2HB       HIS  65  -0.343   0.437  -9.825
  479    HB3  HIS  65          1HB       HIS  65   0.521  -0.842  -8.971
  480    HD1  HIS  65          1HD       HIS  65  -1.325   2.389  -8.083
  481    HD2  HIS  65          2HD       HIS  65  -0.608  -1.413  -6.523
  482    HE1  HIS  65          1HE       HIS  65  -2.647   2.235  -5.925
  483    HE2  HIS  65          2HE       HIS  65  -2.216  -0.073  -4.967
  484    H    PHE  66           H        PHE  66   3.378  -0.541  -8.498
  485    HA   PHE  66           HA       PHE  66   3.417  -0.167  -5.543
  486    HB2  PHE  66          2HB       PHE  66   4.569  -2.337  -7.317
  487    HB3  PHE  66          1HB       PHE  66   4.764  -2.279  -5.565
  488    HD1  PHE  66          1HD       PHE  66   2.359  -2.718  -8.330
  489    HD2  PHE  66          2HD       PHE  66   2.898  -2.709  -4.069
  490    HE1  PHE  66          1HE       PHE  66   0.128  -3.764  -8.044
  491    HE2  PHE  66          2HE       PHE  66   0.669  -3.756  -3.783
  492    HZ   PHE  66           HZ       PHE  66  -0.717  -4.281  -5.771
  493    H    ARG  67           H        ARG  67   4.873   1.257  -8.064
  494    HA   ARG  67           HA       ARG  67   7.654   0.987  -7.608
  495    HB2  ARG  67          2HB       ARG  67   6.739   2.164  -9.562
  496    HB3  ARG  67          1HB       ARG  67   6.107   3.433  -8.521
  497    HG2  ARG  67          2HG       ARG  67   8.171   4.232  -9.474
  498    HG3  ARG  67          1HG       ARG  67   8.478   3.881  -7.780
  499    HD2  ARG  67          2HD       ARG  67   9.589   1.825  -8.312
  500    HD3  ARG  67          1HD       ARG  67   9.040   1.888  -9.987
  501    HE   ARG  67           HE       ARG  67  10.623   4.212  -9.320
  502   HH11  ARG  67          1HH1      ARG  67  12.703   4.308 -10.197
  503   HH12  ARG  67          2HH1      ARG  67  13.435   2.864 -10.816
  504   HH21  ARG  67          1HH2      ARG  67  10.716   0.847 -10.066
  505   HH22  ARG  67          2HH2      ARG  67  12.310   0.905 -10.740
  506    H    SER  68           H        SER  68   5.287   3.161  -6.050
  507    HA   SER  68           HA       SER  68   7.107   3.374  -3.743
  508    HB2  SER  68          2HB       SER  68   7.255   5.780  -3.767
  509    HB3  SER  68          1HB       SER  68   7.778   5.204  -5.348
  510    HG   SER  68           HG       SER  68   6.292   6.536  -6.030
  511    H    ILE  69           H        ILE  69   6.026   4.365  -1.869
  512    HA   ILE  69           HA       ILE  69   3.315   3.543  -1.570
  513    HB   ILE  69           HB       ILE  69   4.981   5.491   0.048
  514   HG12  ILE  69          2HG1      ILE  69   4.639   3.146   1.479
  515   HG13  ILE  69          1HG1      ILE  69   4.847   2.572  -0.172
  516   HG21  ILE  69          1HG2      ILE  69   2.955   5.969   0.958
  517   HG22  ILE  69          2HG2      ILE  69   3.161   4.413   1.762
  518   HG23  ILE  69          3HG2      ILE  69   2.205   4.523   0.285
  519   HD11  ILE  69          1HD1      ILE  69   7.015   2.801   1.042
  520   HD12  ILE  69          2HD1      ILE  69   6.703   4.527   1.207
  521   HD13  ILE  69          3HD1      ILE  69   6.929   3.823  -0.393
  522    H    ARG  70           H        ARG  70   4.774   6.681  -2.339
  523    HA   ARG  70           HA       ARG  70   2.443   8.285  -2.048
  524    HB2  ARG  70          2HB       ARG  70   4.752   9.167  -2.367
  525    HB3  ARG  70          1HB       ARG  70   4.678   8.655  -4.054
  526    HG2  ARG  70          2HG       ARG  70   4.073  10.999  -3.932
  527    HG3  ARG  70          1HG       ARG  70   2.634  10.073  -4.344
  528    HD2  ARG  70          2HD       ARG  70   3.056  10.388  -1.447
  529    HD3  ARG  70          1HD       ARG  70   2.792  11.907  -2.300
  530    HE   ARG  70           HE       ARG  70   0.887   9.756  -2.935
  531   HH11  ARG  70          1HH1      ARG  70  -1.262  10.253  -2.452
  532   HH12  ARG  70          2HH1      ARG  70  -1.620  11.649  -1.490
  533   HH21  ARG  70          1HH2      ARG  70   1.701  12.565  -1.104
  534   HH22  ARG  70          2HH2      ARG  70   0.057  12.956  -0.728
  535    H    SER  71           H        SER  71   3.626   6.420  -4.849
  536    HA   SER  71           HA       SER  71   1.697   7.348  -6.715
  537    HB2  SER  71          2HB       SER  71   2.899   4.572  -6.556
  538    HB3  SER  71          1HB       SER  71   2.213   5.339  -7.982
  539    HG   SER  71           HG       SER  71   3.864   6.852  -7.919
  540    H    ILE  72           H        ILE  72   1.574   4.603  -4.437
  541    HA   ILE  72           HA       ILE  72  -1.017   3.687  -5.234
  542    HB   ILE  72           HB       ILE  72   0.407   3.428  -2.569
  543   HG12  ILE  72          2HG1      ILE  72   0.284   1.522  -4.927
  544   HG13  ILE  72          1HG1      ILE  72   1.660   2.563  -4.562
  545   HG21  ILE  72          1HG2      ILE  72  -1.059   1.447  -2.301
  546   HG22  ILE  72          2HG2      ILE  72  -1.883   1.875  -3.799
  547   HG23  ILE  72          3HG2      ILE  72  -1.983   2.944  -2.401
  548   HD11  ILE  72          1HD1      ILE  72   1.018   0.002  -3.437
  549   HD12  ILE  72          2HD1      ILE  72   0.969   1.212  -2.156
  550   HD13  ILE  72          3HD1      ILE  72   2.428   1.013  -3.125
  551    H    ASP  73           H        ASP  73   0.070   5.999  -2.767
  552    HA   ASP  73           HA       ASP  73  -2.416   6.418  -1.477
  553    HB2  ASP  73          2HB       ASP  73  -0.174   7.325  -0.748
  554    HB3  ASP  73          1HB       ASP  73  -0.327   8.545  -2.012
  555    H    ALA  74           H        ALA  74  -1.102   7.863  -4.447
  556    HA   ALA  74           HA       ALA  74  -3.192   9.796  -4.780
  557    HB1  ALA  74          1HB       ALA  74  -1.045   9.882  -6.020
  558    HB2  ALA  74          2HB       ALA  74  -2.429   9.930  -7.111
  559    HB3  ALA  74          3HB       ALA  74  -1.516   8.435  -6.910
  560    H    PHE  75           H        PHE  75  -2.803   6.491  -6.080
  561    HA   PHE  75           HA       PHE  75  -5.298   6.513  -7.508
  562    HB2  PHE  75          2HB       PHE  75  -3.622   4.236  -6.419
  563    HB3  PHE  75          1HB       PHE  75  -5.038   4.008  -7.441
  564    HD1  PHE  75          1HD       PHE  75  -1.535   4.433  -7.442
  565    HD2  PHE  75          2HD       PHE  75  -5.064   5.466  -9.661
  566    HE1  PHE  75          1HE       PHE  75  -0.147   4.845  -9.455
  567    HE2  PHE  75          2HE       PHE  75  -3.676   5.875 -11.676
  568    HZ   PHE  75           HZ       PHE  75  -1.218   5.566 -11.573
  569    H    VAL  76           H        VAL  76  -4.379   5.446  -4.243
  570    HA   VAL  76           HA       VAL  76  -6.933   4.387  -3.525
  571    HB   VAL  76           HB       VAL  76  -4.678   5.545  -1.865
  572   HG11  VAL  76          1HG1      VAL  76  -6.685   5.708  -0.551
  573   HG12  VAL  76          2HG1      VAL  76  -5.812   4.280   0.004
  574   HG13  VAL  76          3HG1      VAL  76  -7.210   4.102  -1.055
  575   HG21  VAL  76          1HG2      VAL  76  -4.264   3.456  -3.225
  576   HG22  VAL  76          2HG2      VAL  76  -5.551   2.675  -2.307
  577   HG23  VAL  76          3HG2      VAL  76  -4.093   3.228  -1.485
  578    H    VAL  77           H        VAL  77  -5.499   7.636  -3.146
  579    HA   VAL  77           HA       VAL  77  -7.663   8.775  -1.682
  580    HB   VAL  77           HB       VAL  77  -5.636  10.005  -3.568
  581   HG11  VAL  77          1HG1      VAL  77  -6.481  11.978  -1.839
  582   HG12  VAL  77          2HG1      VAL  77  -7.980  11.129  -2.213
  583   HG13  VAL  77          3HG1      VAL  77  -7.002  11.804  -3.514
  584   HG21  VAL  77          1HG2      VAL  77  -5.528  10.606  -0.701
  585   HG22  VAL  77          2HG2      VAL  77  -4.245  10.060  -1.781
  586   HG23  VAL  77          3HG2      VAL  77  -5.336   8.887  -1.046
  587    H    GLY  78           H        GLY  78  -7.029   8.531  -5.171
  588    HA2  GLY  78          2HA       GLY  78  -9.201  10.112  -6.076
  589    HA3  GLY  78          1HA       GLY  78  -8.466   8.803  -6.999
  590    H    ALA  79           H        ALA  79  -9.130   6.787  -4.902
  591    HA   ALA  79           HA       ALA  79 -11.979   6.466  -5.674
  592    HB1  ALA  79          1HB       ALA  79 -10.902   4.175  -4.310
  593    HB2  ALA  79          2HB       ALA  79  -9.778   4.690  -5.568
  594    HB3  ALA  79          3HB       ALA  79 -11.449   4.305  -5.981
  595    H    THR  80           H        THR  80  -9.889   6.142  -2.799
  596    HA   THR  80           HA       THR  80 -12.216   6.960  -1.148
  597    HB   THR  80           HB       THR  80 -12.023   4.411  -1.250
  598    HG1  THR  80          1HG       THR  80 -12.441   6.073   0.765
  599   HG21  THR  80          1HG2      THR  80  -9.846   4.532   0.747
  600   HG22  THR  80          2HG2      THR  80  -9.360   4.867  -0.915
  601   HG23  THR  80          3HG2      THR  80 -10.151   3.342  -0.517
  602    H    THR  81           H        THR  81 -11.571   7.793   0.951
  603    HA   THR  81           HA       THR  81  -8.657   8.267   1.283
  604    HB   THR  81           HB       THR  81  -9.640  10.223   0.109
  605    HG1  THR  81          1HG       THR  81  -9.089  10.877   2.803
  606   HG21  THR  81          1HG2      THR  81 -11.846   9.733   1.668
  607   HG22  THR  81          2HG2      THR  81 -11.559  11.231   0.781
  608   HG23  THR  81          3HG2      THR  81 -11.128  11.119   2.488
  609    HA   PRO  82           HA       PRO  82 -10.615   6.817   5.207
  610    HB2  PRO  82          2HB       PRO  82  -7.842   6.065   5.851
  611    HB3  PRO  82          1HB       PRO  82  -9.301   5.061   5.825
  612    HG2  PRO  82          2HG       PRO  82  -7.341   4.870   3.977
  613    HG3  PRO  82          1HG       PRO  82  -9.041   4.504   3.640
  614    HD2  PRO  82          2HD       PRO  82  -7.440   6.900   2.859
  615    HD3  PRO  82          1HD       PRO  82  -8.791   6.114   2.012
  616    HA   PRO  83           HA       PRO  83  -9.474   9.911   8.156
  617    HB2  PRO  83          2HB       PRO  83  -8.182   8.017  10.035
  618    HB3  PRO  83          1HB       PRO  83  -9.587   9.069  10.283
  619    HG2  PRO  83          2HG       PRO  83  -9.819   6.415  10.020
  620    HG3  PRO  83          1HG       PRO  83 -11.054   7.541   9.434
  621    HD2  PRO  83          2HD       PRO  83  -9.019   6.000   7.877
  622    HD3  PRO  83          1HD       PRO  83 -10.674   6.466   7.426
  623    H    VAL  84           H        VAL  84  -7.710  11.260   8.798
  624    HA   VAL  84           HA       VAL  84  -5.082  10.392   7.698
  625    HB   VAL  84           HB       VAL  84  -5.978  13.167   8.528
  626   HG11  VAL  84          1HG1      VAL  84  -3.462  12.007   7.682
  627   HG12  VAL  84          2HG1      VAL  84  -3.800  13.652   8.225
  628   HG13  VAL  84          3HG1      VAL  84  -3.998  13.227   6.525
  629   HG21  VAL  84          1HG2      VAL  84  -5.954  13.346   5.883
  630   HG22  VAL  84          2HG2      VAL  84  -7.385  12.753   6.725
  631   HG23  VAL  84          3HG2      VAL  84  -6.266  11.612   5.980
  632    H    GLU  85           H        GLU  85  -3.422   9.964   9.074
  633    HA   GLU  85           HA       GLU  85  -3.533  11.077  11.830
  634    HB2  GLU  85          2HB       GLU  85  -2.931   8.189  11.123
  635    HB3  GLU  85          1HB       GLU  85  -2.822   8.890  12.739
  636    HG2  GLU  85          2HG       GLU  85  -5.237   9.475  12.621
  637    HG3  GLU  85          1HG       GLU  85  -5.330   8.690  11.045
  638    H    ALA  86           H        ALA  86  -1.416  11.287  12.812
  639    HA   ALA  86           HA       ALA  86   0.671  11.962  10.954
  640    HB1  ALA  86          1HB       ALA  86   0.203  12.628  13.522
  641    HB2  ALA  86          2HB       ALA  86   1.805  12.747  12.794
  642    HB3  ALA  86          3HB       ALA  86   1.388  11.346  13.780
  643    H    LYS  87           H        LYS  87   2.516  10.791  10.354
  644    HA   LYS  87           HA       LYS  87   2.351   7.959  10.251
  645    HB2  LYS  87          2HB       LYS  87   3.778   9.367   8.752
  646    HB3  LYS  87          1HB       LYS  87   4.873   9.638  10.108
  647    HG2  LYS  87          2HG       LYS  87   5.210   7.185  10.303
  648    HG3  LYS  87          1HG       LYS  87   4.168   6.948   8.899
  649    HD2  LYS  87          2HD       LYS  87   5.720   8.378   7.559
  650    HD3  LYS  87          1HD       LYS  87   6.792   8.466   8.957
  651    HE2  LYS  87          2HE       LYS  87   5.922   5.882   7.627
  652    HE3  LYS  87          1HE       LYS  87   7.465   6.686   7.334
  653    HZ1  LYS  87          1HZ       LYS  87   7.375   4.853   9.090
  654    HZ2  LYS  87          2HZ       LYS  87   6.602   6.002  10.071
  655    HZ3  LYS  87          3HZ       LYS  87   8.171   6.295   9.491
  656    H    LEU  88           H        LEU  88   3.960  10.105  12.568
  657    HA   LEU  88           HA       LEU  88   5.418   8.127  13.999
  658    HB2  LEU  88          2HB       LEU  88   4.101  10.625  15.112
  659    HB3  LEU  88          1HB       LEU  88   5.427   9.730  15.854
  660    HG   LEU  88           HG       LEU  88   5.509  11.164  13.182
  661   HD11  LEU  88          1HD1      LEU  88   6.821  11.694  15.865
  662   HD12  LEU  88          2HD1      LEU  88   5.635  12.712  15.048
  663   HD13  LEU  88          3HD1      LEU  88   7.254  12.527  14.372
  664   HD21  LEU  88          1HD2      LEU  88   6.965   9.371  12.854
  665   HD22  LEU  88          2HD2      LEU  88   7.375   9.258  14.566
  666   HD23  LEU  88          3HD2      LEU  88   8.049  10.557  13.580
  667    H    GLN  89           H        GLN  89   2.032   9.125  14.189
  668    HA   GLN  89           HA       GLN  89   0.231   8.202  15.381
  669    HB2  GLN  89          2HB       GLN  89   1.994   5.745  15.137
  670    HB3  GLN  89          1HB       GLN  89   0.294   5.724  15.605
  671    HG2  GLN  89          2HG       GLN  89  -0.275   6.829  13.439
  672    HG3  GLN  89          1HG       GLN  89   1.420   6.703  12.967
  673   HE21  GLN  89          1HE2      GLN  89   0.902   4.012  14.823
  674   HE22  GLN  89          2HE2      GLN  89   0.453   2.909  13.612
  675    H1   PN7 101          3HO       SAT 101   4.036  -7.840 -14.510
  676    H2   PN7 101          1H1       SAT 101   5.203  -8.986 -11.700
  677    H3   PN7 101          2H1       SAT 101   5.154  -8.267 -10.091
  678    H5   PN7 101          1HE1      SAT 101   3.395  -5.563 -11.656
  679    H6   PN7 101          2HE1      SAT 101   4.998  -6.239 -11.950
  680    H7   PN7 101          3HE1      SAT 101   4.411  -6.048 -10.298
  681    H8   PN7 101          2HE2      SAT 101   1.698  -8.611 -10.715
  682    H9   PN7 101          3HE2      SAT 101   1.698  -6.851 -10.607
  683    H10  PN7 101          1HE2      SAT 101   2.600  -7.806  -9.431
  684    H11  PN7 101          3H        SAT 101   3.207  -9.087 -12.959
  685    H12  PN7 101          5H        SAT 101   1.907  -5.618 -13.206
  686    H13  PN7 101          1H6       SAT 101  -0.425  -6.293 -14.482
  687    H14  PN7 101          2H6       SAT 101   0.827  -5.361 -15.300
  688    H15  PN7 101          1H7       SAT 101   0.350  -8.339 -15.373
  689    H16  PN7 101          2H7       SAT 101   1.926  -7.662 -15.784
  690    H17  PN7 101          9H        SAT 101   1.251  -5.348 -17.151
  691    H18  PN7 101          1H10      SAT 101   0.301  -4.773 -19.337
  692    H19  PN7 101          2H10      SAT 101  -0.807  -6.136 -19.163
  693    H20  PN7 101          1H11      SAT 101  -1.154  -4.324 -16.947
  694    H21  PN7 101          2H11      SAT 101  -2.333  -4.816 -18.164
  695    H22  PN7 101          2HS1      SAT 101  -2.123  -2.513 -19.043
  Start of MODEL   17
    1    H1   MET   1          1HT       MET   1  -2.912  14.864  -0.083
    2    H2   MET   1          2HT       MET   1  -3.136  13.483  -1.046
    3    H3   MET   1          3HT       MET   1  -1.857  14.551  -1.373
    4    HA   MET   1           HA       MET   1  -1.543  12.302  -0.014
    5    HB2  MET   1          2HB       MET   1  -0.147  14.964   0.351
    6    HB3  MET   1          1HB       MET   1   0.476  13.446   1.000
    7    HG2  MET   1          2HG       MET   1   0.479  12.481  -1.275
    8    HG3  MET   1          1HG       MET   1  -0.105  14.017  -1.919
    9    HE1  MET   1          1HE       MET   1   3.448  14.193  -3.250
   10    HE2  MET   1          2HE       MET   1   1.723  14.374  -3.558
   11    HE3  MET   1          3HE       MET   1   2.377  12.787  -3.164
   12    H    GLN   2           H        GLN   2  -3.857  12.774   1.205
   13    HA   GLN   2           HA       GLN   2  -3.469  14.044   3.821
   14    HB2  GLN   2          2HB       GLN   2  -5.762  12.376   2.735
   15    HB3  GLN   2          1HB       GLN   2  -5.785  13.268   4.257
   16    HG2  GLN   2          2HG       GLN   2  -5.410  15.377   3.028
   17    HG3  GLN   2          1HG       GLN   2  -5.396  14.484   1.505
   18   HE21  GLN   2          1HE2      GLN   2  -7.339  16.480   1.833
   19   HE22  GLN   2          2HE2      GLN   2  -8.867  15.766   2.024
   20    H    HIS   3           H        HIS   3  -2.937  12.964   5.701
   21    HA   HIS   3           HA       HIS   3  -2.149  11.199   7.037
   22    HB2  HIS   3          2HB       HIS   3  -4.108   9.560   5.399
   23    HB3  HIS   3          1HB       HIS   3  -3.469   9.153   6.991
   24    HD1  HIS   3          1HD       HIS   3  -5.951  11.365   5.271
   25    HD2  HIS   3          2HD       HIS   3  -4.565  10.694   9.148
   26    HE1  HIS   3          1HE       HIS   3  -7.562  12.554   6.825
   27    HE2  HIS   3          2HE       HIS   3  -6.728  12.152   9.186
   28    H    ALA   4           H        ALA   4  -0.668  11.813   4.665
   29    HA   ALA   4           HA       ALA   4  -0.011   9.562   3.066
   30    HB1  ALA   4          1HB       ALA   4   1.492  12.037   3.892
   31    HB2  ALA   4          2HB       ALA   4   0.866  11.601   2.303
   32    HB3  ALA   4          3HB       ALA   4   2.293  10.785   2.943
   33    H    SER   5           H        SER   5   1.092  10.525   6.286
   34    HA   SER   5           HA       SER   5   3.297   8.756   6.529
   35    HB2  SER   5          2HB       SER   5   2.677  10.558   8.168
   36    HB3  SER   5          1HB       SER   5   1.361   9.531   8.728
   37    HG   SER   5           HG       SER   5   4.140   9.204   8.967
   38    H    VAL   6           H        VAL   6  -0.170   8.214   7.044
   39    HA   VAL   6           HA       VAL   6   0.073   5.573   8.125
   40    HB   VAL   6           HB       VAL   6  -2.159   6.905   6.587
   41   HG11  VAL   6          1HG1      VAL   6  -2.703   4.671   6.245
   42   HG12  VAL   6          2HG1      VAL   6  -3.445   4.940   7.823
   43   HG13  VAL   6          3HG1      VAL   6  -1.877   4.141   7.711
   44   HG21  VAL   6          1HG2      VAL   6  -1.865   7.950   8.708
   45   HG22  VAL   6          2HG2      VAL   6  -1.555   6.408   9.506
   46   HG23  VAL   6          3HG2      VAL   6  -3.180   6.798   8.944
   47    H    ILE   7           H        ILE   7  -0.131   6.787   4.808
   48    HA   ILE   7           HA       ILE   7  -0.471   4.297   3.489
   49    HB   ILE   7           HB       ILE   7   1.084   6.726   2.558
   50   HG12  ILE   7          2HG1      ILE   7  -1.816   5.965   2.083
   51   HG13  ILE   7          1HG1      ILE   7  -1.292   7.140   3.288
   52   HG21  ILE   7          1HG2      ILE   7   1.518   4.711   1.204
   53   HG22  ILE   7          2HG2      ILE   7   0.548   5.871   0.297
   54   HG23  ILE   7          3HG2      ILE   7  -0.217   4.456   1.019
   55   HD11  ILE   7          1HD1      ILE   7  -1.481   7.413   0.361
   56   HD12  ILE   7          2HD1      ILE   7   0.019   8.032   1.050
   57   HD13  ILE   7          3HD1      ILE   7  -1.533   8.653   1.613
   58    H    ALA   8           H        ALA   8   2.556   6.042   4.266
   59    HA   ALA   8           HA       ALA   8   4.296   3.971   3.308
   60    HB1  ALA   8          1HB       ALA   8   5.271   5.534   5.613
   61    HB2  ALA   8          2HB       ALA   8   4.667   6.514   4.277
   62    HB3  ALA   8          3HB       ALA   8   5.966   5.354   4.002
   63    H    GLN   9           H        GLN   9   2.922   4.679   6.490
   64    HA   GLN   9           HA       GLN   9   4.216   2.514   7.870
   65    HB2  GLN   9          2HB       GLN   9   3.183   4.457   9.024
   66    HB3  GLN   9          1HB       GLN   9   1.593   3.902   8.501
   67    HG2  GLN   9          2HG       GLN   9   2.830   1.662   9.690
   68    HG3  GLN   9          1HG       GLN   9   3.163   3.023  10.762
   69   HE21  GLN   9          1HE2      GLN   9   0.375   1.734   8.856
   70   HE22  GLN   9          2HE2      GLN   9  -0.779   2.049  10.062
   71    H    PHE  10           H        PHE  10   1.203   2.797   6.063
   72    HA   PHE  10           HA       PHE  10  -0.032   0.381   6.868
   73    HB2  PHE  10          2HB       PHE  10  -1.066   2.209   5.488
   74    HB3  PHE  10          1HB       PHE  10  -0.127   1.635   4.113
   75    HD1  PHE  10          1HD       PHE  10  -0.676  -0.443   2.989
   76    HD2  PHE  10          2HD       PHE  10  -2.861   0.841   6.457
   77    HE1  PHE  10          1HE       PHE  10  -2.431  -2.130   2.509
   78    HE2  PHE  10          2HE       PHE  10  -4.613  -0.847   5.979
   79    HZ   PHE  10           HZ       PHE  10  -4.398  -2.327   4.004
   80    H    VAL  11           H        VAL  11   2.035   0.939   3.994
   81    HA   VAL  11           HA       VAL  11   2.147  -1.898   3.395
   82    HB   VAL  11           HB       VAL  11   3.860  -1.222   1.732
   83   HG11  VAL  11          1HG1      VAL  11   1.673   0.833   1.611
   84   HG12  VAL  11          2HG1      VAL  11   1.267  -0.881   1.516
   85   HG13  VAL  11          3HG1      VAL  11   2.337  -0.160   0.313
   86   HG21  VAL  11          1HG2      VAL  11   5.127   0.540   2.443
   87   HG22  VAL  11          2HG2      VAL  11   3.816   1.214   3.410
   88   HG23  VAL  11          3HG2      VAL  11   3.865   1.498   1.671
   89    H    VAL  12           H        VAL  12   4.332   0.419   4.967
   90    HA   VAL  12           HA       VAL  12   6.529  -1.380   5.294
   91    HB   VAL  12           HB       VAL  12   5.742   0.990   6.993
   92   HG11  VAL  12          1HG1      VAL  12   8.087   1.042   7.657
   93   HG12  VAL  12          2HG1      VAL  12   8.443  -0.328   6.606
   94   HG13  VAL  12          3HG1      VAL  12   7.424  -0.548   8.024
   95   HG21  VAL  12          1HG2      VAL  12   6.795   2.358   5.462
   96   HG22  VAL  12          2HG2      VAL  12   6.214   1.109   4.362
   97   HG23  VAL  12          3HG2      VAL  12   7.886   1.082   4.921
   98    H    GLU  13           H        GLU  13   3.695  -0.726   7.325
   99    HA   GLU  13           HA       GLU  13   4.510  -2.109   9.649
  100    HB2  GLU  13          2HB       GLU  13   2.438  -0.751   9.496
  101    HB3  GLU  13          1HB       GLU  13   1.719  -2.014   8.504
  102    HG2  GLU  13          2HG       GLU  13   2.069  -3.637  10.350
  103    HG3  GLU  13          1HG       GLU  13   2.704  -2.325  11.343
  104    H    GLU  14           H        GLU  14   3.339  -3.336   6.579
  105    HA   GLU  14           HA       GLU  14   2.771  -6.004   7.460
  106    HB2  GLU  14          2HB       GLU  14   2.053  -5.043   5.262
  107    HB3  GLU  14          1HB       GLU  14   3.730  -5.129   4.721
  108    HG2  GLU  14          2HG       GLU  14   3.719  -7.577   5.184
  109    HG3  GLU  14          1HG       GLU  14   2.010  -7.461   5.603
  110    H    PHE  15           H        PHE  15   5.760  -4.378   6.542
  111    HA   PHE  15           HA       PHE  15   7.241  -6.770   7.496
  112    HB2  PHE  15          2HB       PHE  15   8.718  -6.789   5.579
  113    HB3  PHE  15          1HB       PHE  15   7.060  -6.884   4.987
  114    HD1  PHE  15          1HD       PHE  15   5.917  -4.752   4.200
  115    HD2  PHE  15          2HD       PHE  15  10.138  -4.987   4.959
  116    HE1  PHE  15          1HE       PHE  15   6.273  -2.700   2.853
  117    HE2  PHE  15          2HE       PHE  15  10.493  -2.933   3.616
  118    HZ   PHE  15           HZ       PHE  15   8.560  -1.791   2.562
  119    H    LEU  16           H        LEU  16   6.883  -4.414   8.943
  120    HA   LEU  16           HA       LEU  16   9.132  -2.636   8.466
  121    HB2  LEU  16          2HB       LEU  16   8.192  -1.250  10.014
  122    HB3  LEU  16          1HB       LEU  16   6.774  -2.214   9.657
  123    HG   LEU  16           HG       LEU  16   8.678  -2.650  11.986
  124   HD11  LEU  16          1HD1      LEU  16   6.175  -1.137  11.602
  125   HD12  LEU  16          2HD1      LEU  16   7.442  -0.939  12.813
  126   HD13  LEU  16          3HD1      LEU  16   6.206  -2.179  13.025
  127   HD21  LEU  16          1HD2      LEU  16   6.051  -3.957  12.034
  128   HD22  LEU  16          2HD2      LEU  16   7.638  -4.631  12.395
  129   HD23  LEU  16          3HD2      LEU  16   7.075  -4.548  10.731
  130    HA   PRO  17           HA       PRO  17  11.955  -5.096  10.923
  131    HB2  PRO  17          2HB       PRO  17  14.060  -3.386  10.972
  132    HB3  PRO  17          1HB       PRO  17  13.586  -4.232   9.489
  133    HG2  PRO  17          2HG       PRO  17  13.014  -1.430  10.328
  134    HG3  PRO  17          1HG       PRO  17  13.501  -2.055   8.744
  135    HD2  PRO  17          2HD       PRO  17  10.904  -1.443   9.392
  136    HD3  PRO  17          1HD       PRO  17  11.360  -2.655   8.175
  137    H    ASP  18           H        ASP  18  13.835  -3.608  12.680
  138    HA   ASP  18           HA       ASP  18  12.035  -3.216  14.943
  139    HB2  ASP  18          2HB       ASP  18  14.092  -2.879  16.222
  140    HB3  ASP  18          1HB       ASP  18  14.270  -4.293  15.188
  141    H    VAL  19           H        VAL  19  12.432  -1.349  12.419
  142    HA   VAL  19           HA       VAL  19  12.723   1.201  13.960
  143    HB   VAL  19           HB       VAL  19  13.016   0.760  10.975
  144   HG11  VAL  19          1HG1      VAL  19  13.308   3.107  12.831
  145   HG12  VAL  19          2HG1      VAL  19  12.508   3.021  11.261
  146   HG13  VAL  19          3HG1      VAL  19  14.270   3.033  11.353
  147   HG21  VAL  19          1HG2      VAL  19  14.882  -0.353  11.871
  148   HG22  VAL  19          2HG2      VAL  19  14.993   0.741  13.249
  149   HG23  VAL  19          3HG2      VAL  19  15.494   1.287  11.648
  150    H    ALA  20           H        ALA  20  10.995   2.615  13.956
  151    HA   ALA  20           HA       ALA  20   8.438   1.677  13.002
  152    HB1  ALA  20          1HB       ALA  20   7.554   3.449  14.167
  153    HB2  ALA  20          2HB       ALA  20   8.804   4.564  13.616
  154    HB3  ALA  20          3HB       ALA  20   9.148   3.427  14.920
  155    HA   PRO  21           HA       PRO  21   8.676   2.982   8.720
  156    HB2  PRO  21          2HB       PRO  21   5.912   4.022   9.155
  157    HB3  PRO  21          1HB       PRO  21   6.525   2.941   7.890
  158    HG2  PRO  21          2HG       PRO  21   5.065   2.052   9.951
  159    HG3  PRO  21          1HG       PRO  21   6.339   1.083   9.196
  160    HD2  PRO  21          2HD       PRO  21   6.323   2.400  11.850
  161    HD3  PRO  21          1HD       PRO  21   7.270   1.010  11.271
  162    H    ALA  22           H        ALA  22   7.460   5.180  11.200
  163    HA   ALA  22           HA       ALA  22   7.630   7.594   9.650
  164    HB1  ALA  22          1HB       ALA  22   8.066   8.450  12.200
  165    HB2  ALA  22          2HB       ALA  22   7.335   6.875  12.509
  166    HB3  ALA  22          3HB       ALA  22   6.466   8.080  11.556
  167    H    ASP  23           H        ASP  23   9.991   5.615  11.238
  168    HA   ASP  23           HA       ASP  23  12.055   7.741  11.005
  169    HB2  ASP  23          2HB       ASP  23  12.108   5.004  12.309
  170    HB3  ASP  23          1HB       ASP  23  13.494   6.094  12.240
  171    H    VAL  24           H        VAL  24  10.706   5.534   9.039
  172    HA   VAL  24           HA       VAL  24  13.279   4.711   7.775
  173    HB   VAL  24           HB       VAL  24  10.460   3.713   7.252
  174   HG11  VAL  24          1HG1      VAL  24  11.893   1.808   6.202
  175   HG12  VAL  24          2HG1      VAL  24  13.186   3.007   6.177
  176   HG13  VAL  24          3HG1      VAL  24  11.692   3.303   5.288
  177   HG21  VAL  24          1HG2      VAL  24  12.738   2.665   8.945
  178   HG22  VAL  24          2HG2      VAL  24  11.440   1.619   8.370
  179   HG23  VAL  24          3HG2      VAL  24  11.073   2.975   9.437
  180    H    ASP  25           H        ASP  25  13.791   5.499   5.746
  181    HA   ASP  25           HA       ASP  25  12.475   7.860   4.813
  182    HB2  ASP  25          2HB       ASP  25  14.384   5.970   3.406
  183    HB3  ASP  25          1HB       ASP  25  13.882   7.532   2.758
  184    H    VAL  26           H        VAL  26  10.300   7.576   4.347
  185    HA   VAL  26           HA       VAL  26   9.167   5.323   3.008
  186    HB   VAL  26           HB       VAL  26   7.212   6.727   2.663
  187   HG11  VAL  26          1HG1      VAL  26   6.795   7.374   4.927
  188   HG12  VAL  26          2HG1      VAL  26   8.509   7.651   5.236
  189   HG13  VAL  26          3HG1      VAL  26   7.908   6.008   5.015
  190   HG21  VAL  26          1HG2      VAL  26   9.272   8.853   2.746
  191   HG22  VAL  26          2HG2      VAL  26   7.765   9.241   3.576
  192   HG23  VAL  26          3HG2      VAL  26   7.743   8.802   1.869
  193    H    ASP  27           H        ASP  27  11.504   7.205   1.792
  194    HA   ASP  27           HA       ASP  27  10.382   7.584  -0.909
  195    HB2  ASP  27          2HB       ASP  27  13.134   8.119   0.251
  196    HB3  ASP  27          1HB       ASP  27  12.675   8.472  -1.416
  197    H    LEU  28           H        LEU  28  11.191   4.933   0.642
  198    HA   LEU  28           HA       LEU  28  13.126   3.751  -1.219
  199    HB2  LEU  28          2HB       LEU  28  13.005   3.103   1.196
  200    HB3  LEU  28          1HB       LEU  28  11.418   2.403   0.888
  201    HG   LEU  28           HG       LEU  28  12.480   0.957  -0.881
  202   HD11  LEU  28          1HD1      LEU  28  15.070   0.734  -0.359
  203   HD12  LEU  28          2HD1      LEU  28  14.892   2.414   0.143
  204   HD13  LEU  28          3HD1      LEU  28  14.489   1.939  -1.506
  205   HD21  LEU  28          1HD2      LEU  28  13.579   0.712   1.938
  206   HD22  LEU  28          2HD2      LEU  28  13.520  -0.591   0.751
  207   HD23  LEU  28          3HD2      LEU  28  12.023   0.096   1.382
  208    H    ASP  29           H        ASP  29  12.616   2.630  -3.037
  209    HA   ASP  29           HA       ASP  29   9.912   2.640  -4.008
  210    HB2  ASP  29          2HB       ASP  29  12.370   1.141  -4.961
  211    HB3  ASP  29          1HB       ASP  29  10.841   1.193  -5.840
  212    H    LEU  30           H        LEU  30   8.326   1.253  -3.446
  213    HA   LEU  30           HA       LEU  30   8.753  -0.948  -1.683
  214    HB2  LEU  30          2HB       LEU  30   6.400  -0.475  -3.545
  215    HB3  LEU  30          1HB       LEU  30   6.407  -1.526  -2.129
  216    HG   LEU  30           HG       LEU  30   6.794   1.482  -2.133
  217   HD11  LEU  30          1HD1      LEU  30   4.486  -0.249  -1.951
  218   HD12  LEU  30          2HD1      LEU  30   4.547   1.513  -1.974
  219   HD13  LEU  30          3HD1      LEU  30   4.689   0.646  -0.445
  220   HD21  LEU  30          1HD2      LEU  30   6.536   0.940   0.443
  221   HD22  LEU  30          2HD2      LEU  30   8.114   0.806  -0.333
  222   HD23  LEU  30          3HD2      LEU  30   7.151  -0.641  -0.040
  223    H    VAL  31           H        VAL  31   9.376  -0.665  -4.998
  224    HA   VAL  31           HA       VAL  31   8.641  -3.127  -6.097
  225    HB   VAL  31           HB       VAL  31   9.914  -1.194  -7.217
  226   HG11  VAL  31          1HG1      VAL  31  12.329  -2.772  -6.309
  227   HG12  VAL  31          2HG1      VAL  31  11.770  -1.333  -5.456
  228   HG13  VAL  31          3HG1      VAL  31  12.298  -1.214  -7.135
  229   HG21  VAL  31          1HG2      VAL  31  10.426  -4.127  -7.627
  230   HG22  VAL  31          2HG2      VAL  31  11.271  -2.953  -8.638
  231   HG23  VAL  31          3HG2      VAL  31   9.507  -3.006  -8.633
  232    H    ASP  32           H        ASP  32  11.387  -2.404  -3.971
  233    HA   ASP  32           HA       ASP  32  12.644  -4.958  -4.083
  234    HB2  ASP  32          2HB       ASP  32  12.419  -2.982  -1.788
  235    HB3  ASP  32          1HB       ASP  32  13.482  -4.389  -1.778
  236    H    ASN  33           H        ASN  33   9.918  -3.734  -2.229
  237    HA   ASN  33           HA       ASN  33   9.511  -6.310  -0.866
  238    HB2  ASN  33          2HB       ASN  33   7.835  -3.790  -0.855
  239    HB3  ASN  33          1HB       ASN  33   7.610  -5.178   0.207
  240   HD21  ASN  33          1HD2      ASN  33   9.433  -2.258  -0.272
  241   HD22  ASN  33          2HD2      ASN  33  10.450  -2.425   1.075
  242    H    GLY  34           H        GLY  34   9.208  -5.630  -3.895
  243    HA2  GLY  34          2HA       GLY  34   6.640  -5.706  -4.854
  244    HA3  GLY  34          1HA       GLY  34   7.924  -6.671  -5.583
  245    H    VAL  35           H        VAL  35   8.079  -8.095  -2.810
  246    HA   VAL  35           HA       VAL  35   6.623 -10.411  -3.490
  247    HB   VAL  35           HB       VAL  35   8.366 -10.063  -1.602
  248   HG11  VAL  35          1HG1      VAL  35   7.551  -9.431   0.530
  249   HG12  VAL  35          2HG1      VAL  35   5.870  -9.606   0.025
  250   HG13  VAL  35          3HG1      VAL  35   6.835  -8.262  -0.580
  251   HG21  VAL  35          1HG2      VAL  35   6.751 -11.762  -0.165
  252   HG22  VAL  35          2HG2      VAL  35   7.729 -12.251  -1.548
  253   HG23  VAL  35          3HG2      VAL  35   6.025 -11.855  -1.770
  254    H    ILE  36           H        ILE  36   5.641  -7.509  -1.768
  255    HA   ILE  36           HA       ILE  36   3.032  -8.468  -0.964
  256    HB   ILE  36           HB       ILE  36   4.405  -6.410  -0.119
  257   HG12  ILE  36          2HG1      ILE  36   1.427  -6.273  -0.688
  258   HG13  ILE  36          1HG1      ILE  36   2.193  -6.970   0.738
  259   HG21  ILE  36          1HG2      ILE  36   2.774  -5.012  -2.236
  260   HG22  ILE  36          2HG2      ILE  36   4.432  -5.523  -2.557
  261   HG23  ILE  36          3HG2      ILE  36   4.101  -4.369  -1.267
  262   HD11  ILE  36          1HD1      ILE  36   3.176  -4.719   1.245
  263   HD12  ILE  36          2HD1      ILE  36   1.413  -4.741   1.304
  264   HD13  ILE  36          3HD1      ILE  36   2.239  -4.058  -0.095
  265    H    ASP  37           H        ASP  37   4.350  -7.112  -3.887
  266    HA   ASP  37           HA       ASP  37   1.956  -6.110  -5.052
  267    HB2  ASP  37          2HB       ASP  37   4.418  -7.259  -6.386
  268    HB3  ASP  37          1HB       ASP  37   3.145  -6.375  -7.224
  269    H    SER  38           H        SER  38   3.196  -9.411  -4.850
  270    HA   SER  38           HA       SER  38   0.979 -10.297  -6.628
  271    HB2  SER  38          2HB       SER  38   3.581 -11.535  -5.786
  272    HB3  SER  38          1HB       SER  38   2.277 -12.540  -6.412
  273    H    LEU  39           H        LEU  39   2.566 -11.661  -3.721
  274    HA   LEU  39           HA       LEU  39   0.170 -13.106  -3.013
  275    HB2  LEU  39          2HB       LEU  39   2.729 -12.575  -1.515
  276    HB3  LEU  39          1HB       LEU  39   1.440 -13.592  -0.883
  277    HG   LEU  39           HG       LEU  39   1.662 -14.780  -3.235
  278   HD11  LEU  39          1HD1      LEU  39   3.281 -13.268  -4.217
  279   HD12  LEU  39          2HD1      LEU  39   4.080 -14.812  -3.926
  280   HD13  LEU  39          3HD1      LEU  39   4.359 -13.458  -2.835
  281   HD21  LEU  39          1HD2      LEU  39   3.443 -16.261  -2.199
  282   HD22  LEU  39          2HD2      LEU  39   2.040 -15.958  -1.174
  283   HD23  LEU  39          3HD2      LEU  39   3.547 -15.088  -0.887
  284    H    GLY  40           H        GLY  40   1.817 -10.346  -1.460
  285    HA2  GLY  40          2HA       GLY  40  -0.206  -9.956   0.524
  286    HA3  GLY  40          1HA       GLY  40   0.975  -8.746   0.031
  287    H    LEU  41           H        LEU  41   0.249  -8.617  -2.717
  288    HA   LEU  41           HA       LEU  41  -1.838  -6.685  -2.616
  289    HB2  LEU  41          2HB       LEU  41  -0.091  -6.882  -4.418
  290    HB3  LEU  41          1HB       LEU  41  -0.963  -8.283  -5.034
  291    HG   LEU  41           HG       LEU  41  -2.623  -5.871  -4.580
  292   HD11  LEU  41          1HD1      LEU  41  -1.851  -4.759  -6.618
  293   HD12  LEU  41          2HD1      LEU  41  -0.617  -5.998  -6.852
  294   HD13  LEU  41          3HD1      LEU  41  -0.514  -4.898  -5.477
  295   HD21  LEU  41          1HD2      LEU  41  -3.515  -6.601  -6.793
  296   HD22  LEU  41          2HD2      LEU  41  -3.528  -7.906  -5.610
  297   HD23  LEU  41          3HD2      LEU  41  -2.279  -7.856  -6.852
  298    H    LEU  42           H        LEU  42  -1.869 -10.115  -3.549
  299    HA   LEU  42           HA       LEU  42  -4.576 -10.214  -4.417
  300    HB2  LEU  42          2HB       LEU  42  -2.642 -12.048  -4.373
  301    HB3  LEU  42          1HB       LEU  42  -3.434 -12.506  -2.873
  302    HG   LEU  42           HG       LEU  42  -4.429 -13.799  -4.647
  303   HD11  LEU  42          1HD1      LEU  42  -5.905 -12.655  -2.859
  304   HD12  LEU  42          2HD1      LEU  42  -6.710 -13.299  -4.289
  305   HD13  LEU  42          3HD1      LEU  42  -6.399 -11.568  -4.159
  306   HD21  LEU  42          1HD2      LEU  42  -5.650 -11.659  -6.165
  307   HD22  LEU  42          2HD2      LEU  42  -4.649 -12.993  -6.735
  308   HD23  LEU  42          3HD2      LEU  42  -3.895 -11.503  -6.173
  309    H    LYS  43           H        LYS  43  -3.158 -10.643  -1.175
  310    HA   LYS  43           HA       LYS  43  -5.665 -11.114   0.144
  311    HB2  LYS  43          2HB       LYS  43  -3.044 -10.028   1.186
  312    HB3  LYS  43          1HB       LYS  43  -4.393 -10.519   2.203
  313    HG2  LYS  43          2HG       LYS  43  -4.279 -12.796   1.181
  314    HG3  LYS  43          1HG       LYS  43  -2.845 -12.287   0.289
  315    HD2  LYS  43          2HD       LYS  43  -1.739 -11.743   2.464
  316    HD3  LYS  43          1HD       LYS  43  -3.146 -12.395   3.304
  317    HE2  LYS  43          2HE       LYS  43  -2.786 -14.582   2.230
  318    HE3  LYS  43          1HE       LYS  43  -1.390 -13.935   1.368
  319    HZ1  LYS  43          1HZ       LYS  43  -0.175 -14.476   3.121
  320    HZ2  LYS  43          2HZ       LYS  43  -1.548 -14.924   4.015
  321    HZ3  LYS  43          3HZ       LYS  43  -1.010 -13.313   4.031
  322    H    VAL  44           H        VAL  44  -3.797  -8.194  -0.587
  323    HA   VAL  44           HA       VAL  44  -5.418  -6.390   0.955
  324    HB   VAL  44           HB       VAL  44  -3.656  -5.921  -1.460
  325   HG11  VAL  44          1HG1      VAL  44  -5.064  -4.001   0.410
  326   HG12  VAL  44          2HG1      VAL  44  -5.213  -4.093  -1.345
  327   HG13  VAL  44          3HG1      VAL  44  -3.709  -3.529  -0.616
  328   HG21  VAL  44          1HG2      VAL  44  -1.930  -5.768   0.013
  329   HG22  VAL  44          2HG2      VAL  44  -2.985  -6.669   1.102
  330   HG23  VAL  44          3HG2      VAL  44  -2.907  -4.911   1.205
  331    H    ILE  45           H        ILE  45  -5.513  -7.193  -2.546
  332    HA   ILE  45           HA       ILE  45  -7.662  -5.437  -3.155
  333    HB   ILE  45           HB       ILE  45  -6.962  -8.091  -4.447
  334   HG12  ILE  45          2HG1      ILE  45  -5.050  -6.594  -4.522
  335   HG13  ILE  45          1HG1      ILE  45  -5.793  -6.613  -6.115
  336   HG21  ILE  45          1HG2      ILE  45  -8.755  -7.728  -5.737
  337   HG22  ILE  45          2HG2      ILE  45  -8.036  -6.209  -6.271
  338   HG23  ILE  45          3HG2      ILE  45  -9.103  -6.235  -4.868
  339   HD11  ILE  45          1HD1      ILE  45  -7.142  -4.554  -5.191
  340   HD12  ILE  45          2HD1      ILE  45  -5.493  -4.330  -5.771
  341   HD13  ILE  45          3HD1      ILE  45  -5.810  -4.447  -4.040
  342    H    ALA  46           H        ALA  46  -7.692  -8.851  -2.125
  343    HA   ALA  46           HA       ALA  46 -10.548  -9.132  -2.296
  344    HB1  ALA  46          1HB       ALA  46 -10.018 -11.007  -0.534
  345    HB2  ALA  46          2HB       ALA  46  -8.339 -10.616  -0.905
  346    HB3  ALA  46          3HB       ALA  46  -9.419 -11.172  -2.185
  347    H    TRP  47           H        TRP  47  -8.386  -8.342   0.432
  348    HA   TRP  47           HA       TRP  47 -10.606  -8.023   2.286
  349    HB2  TRP  47          2HB       TRP  47  -8.682  -8.605   3.417
  350    HB3  TRP  47          1HB       TRP  47  -7.650  -7.626   2.377
  351    HD1  TRP  47           HD       TRP  47 -10.747  -6.571   4.455
  352    HE1  TRP  47          1HE       TRP  47 -10.034  -4.607   5.969
  353    HE3  TRP  47          3HE       TRP  47  -5.811  -6.324   3.276
  354    HZ2  TRP  47          2HZ       TRP  47  -7.658  -3.125   6.597
  355    HZ3  TRP  47          3HZ       TRP  47  -4.331  -4.637   4.338
  356    HH2  TRP  47           HH       TRP  47  -5.251  -3.040   5.995
  357    H    LEU  48           H        LEU  48  -8.408  -5.782   0.610
  358    HA   LEU  48           HA       LEU  48  -9.444  -3.373   1.651
  359    HB2  LEU  48          2HB       LEU  48  -7.384  -3.615   0.227
  360    HB3  LEU  48          1HB       LEU  48  -8.432  -3.811  -1.168
  361    HG   LEU  48           HG       LEU  48  -9.507  -1.577  -0.351
  362   HD11  LEU  48          1HD1      LEU  48  -7.706  -1.916   1.681
  363   HD12  LEU  48          2HD1      LEU  48  -8.398  -0.363   1.218
  364   HD13  LEU  48          3HD1      LEU  48  -6.818  -0.844   0.602
  365   HD21  LEU  48          1HD2      LEU  48  -8.505  -1.269  -2.384
  366   HD22  LEU  48          2HD2      LEU  48  -7.050  -2.144  -1.906
  367   HD23  LEU  48          3HD2      LEU  48  -7.266  -0.460  -1.426
  368    H    GLU  49           H        GLU  49 -10.546  -5.297  -1.145
  369    HA   GLU  49           HA       GLU  49 -12.531  -3.442  -2.025
  370    HB2  GLU  49          2HB       GLU  49 -12.217  -5.113  -3.593
  371    HB3  GLU  49          1HB       GLU  49 -12.060  -6.373  -2.381
  372    HG2  GLU  49          2HG       GLU  49 -14.429  -6.411  -1.997
  373    HG3  GLU  49          1HG       GLU  49 -14.667  -4.969  -2.976
  374    H    ASP  50           H        ASP  50 -12.661  -6.096   0.339
  375    HA   ASP  50           HA       ASP  50 -15.457  -5.789   0.933
  376    HB2  ASP  50          2HB       ASP  50 -14.016  -7.781   1.525
  377    HB3  ASP  50          1HB       ASP  50 -13.308  -6.793   2.801
  378    H    ARG  51           H        ARG  51 -12.521  -4.328   2.239
  379    HA   ARG  51           HA       ARG  51 -13.643  -3.068   4.516
  380    HB2  ARG  51          2HB       ARG  51 -11.212  -3.235   4.046
  381    HB3  ARG  51          1HB       ARG  51 -11.400  -2.049   2.753
  382    HG2  ARG  51          2HG       ARG  51 -12.263  -0.410   4.404
  383    HG3  ARG  51          1HG       ARG  51 -12.008  -1.591   5.689
  384    HD2  ARG  51          2HD       ARG  51  -9.593  -1.670   5.106
  385    HD3  ARG  51          1HD       ARG  51  -9.866  -0.431   3.885
  386    HE   ARG  51           HE       ARG  51 -10.099   1.185   5.623
  387   HH11  ARG  51          1HH1      ARG  51  -9.796   1.800   7.774
  388   HH12  ARG  51          2HH1      ARG  51  -9.633   0.583   8.995
  389   HH21  ARG  51          1HH2      ARG  51  -9.955  -2.063   6.780
  390   HH22  ARG  51          2HH2      ARG  51  -9.723  -1.603   8.432
  391    H    PHE  52           H        PHE  52 -13.300  -1.776   1.178
  392    HA   PHE  52           HA       PHE  52 -15.207   0.383   1.981
  393    HB2  PHE  52          2HB       PHE  52 -12.862   0.372   0.093
  394    HB3  PHE  52          1HB       PHE  52 -14.142   1.573  -0.052
  395    HD1  PHE  52          1HD       PHE  52 -14.712   3.021   1.943
  396    HD2  PHE  52          2HD       PHE  52 -11.220   0.524   1.816
  397    HE1  PHE  52          1HE       PHE  52 -13.723   4.309   3.817
  398    HE2  PHE  52          2HE       PHE  52 -10.231   1.815   3.689
  399    HZ   PHE  52           HZ       PHE  52 -11.484   3.706   4.691
  400    H    GLY  53           H        GLY  53 -15.109  -2.450   0.281
  401    HA2  GLY  53          2HA       GLY  53 -16.668  -3.354  -1.238
  402    HA3  GLY  53          1HA       GLY  53 -17.588  -1.857  -1.087
  403    H    ILE  54           H        ILE  54 -14.213  -2.216  -2.146
  404    HA   ILE  54           HA       ILE  54 -14.931  -0.745  -4.622
  405    HB   ILE  54           HB       ILE  54 -12.206  -1.510  -3.530
  406   HG12  ILE  54          2HG1      ILE  54 -13.621   1.169  -3.415
  407   HG13  ILE  54          1HG1      ILE  54 -13.582   0.030  -2.067
  408   HG21  ILE  54          1HG2      ILE  54 -13.119  -0.363  -6.025
  409   HG22  ILE  54          2HG2      ILE  54 -11.480  -0.806  -5.543
  410   HG23  ILE  54          3HG2      ILE  54 -12.113   0.795  -5.154
  411   HD11  ILE  54          1HD1      ILE  54 -11.111   1.133  -3.432
  412   HD12  ILE  54          2HD1      ILE  54 -11.160   0.132  -1.980
  413   HD13  ILE  54          3HD1      ILE  54 -11.789   1.779  -1.937
  414    H    ALA  55           H        ALA  55 -14.668  -1.670  -6.671
  415    HA   ALA  55           HA       ALA  55 -14.847  -4.506  -6.900
  416    HB1  ALA  55          1HB       ALA  55 -15.256  -2.399  -8.605
  417    HB2  ALA  55          2HB       ALA  55 -15.214  -4.089  -9.107
  418    HB3  ALA  55          3HB       ALA  55 -13.769  -3.089  -9.254
  419    H    ALA  56           H        ALA  56 -13.287  -6.067  -7.308
  420    HA   ALA  56           HA       ALA  56 -10.612  -5.583  -6.446
  421    HB1  ALA  56          1HB       ALA  56 -10.168  -7.850  -7.540
  422    HB2  ALA  56          2HB       ALA  56 -11.862  -7.839  -8.029
  423    HB3  ALA  56          3HB       ALA  56 -11.438  -7.825  -6.317
  424    H    ASP  57           H        ASP  57 -12.129  -5.503  -9.617
  425    HA   ASP  57           HA       ASP  57  -9.524  -5.139 -10.961
  426    HB2  ASP  57          2HB       ASP  57 -12.357  -5.222 -12.011
  427    HB3  ASP  57          1HB       ASP  57 -10.934  -5.012 -13.028
  428    H    ASP  58           H        ASP  58 -11.232  -3.181  -9.106
  429    HA   ASP  58           HA       ASP  58 -11.918  -0.886 -10.569
  430    HB2  ASP  58          2HB       ASP  58 -12.243  -1.247  -8.091
  431    HB3  ASP  58          1HB       ASP  58 -10.537  -0.858  -7.884
  432    H    VAL  59           H        VAL  59  -8.735  -2.034  -9.575
  433    HA   VAL  59           HA       VAL  59  -7.535   0.185 -11.191
  434    HB   VAL  59           HB       VAL  59  -5.654   0.233  -9.642
  435   HG11  VAL  59          1HG1      VAL  59  -7.749   1.547  -9.130
  436   HG12  VAL  59          2HG1      VAL  59  -6.766   1.174  -7.714
  437   HG13  VAL  59          3HG1      VAL  59  -8.228   0.244  -8.043
  438   HG21  VAL  59          1HG2      VAL  59  -5.247  -1.806  -8.693
  439   HG22  VAL  59          2HG2      VAL  59  -6.952  -2.253  -8.688
  440   HG23  VAL  59          3HG2      VAL  59  -6.312  -1.206  -7.421
  441    H    GLU  60           H        GLU  60  -5.465  -0.400 -12.207
  442    HA   GLU  60           HA       GLU  60  -5.469  -3.246 -13.032
  443    HB2  GLU  60          2HB       GLU  60  -3.890  -0.877 -14.079
  444    HB3  GLU  60          1HB       GLU  60  -3.897  -2.488 -14.786
  445    HG2  GLU  60          2HG       GLU  60  -6.342  -2.298 -15.129
  446    HG3  GLU  60          1HG       GLU  60  -6.281  -0.656 -14.499
  447    H    LEU  61           H        LEU  61  -3.556  -4.548 -12.864
  448    HA   LEU  61           HA       LEU  61  -1.790  -3.707 -10.635
  449    HB2  LEU  61          2HB       LEU  61  -2.191  -6.409 -11.946
  450    HB3  LEU  61          1HB       LEU  61  -1.134  -6.102 -10.571
  451    HG   LEU  61           HG       LEU  61  -3.119  -5.247  -9.313
  452   HD11  LEU  61          1HD1      LEU  61  -4.403  -5.880 -11.925
  453   HD12  LEU  61          2HD1      LEU  61  -4.792  -4.616 -10.760
  454   HD13  LEU  61          3HD1      LEU  61  -5.319  -6.273 -10.471
  455   HD21  LEU  61          1HD2      LEU  61  -2.308  -7.604  -9.124
  456   HD22  LEU  61          2HD2      LEU  61  -3.444  -8.062 -10.391
  457   HD23  LEU  61          3HD2      LEU  61  -4.044  -7.458  -8.847
  458    H    SER  62           H        SER  62   0.340  -3.226 -10.984
  459    HA   SER  62           HA       SER  62   1.840  -4.335 -13.194
  460    HB2  SER  62          2HB       SER  62   0.320  -2.069 -13.812
  461    HB3  SER  62          1HB       SER  62   1.946  -1.447 -13.542
  462    HG   SER  62           HG       SER  62   1.220  -2.402 -15.723
  463    HA   PRO  63           HA       PRO  63   4.983  -3.374 -10.202
  464    HB2  PRO  63          2HB       PRO  63   7.179  -3.250 -11.891
  465    HB3  PRO  63          1HB       PRO  63   6.488  -4.746 -11.239
  466    HG2  PRO  63          2HG       PRO  63   6.165  -3.521 -13.919
  467    HG3  PRO  63          1HG       PRO  63   6.241  -5.228 -13.454
  468    HD2  PRO  63          2HD       PRO  63   3.902  -3.978 -14.092
  469    HD3  PRO  63          1HD       PRO  63   3.988  -5.331 -12.943
  470    H    GLU  64           H        GLU  64   4.556  -1.381 -13.041
  471    HA   GLU  64           HA       GLU  64   6.354   0.736 -12.356
  472    HB2  GLU  64          2HB       GLU  64   3.804   0.771 -13.967
  473    HB3  GLU  64          1HB       GLU  64   4.954   2.098 -13.899
  474    HG2  GLU  64          2HG       GLU  64   6.717   0.579 -14.741
  475    HG3  GLU  64          1HG       GLU  64   5.520  -0.703 -14.877
  476    H    HIS  65           H        HIS  65   3.049   0.017 -11.390
  477    HA   HIS  65           HA       HIS  65   2.522   2.601 -10.207
  478    HB2  HIS  65          2HB       HIS  65   0.729   1.059 -10.926
  479    HB3  HIS  65          1HB       HIS  65   1.208  -0.072  -9.661
  480    HD1  HIS  65          1HD       HIS  65   0.257   3.629  -9.871
  481    HD2  HIS  65          2HD       HIS  65  -0.213   0.347  -7.337
  482    HE1  HIS  65          1HE       HIS  65  -1.175   4.416  -7.933
  483    HE2  HIS  65          2HE       HIS  65  -1.467   2.428  -6.386
  484    H    PHE  66           H        PHE  66   4.077  -0.314  -9.013
  485    HA   PHE  66           HA       PHE  66   3.943   0.730  -6.237
  486    HB2  PHE  66          2HB       PHE  66   4.966  -1.901  -7.336
  487    HB3  PHE  66          1HB       PHE  66   4.923  -1.473  -5.625
  488    HD1  PHE  66          1HD       PHE  66   2.958  -2.489  -8.532
  489    HD2  PHE  66          2HD       PHE  66   2.750  -1.080  -4.479
  490    HE1  PHE  66          1HE       PHE  66   0.575  -3.166  -8.418
  491    HE2  PHE  66          2HE       PHE  66   0.367  -1.758  -4.366
  492    HZ   PHE  66           HZ       PHE  66  -0.720  -2.797  -6.336
  493    H    ARG  67           H        ARG  67   5.834   1.519  -8.689
  494    HA   ARG  67           HA       ARG  67   8.500   0.964  -7.881
  495    HB2  ARG  67          2HB       ARG  67   7.413   3.430  -9.271
  496    HB3  ARG  67          1HB       ARG  67   9.112   2.966  -9.201
  497    HG2  ARG  67          2HG       ARG  67   7.043   1.062 -10.247
  498    HG3  ARG  67          1HG       ARG  67   7.748   2.283 -11.304
  499    HD2  ARG  67          2HD       ARG  67  10.029   1.410 -10.598
  500    HD3  ARG  67          1HD       ARG  67   9.191   0.067  -9.821
  501    HE   ARG  67           HE       ARG  67   8.202   0.123 -12.432
  502   HH11  ARG  67          1HH1      ARG  67   9.128  -1.136 -14.064
  503   HH12  ARG  67          2HH1      ARG  67  10.773  -1.659 -13.909
  504   HH21  ARG  67          1HH2      ARG  67  11.251  -0.115 -10.842
  505   HH22  ARG  67          2HH2      ARG  67  11.975  -1.081 -12.084
  506    H    SER  68           H        SER  68   6.228   3.440  -6.762
  507    HA   SER  68           HA       SER  68   8.067   3.945  -4.490
  508    HB2  SER  68          2HB       SER  68   7.981   6.350  -4.752
  509    HB3  SER  68          1HB       SER  68   8.544   5.658  -6.270
  510    HG   SER  68           HG       SER  68   5.809   5.871  -6.033
  511    H    ILE  69           H        ILE  69   6.973   4.760  -2.615
  512    HA   ILE  69           HA       ILE  69   4.252   3.916  -2.321
  513    HB   ILE  69           HB       ILE  69   5.901   5.775  -0.584
  514   HG12  ILE  69          2HG1      ILE  69   5.444   2.804  -0.307
  515   HG13  ILE  69          1HG1      ILE  69   6.880   3.496  -1.049
  516   HG21  ILE  69          1HG2      ILE  69   4.067   5.911   0.692
  517   HG22  ILE  69          2HG2      ILE  69   4.071   4.155   0.852
  518   HG23  ILE  69          3HG2      ILE  69   3.181   4.919  -0.465
  519   HD11  ILE  69          1HD1      ILE  69   7.774   4.048   0.954
  520   HD12  ILE  69          2HD1      ILE  69   6.556   2.983   1.655
  521   HD13  ILE  69          3HD1      ILE  69   6.246   4.715   1.533
  522    H    ARG  70           H        ARG  70   5.761   7.065  -2.901
  523    HA   ARG  70           HA       ARG  70   3.487   8.703  -2.447
  524    HB2  ARG  70          2HB       ARG  70   5.813   9.542  -2.757
  525    HB3  ARG  70          1HB       ARG  70   5.698   9.144  -4.472
  526    HG2  ARG  70          2HG       ARG  70   3.795  10.679  -4.720
  527    HG3  ARG  70          1HG       ARG  70   3.864  11.056  -2.999
  528    HD2  ARG  70          2HD       ARG  70   5.023  12.819  -4.176
  529    HD3  ARG  70          1HD       ARG  70   6.236  11.842  -3.349
  530    HE   ARG  70           HE       ARG  70   5.997  10.726  -5.907
  531   HH11  ARG  70          1HH1      ARG  70   7.380  11.348  -7.581
  532   HH12  ARG  70          2HH1      ARG  70   8.168  12.890  -7.509
  533   HH21  ARG  70          1HH2      ARG  70   6.743  13.770  -4.472
  534   HH22  ARG  70          2HH2      ARG  70   7.806  14.261  -5.748
  535    H    SER  71           H        SER  71   4.520   6.969  -5.385
  536    HA   SER  71           HA       SER  71   2.651   8.110  -7.179
  537    HB2  SER  71          2HB       SER  71   3.610   5.237  -7.146
  538    HB3  SER  71          1HB       SER  71   2.988   6.121  -8.533
  539    HG   SER  71           HG       SER  71   4.763   7.521  -8.355
  540    H    ILE  72           H        ILE  72   2.295   5.333  -4.971
  541    HA   ILE  72           HA       ILE  72  -0.367   4.666  -5.809
  542    HB   ILE  72           HB       ILE  72   1.027   4.165  -3.164
  543   HG12  ILE  72          2HG1      ILE  72   0.768   2.394  -5.615
  544   HG13  ILE  72          1HG1      ILE  72   2.221   3.299  -5.190
  545   HG21  ILE  72          1HG2      ILE  72  -0.779   2.110  -3.832
  546   HG22  ILE  72          2HG2      ILE  72  -1.638   3.622  -4.125
  547   HG23  ILE  72          3HG2      ILE  72  -0.945   3.294  -2.538
  548   HD11  ILE  72          1HD1      ILE  72   1.947   2.088  -2.869
  549   HD12  ILE  72          2HD1      ILE  72   2.676   1.226  -4.223
  550   HD13  ILE  72          3HD1      ILE  72   0.986   0.940  -3.802
  551    H    ASP  73           H        ASP  73   0.926   6.773  -3.261
  552    HA   ASP  73           HA       ASP  73  -1.511   7.336  -1.925
  553    HB2  ASP  73          2HB       ASP  73   0.754   8.000  -1.115
  554    HB3  ASP  73          1HB       ASP  73   0.806   9.238  -2.370
  555    H    ALA  74           H        ALA  74  -0.055   8.911  -4.774
  556    HA   ALA  74           HA       ALA  74  -2.025  10.986  -4.955
  557    HB1  ALA  74          1HB       ALA  74  -1.052  10.265  -7.562
  558    HB2  ALA  74          2HB       ALA  74   0.278  10.182  -6.407
  559    HB3  ALA  74          3HB       ALA  74  -0.641  11.677  -6.588
  560    H    PHE  75           H        PHE  75  -1.830   7.772  -6.476
  561    HA   PHE  75           HA       PHE  75  -4.181   8.060  -8.070
  562    HB2  PHE  75          2HB       PHE  75  -2.513   6.223  -8.332
  563    HB3  PHE  75          1HB       PHE  75  -3.111   5.519  -6.832
  564    HD1  PHE  75          1HD       PHE  75  -5.328   4.508  -6.696
  565    HD2  PHE  75          2HD       PHE  75  -3.897   6.245 -10.355
  566    HE1  PHE  75          1HE       PHE  75  -7.172   3.410  -7.939
  567    HE2  PHE  75          2HE       PHE  75  -5.740   5.146 -11.598
  568    HZ   PHE  75           HZ       PHE  75  -7.378   3.728 -10.390
  569    H    VAL  76           H        VAL  76  -3.748   6.645  -4.813
  570    HA   VAL  76           HA       VAL  76  -6.519   6.073  -4.417
  571    HB   VAL  76           HB       VAL  76  -4.253   6.558  -2.467
  572   HG11  VAL  76          1HG1      VAL  76  -7.143   5.857  -2.071
  573   HG12  VAL  76          2HG1      VAL  76  -6.126   6.954  -1.138
  574   HG13  VAL  76          3HG1      VAL  76  -5.929   5.210  -0.968
  575   HG21  VAL  76          1HG2      VAL  76  -4.601   4.492  -4.200
  576   HG22  VAL  76          2HG2      VAL  76  -5.544   3.909  -2.828
  577   HG23  VAL  76          3HG2      VAL  76  -3.840   4.310  -2.619
  578    H    VAL  77           H        VAL  77  -4.509   8.880  -3.436
  579    HA   VAL  77           HA       VAL  77  -6.569  10.290  -2.084
  580    HB   VAL  77           HB       VAL  77  -4.109  11.214  -3.580
  581   HG11  VAL  77          1HG1      VAL  77  -5.533  13.096  -3.695
  582   HG12  VAL  77          2HG1      VAL  77  -4.564  13.375  -2.248
  583   HG13  VAL  77          3HG1      VAL  77  -6.219  12.781  -2.102
  584   HG21  VAL  77          1HG2      VAL  77  -4.188   9.893  -1.277
  585   HG22  VAL  77          2HG2      VAL  77  -4.604  11.483  -0.633
  586   HG23  VAL  77          3HG2      VAL  77  -3.081  11.250  -1.493
  587    H    GLY  78           H        GLY  78  -5.650  10.204  -5.504
  588    HA2  GLY  78          2HA       GLY  78  -7.321  12.287  -6.437
  589    HA3  GLY  78          1HA       GLY  78  -6.824  10.901  -7.406
  590    H    ALA  79           H        ALA  79  -8.106   8.932  -5.599
  591    HA   ALA  79           HA       ALA  79 -10.908   9.432  -6.487
  592    HB1  ALA  79          1HB       ALA  79  -9.452   7.318  -7.113
  593    HB2  ALA  79          2HB       ALA  79 -11.170   7.144  -6.753
  594    HB3  ALA  79          3HB       ALA  79  -9.967   6.762  -5.520
  595    H    THR  80           H        THR  80  -9.118   8.074  -3.711
  596    HA   THR  80           HA       THR  80 -11.008   9.345  -1.870
  597    HB   THR  80           HB       THR  80 -12.090   7.151  -2.626
  598    HG1  THR  80          1HG       THR  80 -11.536   7.972  -0.029
  599   HG21  THR  80          1HG2      THR  80 -10.359   5.688  -0.729
  600   HG22  THR  80          2HG2      THR  80  -9.602   6.108  -2.265
  601   HG23  THR  80          3HG2      THR  80 -11.080   5.148  -2.244
  602    H    THR  81           H        THR  81 -10.177   9.385   0.286
  603    HA   THR  81           HA       THR  81  -7.423   8.266   0.587
  604    HB   THR  81           HB       THR  81  -7.366  10.707   0.224
  605    HG1  THR  81          1HG       THR  81  -6.784  10.810   2.836
  606   HG21  THR  81          1HG2      THR  81  -9.726  10.682   1.690
  607   HG22  THR  81          2HG2      THR  81  -8.824  12.120   1.212
  608   HG23  THR  81          3HG2      THR  81  -8.560  11.401   2.801
  609    HA   PRO  82           HA       PRO  82  -9.906   6.832   4.162
  610    HB2  PRO  82          2HB       PRO  82  -9.385   4.214   3.956
  611    HB3  PRO  82          1HB       PRO  82 -10.525   5.014   2.855
  612    HG2  PRO  82          2HG       PRO  82  -7.745   4.108   2.366
  613    HG3  PRO  82          1HG       PRO  82  -9.128   4.171   1.261
  614    HD2  PRO  82          2HD       PRO  82  -7.034   6.084   1.458
  615    HD3  PRO  82          1HD       PRO  82  -8.541   6.254   0.533
  616    HA   PRO  83           HA       PRO  83  -5.926   6.706   6.453
  617    HB2  PRO  83          2HB       PRO  83  -6.856   7.783   8.777
  618    HB3  PRO  83          1HB       PRO  83  -6.408   8.765   7.371
  619    HG2  PRO  83          2HG       PRO  83  -9.088   8.016   8.376
  620    HG3  PRO  83          1HG       PRO  83  -8.557   9.488   7.551
  621    HD2  PRO  83          2HD       PRO  83  -9.940   7.376   6.351
  622    HD3  PRO  83          1HD       PRO  83  -9.025   8.627   5.484
  623    H    VAL  84           H        VAL  84  -5.204   4.959   7.640
  624    HA   VAL  84           HA       VAL  84  -7.234   3.431   9.229
  625    HB   VAL  84           HB       VAL  84  -4.902   2.269   7.679
  626   HG11  VAL  84          1HG1      VAL  84  -7.275   0.896   8.969
  627   HG12  VAL  84          2HG1      VAL  84  -5.702   1.054   9.749
  628   HG13  VAL  84          3HG1      VAL  84  -5.856   0.129   8.256
  629   HG21  VAL  84          1HG2      VAL  84  -7.729   2.847   6.961
  630   HG22  VAL  84          2HG2      VAL  84  -7.116   1.261   6.493
  631   HG23  VAL  84          3HG2      VAL  84  -6.309   2.722   5.923
  632    H    GLU  85           H        GLU  85  -6.646   3.037  11.321
  633    HA   GLU  85           HA       GLU  85  -4.326   4.267  12.454
  634    HB2  GLU  85          2HB       GLU  85  -6.412   3.693  13.721
  635    HB3  GLU  85          1HB       GLU  85  -5.959   1.991  13.617
  636    HG2  GLU  85          2HG       GLU  85  -3.811   2.528  14.764
  637    HG3  GLU  85          1HG       GLU  85  -4.356   4.196  14.947
  638    H    ALA  86           H        ALA  86  -4.976   0.960  11.360
  639    HA   ALA  86           HA       ALA  86  -2.071   0.467  11.260
  640    HB1  ALA  86          1HB       ALA  86  -3.563  -0.404  13.483
  641    HB2  ALA  86          2HB       ALA  86  -1.942  -0.927  13.026
  642    HB3  ALA  86          3HB       ALA  86  -3.350  -1.835  12.474
  643    H    LYS  87           H        LYS  87  -1.557  -1.334   9.869
  644    HA   LYS  87           HA       LYS  87  -3.295  -1.694   7.653
  645    HB2  LYS  87          2HB       LYS  87  -0.826  -2.120   7.635
  646    HB3  LYS  87          1HB       LYS  87  -1.109  -3.585   8.574
  647    HG2  LYS  87          2HG       LYS  87  -2.594  -4.432   6.772
  648    HG3  LYS  87          1HG       LYS  87  -2.242  -2.987   5.825
  649    HD2  LYS  87          2HD       LYS  87   0.196  -3.587   5.936
  650    HD3  LYS  87          1HD       LYS  87  -0.263  -5.105   6.709
  651    HE2  LYS  87          2HE       LYS  87  -1.484  -4.274   4.081
  652    HE3  LYS  87          1HE       LYS  87   0.066  -5.115   4.137
  653    HZ1  LYS  87          1HZ       LYS  87  -0.902  -7.028   4.724
  654    HZ2  LYS  87          2HZ       LYS  87  -2.327  -6.329   4.117
  655    HZ3  LYS  87          3HZ       LYS  87  -1.997  -6.284   5.783
  656    H    LEU  88           H        LEU  88  -2.838  -3.634  10.587
  657    HA   LEU  88           HA       LEU  88  -4.891  -5.558   9.649
  658    HB2  LEU  88          2HB       LEU  88  -3.297  -5.547  12.230
  659    HB3  LEU  88          1HB       LEU  88  -4.272  -6.876  11.604
  660    HG   LEU  88           HG       LEU  88  -1.791  -5.706  10.313
  661   HD11  LEU  88          1HD1      LEU  88  -1.722  -8.536  10.776
  662   HD12  LEU  88          2HD1      LEU  88  -2.174  -7.732  12.279
  663   HD13  LEU  88          3HD1      LEU  88  -0.677  -7.290  11.459
  664   HD21  LEU  88          1HD2      LEU  88  -3.905  -7.614   9.364
  665   HD22  LEU  88          2HD2      LEU  88  -2.236  -7.871   8.853
  666   HD23  LEU  88          3HD2      LEU  88  -3.054  -6.357   8.466
  667    H    GLN  89           H        GLN  89  -6.917  -5.734  10.627
  668    HA   GLN  89           HA       GLN  89  -7.796  -3.386  12.165
  669    HB2  GLN  89          2HB       GLN  89  -9.375  -5.831  11.311
  670    HB3  GLN  89          1HB       GLN  89 -10.038  -4.300  11.882
  671    HG2  GLN  89          2HG       GLN  89  -8.380  -4.687   9.371
  672    HG3  GLN  89          1HG       GLN  89 -10.121  -4.403   9.425
  673   HE21  GLN  89          1HE2      GLN  89  -7.453  -2.755   8.645
  674   HE22  GLN  89          2HE2      GLN  89  -7.831  -1.213   9.245
  675    H1   PN7 101          3HO       SAT 101   3.504  -9.800 -12.220
  676    H2   PN7 101          1H1       SAT 101   5.369  -8.085  -8.297
  677    H3   PN7 101          2H1       SAT 101   3.630  -8.367  -8.228
  678    H5   PN7 101          1HE1      SAT 101   5.827  -8.827 -11.240
  679    H6   PN7 101          2HE1      SAT 101   6.459  -7.438 -10.355
  680    H7   PN7 101          3HE1      SAT 101   5.546  -7.194 -11.844
  681    H8   PN7 101          2HE2      SAT 101   4.299  -5.650 -10.700
  682    H9   PN7 101          3HE2      SAT 101   4.545  -5.936  -8.979
  683    H10  PN7 101          1HE2      SAT 101   2.947  -6.158  -9.690
  684    H11  PN7 101          3H        SAT 101   2.296  -8.335 -10.362
  685    H12  PN7 101          5H        SAT 101   1.934  -5.891 -12.230
  686    H13  PN7 101          1H6       SAT 101   0.278  -8.115 -11.824
  687    H14  PN7 101          2H6       SAT 101  -0.138  -6.776 -12.896
  688    H15  PN7 101          1H7       SAT 101   1.562  -8.034 -14.523
  689    H16  PN7 101          2H7       SAT 101  -0.136  -8.505 -14.433
  690    H17  PN7 101          9H        SAT 101   3.064 -10.449 -13.766
  691    H18  PN7 101          1H10      SAT 101   2.462 -12.009 -15.477
  692    H19  PN7 101          2H10      SAT 101   0.776 -11.532 -15.286
  693    H20  PN7 101          1H11      SAT 101   2.953  -9.897 -16.628
  694    H21  PN7 101          2H11      SAT 101   1.289  -9.363 -16.389
  695    H22  PN7 101          2HS1      SAT 101   1.102 -11.948 -17.809
  Start of MODEL   18
    1    H1   MET   1          1HT       MET   1   1.354  13.752   1.901
    2    H2   MET   1          2HT       MET   1   1.277  15.448   1.929
    3    H3   MET   1          3HT       MET   1   2.026  14.650   0.629
    4    HA   MET   1           HA       MET   1  -0.201  15.482   0.056
    5    HB2  MET   1          2HB       MET   1  -0.003  12.456   0.172
    6    HB3  MET   1          1HB       MET   1  -0.963  13.402  -0.965
    7    HG2  MET   1          2HG       MET   1   2.061  13.403  -0.738
    8    HG3  MET   1          1HG       MET   1   1.113  12.691  -2.043
    9    HE1  MET   1          1HE       MET   1  -1.258  15.168  -2.400
   10    HE2  MET   1          2HE       MET   1  -0.567  13.811  -3.285
   11    HE3  MET   1          3HE       MET   1  -0.441  15.439  -3.945
   12    H    GLN   2           H        GLN   2  -2.145  13.108   0.422
   13    HA   GLN   2           HA       GLN   2  -3.344  14.169   2.929
   14    HB2  GLN   2          2HB       GLN   2  -4.709  14.137   0.826
   15    HB3  GLN   2          1HB       GLN   2  -4.581  12.378   0.816
   16    HG2  GLN   2          2HG       GLN   2  -6.669  12.886   1.869
   17    HG3  GLN   2          1HG       GLN   2  -5.568  12.419   3.166
   18   HE21  GLN   2          1HE2      GLN   2  -5.558  13.845   4.903
   19   HE22  GLN   2          2HE2      GLN   2  -5.957  15.493   4.818
   20    H    HIS   3           H        HIS   3  -3.029  12.976   4.746
   21    HA   HIS   3           HA       HIS   3  -2.446  11.132   6.093
   22    HB2  HIS   3          2HB       HIS   3  -4.262   9.715   4.118
   23    HB3  HIS   3          1HB       HIS   3  -3.877   9.181   5.754
   24    HD1  HIS   3          1HD       HIS   3  -6.813   9.752   5.006
   25    HD2  HIS   3          2HD       HIS   3  -4.270  12.599   6.688
   26    HE1  HIS   3          1HE       HIS   3  -8.301  11.487   6.101
   27    HE2  HIS   3          2HE       HIS   3  -6.763  13.224   7.128
   28    H    ALA   4           H        ALA   4  -0.730  11.688   3.739
   29    HA   ALA   4           HA       ALA   4   0.016   9.282   2.404
   30    HB1  ALA   4          1HB       ALA   4   2.204  11.170   3.020
   31    HB2  ALA   4          2HB       ALA   4   0.797  11.897   2.243
   32    HB3  ALA   4          3HB       ALA   4   1.646  10.563   1.460
   33    H    SER   5           H        SER   5   0.995  10.642   5.524
   34    HA   SER   5           HA       SER   5   3.181   8.901   6.040
   35    HB2  SER   5          2HB       SER   5   1.219  10.017   8.061
   36    HB3  SER   5          1HB       SER   5   2.853   9.450   8.394
   37    HG   SER   5           HG       SER   5   2.374  11.832   7.985
   38    H    VAL   6           H        VAL   6  -0.303   8.461   6.550
   39    HA   VAL   6           HA       VAL   6  -0.099   5.986   7.977
   40    HB   VAL   6           HB       VAL   6  -2.291   7.087   6.214
   41   HG11  VAL   6          1HG1      VAL   6  -3.011   4.920   6.237
   42   HG12  VAL   6          2HG1      VAL   6  -3.509   5.312   7.882
   43   HG13  VAL   6          3HG1      VAL   6  -1.975   4.490   7.598
   44   HG21  VAL   6          1HG2      VAL   6  -1.995   8.451   8.159
   45   HG22  VAL   6          2HG2      VAL   6  -1.775   7.041   9.195
   46   HG23  VAL   6          3HG2      VAL   6  -3.363   7.395   8.514
   47    H    ILE   7           H        ILE   7  -0.335   6.748   4.528
   48    HA   ILE   7           HA       ILE   7  -0.567   4.091   3.558
   49    HB   ILE   7           HB       ILE   7   0.817   6.473   2.293
   50   HG12  ILE   7          2HG1      ILE   7  -2.012   5.427   1.947
   51   HG13  ILE   7          1HG1      ILE   7  -1.584   6.794   2.977
   52   HG21  ILE   7          1HG2      ILE   7   1.431   4.366   1.195
   53   HG22  ILE   7          2HG2      ILE   7   0.323   5.274   0.167
   54   HG23  ILE   7          3HG2      ILE   7  -0.268   3.899   1.100
   55   HD11  ILE   7          1HD1      ILE   7  -1.575   8.167   1.200
   56   HD12  ILE   7          2HD1      ILE   7  -2.098   6.823   0.186
   57   HD13  ILE   7          3HD1      ILE   7  -0.378   7.154   0.395
   58    H    ALA   8           H        ALA   8   2.331   6.038   4.272
   59    HA   ALA   8           HA       ALA   8   4.229   4.077   3.404
   60    HB1  ALA   8          1HB       ALA   8   4.275   6.541   5.038
   61    HB2  ALA   8          2HB       ALA   8   5.383   6.010   3.774
   62    HB3  ALA   8          3HB       ALA   8   5.548   5.378   5.411
   63    H    GLN   9           H        GLN   9   2.861   4.766   6.618
   64    HA   GLN   9           HA       GLN   9   4.216   2.561   7.885
   65    HB2  GLN   9          2HB       GLN   9   3.302   3.351   9.809
   66    HB3  GLN   9          1HB       GLN   9   2.891   4.746   8.818
   67    HG2  GLN   9          2HG       GLN   9   0.864   4.170   9.882
   68    HG3  GLN   9          1HG       GLN   9   0.713   3.486   8.270
   69   HE21  GLN   9          1HE2      GLN   9  -0.594   1.653   8.772
   70   HE22  GLN   9          2HE2      GLN   9  -0.095   0.414   9.821
   71    H    PHE  10           H        PHE  10   1.126   2.916   6.249
   72    HA   PHE  10           HA       PHE  10  -0.114   0.516   7.121
   73    HB2  PHE  10          2HB       PHE  10  -1.180   2.360   5.778
   74    HB3  PHE  10          1HB       PHE  10  -0.309   1.766   4.368
   75    HD1  PHE  10          1HD       PHE  10  -3.016   1.104   6.760
   76    HD2  PHE  10          2HD       PHE  10  -0.884  -0.386   3.342
   77    HE1  PHE  10          1HE       PHE  10  -4.817  -0.552   6.359
   78    HE2  PHE  10          2HE       PHE  10  -2.685  -2.046   2.943
   79    HZ   PHE  10           HZ       PHE  10  -4.651  -2.123   4.451
   80    H    VAL  11           H        VAL  11   1.834   1.051   4.160
   81    HA   VAL  11           HA       VAL  11   1.895  -1.783   3.551
   82    HB   VAL  11           HB       VAL  11   3.523  -1.122   1.811
   83   HG11  VAL  11          1HG1      VAL  11   2.019   0.317   0.544
   84   HG12  VAL  11          2HG1      VAL  11   1.207   0.820   2.027
   85   HG13  VAL  11          3HG1      VAL  11   1.064  -0.847   1.465
   86   HG21  VAL  11          1HG2      VAL  11   3.612   1.593   1.775
   87   HG22  VAL  11          2HG2      VAL  11   4.876   0.592   2.487
   88   HG23  VAL  11          3HG2      VAL  11   3.629   1.301   3.513
   89    H    VAL  12           H        VAL  12   4.171   0.502   5.040
   90    HA   VAL  12           HA       VAL  12   6.364  -1.317   5.248
   91    HB   VAL  12           HB       VAL  12   5.674   1.052   6.988
   92   HG11  VAL  12          1HG1      VAL  12   7.344  -0.450   8.012
   93   HG12  VAL  12          2HG1      VAL  12   8.083   1.069   7.511
   94   HG13  VAL  12          3HG1      VAL  12   8.304  -0.385   6.537
   95   HG21  VAL  12          1HG2      VAL  12   7.747   1.102   4.840
   96   HG22  VAL  12          2HG2      VAL  12   6.714   2.404   5.430
   97   HG23  VAL  12          3HG2      VAL  12   6.056   1.178   4.348
   98    H    GLU  13           H        GLU  13   3.618  -0.691   7.397
   99    HA   GLU  13           HA       GLU  13   4.536  -2.067   9.684
  100    HB2  GLU  13          2HB       GLU  13   2.436  -0.738   9.594
  101    HB3  GLU  13          1HB       GLU  13   1.704  -2.020   8.637
  102    HG2  GLU  13          2HG       GLU  13   2.158  -3.623  10.484
  103    HG3  GLU  13          1HG       GLU  13   2.781  -2.285  11.445
  104    H    GLU  14           H        GLU  14   3.160  -3.314   6.691
  105    HA   GLU  14           HA       GLU  14   2.757  -6.000   7.613
  106    HB2  GLU  14          2HB       GLU  14   1.785  -5.081   5.510
  107    HB3  GLU  14          1HB       GLU  14   3.398  -5.074   4.800
  108    HG2  GLU  14          2HG       GLU  14   3.562  -7.520   5.221
  109    HG3  GLU  14          1HG       GLU  14   1.908  -7.501   5.831
  110    H    PHE  15           H        PHE  15   5.586  -4.296   6.378
  111    HA   PHE  15           HA       PHE  15   7.217  -6.682   7.113
  112    HB2  PHE  15          2HB       PHE  15   8.666  -6.047   5.054
  113    HB3  PHE  15          1HB       PHE  15   7.169  -6.937   4.770
  114    HD1  PHE  15          1HD       PHE  15   5.243  -5.881   3.753
  115    HD2  PHE  15          2HD       PHE  15   8.815  -3.635   4.549
  116    HE1  PHE  15          1HE       PHE  15   4.395  -4.031   2.339
  117    HE2  PHE  15          2HE       PHE  15   7.969  -1.786   3.131
  118    HZ   PHE  15           HZ       PHE  15   5.759  -1.984   2.025
  119    H    LEU  16           H        LEU  16   6.909  -4.422   8.747
  120    HA   LEU  16           HA       LEU  16   9.072  -2.559   8.200
  121    HB2  LEU  16          2HB       LEU  16   8.233  -1.292   9.902
  122    HB3  LEU  16          1HB       LEU  16   6.812  -2.275   9.614
  123    HG   LEU  16           HG       LEU  16   8.925  -2.795  11.735
  124   HD11  LEU  16          1HD1      LEU  16   7.742  -1.218  12.830
  125   HD12  LEU  16          2HD1      LEU  16   6.487  -2.450  12.962
  126   HD13  LEU  16          3HD1      LEU  16   6.426  -1.266  11.656
  127   HD21  LEU  16          1HD2      LEU  16   6.338  -4.166  11.935
  128   HD22  LEU  16          2HD2      LEU  16   7.964  -4.822  12.111
  129   HD23  LEU  16          3HD2      LEU  16   7.252  -4.652  10.512
  130    HA   PRO  17           HA       PRO  17  12.135  -5.106  10.246
  131    HB2  PRO  17          2HB       PRO  17  14.207  -3.353  10.228
  132    HB3  PRO  17          1HB       PRO  17  13.626  -4.120   8.741
  133    HG2  PRO  17          2HG       PRO  17  13.080  -1.386   9.792
  134    HG3  PRO  17          1HG       PRO  17  13.439  -1.906   8.138
  135    HD2  PRO  17          2HD       PRO  17  10.897  -1.387   9.043
  136    HD3  PRO  17          1HD       PRO  17  11.266  -2.513   7.718
  137    H    ASP  18           H        ASP  18  14.133  -3.706  11.931
  138    HA   ASP  18           HA       ASP  18  12.526  -3.481  14.356
  139    HB2  ASP  18          2HB       ASP  18  14.681  -3.190  15.478
  140    HB3  ASP  18          1HB       ASP  18  14.785  -4.535  14.347
  141    H    VAL  19           H        VAL  19  12.691  -1.459  11.925
  142    HA   VAL  19           HA       VAL  19  13.080   0.997  13.594
  143    HB   VAL  19           HB       VAL  19  13.129   0.758  10.572
  144   HG11  VAL  19          1HG1      VAL  19  13.085   2.969  12.440
  145   HG12  VAL  19          2HG1      VAL  19  13.027   3.005  10.678
  146   HG13  VAL  19          3HG1      VAL  19  14.582   2.986  11.509
  147   HG21  VAL  19          1HG2      VAL  19  15.659   1.223  11.058
  148   HG22  VAL  19          2HG2      VAL  19  15.052  -0.424  11.233
  149   HG23  VAL  19          3HG2      VAL  19  15.297   0.582  12.661
  150    H    ALA  20           H        ALA  20  11.346   2.394  13.795
  151    HA   ALA  20           HA       ALA  20   8.729   1.476  12.985
  152    HB1  ALA  20          1HB       ALA  20   9.814   3.493  14.712
  153    HB2  ALA  20          2HB       ALA  20   8.164   2.871  14.658
  154    HB3  ALA  20          3HB       ALA  20   8.624   4.238  13.644
  155    HA   PRO  21           HA       PRO  21   8.639   3.046   8.788
  156    HB2  PRO  21          2HB       PRO  21   5.907   4.027   9.456
  157    HB3  PRO  21          1HB       PRO  21   6.442   3.003   8.112
  158    HG2  PRO  21          2HG       PRO  21   5.123   2.036  10.248
  159    HG3  PRO  21          1HG       PRO  21   6.309   1.094   9.334
  160    HD2  PRO  21          2HD       PRO  21   6.537   2.241  12.050
  161    HD3  PRO  21          1HD       PRO  21   7.434   0.903  11.299
  162    H    ALA  22           H        ALA  22   7.550   5.068  11.472
  163    HA   ALA  22           HA       ALA  22   7.606   7.573  10.066
  164    HB1  ALA  22          1HB       ALA  22   6.530   7.890  12.062
  165    HB2  ALA  22          2HB       ALA  22   8.152   8.301  12.620
  166    HB3  ALA  22          3HB       ALA  22   7.509   6.682  12.897
  167    H    ASP  23           H        ASP  23  10.074   5.569  11.494
  168    HA   ASP  23           HA       ASP  23  12.092   7.727  11.120
  169    HB2  ASP  23          2HB       ASP  23  12.224   5.081  12.595
  170    HB3  ASP  23          1HB       ASP  23  13.594   6.176  12.406
  171    H    VAL  24           H        VAL  24  10.717   5.416   9.313
  172    HA   VAL  24           HA       VAL  24  13.249   4.441   8.097
  173    HB   VAL  24           HB       VAL  24  10.983   3.063   8.648
  174   HG11  VAL  24          1HG1      VAL  24   9.595   2.817   6.723
  175   HG12  VAL  24          2HG1      VAL  24  10.705   3.738   5.711
  176   HG13  VAL  24          3HG1      VAL  24   9.767   4.554   6.960
  177   HG21  VAL  24          1HG2      VAL  24  12.803   2.658   6.253
  178   HG22  VAL  24          2HG2      VAL  24  11.782   1.413   6.972
  179   HG23  VAL  24          3HG2      VAL  24  13.115   2.102   7.897
  180    H    ASP  25           H        ASP  25  13.769   4.964   5.941
  181    HA   ASP  25           HA       ASP  25  12.694   7.472   4.979
  182    HB2  ASP  25          2HB       ASP  25  15.053   6.679   4.596
  183    HB3  ASP  25          1HB       ASP  25  14.413   5.483   3.469
  184    H    VAL  26           H        VAL  26  10.485   7.215   4.535
  185    HA   VAL  26           HA       VAL  26   9.344   5.022   3.099
  186    HB   VAL  26           HB       VAL  26   7.400   6.469   2.792
  187   HG11  VAL  26          1HG1      VAL  26   7.057   7.158   5.143
  188   HG12  VAL  26          2HG1      VAL  26   8.783   6.971   5.446
  189   HG13  VAL  26          3HG1      VAL  26   7.800   5.562   5.049
  190   HG21  VAL  26          1HG2      VAL  26   7.852   8.618   2.240
  191   HG22  VAL  26          2HG2      VAL  26   9.469   8.535   2.939
  192   HG23  VAL  26          3HG2      VAL  26   8.082   8.895   3.967
  193    H    ASP  27           H        ASP  27  11.690   6.945   1.979
  194    HA   ASP  27           HA       ASP  27  10.564   7.427  -0.711
  195    HB2  ASP  27          2HB       ASP  27  13.299   7.991   0.476
  196    HB3  ASP  27          1HB       ASP  27  12.824   8.406  -1.171
  197    H    LEU  28           H        LEU  28  11.417   4.734   0.720
  198    HA   LEU  28           HA       LEU  28  13.399   3.696  -1.184
  199    HB2  LEU  28          2HB       LEU  28  13.322   2.962   1.210
  200    HB3  LEU  28          1HB       LEU  28  11.764   2.208   0.886
  201    HG   LEU  28           HG       LEU  28  12.880   0.877  -0.948
  202   HD11  LEU  28          1HD1      LEU  28  15.534   0.881  -0.078
  203   HD12  LEU  28          2HD1      LEU  28  15.102   2.589  -0.138
  204   HD13  LEU  28          3HD1      LEU  28  14.930   1.585  -1.577
  205   HD21  LEU  28          1HD2      LEU  28  14.177  -0.582   0.733
  206   HD22  LEU  28          2HD2      LEU  28  12.477  -0.277   1.091
  207   HD23  LEU  28          3HD2      LEU  28  13.733   0.623   1.941
  208    H    ASP  29           H        ASP  29  12.930   2.551  -3.005
  209    HA   ASP  29           HA       ASP  29  10.258   2.540  -4.035
  210    HB2  ASP  29          2HB       ASP  29  12.717   0.979  -4.882
  211    HB3  ASP  29          1HB       ASP  29  11.215   1.041  -5.805
  212    H    LEU  30           H        LEU  30   8.637   1.182  -3.476
  213    HA   LEU  30           HA       LEU  30   9.025  -0.989  -1.654
  214    HB2  LEU  30          2HB       LEU  30   6.672  -0.499  -3.509
  215    HB3  LEU  30          1HB       LEU  30   6.665  -1.524  -2.074
  216    HG   LEU  30           HG       LEU  30   7.123   1.473  -2.132
  217   HD11  LEU  30          1HD1      LEU  30   4.996   0.635  -0.428
  218   HD12  LEU  30          2HD1      LEU  30   4.767  -0.156  -1.986
  219   HD13  LEU  30          3HD1      LEU  30   4.887   1.601  -1.899
  220   HD21  LEU  30          1HD2      LEU  30   7.462  -0.629  -0.021
  221   HD22  LEU  30          2HD2      LEU  30   6.839   0.949   0.460
  222   HD23  LEU  30          3HD2      LEU  30   8.418   0.824  -0.314
  223    H    VAL  31           H        VAL  31   9.760  -0.799  -4.927
  224    HA   VAL  31           HA       VAL  31   8.924  -3.236  -6.025
  225    HB   VAL  31           HB       VAL  31  11.609  -1.858  -6.327
  226   HG11  VAL  31          1HG1      VAL  31  12.050  -3.985  -7.170
  227   HG12  VAL  31          2HG1      VAL  31  11.427  -3.169  -8.605
  228   HG13  VAL  31          3HG1      VAL  31  10.380  -4.242  -7.675
  229   HG21  VAL  31          1HG2      VAL  31  10.302  -0.338  -7.378
  230   HG22  VAL  31          2HG2      VAL  31   8.912  -1.421  -7.404
  231   HG23  VAL  31          3HG2      VAL  31  10.149  -1.545  -8.654
  232    H    ASP  32           H        ASP  32  11.747  -2.618  -3.950
  233    HA   ASP  32           HA       ASP  32  12.759  -5.276  -3.899
  234    HB2  ASP  32          2HB       ASP  32  12.741  -3.149  -1.730
  235    HB3  ASP  32          1HB       ASP  32  13.674  -4.643  -1.639
  236    H    ASN  33           H        ASN  33  10.156  -3.689  -2.169
  237    HA   ASN  33           HA       ASN  33   9.527  -6.079  -0.581
  238    HB2  ASN  33          2HB       ASN  33   8.052  -3.453  -0.882
  239    HB3  ASN  33          1HB       ASN  33   7.679  -4.704   0.301
  240   HD21  ASN  33          1HD2      ASN  33  10.999  -4.747  -0.076
  241   HD22  ASN  33          2HD2      ASN  33  11.432  -3.705   1.192
  242    H    GLY  34           H        GLY  34   9.347  -5.685  -3.675
  243    HA2  GLY  34          2HA       GLY  34   6.797  -5.699  -4.700
  244    HA3  GLY  34          1HA       GLY  34   8.042  -6.796  -5.300
  245    H    VAL  35           H        VAL  35   8.026  -7.923  -2.382
  246    HA   VAL  35           HA       VAL  35   6.516 -10.247  -2.867
  247    HB   VAL  35           HB       VAL  35   7.216  -8.864  -0.260
  248   HG11  VAL  35          1HG1      VAL  35   5.346 -10.215   0.301
  249   HG12  VAL  35          2HG1      VAL  35   6.749 -11.210   0.692
  250   HG13  VAL  35          3HG1      VAL  35   5.847 -11.503  -0.796
  251   HG21  VAL  35          1HG2      VAL  35   8.852 -10.097  -2.046
  252   HG22  VAL  35          2HG2      VAL  35   8.368 -11.480  -1.064
  253   HG23  VAL  35          3HG2      VAL  35   9.149 -10.091  -0.307
  254    H    ILE  36           H        ILE  36   5.558  -7.154  -1.449
  255    HA   ILE  36           HA       ILE  36   2.883  -7.963  -0.731
  256    HB   ILE  36           HB       ILE  36   4.288  -5.873   0.002
  257   HG12  ILE  36          2HG1      ILE  36   1.330  -5.720  -0.657
  258   HG13  ILE  36          1HG1      ILE  36   2.032  -6.372   0.821
  259   HG21  ILE  36          1HG2      ILE  36   4.049  -3.926  -1.305
  260   HG22  ILE  36          2HG2      ILE  36   2.721  -4.614  -2.243
  261   HG23  ILE  36          3HG2      ILE  36   4.372  -5.180  -2.504
  262   HD11  ILE  36          1HD1      ILE  36   2.003  -4.308   1.718
  263   HD12  ILE  36          2HD1      ILE  36   1.388  -3.641   0.207
  264   HD13  ILE  36          3HD1      ILE  36   3.126  -3.774   0.470
  265    H    ASP  37           H        ASP  37   4.371  -6.860  -3.682
  266    HA   ASP  37           HA       ASP  37   2.103  -5.831  -5.022
  267    HB2  ASP  37          2HB       ASP  37   4.503  -7.292  -6.148
  268    HB3  ASP  37          1HB       ASP  37   3.325  -6.414  -7.122
  269    H    SER  38           H        SER  38   3.153  -9.203  -4.641
  270    HA   SER  38           HA       SER  38   0.792 -10.016  -6.261
  271    HB2  SER  38          2HB       SER  38   3.484 -11.035  -5.997
  272    HB3  SER  38          1HB       SER  38   2.307 -12.295  -5.645
  273    H    LEU  39           H        LEU  39   2.492 -11.371  -3.409
  274    HA   LEU  39           HA       LEU  39   0.136 -12.765  -2.547
  275    HB2  LEU  39          2HB       LEU  39   2.775 -12.155  -1.258
  276    HB3  LEU  39          1HB       LEU  39   1.498 -12.960  -0.354
  277    HG   LEU  39           HG       LEU  39   3.167 -14.495  -1.528
  278   HD11  LEU  39          1HD1      LEU  39   0.788 -15.434  -2.799
  279   HD12  LEU  39          2HD1      LEU  39   0.319 -14.655  -1.289
  280   HD13  LEU  39          3HD1      LEU  39   1.492 -15.972  -1.273
  281   HD21  LEU  39          1HD2      LEU  39   3.188 -13.036  -3.619
  282   HD22  LEU  39          2HD2      LEU  39   1.606 -13.713  -4.000
  283   HD23  LEU  39          3HD2      LEU  39   3.015 -14.767  -3.901
  284    H    GLY  40           H        GLY  40   1.743  -9.885  -1.182
  285    HA2  GLY  40          2HA       GLY  40  -0.323  -9.441   0.772
  286    HA3  GLY  40          1HA       GLY  40   0.899  -8.269   0.296
  287    H    LEU  41           H        LEU  41   0.220  -8.231  -2.505
  288    HA   LEU  41           HA       LEU  41  -1.735  -6.183  -2.530
  289    HB2  LEU  41          2HB       LEU  41  -0.070  -6.639  -4.348
  290    HB3  LEU  41          1HB       LEU  41  -1.029  -8.041  -4.818
  291    HG   LEU  41           HG       LEU  41  -2.991  -6.246  -4.863
  292   HD11  LEU  41          1HD1      LEU  41  -0.604  -4.561  -5.626
  293   HD12  LEU  41          2HD1      LEU  41  -1.329  -4.491  -4.019
  294   HD13  LEU  41          3HD1      LEU  41  -2.280  -4.046  -5.435
  295   HD21  LEU  41          1HD2      LEU  41  -0.870  -6.465  -7.024
  296   HD22  LEU  41          2HD2      LEU  41  -2.535  -5.937  -7.268
  297   HD23  LEU  41          3HD2      LEU  41  -2.198  -7.598  -6.781
  298    H    LEU  42           H        LEU  42  -2.066  -9.633  -3.375
  299    HA   LEU  42           HA       LEU  42  -4.848  -9.499  -3.992
  300    HB2  LEU  42          2HB       LEU  42  -3.177 -11.788  -2.931
  301    HB3  LEU  42          1HB       LEU  42  -4.825 -11.967  -3.509
  302    HG   LEU  42           HG       LEU  42  -2.526 -10.866  -5.145
  303   HD11  LEU  42          1HD1      LEU  42  -3.516 -13.594  -4.635
  304   HD12  LEU  42          2HD1      LEU  42  -1.969 -13.066  -5.297
  305   HD13  LEU  42          3HD1      LEU  42  -3.383 -13.187  -6.346
  306   HD21  LEU  42          1HD2      LEU  42  -4.310  -9.988  -6.260
  307   HD22  LEU  42          2HD2      LEU  42  -5.451 -11.101  -5.507
  308   HD23  LEU  42          3HD2      LEU  42  -4.479 -11.630  -6.880
  309    H    LYS  43           H        LYS  43  -3.169 -10.151  -0.918
  310    HA   LYS  43           HA       LYS  43  -5.530 -10.662   0.599
  311    HB2  LYS  43          2HB       LYS  43  -2.854  -9.536   1.441
  312    HB3  LYS  43          1HB       LYS  43  -4.099 -10.083   2.558
  313    HG2  LYS  43          2HG       LYS  43  -4.026 -12.332   1.476
  314    HG3  LYS  43          1HG       LYS  43  -2.690 -11.769   0.472
  315    HD2  LYS  43          2HD       LYS  43  -1.405 -11.247   2.553
  316    HD3  LYS  43          1HD       LYS  43  -2.716 -11.958   3.498
  317    HE2  LYS  43          2HE       LYS  43  -1.315 -13.479   1.292
  318    HE3  LYS  43          1HE       LYS  43  -0.744 -13.504   2.961
  319    HZ1  LYS  43          1HZ       LYS  43  -2.255 -15.349   2.438
  320    HZ2  LYS  43          2HZ       LYS  43  -3.492 -14.233   2.104
  321    HZ3  LYS  43          3HZ       LYS  43  -2.855 -14.355   3.675
  322    H    VAL  44           H        VAL  44  -3.778  -7.670  -0.158
  323    HA   VAL  44           HA       VAL  44  -5.409  -5.984   1.524
  324    HB   VAL  44           HB       VAL  44  -3.672  -5.351  -0.873
  325   HG11  VAL  44          1HG1      VAL  44  -5.108  -3.554   1.098
  326   HG12  VAL  44          2HG1      VAL  44  -5.287  -3.576  -0.657
  327   HG13  VAL  44          3HG1      VAL  44  -3.785  -3.003   0.070
  328   HG21  VAL  44          1HG2      VAL  44  -2.946  -6.214   1.624
  329   HG22  VAL  44          2HG2      VAL  44  -2.957  -4.465   1.855
  330   HG23  VAL  44          3HG2      VAL  44  -1.943  -5.183   0.603
  331    H    ILE  45           H        ILE  45  -5.458  -6.569  -2.012
  332    HA   ILE  45           HA       ILE  45  -7.710  -4.904  -2.512
  333    HB   ILE  45           HB       ILE  45  -6.793  -7.383  -3.999
  334   HG12  ILE  45          2HG1      ILE  45  -5.010  -5.726  -3.918
  335   HG13  ILE  45          1HG1      ILE  45  -5.726  -5.692  -5.524
  336   HG21  ILE  45          1HG2      ILE  45  -8.619  -7.074  -5.254
  337   HG22  ILE  45          2HG2      ILE  45  -7.992  -5.491  -5.711
  338   HG23  ILE  45          3HG2      ILE  45  -9.063  -5.647  -4.320
  339   HD11  ILE  45          1HD1      ILE  45  -7.263  -3.828  -4.473
  340   HD12  ILE  45          2HD1      ILE  45  -5.635  -3.425  -5.016
  341   HD13  ILE  45          3HD1      ILE  45  -5.950  -3.692  -3.303
  342    H    ALA  46           H        ALA  46  -7.502  -8.358  -1.672
  343    HA   ALA  46           HA       ALA  46 -10.316  -8.863  -1.979
  344    HB1  ALA  46          1HB       ALA  46  -8.047 -10.227  -0.564
  345    HB2  ALA  46          2HB       ALA  46  -9.043 -10.815  -1.896
  346    HB3  ALA  46          3HB       ALA  46  -9.701 -10.761  -0.261
  347    H    TRP  47           H        TRP  47  -8.341  -8.034   0.885
  348    HA   TRP  47           HA       TRP  47 -10.680  -7.937   2.619
  349    HB2  TRP  47          2HB       TRP  47  -8.855  -8.392   3.922
  350    HB3  TRP  47          1HB       TRP  47  -7.766  -7.448   2.905
  351    HD1  TRP  47           HD       TRP  47 -10.984  -6.336   4.758
  352    HE1  TRP  47          1HE       TRP  47 -10.377  -4.304   6.228
  353    HE3  TRP  47          3HE       TRP  47  -5.993  -6.089   3.860
  354    HZ2  TRP  47          2HZ       TRP  47  -8.053  -2.776   6.935
  355    HZ3  TRP  47          3HZ       TRP  47  -4.587  -4.350   4.937
  356    HH2  TRP  47           HH       TRP  47  -5.614  -2.691   6.472
  357    H    LEU  48           H        LEU  48  -8.525  -5.517   1.157
  358    HA   LEU  48           HA       LEU  48  -9.768  -3.210   2.196
  359    HB2  LEU  48          2HB       LEU  48  -7.618  -3.275   0.894
  360    HB3  LEU  48          1HB       LEU  48  -8.566  -3.503  -0.565
  361    HG   LEU  48           HG       LEU  48  -9.796  -1.388  -0.007
  362   HD11  LEU  48          1HD1      LEU  48  -9.501  -0.945   2.240
  363   HD12  LEU  48          2HD1      LEU  48  -8.229   0.072   1.568
  364   HD13  LEU  48          3HD1      LEU  48  -7.833  -1.508   2.239
  365   HD21  LEU  48          1HD2      LEU  48  -7.146  -1.769  -1.042
  366   HD22  LEU  48          2HD2      LEU  48  -7.208  -0.223  -0.195
  367   HD23  LEU  48          3HD2      LEU  48  -8.337  -0.555  -1.508
  368    H    GLU  49           H        GLU  49 -10.584  -5.165  -0.662
  369    HA   GLU  49           HA       GLU  49 -12.610  -3.441  -1.700
  370    HB2  GLU  49          2HB       GLU  49 -12.006  -5.141  -3.171
  371    HB3  GLU  49          1HB       GLU  49 -12.053  -6.380  -1.921
  372    HG2  GLU  49          2HG       GLU  49 -14.575  -4.919  -2.614
  373    HG3  GLU  49          1HG       GLU  49 -14.008  -6.194  -3.682
  374    H    ASP  50           H        ASP  50 -12.776  -6.086   0.683
  375    HA   ASP  50           HA       ASP  50 -15.615  -5.970   1.028
  376    HB2  ASP  50          2HB       ASP  50 -14.099  -7.815   1.836
  377    HB3  ASP  50          1HB       ASP  50 -13.573  -6.728   3.119
  378    H    ARG  51           H        ARG  51 -12.952  -4.264   2.617
  379    HA   ARG  51           HA       ARG  51 -14.538  -2.985   4.624
  380    HB2  ARG  51          2HB       ARG  51 -12.053  -3.184   4.676
  381    HB3  ARG  51          1HB       ARG  51 -11.963  -1.987   3.383
  382    HG2  ARG  51          2HG       ARG  51 -13.132  -0.351   4.810
  383    HG3  ARG  51          1HG       ARG  51 -13.225  -1.544   6.106
  384    HD2  ARG  51          2HD       ARG  51 -10.737  -1.677   6.117
  385    HD3  ARG  51          1HD       ARG  51 -10.688  -0.407   4.896
  386    HE   ARG  51           HE       ARG  51 -12.219   0.647   6.986
  387   HH11  ARG  51          1HH1      ARG  51 -11.275   1.899   8.615
  388   HH12  ARG  51          2HH1      ARG  51  -9.584   1.729   8.949
  389   HH21  ARG  51          1HH2      ARG  51  -9.075  -0.692   6.519
  390   HH22  ARG  51          2HH2      ARG  51  -8.339   0.262   7.764
  391    H    PHE  52           H        PHE  52 -13.492  -1.794   1.390
  392    HA   PHE  52           HA       PHE  52 -15.397   0.474   1.770
  393    HB2  PHE  52          2HB       PHE  52 -12.869   0.178   0.163
  394    HB3  PHE  52          1HB       PHE  52 -14.028   1.459  -0.179
  395    HD1  PHE  52          1HD       PHE  52 -14.692   3.044   1.699
  396    HD2  PHE  52          2HD       PHE  52 -11.386   0.320   2.006
  397    HE1  PHE  52          1HE       PHE  52 -13.785   4.359   3.596
  398    HE2  PHE  52          2HE       PHE  52 -10.478   1.636   3.902
  399    HZ   PHE  52           HZ       PHE  52 -11.679   3.654   4.698
  400    H    GLY  53           H        GLY  53 -15.254  -2.477   0.254
  401    HA2  GLY  53          2HA       GLY  53 -16.682  -3.406  -1.374
  402    HA3  GLY  53          1HA       GLY  53 -17.547  -1.870  -1.397
  403    H    ILE  54           H        ILE  54 -14.092  -2.356  -2.074
  404    HA   ILE  54           HA       ILE  54 -14.467  -0.956  -4.648
  405    HB   ILE  54           HB       ILE  54 -11.935  -2.009  -3.349
  406   HG12  ILE  54          2HG1      ILE  54 -13.029   0.817  -3.402
  407   HG13  ILE  54          1HG1      ILE  54 -13.227  -0.277  -2.033
  408   HG21  ILE  54          1HG2      ILE  54 -11.620   0.270  -5.076
  409   HG22  ILE  54          2HG2      ILE  54 -12.461  -1.009  -5.952
  410   HG23  ILE  54          3HG2      ILE  54 -10.887  -1.328  -5.221
  411   HD11  ILE  54          1HD1      ILE  54 -11.110   1.422  -2.331
  412   HD12  ILE  54          2HD1      ILE  54 -10.462  -0.053  -3.051
  413   HD13  ILE  54          3HD1      ILE  54 -11.054  -0.068  -1.389
  414    H    ALA  55           H        ALA  55 -14.040  -1.922  -6.682
  415    HA   ALA  55           HA       ALA  55 -14.663  -4.693  -6.933
  416    HB1  ALA  55          1HB       ALA  55 -13.420  -2.707  -8.842
  417    HB2  ALA  55          2HB       ALA  55 -15.080  -3.300  -8.822
  418    HB3  ALA  55          3HB       ALA  55 -13.767  -4.371  -9.310
  419    H    ALA  56           H        ALA  56 -13.399  -6.417  -6.541
  420    HA   ALA  56           HA       ALA  56 -10.558  -6.110  -5.988
  421    HB1  ALA  56          1HB       ALA  56 -12.605  -8.174  -5.665
  422    HB2  ALA  56          2HB       ALA  56 -11.147  -7.882  -4.715
  423    HB3  ALA  56          3HB       ALA  56 -11.059  -8.836  -6.197
  424    H    ASP  57           H        ASP  57 -12.459  -6.847  -8.771
  425    HA   ASP  57           HA       ASP  57 -10.331  -8.273 -10.183
  426    HB2  ASP  57          2HB       ASP  57 -12.975  -7.137 -11.105
  427    HB3  ASP  57          1HB       ASP  57 -11.887  -8.064 -12.137
  428    H    ASP  58           H        ASP  58 -10.333  -5.222  -9.232
  429    HA   ASP  58           HA       ASP  58  -9.843  -3.841 -11.757
  430    HB2  ASP  58          2HB       ASP  58 -10.712  -2.686  -9.716
  431    HB3  ASP  58          1HB       ASP  58  -9.151  -2.964  -8.949
  432    H    VAL  59           H        VAL  59  -8.033  -4.318 -12.896
  433    HA   VAL  59           HA       VAL  59  -5.494  -4.787 -11.379
  434    HB   VAL  59           HB       VAL  59  -4.751  -6.164 -13.245
  435   HG11  VAL  59          1HG1      VAL  59  -7.533  -6.779 -12.222
  436   HG12  VAL  59          2HG1      VAL  59  -5.998  -7.393 -11.609
  437   HG13  VAL  59          3HG1      VAL  59  -6.596  -7.924 -13.181
  438   HG21  VAL  59          1HG2      VAL  59  -7.202  -5.003 -14.509
  439   HG22  VAL  59          2HG2      VAL  59  -6.740  -6.643 -14.964
  440   HG23  VAL  59          3HG2      VAL  59  -5.614  -5.307 -15.214
  441    H    GLU  60           H        GLU  60  -6.887  -2.296 -12.603
  442    HA   GLU  60           HA       GLU  60  -5.435  -1.354 -14.832
  443    HB2  GLU  60          2HB       GLU  60  -7.409  -0.211 -13.805
  444    HB3  GLU  60          1HB       GLU  60  -6.376   0.306 -12.480
  445    HG2  GLU  60          2HG       GLU  60  -4.895   1.436 -14.123
  446    HG3  GLU  60          1HG       GLU  60  -6.026   0.996 -15.398
  447    H    LEU  61           H        LEU  61  -4.471  -1.620 -11.470
  448    HA   LEU  61           HA       LEU  61  -2.150   0.116 -11.758
  449    HB2  LEU  61          2HB       LEU  61  -2.721  -1.984  -9.644
  450    HB3  LEU  61          1HB       LEU  61  -1.542  -0.680  -9.531
  451    HG   LEU  61           HG       LEU  61  -4.538  -0.354  -9.766
  452   HD11  LEU  61          1HD1      LEU  61  -4.581   0.029  -7.508
  453   HD12  LEU  61          2HD1      LEU  61  -2.975   0.759  -7.501
  454   HD13  LEU  61          3HD1      LEU  61  -3.145  -0.996  -7.535
  455   HD21  LEU  61          1HD2      LEU  61  -3.764   1.548 -10.847
  456   HD22  LEU  61          2HD2      LEU  61  -2.231   1.543  -9.973
  457   HD23  LEU  61          3HD2      LEU  61  -3.700   2.099  -9.173
  458    H    SER  62           H        SER  62  -0.034  -0.489 -12.146
  459    HA   SER  62           HA       SER  62   0.434  -3.342 -12.889
  460    HB2  SER  62          2HB       SER  62   2.329  -1.771 -14.225
  461    HB3  SER  62          1HB       SER  62   0.910  -2.532 -14.940
  462    HG   SER  62           HG       SER  62   0.989   0.027 -13.707
  463    HA   PRO  63           HA       PRO  63   3.837  -3.637 -10.111
  464    HB2  PRO  63          2HB       PRO  63   5.975  -4.093 -11.920
  465    HB3  PRO  63          1HB       PRO  63   5.004  -5.321 -11.094
  466    HG2  PRO  63          2HG       PRO  63   4.821  -4.316 -13.857
  467    HG3  PRO  63          1HG       PRO  63   4.357  -5.888 -13.187
  468    HD2  PRO  63          2HD       PRO  63   2.525  -4.015 -13.916
  469    HD3  PRO  63          1HD       PRO  63   2.238  -5.163 -12.593
  470    H    GLU  64           H        GLU  64   4.386  -1.640 -12.970
  471    HA   GLU  64           HA       GLU  64   6.607  -0.146 -11.920
  472    HB2  GLU  64          2HB       GLU  64   4.540   0.587 -14.000
  473    HB3  GLU  64          1HB       GLU  64   6.000   1.513 -13.682
  474    HG2  GLU  64          2HG       GLU  64   7.352  -0.496 -14.201
  475    HG3  GLU  64          1HG       GLU  64   5.873  -1.363 -14.597
  476    H    HIS  65           H        HIS  65   3.146   0.050 -11.502
  477    HA   HIS  65           HA       HIS  65   3.035   2.745 -10.500
  478    HB2  HIS  65          2HB       HIS  65   1.023   1.561 -11.254
  479    HB3  HIS  65          1HB       HIS  65   1.217   0.378  -9.961
  480    HD1  HIS  65          1HD       HIS  65  -0.361   0.867  -8.106
  481    HD2  HIS  65          2HD       HIS  65   1.085   4.375  -9.838
  482    HE1  HIS  65          1HE       HIS  65  -1.386   2.785  -6.805
  483    HE2  HIS  65          2HE       HIS  65  -0.510   4.925  -7.849
  484    H    PHE  66           H        PHE  66   3.918  -0.311  -9.059
  485    HA   PHE  66           HA       PHE  66   3.806   0.808  -6.327
  486    HB2  PHE  66          2HB       PHE  66   4.694  -1.901  -7.367
  487    HB3  PHE  66          1HB       PHE  66   4.611  -1.459  -5.661
  488    HD1  PHE  66          1HD       PHE  66   2.687  -2.296  -8.666
  489    HD2  PHE  66          2HD       PHE  66   2.440  -1.016  -4.573
  490    HE1  PHE  66          1HE       PHE  66   0.270  -2.849  -8.639
  491    HE2  PHE  66          2HE       PHE  66   0.022  -1.569  -4.547
  492    HZ   PHE  66           HZ       PHE  66  -1.062  -2.486  -6.579
  493    H    ARG  67           H        ARG  67   5.777   1.436  -8.726
  494    HA   ARG  67           HA       ARG  67   8.393   0.719  -8.008
  495    HB2  ARG  67          2HB       ARG  67   7.746   1.948 -10.088
  496    HB3  ARG  67          1HB       ARG  67   7.511   3.399  -9.120
  497    HG2  ARG  67          2HG       ARG  67   9.696   3.678  -9.909
  498    HG3  ARG  67          1HG       ARG  67   9.963   2.953  -8.328
  499    HD2  ARG  67          2HD       ARG  67  10.158   0.722  -9.386
  500    HD3  ARG  67          1HD       ARG  67   9.905   1.459 -10.966
  501    HE   ARG  67           HE       ARG  67  12.130   2.643  -9.499
  502   HH11  ARG  67          1HH1      ARG  67  14.179   2.259 -10.373
  503   HH12  ARG  67          2HH1      ARG  67  14.379   1.016 -11.563
  504   HH21  ARG  67          1HH2      ARG  67  11.035   0.100 -11.554
  505   HH22  ARG  67          2HH2      ARG  67  12.599  -0.206 -12.232
  506    H    SER  68           H        SER  68   6.358   3.325  -6.715
  507    HA   SER  68           HA       SER  68   8.211   3.497  -4.405
  508    HB2  SER  68          2HB       SER  68   8.397   5.906  -4.532
  509    HB3  SER  68          1HB       SER  68   8.897   5.242  -6.085
  510    HG   SER  68           HG       SER  68   7.176   6.078  -6.999
  511    H    ILE  69           H        ILE  69   7.210   4.535  -2.534
  512    HA   ILE  69           HA       ILE  69   4.467   3.835  -2.171
  513    HB   ILE  69           HB       ILE  69   6.202   5.733  -0.566
  514   HG12  ILE  69          2HG1      ILE  69   5.631   2.805  -0.108
  515   HG13  ILE  69          1HG1      ILE  69   7.087   3.396  -0.893
  516   HG21  ILE  69          1HG2      ILE  69   3.451   5.008  -0.369
  517   HG22  ILE  69          2HG2      ILE  69   4.396   6.019   0.724
  518   HG23  ILE  69          3HG2      ILE  69   4.319   4.277   0.978
  519   HD11  ILE  69          1HD1      ILE  69   6.444   4.725   1.660
  520   HD12  ILE  69          2HD1      ILE  69   7.994   4.133   1.060
  521   HD13  ILE  69          3HD1      ILE  69   6.852   3.015   1.804
  522    H    ARG  70           H        ARG  70   6.062   6.903  -2.956
  523    HA   ARG  70           HA       ARG  70   3.829   8.617  -2.573
  524    HB2  ARG  70          2HB       ARG  70   6.167   9.389  -2.967
  525    HB3  ARG  70          1HB       ARG  70   6.015   8.894  -4.653
  526    HG2  ARG  70          2HG       ARG  70   4.139  10.448  -4.961
  527    HG3  ARG  70          1HG       ARG  70   4.237  10.922  -3.265
  528    HD2  ARG  70          2HD       ARG  70   5.409  12.596  -4.543
  529    HD3  ARG  70          1HD       ARG  70   6.623  11.638  -3.696
  530    HE   ARG  70           HE       ARG  70   6.384  10.371  -6.145
  531   HH11  ARG  70          1HH1      ARG  70   7.638  10.933  -7.940
  532   HH12  ARG  70          2HH1      ARG  70   8.296  12.531  -8.053
  533   HH21  ARG  70          1HH2      ARG  70   6.932  13.592  -5.046
  534   HH22  ARG  70          2HH2      ARG  70   7.896  14.037  -6.415
  535    H    SER  71           H        SER  71   4.806   6.721  -5.433
  536    HA   SER  71           HA       SER  71   2.839   7.783  -7.203
  537    HB2  SER  71          2HB       SER  71   3.276   5.837  -8.568
  538    HB3  SER  71          1HB       SER  71   4.801   6.345  -7.853
  539    HG   SER  71           HG       SER  71   4.185   4.021  -7.739
  540    H    ILE  72           H        ILE  72   2.716   5.102  -4.873
  541    HA   ILE  72           HA       ILE  72   0.104   4.185  -5.629
  542    HB   ILE  72           HB       ILE  72   1.559   3.955  -2.978
  543   HG12  ILE  72          2HG1      ILE  72   1.410   2.021  -5.313
  544   HG13  ILE  72          1HG1      ILE  72   2.798   3.050  -4.957
  545   HG21  ILE  72          1HG2      ILE  72  -1.076   3.201  -3.821
  546   HG22  ILE  72          2HG2      ILE  72  -0.303   2.931  -2.259
  547   HG23  ILE  72          3HG2      ILE  72  -0.124   1.743  -3.549
  548   HD11  ILE  72          1HD1      ILE  72   3.342   0.996  -3.924
  549   HD12  ILE  72          2HD1      ILE  72   1.697   0.760  -3.333
  550   HD13  ILE  72          3HD1      ILE  72   2.729   1.986  -2.599
  551    H    ASP  73           H        ASP  73   1.270   6.531  -3.239
  552    HA   ASP  73           HA       ASP  73  -1.187   7.007  -1.907
  553    HB2  ASP  73          2HB       ASP  73   1.078   7.864  -1.212
  554    HB3  ASP  73          1HB       ASP  73   0.953   9.068  -2.495
  555    H    ALA  74           H        ALA  74   0.139   8.491  -4.863
  556    HA   ALA  74           HA       ALA  74  -1.965  10.418  -5.156
  557    HB1  ALA  74          1HB       ALA  74   0.282   9.430  -6.757
  558    HB2  ALA  74          2HB       ALA  74  -0.376  11.061  -6.634
  559    HB3  ALA  74          3HB       ALA  74  -1.112   9.893  -7.733
  560    H    PHE  75           H        PHE  75  -1.565   7.138  -6.492
  561    HA   PHE  75           HA       PHE  75  -3.923   7.177  -8.096
  562    HB2  PHE  75          2HB       PHE  75  -2.153   5.434  -8.244
  563    HB3  PHE  75          1HB       PHE  75  -2.700   4.795  -6.695
  564    HD1  PHE  75          1HD       PHE  75  -3.611   5.315 -10.239
  565    HD2  PHE  75          2HD       PHE  75  -4.773   3.565  -6.492
  566    HE1  PHE  75          1HE       PHE  75  -5.381   4.017 -11.393
  567    HE2  PHE  75          2HE       PHE  75  -6.543   2.267  -7.646
  568    HZ   PHE  75           HZ       PHE  75  -6.847   2.492 -10.097
  569    H    VAL  76           H        VAL  76  -3.438   5.984  -4.757
  570    HA   VAL  76           HA       VAL  76  -6.189   5.301  -4.356
  571    HB   VAL  76           HB       VAL  76  -3.953   5.956  -2.421
  572   HG11  VAL  76          1HG1      VAL  76  -5.918   6.366  -1.181
  573   HG12  VAL  76          2HG1      VAL  76  -5.528   4.687  -0.818
  574   HG13  VAL  76          3HG1      VAL  76  -6.797   5.064  -1.982
  575   HG21  VAL  76          1HG2      VAL  76  -4.154   3.822  -4.053
  576   HG22  VAL  76          2HG2      VAL  76  -5.172   3.253  -2.729
  577   HG23  VAL  76          3HG2      VAL  76  -3.494   3.699  -2.421
  578    H    VAL  77           H        VAL  77  -4.303   8.233  -3.537
  579    HA   VAL  77           HA       VAL  77  -6.442   9.608  -2.246
  580    HB   VAL  77           HB       VAL  77  -3.976  10.572  -3.705
  581   HG11  VAL  77          1HG1      VAL  77  -4.497  12.744  -2.465
  582   HG12  VAL  77          2HG1      VAL  77  -6.123  12.104  -2.235
  583   HG13  VAL  77          3HG1      VAL  77  -5.509  12.386  -3.862
  584   HG21  VAL  77          1HG2      VAL  77  -3.856   9.275  -1.490
  585   HG22  VAL  77          2HG2      VAL  77  -4.648  10.669  -0.755
  586   HG23  VAL  77          3HG2      VAL  77  -3.068  10.853  -1.515
  587    H    GLY  78           H        GLY  78  -5.422   9.463  -5.639
  588    HA2  GLY  78          2HA       GLY  78  -7.118  11.478  -6.667
  589    HA3  GLY  78          1HA       GLY  78  -6.562  10.083  -7.588
  590    H    ALA  79           H        ALA  79  -7.836   8.111  -5.814
  591    HA   ALA  79           HA       ALA  79 -10.629   8.530  -6.757
  592    HB1  ALA  79          1HB       ALA  79  -9.897   5.874  -5.731
  593    HB2  ALA  79          2HB       ALA  79  -8.955   6.394  -7.128
  594    HB3  ALA  79          3HB       ALA  79 -10.714   6.315  -7.230
  595    H    THR  80           H        THR  80  -8.861   7.272  -3.917
  596    HA   THR  80           HA       THR  80 -10.871   8.466  -2.148
  597    HB   THR  80           HB       THR  80 -10.506   5.466  -2.190
  598    HG1  THR  80          1HG       THR  80 -12.747   5.569  -2.829
  599   HG21  THR  80          1HG2      THR  80 -12.245   5.446  -0.491
  600   HG22  THR  80          2HG2      THR  80 -12.415   7.198  -0.603
  601   HG23  THR  80          3HG2      THR  80 -10.933   6.496   0.045
  602    H    THR  81           H        THR  81  -9.964   8.911  -0.149
  603    HA   THR  81           HA       THR  81  -7.269   7.732   0.387
  604    HB   THR  81           HB       THR  81  -7.199  10.153  -0.160
  605    HG1  THR  81          1HG       THR  81  -6.772   9.996   2.597
  606   HG21  THR  81          1HG2      THR  81  -8.476  10.941   2.373
  607   HG22  THR  81          2HG2      THR  81  -9.589  10.270   1.183
  608   HG23  THR  81          3HG2      THR  81  -8.602  11.672   0.773
  609    HA   PRO  82           HA       PRO  82  -9.856   6.648   4.009
  610    HB2  PRO  82          2HB       PRO  82  -9.497   4.001   3.972
  611    HB3  PRO  82          1HB       PRO  82 -10.554   4.793   2.785
  612    HG2  PRO  82          2HG       PRO  82  -7.821   3.696   2.443
  613    HG3  PRO  82          1HG       PRO  82  -9.166   3.767   1.292
  614    HD2  PRO  82          2HD       PRO  82  -6.969   5.578   1.455
  615    HD3  PRO  82          1HD       PRO  82  -8.422   5.751   0.446
  616    HA   PRO  83           HA       PRO  83  -5.901   6.475   6.333
  617    HB2  PRO  83          2HB       PRO  83  -6.808   7.651   8.617
  618    HB3  PRO  83          1HB       PRO  83  -6.338   8.576   7.177
  619    HG2  PRO  83          2HG       PRO  83  -9.035   7.911   8.202
  620    HG3  PRO  83          1HG       PRO  83  -8.473   9.349   7.337
  621    HD2  PRO  83          2HD       PRO  83  -9.898   7.240   6.190
  622    HD3  PRO  83          1HD       PRO  83  -8.942   8.438   5.290
  623    H    VAL  84           H        VAL  84  -5.210   4.772   7.596
  624    HA   VAL  84           HA       VAL  84  -7.271   3.327   9.223
  625    HB   VAL  84           HB       VAL  84  -4.944   2.089   7.722
  626   HG11  VAL  84          1HG1      VAL  84  -7.310   0.809   9.122
  627   HG12  VAL  84          2HG1      VAL  84  -5.696   0.938   9.820
  628   HG13  VAL  84          3HG1      VAL  84  -5.952  -0.026   8.366
  629   HG21  VAL  84          1HG2      VAL  84  -6.434   2.639   6.008
  630   HG22  VAL  84          2HG2      VAL  84  -7.846   2.491   7.054
  631   HG23  VAL  84          3HG2      VAL  84  -7.020   1.043   6.479
  632    H    GLU  85           H        GLU  85  -6.693   2.980  11.332
  633    HA   GLU  85           HA       GLU  85  -4.393   4.248  12.451
  634    HB2  GLU  85          2HB       GLU  85  -6.476   3.671  13.719
  635    HB3  GLU  85          1HB       GLU  85  -6.001   1.974  13.651
  636    HG2  GLU  85          2HG       GLU  85  -3.864   2.562  14.796
  637    HG3  GLU  85          1HG       GLU  85  -4.435   4.225  14.945
  638    H    ALA  86           H        ALA  86  -4.996   0.903  11.443
  639    HA   ALA  86           HA       ALA  86  -2.085   0.452  11.344
  640    HB1  ALA  86          1HB       ALA  86  -3.359  -1.822  12.637
  641    HB2  ALA  86          2HB       ALA  86  -3.522  -0.359  13.608
  642    HB3  ALA  86          3HB       ALA  86  -1.922  -0.924  13.126
  643    H    LYS  87           H        LYS  87  -1.546  -1.326   9.957
  644    HA   LYS  87           HA       LYS  87  -3.344  -1.799   7.804
  645    HB2  LYS  87          2HB       LYS  87  -0.841  -2.091   7.728
  646    HB3  LYS  87          1HB       LYS  87  -1.045  -3.587   8.641
  647    HG2  LYS  87          2HG       LYS  87  -2.541  -4.452   6.856
  648    HG3  LYS  87          1HG       LYS  87  -2.262  -2.976   5.931
  649    HD2  LYS  87          2HD       LYS  87   0.217  -3.502   6.041
  650    HD3  LYS  87          1HD       LYS  87  -0.223  -5.077   6.700
  651    HE2  LYS  87          2HE       LYS  87  -0.596  -4.004   3.942
  652    HE3  LYS  87          1HE       LYS  87  -0.180  -5.635   4.466
  653    HZ1  LYS  87          1HZ       LYS  87  -2.849  -4.346   4.615
  654    HZ2  LYS  87          2HZ       LYS  87  -2.478  -5.858   5.294
  655    HZ3  LYS  87          3HZ       LYS  87  -2.397  -5.637   3.612
  656    H    LEU  88           H        LEU  88  -2.686  -3.656  10.748
  657    HA   LEU  88           HA       LEU  88  -4.603  -5.747   9.906
  658    HB2  LEU  88          2HB       LEU  88  -3.050  -5.486  12.499
  659    HB3  LEU  88          1HB       LEU  88  -3.910  -6.917  11.928
  660    HG   LEU  88           HG       LEU  88  -1.509  -5.617  10.608
  661   HD11  LEU  88          1HD1      LEU  88  -0.275  -7.495  11.327
  662   HD12  LEU  88          2HD1      LEU  88  -1.730  -8.432  11.667
  663   HD13  LEU  88          3HD1      LEU  88  -1.271  -7.100  12.727
  664   HD21  LEU  88          1HD2      LEU  88  -2.728  -6.452   8.793
  665   HD22  LEU  88          2HD2      LEU  88  -3.430  -7.763   9.741
  666   HD23  LEU  88          3HD2      LEU  88  -1.744  -7.849   9.231
  667    H    GLN  89           H        GLN  89  -6.624  -6.026  10.870
  668    HA   GLN  89           HA       GLN  89  -7.899  -3.717  11.996
  669    HB2  GLN  89          2HB       GLN  89  -8.750  -6.629  11.993
  670    HB3  GLN  89          1HB       GLN  89  -9.793  -5.281  12.445
  671    HG2  GLN  89          2HG       GLN  89  -9.526  -4.296  10.212
  672    HG3  GLN  89          1HG       GLN  89  -8.435  -5.604   9.751
  673   HE21  GLN  89          1HE2      GLN  89 -10.857  -5.167   8.307
  674   HE22  GLN  89          2HE2      GLN  89 -11.906  -6.469   8.600
  675    H1   PN7 101          3HO       SAT 101   2.664  -7.880 -12.399
  676    H2   PN7 101          1H1       SAT 101   2.865  -8.998 -11.034
  677    H3   PN7 101          2H1       SAT 101   3.260  -8.249  -9.487
  678    H5   PN7 101          1HE1      SAT 101   1.310  -5.478 -10.528
  679    H6   PN7 101          2HE1      SAT 101   2.928  -6.162 -10.658
  680    H7   PN7 101          3HE1      SAT 101   2.151  -6.034  -9.082
  681    H8   PN7 101          2HE2      SAT 101  -0.303  -6.892  -9.204
  682    H9   PN7 101          3HE2      SAT 101   0.657  -8.105  -8.358
  683    H10  PN7 101          1HE2      SAT 101  -0.416  -8.588  -9.671
  684    H11  PN7 101          3H        SAT 101   0.510  -8.774 -11.896
  685    H12  PN7 101          5H        SAT 101   0.475  -5.072 -12.450
  686    H13  PN7 101          1H6       SAT 101  -1.723  -6.387 -13.990
  687    H14  PN7 101          2H6       SAT 101  -1.397  -4.655 -14.008
  688    H15  PN7 101          1H7       SAT 101   1.007  -5.711 -14.850
  689    H16  PN7 101          2H7       SAT 101  -0.247  -5.081 -15.918
  690    H17  PN7 101          9H        SAT 101   0.735  -8.704 -14.839
  691    H18  PN7 101          1H10      SAT 101   1.521  -8.477 -17.523
  692    H19  PN7 101          2H10      SAT 101   2.285  -7.127 -16.684
  693    H20  PN7 101          1H11      SAT 101   2.697 -10.082 -16.268
  694    H21  PN7 101          2H11      SAT 101   3.072  -8.934 -14.981
  695    H22  PN7 101          2HS1      SAT 101   4.367  -8.013 -17.538
  Start of MODEL   19
    1    H1   MET   1          1HT       MET   1  -0.981  12.484   0.674
    2    H2   MET   1          2HT       MET   1  -2.587  12.535   1.226
    3    H3   MET   1          3HT       MET   1  -2.051  11.229   0.279
    4    HA   MET   1           HA       MET   1  -1.204  10.144   2.012
    5    HB2  MET   1          2HB       MET   1  -0.247  12.858   2.964
    6    HB3  MET   1          1HB       MET   1   0.139  11.331   3.759
    7    HG2  MET   1          2HG       MET   1   1.105  10.522   1.585
    8    HG3  MET   1          1HG       MET   1   0.866  12.143   0.932
    9    HE1  MET   1          1HE       MET   1   3.026  14.451   2.865
   10    HE2  MET   1          2HE       MET   1   1.636  13.927   3.811
   11    HE3  MET   1          3HE       MET   1   1.472  14.160   2.073
   12    H    GLN   2           H        GLN   2  -3.897  11.186   1.884
   13    HA   GLN   2           HA       GLN   2  -4.811  12.294   4.336
   14    HB2  GLN   2          2HB       GLN   2  -6.202  10.362   2.451
   15    HB3  GLN   2          1HB       GLN   2  -7.007  11.276   3.726
   16    HG2  GLN   2          2HG       GLN   2  -6.317  13.387   2.679
   17    HG3  GLN   2          1HG       GLN   2  -5.461  12.496   1.420
   18   HE21  GLN   2          1HE2      GLN   2  -7.583  14.273   0.735
   19   HE22  GLN   2          2HE2      GLN   2  -8.891  13.359   0.157
   20    H    HIS   3           H        HIS   3  -4.122   8.962   3.388
   21    HA   HIS   3           HA       HIS   3  -4.065   8.205   6.248
   22    HB2  HIS   3          2HB       HIS   3  -6.271   7.579   4.581
   23    HB3  HIS   3          1HB       HIS   3  -5.351   6.087   4.768
   24    HD1  HIS   3          1HD       HIS   3  -6.409   4.803   6.628
   25    HD2  HIS   3          2HD       HIS   3  -6.149   8.870   7.522
   26    HE1  HIS   3          1HE       HIS   3  -7.255   5.073   9.002
   27    HE2  HIS   3          2HE       HIS   3  -7.102   7.544   9.556
   28    H    ALA   4           H        ALA   4  -2.118   8.579   4.050
   29    HA   ALA   4           HA       ALA   4  -1.254   6.105   2.953
   30    HB1  ALA   4          1HB       ALA   4   0.171   8.677   3.616
   31    HB2  ALA   4          2HB       ALA   4  -0.271   8.044   2.031
   32    HB3  ALA   4          3HB       ALA   4   1.042   7.299   2.944
   33    H    SER   5           H        SER   5  -0.699   7.554   6.130
   34    HA   SER   5           HA       SER   5   1.450   5.897   6.960
   35    HB2  SER   5          2HB       SER   5   0.809   6.462   9.230
   36    HB3  SER   5          1HB       SER   5   0.562   7.884   8.219
   37    HG   SER   5           HG       SER   5  -1.659   7.170   8.037
   38    H    VAL   6           H        VAL   6  -2.057   5.327   7.026
   39    HA   VAL   6           HA       VAL   6  -1.864   2.790   8.392
   40    HB   VAL   6           HB       VAL   6  -3.989   3.929   6.566
   41   HG11  VAL   6          1HG1      VAL   6  -5.286   2.042   7.983
   42   HG12  VAL   6          2HG1      VAL   6  -3.698   1.280   7.896
   43   HG13  VAL   6          3HG1      VAL   6  -4.556   1.704   6.413
   44   HG21  VAL   6          1HG2      VAL   6  -3.613   3.750   9.558
   45   HG22  VAL   6          2HG2      VAL   6  -5.197   4.028   8.835
   46   HG23  VAL   6          3HG2      VAL   6  -3.895   5.191   8.581
   47    H    ILE   7           H        ILE   7  -1.858   3.788   5.005
   48    HA   ILE   7           HA       ILE   7  -1.931   1.189   3.841
   49    HB   ILE   7           HB       ILE   7  -0.556   3.703   2.846
   50   HG12  ILE   7          2HG1      ILE   7  -3.317   2.588   2.248
   51   HG13  ILE   7          1HG1      ILE   7  -2.997   3.934   3.343
   52   HG21  ILE   7          1HG2      ILE   7  -1.379   1.130   1.469
   53   HG22  ILE   7          2HG2      ILE   7   0.251   1.787   1.614
   54   HG23  ILE   7          3HG2      ILE   7  -0.940   2.601   0.600
   55   HD11  ILE   7          1HD1      ILE   7  -3.313   4.022   0.514
   56   HD12  ILE   7          2HD1      ILE   7  -1.635   4.432   0.870
   57   HD13  ILE   7          3HD1      ILE   7  -2.945   5.358   1.604
   58    H    ALA   8           H        ALA   8   0.851   3.268   4.676
   59    HA   ALA   8           HA       ALA   8   2.850   1.328   3.992
   60    HB1  ALA   8          1HB       ALA   8   3.851   3.382   4.235
   61    HB2  ALA   8          2HB       ALA   8   4.110   2.790   5.876
   62    HB3  ALA   8          3HB       ALA   8   2.760   3.873   5.531
   63    H    GLN   9           H        GLN   9   1.336   2.187   7.093
   64    HA   GLN   9           HA       GLN   9   2.729   0.253   8.673
   65    HB2  GLN   9          2HB       GLN   9   1.419   2.156   9.608
   66    HB3  GLN   9          1HB       GLN   9  -0.065   1.364   9.078
   67    HG2  GLN   9          2HG       GLN   9   1.291  -0.625  10.480
   68    HG3  GLN   9          1HG       GLN   9   1.571   0.832  11.431
   69   HE21  GLN   9          1HE2      GLN   9  -1.108  -0.949   9.809
   70   HE22  GLN   9          2HE2      GLN   9  -2.290  -0.505  10.946
   71    H    PHE  10           H        PHE  10  -0.378   0.136   6.978
   72    HA   PHE  10           HA       PHE  10  -1.043  -2.549   7.762
   73    HB2  PHE  10          2HB       PHE  10  -2.651  -0.828   6.869
   74    HB3  PHE  10          1HB       PHE  10  -1.923  -1.053   5.279
   75    HD1  PHE  10          1HD       PHE  10  -2.387  -2.993   3.951
   76    HD2  PHE  10          2HD       PHE  10  -3.844  -2.710   7.979
   77    HE1  PHE  10          1HE       PHE  10  -3.850  -4.957   3.559
   78    HE2  PHE  10          2HE       PHE  10  -5.305  -4.676   7.591
   79    HZ   PHE  10           HZ       PHE  10  -5.310  -5.796   5.379
   80    H    VAL  11           H        VAL  11   0.351  -1.189   4.791
   81    HA   VAL  11           HA       VAL  11   0.741  -3.716   3.484
   82    HB   VAL  11           HB       VAL  11   2.147  -1.056   3.102
   83   HG11  VAL  11          1HG1      VAL  11   2.066  -2.574   0.716
   84   HG12  VAL  11          2HG1      VAL  11   2.647  -3.664   1.975
   85   HG13  VAL  11          3HG1      VAL  11   3.490  -2.145   1.665
   86   HG21  VAL  11          1HG2      VAL  11   0.087  -2.174   1.244
   87   HG22  VAL  11          2HG2      VAL  11   0.455  -0.493   1.630
   88   HG23  VAL  11          3HG2      VAL  11  -0.466  -1.477   2.767
   89    H    VAL  12           H        VAL  12   2.940  -1.642   5.382
   90    HA   VAL  12           HA       VAL  12   5.232  -3.330   5.119
   91    HB   VAL  12           HB       VAL  12   4.485  -1.422   7.341
   92   HG11  VAL  12          1HG1      VAL  12   7.141  -2.659   6.563
   93   HG12  VAL  12          2HG1      VAL  12   6.246  -2.961   8.050
   94   HG13  VAL  12          3HG1      VAL  12   6.944  -1.371   7.751
   95   HG21  VAL  12          1HG2      VAL  12   6.523  -0.762   5.284
   96   HG22  VAL  12          2HG2      VAL  12   5.325   0.279   6.054
   97   HG23  VAL  12          3HG2      VAL  12   4.848  -0.788   4.734
   98    H    GLU  13           H        GLU  13   2.563  -3.281   7.432
   99    HA   GLU  13           HA       GLU  13   3.562  -5.128   9.323
  100    HB2  GLU  13          2HB       GLU  13   1.450  -3.836   9.583
  101    HB3  GLU  13          1HB       GLU  13   0.705  -4.877   8.377
  102    HG2  GLU  13          2HG       GLU  13   1.220  -6.851   9.805
  103    HG3  GLU  13          1HG       GLU  13   1.848  -5.752  11.031
  104    H    GLU  14           H        GLU  14   2.215  -5.648   6.124
  105    HA   GLU  14           HA       GLU  14   1.748  -8.463   6.373
  106    HB2  GLU  14          2HB       GLU  14   0.856  -7.065   4.523
  107    HB3  GLU  14          1HB       GLU  14   2.492  -6.880   3.896
  108    HG2  GLU  14          2HG       GLU  14   2.654  -9.363   3.700
  109    HG3  GLU  14          1HG       GLU  14   0.972  -9.481   4.213
  110    H    PHE  15           H        PHE  15   4.626  -6.563   5.679
  111    HA   PHE  15           HA       PHE  15   6.259  -8.997   6.080
  112    HB2  PHE  15          2HB       PHE  15   7.704  -8.208   4.074
  113    HB3  PHE  15          1HB       PHE  15   6.214  -9.082   3.723
  114    HD1  PHE  15          1HD       PHE  15   4.227  -7.911   2.891
  115    HD2  PHE  15          2HD       PHE  15   7.910  -5.824   3.612
  116    HE1  PHE  15          1HE       PHE  15   3.387  -5.980   1.587
  117    HE2  PHE  15          2HE       PHE  15   7.071  -3.891   2.305
  118    HZ   PHE  15           HZ       PHE  15   4.809  -3.969   1.291
  119    H    LEU  16           H        LEU  16   6.027  -7.082   7.968
  120    HA   LEU  16           HA       LEU  16   7.990  -4.975   7.598
  121    HB2  LEU  16          2HB       LEU  16   7.314  -4.159   9.676
  122    HB3  LEU  16          1HB       LEU  16   5.861  -4.932   9.082
  123    HG   LEU  16           HG       LEU  16   7.831  -6.222  10.993
  124   HD11  LEU  16          1HD1      LEU  16   5.773  -5.970  12.534
  125   HD12  LEU  16          2HD1      LEU  16   5.233  -4.753  11.377
  126   HD13  LEU  16          3HD1      LEU  16   6.758  -4.538  12.236
  127   HD21  LEU  16          1HD2      LEU  16   6.589  -7.836   9.569
  128   HD22  LEU  16          2HD2      LEU  16   5.074  -7.061  10.024
  129   HD23  LEU  16          3HD2      LEU  16   6.030  -7.909  11.238
  130    HA   PRO  17           HA       PRO  17  11.427  -7.481   8.938
  131    HB2  PRO  17          2HB       PRO  17  13.253  -5.485   9.356
  132    HB3  PRO  17          1HB       PRO  17  12.790  -6.041   7.738
  133    HG2  PRO  17          2HG       PRO  17  11.902  -3.633   9.235
  134    HG3  PRO  17          1HG       PRO  17  12.264  -3.824   7.513
  135    HD2  PRO  17          2HD       PRO  17   9.714  -3.785   8.529
  136    HD3  PRO  17          1HD       PRO  17  10.163  -4.620   7.028
  137    H    ASP  18           H        ASP  18  13.317  -6.369  10.878
  138    HA   ASP  18           HA       ASP  18  11.802  -6.902  13.310
  139    HB2  ASP  18          2HB       ASP  18  14.678  -6.104  12.828
  140    HB3  ASP  18          1HB       ASP  18  14.019  -6.479  14.415
  141    H    VAL  19           H        VAL  19  11.733  -4.320  11.439
  142    HA   VAL  19           HA       VAL  19  11.879  -2.341  13.681
  143    HB   VAL  19           HB       VAL  19  11.983  -1.838  10.693
  144   HG11  VAL  19          1HG1      VAL  19  11.146   0.097  11.847
  145   HG12  VAL  19          2HG1      VAL  19  12.851   0.406  11.519
  146   HG13  VAL  19          3HG1      VAL  19  12.337  -0.080  13.136
  147   HG21  VAL  19          1HG2      VAL  19  14.030  -2.624  12.641
  148   HG22  VAL  19          2HG2      VAL  19  14.422  -1.117  11.813
  149   HG23  VAL  19          3HG2      VAL  19  14.117  -2.583  10.880
  150    H    ALA  20           H        ALA  20  10.011  -1.225  14.190
  151    HA   ALA  20           HA       ALA  20   7.497  -2.148  13.119
  152    HB1  ALA  20          1HB       ALA  20   6.511  -0.347  14.511
  153    HB2  ALA  20          2HB       ALA  20   8.128   0.290  14.808
  154    HB3  ALA  20          3HB       ALA  20   7.681  -1.302  15.422
  155    HA   PRO  21           HA       PRO  21   7.210   0.332   9.415
  156    HB2  PRO  21          2HB       PRO  21   4.446   1.004  10.296
  157    HB3  PRO  21          1HB       PRO  21   5.006   0.319   8.761
  158    HG2  PRO  21          2HG       PRO  21   3.769  -1.141  10.660
  159    HG3  PRO  21          1HG       PRO  21   4.964  -1.812   9.542
  160    HD2  PRO  21          2HD       PRO  21   5.218  -1.289  12.437
  161    HD3  PRO  21          1HD       PRO  21   6.156  -2.376  11.390
  162    H    ALA  22           H        ALA  22   6.049   1.630  12.485
  163    HA   ALA  22           HA       ALA  22   6.007   4.397  11.688
  164    HB1  ALA  22          1HB       ALA  22   5.947   2.883  14.258
  165    HB2  ALA  22          2HB       ALA  22   4.852   4.133  13.665
  166    HB3  ALA  22          3HB       ALA  22   6.421   4.580  14.336
  167    H    ASP  23           H        ASP  23   8.526   2.201  12.654
  168    HA   ASP  23           HA       ASP  23  10.462   4.458  12.868
  169    HB2  ASP  23          2HB       ASP  23  10.672   1.549  13.704
  170    HB3  ASP  23          1HB       ASP  23  11.990   2.715  13.828
  171    H    VAL  24           H        VAL  24   9.229   2.626  10.518
  172    HA   VAL  24           HA       VAL  24  11.814   1.944   9.227
  173    HB   VAL  24           HB       VAL  24   9.520   0.529   9.281
  174   HG11  VAL  24          1HG1      VAL  24   8.191   0.850   7.330
  175   HG12  VAL  24          2HG1      VAL  24   9.360   1.967   6.627
  176   HG13  VAL  24          3HG1      VAL  24   8.397   2.458   8.020
  177   HG21  VAL  24          1HG2      VAL  24  11.692   0.770   7.222
  178   HG22  VAL  24          2HG2      VAL  24  10.365  -0.358   6.945
  179   HG23  VAL  24          3HG2      VAL  24  11.388  -0.532   8.371
  180    H    ASP  25           H        ASP  25  12.489   2.988   7.324
  181    HA   ASP  25           HA       ASP  25  11.499   5.684   6.958
  182    HB2  ASP  25          2HB       ASP  25  13.880   4.941   6.561
  183    HB3  ASP  25          1HB       ASP  25  13.316   4.116   5.108
  184    H    VAL  26           H        VAL  26   9.299   5.510   6.343
  185    HA   VAL  26           HA       VAL  26   8.328   3.806   4.257
  186    HB   VAL  26           HB       VAL  26   6.353   5.242   4.255
  187   HG11  VAL  26          1HG1      VAL  26   7.274   3.843   6.399
  188   HG12  VAL  26          2HG1      VAL  26   5.707   4.651   6.366
  189   HG13  VAL  26          3HG1      VAL  26   7.091   5.442   7.119
  190   HG21  VAL  26          1HG2      VAL  26   8.336   7.209   5.183
  191   HG22  VAL  26          2HG2      VAL  26   6.824   7.247   6.091
  192   HG23  VAL  26          3HG2      VAL  26   6.808   7.467   4.341
  193    H    ASP  27           H        ASP  27  10.659   6.028   3.925
  194    HA   ASP  27           HA       ASP  27   9.689   7.164   1.360
  195    HB2  ASP  27          2HB       ASP  27  12.220   7.658   2.962
  196    HB3  ASP  27          1HB       ASP  27  11.835   8.453   1.435
  197    H    LEU  28           H        LEU  28  10.802   4.304   2.209
  198    HA   LEU  28           HA       LEU  28  12.973   4.022   0.227
  199    HB2  LEU  28          2HB       LEU  28  13.053   2.846   2.436
  200    HB3  LEU  28          1HB       LEU  28  11.640   1.913   1.951
  201    HG   LEU  28           HG       LEU  28  13.089   1.339  -0.167
  202   HD11  LEU  28          1HD1      LEU  28  15.165   2.176   1.877
  203   HD12  LEU  28          2HD1      LEU  28  14.932   2.853   0.265
  204   HD13  LEU  28          3HD1      LEU  28  15.518   1.201   0.450
  205   HD21  LEU  28          1HD2      LEU  28  13.411   0.222   2.620
  206   HD22  LEU  28          2HD2      LEU  28  14.199  -0.525   1.230
  207   HD23  LEU  28          3HD2      LEU  28  12.439  -0.413   1.292
  208    H    ASP  29           H        ASP  29  12.689   3.122  -1.780
  209    HA   ASP  29           HA       ASP  29  10.048   2.872  -2.858
  210    HB2  ASP  29          2HB       ASP  29  12.708   1.822  -3.877
  211    HB3  ASP  29          1HB       ASP  29  11.213   1.824  -4.814
  212    H    LEU  30           H        LEU  30   8.651   1.215  -2.519
  213    HA   LEU  30           HA       LEU  30   9.525  -1.175  -1.130
  214    HB2  LEU  30          2HB       LEU  30   7.151  -1.876  -1.360
  215    HB3  LEU  30          1HB       LEU  30   7.301  -0.242  -0.713
  216    HG   LEU  30           HG       LEU  30   7.230  -0.243  -3.625
  217   HD11  LEU  30          1HD1      LEU  30   4.709  -0.772  -3.624
  218   HD12  LEU  30          2HD1      LEU  30   5.003  -1.578  -2.084
  219   HD13  LEU  30          3HD1      LEU  30   5.813  -2.145  -3.544
  220   HD21  LEU  30          1HD2      LEU  30   5.301   0.950  -1.623
  221   HD22  LEU  30          2HD2      LEU  30   5.650   1.522  -3.254
  222   HD23  LEU  30          3HD2      LEU  30   6.871   1.668  -1.988
  223    H    VAL  31           H        VAL  31  10.110  -0.390  -4.210
  224    HA   VAL  31           HA       VAL  31   9.102  -2.474  -5.822
  225    HB   VAL  31           HB       VAL  31  11.809  -1.106  -5.888
  226   HG11  VAL  31          1HG1      VAL  31  11.591  -1.963  -8.378
  227   HG12  VAL  31          2HG1      VAL  31  10.581  -3.205  -7.640
  228   HG13  VAL  31          3HG1      VAL  31  12.259  -3.015  -7.132
  229   HG21  VAL  31          1HG2      VAL  31  10.468  -0.257  -8.076
  230   HG22  VAL  31          2HG2      VAL  31  10.371   0.569  -6.521
  231   HG23  VAL  31          3HG2      VAL  31   9.102  -0.556  -7.003
  232    H    ASP  32           H        ASP  32  11.936  -2.447  -3.687
  233    HA   ASP  32           HA       ASP  32  12.893  -5.056  -4.268
  234    HB2  ASP  32          2HB       ASP  32  14.010  -3.354  -2.753
  235    HB3  ASP  32          1HB       ASP  32  12.830  -3.782  -1.514
  236    H    ASN  33           H        ASN  33  10.262  -3.899  -2.256
  237    HA   ASN  33           HA       ASN  33   9.581  -6.589  -1.298
  238    HB2  ASN  33          2HB       ASN  33   8.096  -3.968  -1.023
  239    HB3  ASN  33          1HB       ASN  33   7.715  -5.459  -0.165
  240   HD21  ASN  33          1HD2      ASN  33   9.616  -2.604  -0.045
  241   HD22  ASN  33          2HD2      ASN  33  10.611  -3.047   1.257
  242    H    GLY  34           H        GLY  34   9.485  -5.482  -4.219
  243    HA2  GLY  34          2HA       GLY  34   6.957  -5.263  -5.283
  244    HA3  GLY  34          1HA       GLY  34   8.229  -6.179  -6.093
  245    H    VAL  35           H        VAL  35   8.146  -7.928  -3.490
  246    HA   VAL  35           HA       VAL  35   6.725 -10.119  -4.535
  247    HB   VAL  35           HB       VAL  35   7.284  -9.326  -1.662
  248   HG11  VAL  35          1HG1      VAL  35   5.658 -11.515  -2.774
  249   HG12  VAL  35          2HG1      VAL  35   5.715 -10.878  -1.129
  250   HG13  VAL  35          3HG1      VAL  35   6.917 -12.052  -1.662
  251   HG21  VAL  35          1HG2      VAL  35   9.116  -9.955  -3.426
  252   HG22  VAL  35          2HG2      VAL  35   8.514 -11.598  -3.207
  253   HG23  VAL  35          3HG2      VAL  35   9.171 -10.708  -1.833
  254    H    ILE  36           H        ILE  36   5.599  -7.427  -2.539
  255    HA   ILE  36           HA       ILE  36   2.938  -8.455  -2.114
  256    HB   ILE  36           HB       ILE  36   4.227  -6.518  -0.906
  257   HG12  ILE  36          2HG1      ILE  36   1.293  -6.516  -1.643
  258   HG13  ILE  36          1HG1      ILE  36   2.044  -7.144  -0.180
  259   HG21  ILE  36          1HG2      ILE  36   2.694  -4.869  -2.912
  260   HG22  ILE  36          2HG2      ILE  36   4.373  -5.321  -3.215
  261   HG23  ILE  36          3HG2      ILE  36   3.963  -4.352  -1.801
  262   HD11  ILE  36          1HD1      ILE  36   1.440  -5.140   0.715
  263   HD12  ILE  36          2HD1      ILE  36   1.298  -4.372  -0.865
  264   HD13  ILE  36          3HD1      ILE  36   2.881  -4.547  -0.110
  265    H    ASP  37           H        ASP  37   4.470  -6.722  -4.709
  266    HA   ASP  37           HA       ASP  37   2.228  -5.502  -5.914
  267    HB2  ASP  37          2HB       ASP  37   4.690  -6.688  -7.219
  268    HB3  ASP  37          1HB       ASP  37   3.527  -5.652  -8.043
  269    H    SER  38           H        SER  38   3.308  -8.876  -6.108
  270    HA   SER  38           HA       SER  38   1.045  -9.399  -7.969
  271    HB2  SER  38          2HB       SER  38   3.642 -10.194  -8.154
  272    HB3  SER  38          1HB       SER  38   2.916 -11.594  -7.374
  273    H    LEU  39           H        LEU  39   2.595 -11.237  -5.298
  274    HA   LEU  39           HA       LEU  39   0.172 -12.719  -4.828
  275    HB2  LEU  39          2HB       LEU  39   2.779 -12.464  -3.373
  276    HB3  LEU  39          1HB       LEU  39   1.441 -13.346  -2.645
  277    HG   LEU  39           HG       LEU  39   2.996 -14.808  -3.959
  278   HD11  LEU  39          1HD1      LEU  39   0.589 -15.022  -5.604
  279   HD12  LEU  39          2HD1      LEU  39   0.215 -14.807  -3.894
  280   HD13  LEU  39          3HD1      LEU  39   1.235 -16.149  -4.412
  281   HD21  LEU  39          1HD2      LEU  39   3.092 -14.620  -6.359
  282   HD22  LEU  39          2HD2      LEU  39   3.461 -13.028  -5.697
  283   HD23  LEU  39          3HD2      LEU  39   1.862 -13.356  -6.365
  284    H    GLY  40           H        GLY  40   1.795 -10.218  -2.868
  285    HA2  GLY  40          2HA       GLY  40  -0.298 -10.079  -0.915
  286    HA3  GLY  40          1HA       GLY  40   0.929  -8.846  -1.173
  287    H    LEU  41           H        LEU  41   0.271  -8.361  -3.946
  288    HA   LEU  41           HA       LEU  41  -1.659  -6.317  -3.653
  289    HB2  LEU  41          2HB       LEU  41   0.003  -6.512  -5.519
  290    HB3  LEU  41          1HB       LEU  41  -0.979  -7.806  -6.205
  291    HG   LEU  41           HG       LEU  41  -2.919  -6.026  -5.995
  292   HD11  LEU  41          1HD1      LEU  41  -2.035  -3.730  -6.398
  293   HD12  LEU  41          2HD1      LEU  41  -0.407  -4.336  -6.089
  294   HD13  LEU  41          3HD1      LEU  41  -1.610  -4.346  -4.800
  295   HD21  LEU  41          1HD2      LEU  41  -2.435  -5.300  -8.286
  296   HD22  LEU  41          2HD2      LEU  41  -2.021  -7.006  -8.103
  297   HD23  LEU  41          3HD2      LEU  41  -0.749  -5.784  -8.102
  298    H    LEU  42           H        LEU  42  -2.028  -9.643  -4.877
  299    HA   LEU  42           HA       LEU  42  -4.816  -9.404  -5.494
  300    HB2  LEU  42          2HB       LEU  42  -3.166 -11.815  -4.698
  301    HB3  LEU  42          1HB       LEU  42  -4.809 -11.904  -5.311
  302    HG   LEU  42           HG       LEU  42  -2.476 -10.657  -6.784
  303   HD11  LEU  42          1HD1      LEU  42  -3.692 -12.964  -8.034
  304   HD12  LEU  42          2HD1      LEU  42  -3.131 -13.379  -6.414
  305   HD13  LEU  42          3HD1      LEU  42  -2.003 -12.709  -7.593
  306   HD21  LEU  42          1HD2      LEU  42  -4.412 -11.168  -8.619
  307   HD22  LEU  42          2HD2      LEU  42  -4.238  -9.620  -7.794
  308   HD23  LEU  42          3HD2      LEU  42  -5.400 -10.806  -7.204
  309    H    LYS  43           H        LYS  43  -3.077 -10.389  -2.557
  310    HA   LYS  43           HA       LYS  43  -5.398 -11.065  -1.033
  311    HB2  LYS  43          2HB       LYS  43  -2.682 -10.066  -0.161
  312    HB3  LYS  43          1HB       LYS  43  -3.896 -10.722   0.930
  313    HG2  LYS  43          2HG       LYS  43  -3.888 -12.838  -0.390
  314    HG3  LYS  43          1HG       LYS  43  -2.585 -12.179  -1.381
  315    HD2  LYS  43          2HD       LYS  43  -1.212 -11.898   0.689
  316    HD3  LYS  43          1HD       LYS  43  -2.494 -12.692   1.606
  317    HE2  LYS  43          2HE       LYS  43  -2.217 -14.740   0.378
  318    HE3  LYS  43          1HE       LYS  43  -1.146 -13.964  -0.789
  319    HZ1  LYS  43          1HZ       LYS  43  -0.530 -15.085   1.754
  320    HZ2  LYS  43          2HZ       LYS  43  -0.018 -13.467   1.660
  321    HZ3  LYS  43          3HZ       LYS  43   0.517 -14.598   0.511
  322    H    VAL  44           H        VAL  44  -3.685  -8.017  -1.576
  323    HA   VAL  44           HA       VAL  44  -5.044  -6.463   0.395
  324    HB   VAL  44           HB       VAL  44  -3.829  -5.671  -2.263
  325   HG11  VAL  44          1HG1      VAL  44  -3.793  -3.459  -0.597
  326   HG12  VAL  44          2HG1      VAL  44  -5.384  -4.155  -0.291
  327   HG13  VAL  44          3HG1      VAL  44  -4.916  -3.711  -1.933
  328   HG21  VAL  44          1HG2      VAL  44  -2.631  -6.599   0.042
  329   HG22  VAL  44          2HG2      VAL  44  -2.587  -4.852   0.276
  330   HG23  VAL  44          3HG2      VAL  44  -1.848  -5.568  -1.155
  331    H    ILE  45           H        ILE  45  -5.808  -7.015  -3.050
  332    HA   ILE  45           HA       ILE  45  -8.102  -5.338  -3.135
  333    HB   ILE  45           HB       ILE  45  -7.551  -7.886  -4.685
  334   HG12  ILE  45          2HG1      ILE  45  -5.720  -6.322  -4.995
  335   HG13  ILE  45          1HG1      ILE  45  -6.728  -6.277  -6.438
  336   HG21  ILE  45          1HG2      ILE  45  -9.820  -7.341  -4.999
  337   HG22  ILE  45          2HG2      ILE  45  -9.001  -6.618  -6.385
  338   HG23  ILE  45          3HG2      ILE  45  -9.488  -5.609  -5.021
  339   HD11  ILE  45          1HD1      ILE  45  -7.954  -4.323  -5.175
  340   HD12  ILE  45          2HD1      ILE  45  -6.432  -4.004  -6.006
  341   HD13  ILE  45          3HD1      ILE  45  -6.449  -4.231  -4.258
  342    H    ALA  46           H        ALA  46  -7.783  -8.806  -2.374
  343    HA   ALA  46           HA       ALA  46 -10.588  -9.277  -2.023
  344    HB1  ALA  46          1HB       ALA  46  -8.073 -10.655  -1.131
  345    HB2  ALA  46          2HB       ALA  46  -9.336 -11.238  -2.217
  346    HB3  ALA  46          3HB       ALA  46  -9.627 -11.177  -0.479
  347    H    TRP  47           H        TRP  47  -8.018  -8.392   0.276
  348    HA   TRP  47           HA       TRP  47  -9.800  -8.363   2.562
  349    HB2  TRP  47          2HB       TRP  47  -7.621  -8.633   3.266
  350    HB3  TRP  47          1HB       TRP  47  -6.974  -7.586   2.004
  351    HD1  TRP  47           HD       TRP  47  -8.594  -7.473   5.461
  352    HE1  TRP  47          1HE       TRP  47  -8.195  -5.137   6.478
  353    HE3  TRP  47          3HE       TRP  47  -6.539  -5.106   1.439
  354    HZ2  TRP  47          2HZ       TRP  47  -7.136  -2.595   5.682
  355    HZ3  TRP  47          3HZ       TRP  47  -5.842  -2.735   1.589
  356    HH2  TRP  47           HH       TRP  47  -6.138  -1.479   3.702
  357    H    LEU  48           H        LEU  48  -8.556  -5.902   0.330
  358    HA   LEU  48           HA       LEU  48  -9.522  -3.606   1.687
  359    HB2  LEU  48          2HB       LEU  48  -7.985  -3.616  -0.308
  360    HB3  LEU  48          1HB       LEU  48  -9.371  -4.007  -1.309
  361    HG   LEU  48           HG       LEU  48 -10.500  -1.946  -0.404
  362   HD11  LEU  48          1HD1      LEU  48  -9.521  -0.973   1.372
  363   HD12  LEU  48          2HD1      LEU  48  -8.247  -0.429   0.282
  364   HD13  LEU  48          3HD1      LEU  48  -8.063  -1.942   1.168
  365   HD21  LEU  48          1HD2      LEU  48  -8.321  -0.608  -1.628
  366   HD22  LEU  48          2HD2      LEU  48  -9.806  -1.165  -2.401
  367   HD23  LEU  48          3HD2      LEU  48  -8.391  -2.216  -2.348
  368    H    GLU  49           H        GLU  49 -11.121  -5.703  -0.720
  369    HA   GLU  49           HA       GLU  49 -13.543  -4.174  -0.842
  370    HB2  GLU  49          2HB       GLU  49 -13.177  -5.731  -2.599
  371    HB3  GLU  49          1HB       GLU  49 -12.902  -7.056  -1.477
  372    HG2  GLU  49          2HG       GLU  49 -15.228  -7.040  -0.804
  373    HG3  GLU  49          1HG       GLU  49 -15.538  -5.603  -1.765
  374    H    ASP  50           H        ASP  50 -12.479  -6.783   1.300
  375    HA   ASP  50           HA       ASP  50 -14.990  -7.302   2.523
  376    HB2  ASP  50          2HB       ASP  50 -12.898  -8.659   2.823
  377    HB3  ASP  50          1HB       ASP  50 -12.296  -7.383   3.880
  378    H    ARG  51           H        ARG  51 -12.531  -4.844   3.245
  379    HA   ARG  51           HA       ARG  51 -13.892  -3.894   5.614
  380    HB2  ARG  51          2HB       ARG  51 -11.716  -2.694   3.894
  381    HB3  ARG  51          1HB       ARG  51 -12.312  -1.946   5.373
  382    HG2  ARG  51          2HG       ARG  51 -11.775  -4.083   6.590
  383    HG3  ARG  51          1HG       ARG  51 -11.011  -4.667   5.110
  384    HD2  ARG  51          2HD       ARG  51  -9.294  -3.710   6.535
  385    HD3  ARG  51          1HD       ARG  51  -9.524  -2.648   5.146
  386    HE   ARG  51           HE       ARG  51 -11.202  -1.505   6.942
  387   HH11  ARG  51          1HH1      ARG  51 -10.615  -0.062   8.578
  388   HH12  ARG  51          2HH1      ARG  51  -9.015  -0.127   9.240
  389   HH21  ARG  51          1HH2      ARG  51  -7.994  -2.747   7.213
  390   HH22  ARG  51          2HH2      ARG  51  -7.534  -1.645   8.468
  391    H    PHE  52           H        PHE  52 -13.743  -2.631   2.242
  392    HA   PHE  52           HA       PHE  52 -15.854  -0.677   3.031
  393    HB2  PHE  52          2HB       PHE  52 -13.904  -0.731   0.723
  394    HB3  PHE  52          1HB       PHE  52 -15.181   0.467   0.902
  395    HD1  PHE  52          1HD       PHE  52 -15.177   2.035   2.836
  396    HD2  PHE  52          2HD       PHE  52 -11.927  -0.674   2.095
  397    HE1  PHE  52          1HE       PHE  52 -13.735   3.343   4.373
  398    HE2  PHE  52          2HE       PHE  52 -10.486   0.633   3.632
  399    HZ   PHE  52           HZ       PHE  52 -11.391   2.643   4.771
  400    H    GLY  53           H        GLY  53 -15.536  -3.630   1.417
  401    HA2  GLY  53          2HA       GLY  53 -17.125  -4.834   0.154
  402    HA3  GLY  53          1HA       GLY  53 -18.274  -3.541   0.502
  403    H    ILE  54           H        ILE  54 -15.156  -2.983  -1.032
  404    HA   ILE  54           HA       ILE  54 -16.576  -1.841  -3.363
  405    HB   ILE  54           HB       ILE  54 -13.631  -1.857  -2.637
  406   HG12  ILE  54          2HG1      ILE  54 -15.636   0.412  -2.515
  407   HG13  ILE  54          1HG1      ILE  54 -15.232  -0.591  -1.122
  408   HG21  ILE  54          1HG2      ILE  54 -14.060   0.241  -4.352
  409   HG22  ILE  54          2HG2      ILE  54 -15.147  -0.979  -5.014
  410   HG23  ILE  54          3HG2      ILE  54 -13.427  -1.329  -4.842
  411   HD11  ILE  54          1HD1      ILE  54 -13.880   1.495  -1.190
  412   HD12  ILE  54          2HD1      ILE  54 -13.228   0.998  -2.751
  413   HD13  ILE  54          3HD1      ILE  54 -12.876   0.050  -1.306
  414    H    ALA  55           H        ALA  55 -16.081  -2.494  -5.542
  415    HA   ALA  55           HA       ALA  55 -15.901  -5.305  -5.941
  416    HB1  ALA  55          1HB       ALA  55 -15.319  -3.051  -7.888
  417    HB2  ALA  55          2HB       ALA  55 -16.890  -3.808  -7.620
  418    HB3  ALA  55          3HB       ALA  55 -15.574  -4.737  -8.337
  419    H    ALA  56           H        ALA  56 -14.143  -6.584  -6.734
  420    HA   ALA  56           HA       ALA  56 -11.646  -6.111  -5.528
  421    HB1  ALA  56          1HB       ALA  56 -11.854  -8.324  -6.137
  422    HB2  ALA  56          2HB       ALA  56 -10.883  -7.755  -7.496
  423    HB3  ALA  56          3HB       ALA  56 -12.628  -7.935  -7.673
  424    H    ASP  57           H        ASP  57 -12.723  -5.344  -8.830
  425    HA   ASP  57           HA       ASP  57 -11.681  -4.033 -10.485
  426    HB2  ASP  57          2HB       ASP  57 -10.686  -2.670  -7.976
  427    HB3  ASP  57          1HB       ASP  57 -10.557  -1.988  -9.596
  428    H    ASP  58           H        ASP  58 -10.327  -6.385 -10.148
  429    HA   ASP  58           HA       ASP  58  -7.531  -5.972  -9.494
  430    HB2  ASP  58          2HB       ASP  58  -8.680  -8.183  -9.341
  431    HB3  ASP  58          1HB       ASP  58  -8.783  -8.204 -11.100
  432    H    VAL  59           H        VAL  59  -6.191  -4.808 -10.756
  433    HA   VAL  59           HA       VAL  59  -6.496  -5.019 -13.723
  434    HB   VAL  59           HB       VAL  59  -5.565  -2.585 -12.191
  435   HG11  VAL  59          1HG1      VAL  59  -4.661  -2.821 -14.483
  436   HG12  VAL  59          2HG1      VAL  59  -5.793  -1.474 -14.377
  437   HG13  VAL  59          3HG1      VAL  59  -6.301  -2.999 -15.102
  438   HG21  VAL  59          1HG2      VAL  59  -8.237  -3.248 -13.455
  439   HG22  VAL  59          2HG2      VAL  59  -7.769  -1.628 -12.939
  440   HG23  VAL  59          3HG2      VAL  59  -7.926  -2.922 -11.750
  441    H    GLU  60           H        GLU  60  -4.570  -5.332 -14.867
  442    HA   GLU  60           HA       GLU  60  -2.380  -6.520 -13.511
  443    HB2  GLU  60          2HB       GLU  60  -1.304  -6.629 -15.623
  444    HB3  GLU  60          1HB       GLU  60  -3.026  -6.755 -15.967
  445    HG2  GLU  60          2HG       GLU  60  -3.034  -4.263 -16.306
  446    HG3  GLU  60          1HG       GLU  60  -1.280  -4.317 -16.222
  447    H    LEU  61           H        LEU  61  -2.945  -3.174 -14.439
  448    HA   LEU  61           HA       LEU  61  -1.593  -1.260 -14.140
  449    HB2  LEU  61          2HB       LEU  61  -0.895  -2.755 -11.595
  450    HB3  LEU  61          1HB       LEU  61  -0.784  -1.016 -11.852
  451    HG   LEU  61           HG       LEU  61  -3.312  -2.668 -11.899
  452   HD11  LEU  61          1HD1      LEU  61  -3.839  -1.701  -9.830
  453   HD12  LEU  61          2HD1      LEU  61  -2.695  -0.377 -10.052
  454   HD13  LEU  61          3HD1      LEU  61  -2.107  -1.998  -9.678
  455   HD21  LEU  61          1HD2      LEU  61  -4.257  -0.208 -11.944
  456   HD22  LEU  61          2HD2      LEU  61  -3.761  -0.981 -13.449
  457   HD23  LEU  61          3HD2      LEU  61  -2.688   0.169 -12.653
  458    H    SER  62           H        SER  62   0.844  -0.796 -13.030
  459    HA   SER  62           HA       SER  62   2.700  -2.754 -14.292
  460    HB2  SER  62          2HB       SER  62   2.166  -0.046 -15.148
  461    HB3  SER  62          1HB       SER  62   3.842  -0.195 -14.627
  462    HG   SER  62           HG       SER  62   2.670  -1.105 -16.861
  463    HA   PRO  63           HA       PRO  63   5.160  -2.437 -10.665
  464    HB2  PRO  63          2HB       PRO  63   7.700  -2.021 -11.726
  465    HB3  PRO  63          1HB       PRO  63   6.906  -3.599 -11.572
  466    HG2  PRO  63          2HG       PRO  63   7.185  -1.840 -13.945
  467    HG3  PRO  63          1HG       PRO  63   7.191  -3.609 -13.836
  468    HD2  PRO  63          2HD       PRO  63   5.034  -2.218 -14.735
  469    HD3  PRO  63          1HD       PRO  63   4.876  -3.753 -13.854
  470    H    GLU  64           H        GLU  64   5.486   0.145 -13.019
  471    HA   GLU  64           HA       GLU  64   7.014   1.983 -11.474
  472    HB2  GLU  64          2HB       GLU  64   6.472   2.252 -13.896
  473    HB3  GLU  64          1HB       GLU  64   4.819   2.639 -13.442
  474    HG2  GLU  64          2HG       GLU  64   5.674   4.516 -12.060
  475    HG3  GLU  64          1HG       GLU  64   7.298   4.163 -12.639
  476    H    HIS  65           H        HIS  65   3.596   1.152 -11.402
  477    HA   HIS  65           HA       HIS  65   2.743   3.406  -9.827
  478    HB2  HIS  65          2HB       HIS  65   1.150   1.998 -11.070
  479    HB3  HIS  65          1HB       HIS  65   1.545   0.627 -10.032
  480    HD1  HIS  65          1HD       HIS  65   0.469   4.260  -9.467
  481    HD2  HIS  65          2HD       HIS  65  -0.256   0.439  -7.958
  482    HE1  HIS  65          1HE       HIS  65  -1.246   4.530  -7.620
  483    HE2  HIS  65          2HE       HIS  65  -1.694   2.211  -6.696
  484    H    PHE  66           H        PHE  66   4.293   0.376  -9.016
  485    HA   PHE  66           HA       PHE  66   3.757   0.829  -6.129
  486    HB2  PHE  66          2HB       PHE  66   5.151  -1.467  -7.542
  487    HB3  PHE  66          1HB       PHE  66   4.759  -1.404  -5.823
  488    HD1  PHE  66          1HD       PHE  66   3.486  -1.984  -9.181
  489    HD2  PHE  66          2HD       PHE  66   2.360  -1.319  -5.090
  490    HE1  PHE  66          1HE       PHE  66   1.206  -2.823  -9.673
  491    HE2  PHE  66          2HE       PHE  66   0.079  -2.159  -5.582
  492    HZ   PHE  66           HZ       PHE  66  -0.498  -2.910  -7.875
  493    H    ARG  67           H        ARG  67   5.825   2.152  -8.177
  494    HA   ARG  67           HA       ARG  67   8.433   1.615  -7.255
  495    HB2  ARG  67          2HB       ARG  67   7.847   3.076  -9.206
  496    HB3  ARG  67          1HB       ARG  67   7.349   4.326  -8.071
  497    HG2  ARG  67          2HG       ARG  67   9.561   4.930  -8.566
  498    HG3  ARG  67          1HG       ARG  67   9.735   4.023  -7.067
  499    HD2  ARG  67          2HD       ARG  67  10.368   2.014  -8.304
  500    HD3  ARG  67          1HD       ARG  67  10.072   2.833  -9.834
  501    HE   ARG  67           HE       ARG  67  12.094   4.084  -9.519
  502   HH11  ARG  67          1HH1      ARG  67  14.135   4.230  -8.578
  503   HH12  ARG  67          2HH1      ARG  67  14.459   3.390  -7.099
  504   HH21  ARG  67          1HH2      ARG  67  11.275   2.049  -6.846
  505   HH22  ARG  67          2HH2      ARG  67  12.843   2.157  -6.122
  506    H    SER  68           H        SER  68   5.952   3.763  -5.876
  507    HA   SER  68           HA       SER  68   7.600   3.859  -3.390
  508    HB2  SER  68          2HB       SER  68   7.171   6.235  -3.119
  509    HB3  SER  68          1HB       SER  68   7.917   5.973  -4.693
  510    HG   SER  68           HG       SER  68   5.116   5.944  -4.406
  511    H    ILE  69           H        ILE  69   6.339   4.192  -1.451
  512    HA   ILE  69           HA       ILE  69   3.813   2.877  -1.421
  513    HB   ILE  69           HB       ILE  69   5.020   4.761   0.624
  514   HG12  ILE  69          2HG1      ILE  69   5.113   1.746   0.504
  515   HG13  ILE  69          1HG1      ILE  69   6.423   2.780  -0.045
  516   HG21  ILE  69          1HG2      ILE  69   3.154   4.397   1.806
  517   HG22  ILE  69          2HG2      ILE  69   3.468   2.664   1.738
  518   HG23  ILE  69          3HG2      ILE  69   2.500   3.433   0.482
  519   HD11  ILE  69          1HD1      ILE  69   6.073   1.857   2.549
  520   HD12  ILE  69          2HD1      ILE  69   5.469   3.513   2.616
  521   HD13  ILE  69          3HD1      ILE  69   7.114   3.197   2.067
  522    H    ARG  70           H        ARG  70   4.694   6.308  -1.528
  523    HA   ARG  70           HA       ARG  70   2.120   7.396  -1.003
  524    HB2  ARG  70          2HB       ARG  70   4.366   8.465  -2.737
  525    HB3  ARG  70          1HB       ARG  70   2.968   9.407  -2.217
  526    HG2  ARG  70          2HG       ARG  70   3.577   8.933   0.156
  527    HG3  ARG  70          1HG       ARG  70   5.028   8.106  -0.412
  528    HD2  ARG  70          2HD       ARG  70   4.328  11.017  -0.897
  529    HD3  ARG  70          1HD       ARG  70   5.575  10.415   0.196
  530    HE   ARG  70           HE       ARG  70   6.260   9.325  -2.259
  531   HH11  ARG  70          1HH1      ARG  70   7.637  10.375  -3.711
  532   HH12  ARG  70          2HH1      ARG  70   7.787  12.099  -3.650
  533   HH21  ARG  70          1HH2      ARG  70   5.561  12.465  -1.016
  534   HH22  ARG  70          2HH2      ARG  70   6.612  13.282  -2.123
  535    H    SER  71           H        SER  71   3.553   6.218  -4.034
  536    HA   SER  71           HA       SER  71   1.536   7.193  -5.790
  537    HB2  SER  71          2HB       SER  71   2.342   5.497  -7.343
  538    HB3  SER  71          1HB       SER  71   3.718   6.212  -6.510
  539    HG   SER  71           HG       SER  71   3.859   3.947  -6.516
  540    H    ILE  72           H        ILE  72   1.706   4.282  -3.779
  541    HA   ILE  72           HA       ILE  72  -0.601   2.978  -4.838
  542    HB   ILE  72           HB       ILE  72   0.550   2.889  -2.033
  543   HG12  ILE  72          2HG1      ILE  72   1.044   1.066  -4.409
  544   HG13  ILE  72          1HG1      ILE  72   2.158   2.326  -3.878
  545   HG21  ILE  72          1HG2      ILE  72  -1.764   1.685  -3.244
  546   HG22  ILE  72          2HG2      ILE  72  -1.179   1.529  -1.588
  547   HG23  ILE  72          3HG2      ILE  72  -0.593   0.432  -2.837
  548   HD11  ILE  72          1HD1      ILE  72   3.056   0.796  -2.485
  549   HD12  ILE  72          2HD1      ILE  72   1.742  -0.341  -2.786
  550   HD13  ILE  72          3HD1      ILE  72   1.567   0.900  -1.546
  551    H    ASP  73           H        ASP  73  -0.153   5.390  -2.280
  552    HA   ASP  73           HA       ASP  73  -2.785   5.394  -1.233
  553    HB2  ASP  73          2HB       ASP  73  -0.788   6.656  -0.317
  554    HB3  ASP  73          1HB       ASP  73  -1.040   7.844  -1.597
  555    H    ALA  74           H        ALA  74  -1.433   6.986  -4.098
  556    HA   ALA  74           HA       ALA  74  -3.692   8.617  -4.703
  557    HB1  ALA  74          1HB       ALA  74  -2.010   7.319  -6.839
  558    HB2  ALA  74          2HB       ALA  74  -1.326   8.566  -5.797
  559    HB3  ALA  74          3HB       ALA  74  -2.714   8.935  -6.822
  560    H    PHE  75           H        PHE  75  -2.889   5.275  -5.640
  561    HA   PHE  75           HA       PHE  75  -5.226   4.878  -7.263
  562    HB2  PHE  75          2HB       PHE  75  -3.231   3.380  -7.286
  563    HB3  PHE  75          1HB       PHE  75  -3.693   2.803  -5.688
  564    HD1  PHE  75          1HD       PHE  75  -4.697   2.948  -9.249
  565    HD2  PHE  75          2HD       PHE  75  -5.538   1.285  -5.379
  566    HE1  PHE  75          1HE       PHE  75  -6.269   1.333 -10.285
  567    HE2  PHE  75          2HE       PHE  75  -7.110  -0.330  -6.414
  568    HZ   PHE  75           HZ       PHE  75  -7.475  -0.306  -8.867
  569    H    VAL  76           H        VAL  76  -4.547   4.130  -3.844
  570    HA   VAL  76           HA       VAL  76  -7.134   3.060  -3.264
  571    HB   VAL  76           HB       VAL  76  -5.018   4.339  -1.517
  572   HG11  VAL  76          1HG1      VAL  76  -7.638   3.010  -0.816
  573   HG12  VAL  76          2HG1      VAL  76  -7.076   4.611  -0.338
  574   HG13  VAL  76          3HG1      VAL  76  -6.313   3.171   0.337
  575   HG21  VAL  76          1HG2      VAL  76  -4.281   2.255  -2.470
  576   HG22  VAL  76          2HG2      VAL  76  -5.838   1.491  -2.149
  577   HG23  VAL  76          3HG2      VAL  76  -4.768   1.909  -0.810
  578    H    VAL  77           H        VAL  77  -5.790   6.349  -3.036
  579    HA   VAL  77           HA       VAL  77  -7.982   7.585  -1.745
  580    HB   VAL  77           HB       VAL  77  -5.982   8.627  -3.759
  581   HG11  VAL  77          1HG1      VAL  77  -7.731  10.162  -3.985
  582   HG12  VAL  77          2HG1      VAL  77  -6.771  10.874  -2.689
  583   HG13  VAL  77          3HG1      VAL  77  -8.240   9.976  -2.308
  584   HG21  VAL  77          1HG2      VAL  77  -5.739   7.902  -1.081
  585   HG22  VAL  77          2HG2      VAL  77  -5.963   9.650  -1.017
  586   HG23  VAL  77          3HG2      VAL  77  -4.642   8.965  -1.964
  587    H    GLY  78           H        GLY  78  -7.371   6.994  -5.200
  588    HA2  GLY  78          2HA       GLY  78  -9.669   8.364  -6.189
  589    HA3  GLY  78          1HA       GLY  78  -8.818   7.079  -7.041
  590    H    ALA  79           H        ALA  79  -9.273   5.055  -4.971
  591    HA   ALA  79           HA       ALA  79 -12.019   4.351  -5.752
  592    HB1  ALA  79          1HB       ALA  79  -9.668   2.905  -5.136
  593    HB2  ALA  79          2HB       ALA  79 -11.239   2.247  -5.594
  594    HB3  ALA  79          3HB       ALA  79 -10.847   2.490  -3.891
  595    H    THR  80           H        THR  80 -10.218   4.796  -2.720
  596    HA   THR  80           HA       THR  80 -12.782   5.558  -1.419
  597    HB   THR  80           HB       THR  80 -12.139   3.119  -0.932
  598    HG1  THR  80          1HG       THR  80 -12.044   4.250   1.523
  599   HG21  THR  80          1HG2      THR  80 -10.190   2.610   0.139
  600   HG22  THR  80          2HG2      THR  80 -10.191   4.109   1.067
  601   HG23  THR  80          3HG2      THR  80  -9.637   4.109  -0.607
  602    H    THR  81           H        THR  81 -12.455   7.053   0.346
  603    HA   THR  81           HA       THR  81  -9.661   8.051   0.627
  604    HB   THR  81           HB       THR  81 -10.867   9.463  -0.993
  605    HG1  THR  81          1HG       THR  81  -9.985  11.155  -0.110
  606   HG21  THR  81          1HG2      THR  81 -13.051   8.971   0.663
  607   HG22  THR  81          2HG2      THR  81 -13.007  10.108  -0.685
  608   HG23  THR  81          3HG2      THR  81 -12.677  10.670   0.954
  609    HA   PRO  82           HA       PRO  82 -11.489   7.342   4.815
  610    HB2  PRO  82          2HB       PRO  82  -8.641   7.143   5.551
  611    HB3  PRO  82          1HB       PRO  82  -9.952   5.981   5.817
  612    HG2  PRO  82          2HG       PRO  82  -7.979   5.574   4.034
  613    HG3  PRO  82          1HG       PRO  82  -9.622   4.949   3.815
  614    HD2  PRO  82          2HD       PRO  82  -8.303   7.282   2.487
  615    HD3  PRO  82          1HD       PRO  82  -9.500   6.139   1.839
  616    HA   PRO  83           HA       PRO  83 -10.738  11.193   6.875
  617    HB2  PRO  83          2HB       PRO  83  -9.088  10.021   9.048
  618    HB3  PRO  83          1HB       PRO  83 -10.616  10.915   9.150
  619    HG2  PRO  83          2HG       PRO  83 -10.494   8.277   9.558
  620    HG3  PRO  83          1HG       PRO  83 -11.891   9.048   8.788
  621    HD2  PRO  83          2HD       PRO  83  -9.698   7.445   7.538
  622    HD3  PRO  83          1HD       PRO  83 -11.416   7.546   7.092
  623    H    VAL  84           H        VAL  84  -9.170  12.898   7.019
  624    HA   VAL  84           HA       VAL  84  -6.593  12.223   5.756
  625    HB   VAL  84           HB       VAL  84  -6.333  14.589   5.410
  626   HG11  VAL  84          1HG1      VAL  84  -7.979  14.733   3.854
  627   HG12  VAL  84          2HG1      VAL  84  -9.254  14.575   5.063
  628   HG13  VAL  84          3HG1      VAL  84  -8.459  13.136   4.427
  629   HG21  VAL  84          1HG2      VAL  84  -6.907  15.535   7.507
  630   HG22  VAL  84          2HG2      VAL  84  -8.500  14.775   7.507
  631   HG23  VAL  84          3HG2      VAL  84  -8.162  16.116   6.413
  632    H    GLU  85           H        GLU  85  -4.741  12.014   6.869
  633    HA   GLU  85           HA       GLU  85  -4.471  13.353   9.505
  634    HB2  GLU  85          2HB       GLU  85  -5.192  10.980   9.868
  635    HB3  GLU  85          1HB       GLU  85  -3.747  10.451   9.007
  636    HG2  GLU  85          2HG       GLU  85  -2.350  11.684  10.664
  637    HG3  GLU  85          1HG       GLU  85  -3.816  12.091  11.556
  638    H    ALA  86           H        ALA  86  -2.342  14.028   9.926
  639    HA   ALA  86           HA       ALA  86  -0.595  14.369   7.688
  640    HB1  ALA  86          1HB       ALA  86   1.109  14.829   9.660
  641    HB2  ALA  86          2HB       ALA  86  -0.348  14.767  10.651
  642    HB3  ALA  86          3HB       ALA  86  -0.216  15.951   9.351
  643    H    LYS  87           H        LYS  87   1.229  13.206   7.041
  644    HA   LYS  87           HA       LYS  87   1.358  10.422   7.948
  645    HB2  LYS  87          2HB       LYS  87   1.664  11.175   5.537
  646    HB3  LYS  87          1HB       LYS  87   3.231  11.823   6.024
  647    HG2  LYS  87          2HG       LYS  87   3.897   9.576   6.834
  648    HG3  LYS  87          1HG       LYS  87   2.344   8.935   6.295
  649    HD2  LYS  87          2HD       LYS  87   2.909   9.767   3.974
  650    HD3  LYS  87          1HD       LYS  87   4.528  10.131   4.571
  651    HE2  LYS  87          2HE       LYS  87   4.566   7.929   3.543
  652    HE3  LYS  87          1HE       LYS  87   4.740   7.736   5.288
  653    HZ1  LYS  87          1HZ       LYS  87   3.023   6.355   5.135
  654    HZ2  LYS  87          2HZ       LYS  87   2.638   6.853   3.557
  655    HZ3  LYS  87          3HZ       LYS  87   2.050   7.722   4.893
  656    H    LEU  88           H        LEU  88   2.954   9.541   9.252
  657    HA   LEU  88           HA       LEU  88   4.365  11.186  11.071
  658    HB2  LEU  88          2HB       LEU  88   5.089   8.372  10.198
  659    HB3  LEU  88          1HB       LEU  88   5.595   9.159  11.693
  660    HG   LEU  88           HG       LEU  88   2.742   8.510  10.895
  661   HD11  LEU  88          1HD1      LEU  88   3.803   7.460  13.413
  662   HD12  LEU  88          2HD1      LEU  88   4.690   6.873  12.007
  663   HD13  LEU  88          3HD1      LEU  88   2.949   6.619  12.120
  664   HD21  LEU  88          1HD2      LEU  88   3.956  10.129  13.112
  665   HD22  LEU  88          2HD2      LEU  88   2.487   9.207  13.433
  666   HD23  LEU  88          3HD2      LEU  88   2.496  10.443  12.175
  667    H    GLN  89           H        GLN  89   5.369   9.824   7.958
  668    HA   GLN  89           HA       GLN  89   7.650  11.724   7.967
  669    HB2  GLN  89          2HB       GLN  89   7.899   8.744   7.446
  670    HB3  GLN  89          1HB       GLN  89   9.167   9.925   7.115
  671    HG2  GLN  89          2HG       GLN  89   9.215  10.564   9.490
  672    HG3  GLN  89          1HG       GLN  89   7.924   9.411   9.834
  673   HE21  GLN  89          1HE2      GLN  89  10.476   9.175  11.102
  674   HE22  GLN  89          2HE2      GLN  89  11.235   7.769  10.527
  675    H1   PN7 101          3HO       SAT 101   2.007  -8.658 -13.893
  676    H2   PN7 101          1H1       SAT 101   3.862  -8.393 -11.425
  677    H3   PN7 101          2H1       SAT 101   4.086  -7.349 -10.023
  678    H5   PN7 101          1HE1      SAT 101   4.195  -5.478 -11.333
  679    H6   PN7 101          2HE1      SAT 101   2.960  -5.009 -10.164
  680    H7   PN7 101          3HE1      SAT 101   2.709  -4.702 -11.882
  681    H8   PN7 101          2HE2      SAT 101   0.485  -5.976 -11.082
  682    H9   PN7 101          3HE2      SAT 101   1.225  -6.522  -9.578
  683    H10  PN7 101          1HE2      SAT 101   0.626  -7.702 -10.744
  684    H11  PN7 101          3H        SAT 101   1.405  -6.579 -13.163
  685    H12  PN7 101          5H        SAT 101   3.339  -4.631 -13.850
  686    H13  PN7 101          1H6       SAT 101   2.543  -6.442 -15.993
  687    H14  PN7 101          2H6       SAT 101   2.733  -4.694 -16.133
  688    H15  PN7 101          1H7       SAT 101   5.316  -5.857 -15.684
  689    H16  PN7 101          2H7       SAT 101   4.745  -4.975 -17.101
  690    H17  PN7 101          9H        SAT 101   5.945  -7.991 -16.163
  691    H18  PN7 101          1H10      SAT 101   5.288  -9.696 -18.205
  692    H19  PN7 101          2H10      SAT 101   5.944  -8.307 -19.073
  693    H20  PN7 101          1H11      SAT 101   8.003  -8.499 -17.598
  694    H21  PN7 101          2H11      SAT 101   7.770  -9.832 -18.727
  695    H22  PN7 101          2HS1      SAT 101   6.471 -10.466 -16.066
  Start of MODEL   20
    1    H1   MET   1          1HT       MET   1   0.842  14.600   0.078
    2    H2   MET   1          2HT       MET   1  -0.605  14.024  -0.601
    3    H3   MET   1          3HT       MET   1   0.888  13.581  -1.278
    4    HA   MET   1           HA       MET   1   0.438  11.704  -0.096
    5    HB2  MET   1          2HB       MET   1   1.853  13.643   1.738
    6    HB3  MET   1          1HB       MET   1   1.643  11.941   2.154
    7    HG2  MET   1          2HG       MET   1   2.748  11.297   0.037
    8    HG3  MET   1          1HG       MET   1   2.999  13.002  -0.338
    9    HE1  MET   1          1HE       MET   1   5.021  10.343   2.742
   10    HE2  MET   1          2HE       MET   1   3.622  10.026   1.719
   11    HE3  MET   1          3HE       MET   1   3.429  10.964   3.198
   12    H    GLN   2           H        GLN   2  -1.984  12.080  -0.060
   13    HA   GLN   2           HA       GLN   2  -3.068  12.985   2.531
   14    HB2  GLN   2          2HB       GLN   2  -4.471  11.784   0.119
   15    HB3  GLN   2          1HB       GLN   2  -5.263  12.528   1.509
   16    HG2  GLN   2          2HG       GLN   2  -3.365  13.924  -0.400
   17    HG3  GLN   2          1HG       GLN   2  -5.117  14.129  -0.354
   18   HE21  GLN   2          1HE2      GLN   2  -2.493  15.815   0.486
   19   HE22  GLN   2          2HE2      GLN   2  -3.012  16.537   1.931
   20    H    HIS   3           H        HIS   3  -3.310  11.579   4.208
   21    HA   HIS   3           HA       HIS   3  -3.393   9.537   5.377
   22    HB2  HIS   3          2HB       HIS   3  -4.675   8.349   2.918
   23    HB3  HIS   3          1HB       HIS   3  -5.013   8.001   4.614
   24    HD1  HIS   3          1HD       HIS   3  -6.308   9.903   5.972
   25    HD2  HIS   3          2HD       HIS   3  -6.174  10.455   1.839
   26    HE1  HIS   3          1HE       HIS   3  -8.051  11.661   5.426
   27    HE2  HIS   3          2HE       HIS   3  -7.977  12.003   2.914
   28    H    ALA   4           H        ALA   4  -1.301  10.146   3.130
   29    HA   ALA   4           HA       ALA   4  -0.461   7.649   2.026
   30    HB1  ALA   4          1HB       ALA   4   1.581   9.708   2.708
   31    HB2  ALA   4          2HB       ALA   4   0.292  10.177   1.600
   32    HB3  ALA   4          3HB       ALA   4   1.342   8.816   1.205
   33    H    SER   5           H        SER   5   0.398   9.295   5.060
   34    HA   SER   5           HA       SER   5   2.481   7.526   5.843
   35    HB2  SER   5          2HB       SER   5   0.528   8.962   7.660
   36    HB3  SER   5          1HB       SER   5   2.126   8.367   8.101
   37    HG   SER   5           HG       SER   5   1.819  10.694   7.440
   38    H    VAL   6           H        VAL   6  -1.028   7.316   6.316
   39    HA   VAL   6           HA       VAL   6  -0.968   5.012   8.021
   40    HB   VAL   6           HB       VAL   6  -3.086   6.013   6.111
   41   HG11  VAL   6          1HG1      VAL   6  -2.962   3.646   7.924
   42   HG12  VAL   6          2HG1      VAL   6  -3.816   3.843   6.393
   43   HG13  VAL   6          3HG1      VAL   6  -4.476   4.551   7.868
   44   HG21  VAL   6          1HG2      VAL   6  -2.481   7.502   8.018
   45   HG22  VAL   6          2HG2      VAL   6  -2.842   6.182   9.130
   46   HG23  VAL   6          3HG2      VAL   6  -4.127   6.884   8.148
   47    H    ILE   7           H        ILE   7  -1.024   5.407   4.518
   48    HA   ILE   7           HA       ILE   7  -1.429   2.660   3.856
   49    HB   ILE   7           HB       ILE   7   0.012   4.840   2.327
   50   HG12  ILE   7          2HG1      ILE   7  -2.835   3.806   2.124
   51   HG13  ILE   7          1HG1      ILE   7  -2.373   5.287   2.962
   52   HG21  ILE   7          1HG2      ILE   7  -1.033   2.115   1.506
   53   HG22  ILE   7          2HG2      ILE   7   0.628   2.698   1.400
   54   HG23  ILE   7          3HG2      ILE   7  -0.616   3.381   0.351
   55   HD11  ILE   7          1HD1      ILE   7  -1.305   5.094   0.229
   56   HD12  ILE   7          2HD1      ILE   7  -2.121   6.438   1.027
   57   HD13  ILE   7          3HD1      ILE   7  -3.067   5.136   0.306
   58    H    ALA   8           H        ALA   8   1.530   4.497   4.559
   59    HA   ALA   8           HA       ALA   8   3.370   2.472   3.723
   60    HB1  ALA   8          1HB       ALA   8   4.809   3.647   5.617
   61    HB2  ALA   8          2HB       ALA   8   3.501   4.828   5.560
   62    HB3  ALA   8          3HB       ALA   8   4.443   4.487   4.109
   63    H    GLN   9           H        GLN   9   2.076   3.180   6.987
   64    HA   GLN   9           HA       GLN   9   3.315   0.830   8.126
   65    HB2  GLN   9          2HB       GLN   9   2.298   1.425  10.145
   66    HB3  GLN   9          1HB       GLN   9   2.458   2.980   9.333
   67    HG2  GLN   9          2HG       GLN   9   0.235   3.027  10.048
   68    HG3  GLN   9          1HG       GLN   9   0.085   2.446   8.394
   69   HE21  GLN   9          1HE2      GLN   9  -1.755   1.076   8.651
   70   HE22  GLN   9          2HE2      GLN   9  -1.771  -0.273   9.681
   71    H    PHE  10           H        PHE  10   0.142   1.536   6.760
   72    HA   PHE  10           HA       PHE  10  -1.116  -0.918   7.535
   73    HB2  PHE  10          2HB       PHE  10  -2.290   1.139   6.683
   74    HB3  PHE  10          1HB       PHE  10  -1.694   0.744   5.072
   75    HD1  PHE  10          1HD       PHE  10  -2.633  -1.069   3.789
   76    HD2  PHE  10          2HD       PHE  10  -3.887  -0.369   7.838
   77    HE1  PHE  10          1HE       PHE  10  -4.538  -2.624   3.469
   78    HE2  PHE  10          2HE       PHE  10  -5.790  -1.926   7.518
   79    HZ   PHE  10           HZ       PHE  10  -6.117  -3.051   5.333
   80    H    VAL  11           H        VAL  11   0.426   0.027   4.450
   81    HA   VAL  11           HA       VAL  11   0.155  -2.597   3.291
   82    HB   VAL  11           HB       VAL  11   0.599  -0.357   2.088
   83   HG11  VAL  11          1HG1      VAL  11   2.639   0.099   3.558
   84   HG12  VAL  11          2HG1      VAL  11   2.870   0.332   1.825
   85   HG13  VAL  11          3HG1      VAL  11   3.475  -1.129   2.607
   86   HG21  VAL  11          1HG2      VAL  11   1.807  -3.032   1.522
   87   HG22  VAL  11          2HG2      VAL  11   2.274  -1.685   0.483
   88   HG23  VAL  11          3HG2      VAL  11   0.576  -2.145   0.622
   89    H    VAL  12           H        VAL  12   2.804  -0.969   5.024
   90    HA   VAL  12           HA       VAL  12   4.708  -3.087   4.721
   91    HB   VAL  12           HB       VAL  12   4.444  -1.016   6.904
   92   HG11  VAL  12          1HG1      VAL  12   5.947  -2.468   7.865
   93   HG12  VAL  12          2HG1      VAL  12   7.064  -1.582   6.832
   94   HG13  VAL  12          3HG1      VAL  12   6.440  -3.150   6.318
   95   HG21  VAL  12          1HG2      VAL  12   6.491  -0.915   4.732
   96   HG22  VAL  12          2HG2      VAL  12   5.691   0.409   5.576
   97   HG23  VAL  12          3HG2      VAL  12   4.836  -0.476   4.315
   98    H    GLU  13           H        GLU  13   2.232  -2.430   7.166
   99    HA   GLU  13           HA       GLU  13   2.926  -4.418   9.045
  100    HB2  GLU  13          2HB       GLU  13   1.143  -2.711   9.382
  101    HB3  GLU  13          1HB       GLU  13   0.129  -3.600   8.253
  102    HG2  GLU  13          2HG       GLU  13   0.317  -5.609   9.710
  103    HG3  GLU  13          1HG       GLU  13   1.232  -4.642  10.864
  104    H    GLU  14           H        GLU  14   1.399  -4.714   5.910
  105    HA   GLU  14           HA       GLU  14   0.327  -7.354   6.254
  106    HB2  GLU  14          2HB       GLU  14   1.336  -5.964   3.750
  107    HB3  GLU  14          1HB       GLU  14   0.369  -7.438   3.768
  108    HG2  GLU  14          2HG       GLU  14  -1.440  -6.222   4.943
  109    HG3  GLU  14          1HG       GLU  14  -0.474  -4.748   4.883
  110    H    PHE  15           H        PHE  15   3.535  -6.120   5.572
  111    HA   PHE  15           HA       PHE  15   4.643  -8.822   5.996
  112    HB2  PHE  15          2HB       PHE  15   5.917  -8.868   3.949
  113    HB3  PHE  15          1HB       PHE  15   4.240  -8.558   3.503
  114    HD1  PHE  15          1HD       PHE  15   7.622  -7.353   3.324
  115    HD2  PHE  15          2HD       PHE  15   3.518  -6.106   3.194
  116    HE1  PHE  15          1HE       PHE  15   8.300  -5.234   2.230
  117    HE2  PHE  15          2HE       PHE  15   4.192  -3.987   2.100
  118    HZ   PHE  15           HZ       PHE  15   6.585  -3.552   1.616
  119    H    LEU  16           H        LEU  16   4.811  -6.706   7.753
  120    HA   LEU  16           HA       LEU  16   7.204  -5.153   7.238
  121    HB2  LEU  16          2HB       LEU  16   6.774  -4.050   9.259
  122    HB3  LEU  16          1HB       LEU  16   5.177  -4.451   8.663
  123    HG   LEU  16           HG       LEU  16   6.715  -6.067  10.717
  124   HD11  LEU  16          1HD1      LEU  16   5.995  -3.887  11.587
  125   HD12  LEU  16          2HD1      LEU  16   5.035  -5.185  12.294
  126   HD13  LEU  16          3HD1      LEU  16   4.357  -4.188  11.008
  127   HD21  LEU  16          1HD2      LEU  16   4.077  -6.375   9.310
  128   HD22  LEU  16          2HD2      LEU  16   4.208  -6.907  10.985
  129   HD23  LEU  16          3HD2      LEU  16   5.247  -7.617   9.753
  130    HA   PRO  17           HA       PRO  17  10.004  -8.231   8.834
  131    HB2  PRO  17          2HB       PRO  17  12.227  -6.663   9.114
  132    HB3  PRO  17          1HB       PRO  17  11.638  -7.215   7.537
  133    HG2  PRO  17          2HG       PRO  17  11.296  -4.573   8.864
  134    HG3  PRO  17          1HG       PRO  17  11.622  -4.949   7.165
  135    HD2  PRO  17          2HD       PRO  17   9.137  -4.294   8.107
  136    HD3  PRO  17          1HD       PRO  17   9.405  -5.328   6.687
  137    H    ASP  18           H        ASP  18  12.101  -7.411  10.703
  138    HA   ASP  18           HA       ASP  18  10.500  -7.355  13.149
  139    HB2  ASP  18          2HB       ASP  18  12.651  -7.616  14.284
  140    HB3  ASP  18          1HB       ASP  18  12.554  -8.753  12.945
  141    H    VAL  19           H        VAL  19  11.000  -5.011  11.106
  142    HA   VAL  19           HA       VAL  19  11.801  -2.968  13.141
  143    HB   VAL  19           HB       VAL  19  11.794  -2.732  10.121
  144   HG11  VAL  19          1HG1      VAL  19  13.380  -0.787  10.792
  145   HG12  VAL  19          2HG1      VAL  19  12.668  -0.955  12.396
  146   HG13  VAL  19          3HG1      VAL  19  11.646  -0.554  11.016
  147   HG21  VAL  19          1HG2      VAL  19  13.572  -4.173  10.398
  148   HG22  VAL  19          2HG2      VAL  19  13.823  -3.708  12.080
  149   HG23  VAL  19          3HG2      VAL  19  14.401  -2.664  10.780
  150    H    ALA  20           H        ALA  20  10.331  -1.361  13.633
  151    HA   ALA  20           HA       ALA  20   7.593  -1.680  12.733
  152    HB1  ALA  20          1HB       ALA  20   8.833  -0.506  14.925
  153    HB2  ALA  20          2HB       ALA  20   7.113  -0.416  14.545
  154    HB3  ALA  20          3HB       ALA  20   8.201   0.870  14.021
  155    HA   PRO  21           HA       PRO  21   7.765   0.783   8.989
  156    HB2  PRO  21          2HB       PRO  21   5.250   2.034   9.989
  157    HB3  PRO  21          1HB       PRO  21   5.586   1.276   8.422
  158    HG2  PRO  21          2HG       PRO  21   4.132   0.071  10.332
  159    HG3  PRO  21          1HG       PRO  21   5.144  -0.819   9.187
  160    HD2  PRO  21          2HD       PRO  21   5.563  -0.366  12.080
  161    HD3  PRO  21          1HD       PRO  21   6.215  -1.634  11.018
  162    H    ALA  22           H        ALA  22   7.042   2.276  12.098
  163    HA   ALA  22           HA       ALA  22   7.552   4.999  11.319
  164    HB1  ALA  22          1HB       ALA  22   7.916   3.758  14.061
  165    HB2  ALA  22          2HB       ALA  22   6.354   4.260  13.413
  166    HB3  ALA  22          3HB       ALA  22   7.618   5.458  13.696
  167    H    ASP  23           H        ASP  23   9.596   2.303  12.024
  168    HA   ASP  23           HA       ASP  23  11.968   4.054  12.378
  169    HB2  ASP  23          2HB       ASP  23  11.602   1.055  12.641
  170    HB3  ASP  23          1HB       ASP  23  13.146   1.883  12.849
  171    H    VAL  24           H        VAL  24  10.245   2.844   9.886
  172    HA   VAL  24           HA       VAL  24  12.649   2.261   8.213
  173    HB   VAL  24           HB       VAL  24   9.721   1.737   7.604
  174   HG11  VAL  24          1HG1      VAL  24  10.782   0.209   5.871
  175   HG12  VAL  24          2HG1      VAL  24  12.319   0.994   6.237
  176   HG13  VAL  24          3HG1      VAL  24  10.983   1.934   5.571
  177   HG21  VAL  24          1HG2      VAL  24  10.254   0.268   9.383
  178   HG22  VAL  24          2HG2      VAL  24  11.903   0.029   8.804
  179   HG23  VAL  24          3HG2      VAL  24  10.550  -0.696   7.935
  180    H    ASP  25           H        ASP  25  13.117   3.642   6.509
  181    HA   ASP  25           HA       ASP  25  11.881   6.252   6.527
  182    HB2  ASP  25          2HB       ASP  25  14.263   5.811   5.866
  183    HB3  ASP  25          1HB       ASP  25  13.666   5.042   4.395
  184    H    VAL  26           H        VAL  26   9.714   6.193   5.972
  185    HA   VAL  26           HA       VAL  26   8.551   4.542   3.963
  186    HB   VAL  26           HB       VAL  26   6.632   6.020   4.084
  187   HG11  VAL  26          1HG1      VAL  26   6.809   4.674   6.041
  188   HG12  VAL  26          2HG1      VAL  26   6.494   6.304   6.633
  189   HG13  VAL  26          3HG1      VAL  26   8.128   5.649   6.685
  190   HG21  VAL  26          1HG2      VAL  26   8.713   7.964   5.026
  191   HG22  VAL  26          2HG2      VAL  26   7.057   8.149   5.608
  192   HG23  VAL  26          3HG2      VAL  26   7.397   8.207   3.878
  193    H    ASP  27           H        ASP  27  10.940   6.679   3.434
  194    HA   ASP  27           HA       ASP  27   9.833   7.792   0.913
  195    HB2  ASP  27          2HB       ASP  27  12.466   8.257   2.350
  196    HB3  ASP  27          1HB       ASP  27  12.019   9.020   0.824
  197    H    LEU  28           H        LEU  28  10.942   4.928   1.768
  198    HA   LEU  28           HA       LEU  28  12.957   4.541  -0.358
  199    HB2  LEU  28          2HB       LEU  28  13.171   3.434   1.885
  200    HB3  LEU  28          1HB       LEU  28  11.721   2.505   1.516
  201    HG   LEU  28           HG       LEU  28  13.033   1.874  -0.680
  202   HD11  LEU  28          1HD1      LEU  28  15.489   1.710  -0.205
  203   HD12  LEU  28          2HD1      LEU  28  15.234   2.696   1.234
  204   HD13  LEU  28          3HD1      LEU  28  14.919   3.371  -0.365
  205   HD21  LEU  28          1HD2      LEU  28  12.434   0.159   0.845
  206   HD22  LEU  28          2HD2      LEU  28  13.494   0.794   2.103
  207   HD23  LEU  28          3HD2      LEU  28  14.184   0.011   0.681
  208    H    ASP  29           H        ASP  29  12.530   3.508  -2.285
  209    HA   ASP  29           HA       ASP  29   9.808   3.319  -3.179
  210    HB2  ASP  29          2HB       ASP  29  12.379   2.163  -4.308
  211    HB3  ASP  29          1HB       ASP  29  10.828   2.102  -5.144
  212    H    LEU  30           H        LEU  30   8.390   1.724  -2.646
  213    HA   LEU  30           HA       LEU  30   9.255  -0.601  -1.173
  214    HB2  LEU  30          2HB       LEU  30   6.858  -1.318  -1.422
  215    HB3  LEU  30          1HB       LEU  30   7.043   0.308  -0.763
  216    HG   LEU  30           HG       LEU  30   6.954   0.256  -3.693
  217   HD11  LEU  30          1HD1      LEU  30   4.496  -0.578  -2.122
  218   HD12  LEU  30          2HD1      LEU  30   5.415  -1.631  -3.198
  219   HD13  LEU  30          3HD1      LEU  30   4.556  -0.237  -3.853
  220   HD21  LEU  30          1HD2      LEU  30   5.096   1.661  -1.776
  221   HD22  LEU  30          2HD2      LEU  30   5.638   2.194  -3.367
  222   HD23  LEU  30          3HD2      LEU  30   6.756   2.210  -2.003
  223    H    VAL  31           H        VAL  31   9.853   0.012  -4.272
  224    HA   VAL  31           HA       VAL  31   8.848  -2.175  -5.764
  225    HB   VAL  31           HB       VAL  31  11.503  -0.724  -5.958
  226   HG11  VAL  31          1HG1      VAL  31  11.067  -1.762  -8.434
  227   HG12  VAL  31          2HG1      VAL  31  10.411  -3.053  -7.429
  228   HG13  VAL  31          3HG1      VAL  31  12.084  -2.537  -7.220
  229   HG21  VAL  31          1HG2      VAL  31  10.429   0.753  -7.329
  230   HG22  VAL  31          2HG2      VAL  31   8.999   0.212  -6.449
  231   HG23  VAL  31          3HG2      VAL  31   9.387  -0.488  -8.022
  232    H    ASP  32           H        ASP  32  11.702  -1.935  -3.671
  233    HA   ASP  32           HA       ASP  32  12.773  -4.520  -4.146
  234    HB2  ASP  32          2HB       ASP  32  13.806  -2.694  -2.702
  235    HB3  ASP  32          1HB       ASP  32  12.658  -3.148  -1.441
  236    H    ASN  33           H        ASN  33  10.078  -3.390  -2.219
  237    HA   ASN  33           HA       ASN  33   9.519  -6.038  -1.087
  238    HB2  ASN  33          2HB       ASN  33   7.807  -3.544  -1.077
  239    HB3  ASN  33          1HB       ASN  33   7.616  -4.951  -0.037
  240   HD21  ASN  33          1HD2      ASN  33  10.925  -4.294  -0.553
  241   HD22  ASN  33          2HD2      ASN  33  11.223  -3.435   0.879
  242    H    GLY  34           H        GLY  34   9.449  -5.127  -4.079
  243    HA2  GLY  34          2HA       GLY  34   6.957  -5.125  -5.233
  244    HA3  GLY  34          1HA       GLY  34   8.308  -6.005  -5.947
  245    H    VAL  35           H        VAL  35   8.221  -7.641  -3.267
  246    HA   VAL  35           HA       VAL  35   6.939  -9.935  -4.277
  247    HB   VAL  35           HB       VAL  35   7.353  -9.030  -1.412
  248   HG11  VAL  35          1HG1      VAL  35   5.880 -11.318  -2.519
  249   HG12  VAL  35          2HG1      VAL  35   5.877 -10.666  -0.881
  250   HG13  VAL  35          3HG1      VAL  35   7.145 -11.784  -1.382
  251   HG21  VAL  35          1HG2      VAL  35   9.433  -9.896  -1.630
  252   HG22  VAL  35          2HG2      VAL  35   9.136  -9.909  -3.369
  253   HG23  VAL  35          3HG2      VAL  35   8.818 -11.354  -2.409
  254    H    ILE  36           H        ILE  36   5.644  -7.257  -2.361
  255    HA   ILE  36           HA       ILE  36   2.994  -8.367  -2.050
  256    HB   ILE  36           HB       ILE  36   4.175  -6.403  -0.782
  257   HG12  ILE  36          2HG1      ILE  36   1.277  -6.297  -1.671
  258   HG13  ILE  36          1HG1      ILE  36   1.914  -7.161  -0.273
  259   HG21  ILE  36          1HG2      ILE  36   2.708  -4.787  -2.859
  260   HG22  ILE  36          2HG2      ILE  36   4.409  -5.199  -3.077
  261   HG23  ILE  36          3HG2      ILE  36   3.906  -4.242  -1.684
  262   HD11  ILE  36          1HD1      ILE  36   2.721  -4.971   0.645
  263   HD12  ILE  36          2HD1      ILE  36   0.966  -5.061   0.496
  264   HD13  ILE  36          3HD1      ILE  36   1.908  -4.160  -0.694
  265    H    ASP  37           H        ASP  37   4.607  -6.582  -4.573
  266    HA   ASP  37           HA       ASP  37   2.331  -5.485  -5.875
  267    HB2  ASP  37          2HB       ASP  37   4.977  -6.391  -7.036
  268    HB3  ASP  37          1HB       ASP  37   3.775  -5.449  -7.915
  269    H    SER  38           H        SER  38   3.695  -8.746  -6.009
  270    HA   SER  38           HA       SER  38   1.670  -9.432  -8.081
  271    HB2  SER  38          2HB       SER  38   4.269 -10.666  -7.232
  272    HB3  SER  38          1HB       SER  38   3.064 -11.641  -8.071
  273    H    LEU  39           H        LEU  39   3.091 -11.158  -5.280
  274    HA   LEU  39           HA       LEU  39   0.758 -12.813  -5.009
  275    HB2  LEU  39          2HB       LEU  39   3.056 -13.475  -4.287
  276    HB3  LEU  39          1HB       LEU  39   2.918 -12.320  -2.965
  277    HG   LEU  39           HG       LEU  39   0.644 -14.184  -3.204
  278   HD11  LEU  39          1HD1      LEU  39   3.421 -15.138  -2.445
  279   HD12  LEU  39          2HD1      LEU  39   2.428 -15.739  -3.774
  280   HD13  LEU  39          3HD1      LEU  39   1.937 -16.028  -2.105
  281   HD21  LEU  39          1HD2      LEU  39   1.017 -14.273  -0.736
  282   HD22  LEU  39          2HD2      LEU  39   0.866 -12.620  -1.332
  283   HD23  LEU  39          3HD2      LEU  39   2.456 -13.276  -0.944
  284    H    GLY  40           H        GLY  40   2.003 -10.183  -2.946
  285    HA2  GLY  40          2HA       GLY  40  -0.276 -10.203  -1.196
  286    HA3  GLY  40          1HA       GLY  40   0.899  -8.899  -1.325
  287    H    LEU  41           H        LEU  41   0.494  -8.395  -4.129
  288    HA   LEU  41           HA       LEU  41  -1.581  -6.475  -4.014
  289    HB2  LEU  41          2HB       LEU  41   0.297  -6.522  -5.675
  290    HB3  LEU  41          1HB       LEU  41  -0.522  -7.846  -6.500
  291    HG   LEU  41           HG       LEU  41  -2.569  -6.116  -6.395
  292   HD11  LEU  41          1HD1      LEU  41  -1.706  -3.827  -6.806
  293   HD12  LEU  41          2HD1      LEU  41  -0.073  -4.398  -6.459
  294   HD13  LEU  41          3HD1      LEU  41  -1.297  -4.402  -5.189
  295   HD21  LEU  41          1HD2      LEU  41  -1.977  -5.464  -8.685
  296   HD22  LEU  41          2HD2      LEU  41  -1.569  -7.159  -8.424
  297   HD23  LEU  41          3HD2      LEU  41  -0.300  -5.934  -8.404
  298    H    LEU  42           H        LEU  42  -1.603  -9.777  -5.341
  299    HA   LEU  42           HA       LEU  42  -4.315  -9.636  -6.291
  300    HB2  LEU  42          2HB       LEU  42  -2.596 -12.003  -5.521
  301    HB3  LEU  42          1HB       LEU  42  -4.156 -12.138  -6.313
  302    HG   LEU  42           HG       LEU  42  -1.779 -10.618  -7.415
  303   HD11  LEU  42          1HD1      LEU  42  -2.689 -12.864  -8.989
  304   HD12  LEU  42          2HD1      LEU  42  -2.284 -13.400  -7.358
  305   HD13  LEU  42          3HD1      LEU  42  -1.082 -12.555  -8.333
  306   HD21  LEU  42          1HD2      LEU  42  -3.502  -9.602  -8.514
  307   HD22  LEU  42          2HD2      LEU  42  -4.627 -10.912  -8.164
  308   HD23  LEU  42          3HD2      LEU  42  -3.473 -11.072  -9.487
  309    H    LYS  43           H        LYS  43  -2.901 -10.866  -3.256
  310    HA   LYS  43           HA       LYS  43  -5.376 -11.767  -2.147
  311    HB2  LYS  43          2HB       LYS  43  -2.825 -10.850  -0.815
  312    HB3  LYS  43          1HB       LYS  43  -4.154 -11.637   0.028
  313    HG2  LYS  43          2HG       LYS  43  -3.935 -13.579  -1.532
  314    HG3  LYS  43          1HG       LYS  43  -2.520 -12.803  -2.241
  315    HD2  LYS  43          2HD       LYS  43  -1.447 -12.783   0.012
  316    HD3  LYS  43          1HD       LYS  43  -2.834 -13.669   0.647
  317    HE2  LYS  43          2HE       LYS  43  -1.064 -14.636  -1.617
  318    HE3  LYS  43          1HE       LYS  43  -0.933 -15.172   0.058
  319    HZ1  LYS  43          1HZ       LYS  43  -3.500 -15.591  -0.327
  320    HZ2  LYS  43          2HZ       LYS  43  -2.327 -16.758  -0.714
  321    HZ3  LYS  43          3HZ       LYS  43  -2.981 -15.768  -1.931
  322    H    VAL  44           H        VAL  44  -3.760  -8.625  -2.124
  323    HA   VAL  44           HA       VAL  44  -5.376  -7.389  -0.126
  324    HB   VAL  44           HB       VAL  44  -3.916  -6.225  -2.505
  325   HG11  VAL  44          1HG1      VAL  44  -5.416  -4.926  -0.228
  326   HG12  VAL  44          2HG1      VAL  44  -5.557  -4.599  -1.955
  327   HG13  VAL  44          3HG1      VAL  44  -4.115  -4.090  -1.077
  328   HG21  VAL  44          1HG2      VAL  44  -3.020  -5.671   0.239
  329   HG22  VAL  44          2HG2      VAL  44  -2.088  -6.209  -1.159
  330   HG23  VAL  44          3HG2      VAL  44  -2.968  -7.383  -0.181
  331    H    ILE  45           H        ILE  45  -5.820  -7.499  -3.681
  332    HA   ILE  45           HA       ILE  45  -8.120  -5.841  -3.744
  333    HB   ILE  45           HB       ILE  45  -7.470  -8.199  -5.536
  334   HG12  ILE  45          2HG1      ILE  45  -5.604  -6.645  -5.519
  335   HG13  ILE  45          1HG1      ILE  45  -6.496  -6.411  -7.017
  336   HG21  ILE  45          1HG2      ILE  45  -8.811  -6.865  -7.184
  337   HG22  ILE  45          2HG2      ILE  45  -9.257  -5.784  -5.866
  338   HG23  ILE  45          3HG2      ILE  45  -9.754  -7.475  -5.824
  339   HD11  ILE  45          1HD1      ILE  45  -7.795  -4.593  -5.631
  340   HD12  ILE  45          2HD1      ILE  45  -6.206  -4.212  -6.295
  341   HD13  ILE  45          3HD1      ILE  45  -6.370  -4.643  -4.593
  342    H    ALA  46           H        ALA  46  -7.856  -9.376  -3.338
  343    HA   ALA  46           HA       ALA  46 -10.693  -9.829  -3.257
  344    HB1  ALA  46          1HB       ALA  46  -9.443 -11.765  -3.642
  345    HB2  ALA  46          2HB       ALA  46  -9.873 -11.944  -1.940
  346    HB3  ALA  46          3HB       ALA  46  -8.266 -11.370  -2.388
  347    H    TRP  47           H        TRP  47  -8.280  -9.376  -0.664
  348    HA   TRP  47           HA       TRP  47 -10.286  -9.564   1.432
  349    HB2  TRP  47          2HB       TRP  47  -8.226 -10.164   2.260
  350    HB3  TRP  47          1HB       TRP  47  -7.372  -8.969   1.285
  351    HD1  TRP  47           HD       TRP  47 -10.263  -8.434   3.812
  352    HE1  TRP  47          1HE       TRP  47  -9.468  -6.691   5.544
  353    HE3  TRP  47          3HE       TRP  47  -5.502  -7.735   2.197
  354    HZ2  TRP  47          2HZ       TRP  47  -7.095  -5.196   6.159
  355    HZ3  TRP  47          3HZ       TRP  47  -3.979  -6.158   3.360
  356    HH2  TRP  47           HH       TRP  47  -4.770  -4.887   5.335
  357    H    LEU  48           H        LEU  48  -8.490  -6.899  -0.086
  358    HA   LEU  48           HA       LEU  48  -9.518  -4.790   1.484
  359    HB2  LEU  48          2HB       LEU  48  -7.683  -4.599  -0.222
  360    HB3  LEU  48          1HB       LEU  48  -8.902  -4.693  -1.482
  361    HG   LEU  48           HG       LEU  48 -10.016  -2.724  -0.158
  362   HD11  LEU  48          1HD1      LEU  48  -7.240  -1.925   0.477
  363   HD12  LEU  48          2HD1      LEU  48  -7.930  -3.167   1.519
  364   HD13  LEU  48          3HD1      LEU  48  -8.732  -1.605   1.361
  365   HD21  LEU  48          1HD2      LEU  48  -8.098  -1.233  -1.374
  366   HD22  LEU  48          2HD2      LEU  48  -9.395  -2.043  -2.255
  367   HD23  LEU  48          3HD2      LEU  48  -7.805  -2.798  -2.134
  368    H    GLU  49           H        GLU  49 -10.876  -6.410  -1.374
  369    HA   GLU  49           HA       GLU  49 -13.096  -4.660  -1.748
  370    HB2  GLU  49          2HB       GLU  49 -12.866  -6.128  -3.524
  371    HB3  GLU  49          1HB       GLU  49 -12.472  -7.490  -2.487
  372    HG2  GLU  49          2HG       GLU  49 -14.764  -7.755  -1.831
  373    HG3  GLU  49          1HG       GLU  49 -15.222  -6.245  -2.608
  374    H    ASP  50           H        ASP  50 -12.721  -7.575   0.266
  375    HA   ASP  50           HA       ASP  50 -15.422  -7.578   1.236
  376    HB2  ASP  50          2HB       ASP  50 -13.785  -9.488   1.403
  377    HB3  ASP  50          1HB       ASP  50 -12.979  -8.591   2.687
  378    H    ARG  51           H        ARG  51 -12.446  -6.078   2.442
  379    HA   ARG  51           HA       ARG  51 -13.504  -5.150   4.921
  380    HB2  ARG  51          2HB       ARG  51 -11.082  -5.217   4.342
  381    HB3  ARG  51          1HB       ARG  51 -11.337  -3.860   3.245
  382    HG2  ARG  51          2HG       ARG  51 -12.167  -2.495   5.137
  383    HG3  ARG  51          1HG       ARG  51 -11.870  -3.848   6.231
  384    HD2  ARG  51          2HD       ARG  51  -9.464  -3.804   5.575
  385    HD3  ARG  51          1HD       ARG  51  -9.788  -2.381   4.585
  386    HE   ARG  51           HE       ARG  51 -10.653  -2.041   7.344
  387   HH11  ARG  51          1HH1      ARG  51  -9.471  -0.546   8.560
  388   HH12  ARG  51          2HH1      ARG  51  -7.929  -0.007   7.984
  389   HH21  ARG  51          1HH2      ARG  51  -8.030  -1.940   5.108
  390   HH22  ARG  51          2HH2      ARG  51  -7.114  -0.795   6.030
  391    H    PHE  52           H        PHE  52 -13.298  -3.469   1.750
  392    HA   PHE  52           HA       PHE  52 -15.043  -1.343   2.900
  393    HB2  PHE  52          2HB       PHE  52 -13.206  -1.395   0.500
  394    HB3  PHE  52          1HB       PHE  52 -14.327  -0.079   0.826
  395    HD1  PHE  52          1HD       PHE  52 -14.152   1.172   3.030
  396    HD2  PHE  52          2HD       PHE  52 -11.135  -1.559   1.654
  397    HE1  PHE  52          1HE       PHE  52 -12.526   2.172   4.612
  398    HE2  PHE  52          2HE       PHE  52  -9.509  -0.558   3.238
  399    HZ   PHE  52           HZ       PHE  52 -10.204   1.306   4.717
  400    H    GLY  53           H        GLY  53 -15.267  -4.108   1.005
  401    HA2  GLY  53          2HA       GLY  53 -17.080  -4.927  -0.260
  402    HA3  GLY  53          1HA       GLY  53 -17.985  -3.493   0.231
  403    H    ILE  54           H        ILE  54 -14.864  -3.401  -1.411
  404    HA   ILE  54           HA       ILE  54 -16.171  -1.901  -3.622
  405    HB   ILE  54           HB       ILE  54 -13.230  -2.230  -2.952
  406   HG12  ILE  54          2HG1      ILE  54 -15.032   0.161  -2.481
  407   HG13  ILE  54          1HG1      ILE  54 -14.661  -1.028  -1.231
  408   HG21  ILE  54          1HG2      ILE  54 -14.582  -1.248  -5.267
  409   HG22  ILE  54          2HG2      ILE  54 -12.852  -1.214  -4.924
  410   HG23  ILE  54          3HG2      ILE  54 -13.875   0.135  -4.431
  411   HD11  ILE  54          1HD1      ILE  54 -12.282  -0.549  -1.421
  412   HD12  ILE  54          2HD1      ILE  54 -13.152   0.960  -1.145
  413   HD13  ILE  54          3HD1      ILE  54 -12.579   0.554  -2.764
  414    H    ALA  55           H        ALA  55 -15.969  -2.575  -5.781
  415    HA   ALA  55           HA       ALA  55 -15.783  -5.374  -6.280
  416    HB1  ALA  55          1HB       ALA  55 -15.703  -2.948  -8.073
  417    HB2  ALA  55          2HB       ALA  55 -17.007  -4.116  -7.868
  418    HB3  ALA  55          3HB       ALA  55 -15.538  -4.577  -8.727
  419    H    ALA  56           H        ALA  56 -14.112  -6.603  -7.253
  420    HA   ALA  56           HA       ALA  56 -11.461  -6.023  -6.425
  421    HB1  ALA  56          1HB       ALA  56 -11.862  -8.290  -6.860
  422    HB2  ALA  56          2HB       ALA  56 -10.902  -7.806  -8.258
  423    HB3  ALA  56          3HB       ALA  56 -12.653  -7.955  -8.400
  424    H    ASP  57           H        ASP  57 -13.188  -5.208  -9.376
  425    HA   ASP  57           HA       ASP  57 -12.534  -3.923 -11.227
  426    HB2  ASP  57          2HB       ASP  57 -10.626  -2.833  -9.150
  427    HB3  ASP  57          1HB       ASP  57 -10.906  -2.098 -10.726
  428    H    ASP  58           H        ASP  58 -11.509  -6.452 -11.325
  429    HA   ASP  58           HA       ASP  58  -8.834  -7.015 -11.385
  430    HB2  ASP  58          2HB       ASP  58  -9.259  -8.419 -13.402
  431    HB3  ASP  58          1HB       ASP  58 -10.494  -8.622 -12.160
  432    H    VAL  59           H        VAL  59  -7.537  -5.173 -11.753
  433    HA   VAL  59           HA       VAL  59  -7.378  -4.330 -14.618
  434    HB   VAL  59           HB       VAL  59  -6.764  -2.068 -13.866
  435   HG11  VAL  59          1HG1      VAL  59  -8.973  -1.667 -14.014
  436   HG12  VAL  59          2HG1      VAL  59  -9.128  -2.052 -12.300
  437   HG13  VAL  59          3HG1      VAL  59  -9.335  -3.317 -13.509
  438   HG21  VAL  59          1HG2      VAL  59  -6.674  -3.463 -11.274
  439   HG22  VAL  59          2HG2      VAL  59  -7.512  -1.912 -11.217
  440   HG23  VAL  59          3HG2      VAL  59  -5.846  -1.994 -11.788
  441    H    GLU  60           H        GLU  60  -5.170  -3.690 -15.268
  442    HA   GLU  60           HA       GLU  60  -3.142  -5.210 -13.707
  443    HB2  GLU  60          2HB       GLU  60  -3.442  -5.727 -16.135
  444    HB3  GLU  60          1HB       GLU  60  -2.947  -4.082 -16.513
  445    HG2  GLU  60          2HG       GLU  60  -0.803  -4.497 -15.327
  446    HG3  GLU  60          1HG       GLU  60  -1.295  -6.170 -15.086
  447    H    LEU  61           H        LEU  61  -1.566  -4.141 -12.613
  448    HA   LEU  61           HA       LEU  61  -1.320  -1.202 -13.060
  449    HB2  LEU  61          2HB       LEU  61  -0.628  -2.866 -10.622
  450    HB3  LEU  61          1HB       LEU  61  -0.413  -1.120 -10.754
  451    HG   LEU  61           HG       LEU  61  -3.001  -1.305 -11.484
  452   HD11  LEU  61          1HD1      LEU  61  -4.168  -3.001 -10.305
  453   HD12  LEU  61          2HD1      LEU  61  -2.752  -3.412  -9.337
  454   HD13  LEU  61          3HD1      LEU  61  -2.804  -3.836 -11.048
  455   HD21  LEU  61          1HD2      LEU  61  -1.830  -1.186  -8.692
  456   HD22  LEU  61          2HD2      LEU  61  -3.517  -0.817  -9.048
  457   HD23  LEU  61          3HD2      LEU  61  -2.233   0.173  -9.741
  458    H    SER  62           H        SER  62   0.719  -0.344 -13.488
  459    HA   SER  62           HA       SER  62   2.771  -2.285 -14.308
  460    HB2  SER  62          2HB       SER  62   2.026   0.348 -15.094
  461    HB3  SER  62          1HB       SER  62   3.684   0.426 -14.504
  462    HG   SER  62           HG       SER  62   3.463  -1.775 -15.939
  463    HA   PRO  63           HA       PRO  63   5.312  -2.052 -10.718
  464    HB2  PRO  63          2HB       PRO  63   7.824  -1.752 -11.877
  465    HB3  PRO  63          1HB       PRO  63   6.974  -3.294 -11.671
  466    HG2  PRO  63          2HG       PRO  63   7.238  -1.581 -14.078
  467    HG3  PRO  63          1HG       PRO  63   7.175  -3.347 -13.944
  468    HD2  PRO  63          2HD       PRO  63   5.047  -1.875 -14.784
  469    HD3  PRO  63          1HD       PRO  63   4.858  -3.396 -13.884
  470    H    GLU  64           H        GLU  64   5.634   0.480 -13.124
  471    HA   GLU  64           HA       GLU  64   7.275   2.280 -11.630
  472    HB2  GLU  64          2HB       GLU  64   5.149   2.836 -13.703
  473    HB3  GLU  64          1HB       GLU  64   6.292   4.030 -13.109
  474    HG2  GLU  64          2HG       GLU  64   8.154   2.585 -13.867
  475    HG3  GLU  64          1HG       GLU  64   6.979   1.454 -14.528
  476    H    HIS  65           H        HIS  65   3.835   1.572 -11.526
  477    HA   HIS  65           HA       HIS  65   3.060   3.888 -10.002
  478    HB2  HIS  65          2HB       HIS  65   1.442   2.443 -11.213
  479    HB3  HIS  65          1HB       HIS  65   1.772   1.143 -10.068
  480    HD1  HIS  65          1HD       HIS  65   0.762   4.828  -9.859
  481    HD2  HIS  65          2HD       HIS  65   0.004   1.195  -7.955
  482    HE1  HIS  65          1HE       HIS  65  -0.954   5.306  -8.056
  483    HE2  HIS  65          2HE       HIS  65  -1.420   3.103  -6.891
  484    H    PHE  66           H        PHE  66   4.531   0.835  -9.153
  485    HA   PHE  66           HA       PHE  66   4.048   1.305  -6.267
  486    HB2  PHE  66          2HB       PHE  66   5.497  -0.951  -7.694
  487    HB3  PHE  66          1HB       PHE  66   5.125  -0.898  -5.971
  488    HD1  PHE  66          1HD       PHE  66   3.695  -1.165  -9.366
  489    HD2  PHE  66          2HD       PHE  66   2.868  -1.265  -5.151
  490    HE1  PHE  66          1HE       PHE  66   1.445  -2.094  -9.831
  491    HE2  PHE  66          2HE       PHE  66   0.616  -2.192  -5.618
  492    HZ   PHE  66           HZ       PHE  66  -0.095  -2.606  -7.959
  493    H    ARG  67           H        ARG  67   6.053   2.653  -8.372
  494    HA   ARG  67           HA       ARG  67   8.688   2.213  -7.491
  495    HB2  ARG  67          2HB       ARG  67   8.108   3.610  -9.446
  496    HB3  ARG  67          1HB       ARG  67   7.440   4.833  -8.375
  497    HG2  ARG  67          2HG       ARG  67   9.632   5.589  -8.907
  498    HG3  ARG  67          1HG       ARG  67   9.757   4.924  -7.284
  499    HD2  ARG  67          2HD       ARG  67  10.716   2.866  -8.129
  500    HD3  ARG  67          1HD       ARG  67  10.415   3.360  -9.795
  501    HE   ARG  67           HE       ARG  67  12.125   5.195  -8.272
  502   HH11  ARG  67          1HH1      ARG  67  14.243   5.366  -9.043
  503   HH12  ARG  67          2HH1      ARG  67  14.828   4.210 -10.191
  504   HH21  ARG  67          1HH2      ARG  67  11.857   2.426 -10.310
  505   HH22  ARG  67          2HH2      ARG  67  13.478   2.545 -10.909
  506    H    SER  68           H        SER  68   6.186   4.331  -6.104
  507    HA   SER  68           HA       SER  68   7.810   4.410  -3.615
  508    HB2  SER  68          2HB       SER  68   6.646   6.850  -4.978
  509    HB3  SER  68          1HB       SER  68   7.369   6.842  -3.373
  510    HG   SER  68           HG       SER  68   8.611   6.180  -5.843
  511    H    ILE  69           H        ILE  69   6.536   4.842  -1.709
  512    HA   ILE  69           HA       ILE  69   3.969   3.648  -1.669
  513    HB   ILE  69           HB       ILE  69   5.184   5.624   0.284
  514   HG12  ILE  69          2HG1      ILE  69   5.204   2.601   0.303
  515   HG13  ILE  69          1HG1      ILE  69   6.563   3.597  -0.197
  516   HG21  ILE  69          1HG2      ILE  69   2.622   4.399   0.175
  517   HG22  ILE  69          2HG2      ILE  69   3.305   5.374   1.475
  518   HG23  ILE  69          3HG2      ILE  69   3.534   3.626   1.468
  519   HD11  ILE  69          1HD1      ILE  69   5.675   2.922   2.487
  520   HD12  ILE  69          2HD1      ILE  69   5.788   4.668   2.266
  521   HD13  ILE  69          3HD1      ILE  69   7.196   3.649   1.967
  522    H    ARG  70           H        ARG  70   4.947   7.044  -1.971
  523    HA   ARG  70           HA       ARG  70   2.391   8.228  -1.596
  524    HB2  ARG  70          2HB       ARG  70   4.511   9.511  -1.697
  525    HB3  ARG  70          1HB       ARG  70   4.625   9.160  -3.422
  526    HG2  ARG  70          2HG       ARG  70   2.512  10.328  -3.831
  527    HG3  ARG  70          1HG       ARG  70   2.320  10.625  -2.102
  528    HD2  ARG  70          2HD       ARG  70   3.230  12.634  -3.078
  529    HD3  ARG  70          1HD       ARG  70   4.525  11.862  -2.164
  530    HE   ARG  70           HE       ARG  70   4.738  10.871  -4.782
  531   HH11  ARG  70          1HH1      ARG  70   6.151  11.829  -6.264
  532   HH12  ARG  70          2HH1      ARG  70   6.648  13.471  -6.028
  533   HH21  ARG  70          1HH2      ARG  70   4.802  13.893  -3.124
  534   HH22  ARG  70          2HH2      ARG  70   5.884  14.640  -4.251
  535    H    SER  71           H        SER  71   3.896   6.873  -4.526
  536    HA   SER  71           HA       SER  71   1.947   7.751  -6.391
  537    HB2  SER  71          2HB       SER  71   4.106   6.618  -6.976
  538    HB3  SER  71          1HB       SER  71   3.413   5.098  -6.421
  539    HG   SER  71           HG       SER  71   3.232   6.034  -8.796
  540    H    ILE  72           H        ILE  72   2.012   4.813  -4.369
  541    HA   ILE  72           HA       ILE  72  -0.409   3.687  -5.360
  542    HB   ILE  72           HB       ILE  72   0.836   3.457  -2.604
  543   HG12  ILE  72          2HG1      ILE  72   1.120   1.674  -5.044
  544   HG13  ILE  72          1HG1      ILE  72   2.337   2.836  -4.512
  545   HG21  ILE  72          1HG2      ILE  72  -0.934   2.171  -2.111
  546   HG22  ILE  72          2HG2      ILE  72  -0.507   1.103  -3.448
  547   HG23  ILE  72          3HG2      ILE  72  -1.606   2.456  -3.715
  548   HD11  ILE  72          1HD1      ILE  72   1.548   1.233  -2.265
  549   HD12  ILE  72          2HD1      ILE  72   3.136   1.356  -3.022
  550   HD13  ILE  72          3HD1      ILE  72   1.971   0.167  -3.604
  551    H    ASP  73           H        ASP  73   0.260   6.002  -2.762
  552    HA   ASP  73           HA       ASP  73  -2.314   6.114  -1.603
  553    HB2  ASP  73          2HB       ASP  73  -0.230   7.265  -0.755
  554    HB3  ASP  73          1HB       ASP  73  -0.470   8.481  -2.009
  555    H    ALA  74           H        ALA  74  -1.039   7.735  -4.490
  556    HA   ALA  74           HA       ALA  74  -3.296   9.437  -4.921
  557    HB1  ALA  74          1HB       ALA  74  -0.864   8.870  -6.243
  558    HB2  ALA  74          2HB       ALA  74  -2.024  10.136  -6.644
  559    HB3  ALA  74          3HB       ALA  74  -2.142   8.554  -7.416
  560    H    PHE  75           H        PHE  75  -2.576   6.136  -6.049
  561    HA   PHE  75           HA       PHE  75  -4.929   5.870  -7.665
  562    HB2  PHE  75          2HB       PHE  75  -2.988   4.313  -7.762
  563    HB3  PHE  75          1HB       PHE  75  -3.448   3.692  -6.180
  564    HD1  PHE  75          1HD       PHE  75  -5.331   2.217  -5.904
  565    HD2  PHE  75          2HD       PHE  75  -4.482   3.991  -9.723
  566    HE1  PHE  75          1HE       PHE  75  -6.957   0.682  -6.979
  567    HE2  PHE  75          2HE       PHE  75  -6.109   2.457 -10.798
  568    HZ   PHE  75           HZ       PHE  75  -7.345   0.802  -9.426
  569    H    VAL  76           H        VAL  76  -4.280   4.910  -4.287
  570    HA   VAL  76           HA       VAL  76  -6.918   3.924  -3.785
  571    HB   VAL  76           HB       VAL  76  -4.754   4.975  -1.950
  572   HG11  VAL  76          1HG1      VAL  76  -7.525   3.998  -1.423
  573   HG12  VAL  76          2HG1      VAL  76  -6.587   5.223  -0.570
  574   HG13  VAL  76          3HG1      VAL  76  -6.250   3.512  -0.307
  575   HG21  VAL  76          1HG2      VAL  76  -5.578   2.151  -1.871
  576   HG22  VAL  76          2HG2      VAL  76  -3.959   2.846  -1.950
  577   HG23  VAL  76          3HG2      VAL  76  -4.906   2.646  -3.424
  578    H    VAL  77           H        VAL  77  -5.422   7.125  -3.264
  579    HA   VAL  77           HA       VAL  77  -7.660   8.310  -1.956
  580    HB   VAL  77           HB       VAL  77  -5.454   9.495  -3.657
  581   HG11  VAL  77          1HG1      VAL  77  -6.152  11.632  -2.454
  582   HG12  VAL  77          2HG1      VAL  77  -7.645  10.793  -2.036
  583   HG13  VAL  77          3HG1      VAL  77  -7.236  11.074  -3.728
  584   HG21  VAL  77          1HG2      VAL  77  -4.239   9.610  -1.730
  585   HG22  VAL  77          2HG2      VAL  77  -5.324   8.332  -1.182
  586   HG23  VAL  77          3HG2      VAL  77  -5.651  10.012  -0.752
  587    H    GLY  78           H        GLY  78  -6.784   8.068  -5.392
  588    HA2  GLY  78          2HA       GLY  78  -8.821   9.736  -6.438
  589    HA3  GLY  78          1HA       GLY  78  -8.080   8.399  -7.315
  590    H    ALA  79           H        ALA  79  -8.954   6.353  -5.387
  591    HA   ALA  79           HA       ALA  79 -11.794   6.237  -6.258
  592    HB1  ALA  79          1HB       ALA  79 -10.598   4.322  -7.000
  593    HB2  ALA  79          2HB       ALA  79 -11.525   3.776  -5.604
  594    HB3  ALA  79          3HB       ALA  79  -9.804   4.122  -5.438
  595    H    THR  80           H        THR  80  -9.794   5.576  -3.377
  596    HA   THR  80           HA       THR  80 -12.223   6.129  -1.722
  597    HB   THR  80           HB       THR  80 -10.084   4.085  -1.109
  598    HG1  THR  80          1HG       THR  80 -11.519   3.556  -2.863
  599   HG21  THR  80          1HG2      THR  80 -12.187   5.350   0.439
  600   HG22  THR  80          2HG2      THR  80 -10.906   4.264   0.979
  601   HG23  THR  80          3HG2      THR  80 -12.418   3.604   0.359
  602    H    THR  81           H        THR  81 -11.894   7.499   0.000
  603    HA   THR  81           HA       THR  81  -9.079   8.298   0.593
  604    HB   THR  81           HB       THR  81 -10.238  10.029  -0.759
  605    HG1  THR  81          1HG       THR  81  -8.882  10.348   1.363
  606   HG21  THR  81          1HG2      THR  81 -12.331  10.769  -0.288
  607   HG22  THR  81          2HG2      THR  81 -12.029  10.798   1.449
  608   HG23  THR  81          3HG2      THR  81 -12.467   9.286   0.656
  609    HA   PRO  82           HA       PRO  82 -11.151   7.122   4.521
  610    HB2  PRO  82          2HB       PRO  82  -9.101   5.667   5.548
  611    HB3  PRO  82          1HB       PRO  82 -10.249   5.002   4.372
  612    HG2  PRO  82          2HG       PRO  82  -7.456   5.888   3.992
  613    HG3  PRO  82          1HG       PRO  82  -8.366   4.619   3.160
  614    HD2  PRO  82          2HD       PRO  82  -7.854   7.206   2.168
  615    HD3  PRO  82          1HD       PRO  82  -9.035   6.052   1.513
  616    HA   PRO  83           HA       PRO  83  -9.460  10.205   7.192
  617    HB2  PRO  83          2HB       PRO  83  -9.468   8.840   9.628
  618    HB3  PRO  83          1HB       PRO  83 -10.855   9.688   8.922
  619    HG2  PRO  83          2HG       PRO  83 -10.212   6.794   8.936
  620    HG3  PRO  83          1HG       PRO  83 -11.785   7.607   9.015
  621    HD2  PRO  83          2HD       PRO  83 -10.888   6.416   6.744
  622    HD3  PRO  83          1HD       PRO  83 -11.924   7.859   6.711
  623    H    VAL  84           H        VAL  84  -7.483  10.826   8.225
  624    HA   VAL  84           HA       VAL  84  -5.299   8.829   7.898
  625    HB   VAL  84           HB       VAL  84  -5.051  11.008   6.736
  626   HG11  VAL  84          1HG1      VAL  84  -6.250  12.075   8.938
  627   HG12  VAL  84          2HG1      VAL  84  -5.308  13.019   7.783
  628   HG13  VAL  84          3HG1      VAL  84  -4.560  12.450   9.275
  629   HG21  VAL  84          1HG2      VAL  84  -3.173   9.668   8.277
  630   HG22  VAL  84          2HG2      VAL  84  -2.999  11.341   8.805
  631   HG23  VAL  84          3HG2      VAL  84  -2.814  10.931   7.100
  632    H    GLU  85           H        GLU  85  -4.191   8.078   9.643
  633    HA   GLU  85           HA       GLU  85  -4.708   9.356  12.289
  634    HB2  GLU  85          2HB       GLU  85  -4.374   6.400  11.690
  635    HB3  GLU  85          1HB       GLU  85  -4.599   7.102  13.292
  636    HG2  GLU  85          2HG       GLU  85  -6.572   7.338  11.000
  637    HG3  GLU  85          1HG       GLU  85  -6.729   6.226  12.361
  638    H    ALA  86           H        ALA  86  -2.895   8.915  13.870
  639    HA   ALA  86           HA       ALA  86  -0.383   9.652  12.822
  640    HB1  ALA  86          1HB       ALA  86  -1.370   9.355  15.337
  641    HB2  ALA  86          2HB       ALA  86   0.349   9.546  14.989
  642    HB3  ALA  86          3HB       ALA  86  -0.325   7.936  15.242
  643    H    LYS  87           H        LYS  87   1.348   8.482  12.011
  644    HA   LYS  87           HA       LYS  87   0.895   5.912  10.883
  645    HB2  LYS  87          2HB       LYS  87   2.672   7.572  10.177
  646    HB3  LYS  87          1HB       LYS  87   3.603   7.070  11.589
  647    HG2  LYS  87          2HG       LYS  87   3.560   4.731  10.777
  648    HG3  LYS  87          1HG       LYS  87   2.663   5.254   9.351
  649    HD2  LYS  87          2HD       LYS  87   4.571   6.828   8.835
  650    HD3  LYS  87          1HD       LYS  87   5.477   6.052  10.134
  651    HE2  LYS  87          2HE       LYS  87   4.642   3.862   8.758
  652    HE3  LYS  87          1HE       LYS  87   4.785   5.025   7.441
  653    HZ1  LYS  87          1HZ       LYS  87   7.038   5.513   8.165
  654    HZ2  LYS  87          2HZ       LYS  87   6.863   3.860   7.811
  655    HZ3  LYS  87          3HZ       LYS  87   6.900   4.388   9.426
  656    H    LEU  88           H        LEU  88   2.274   6.888  13.984
  657    HA   LEU  88           HA       LEU  88   3.393   4.408  14.778
  658    HB2  LEU  88          2HB       LEU  88   1.962   6.418  16.546
  659    HB3  LEU  88          1HB       LEU  88   3.141   5.217  17.071
  660    HG   LEU  88           HG       LEU  88   3.657   7.539  15.189
  661   HD11  LEU  88          1HD1      LEU  88   4.671   8.608  16.953
  662   HD12  LEU  88          2HD1      LEU  88   5.164   7.098  17.721
  663   HD13  LEU  88          3HD1      LEU  88   3.500   7.662  17.873
  664   HD21  LEU  88          1HD2      LEU  88   5.242   5.103  15.936
  665   HD22  LEU  88          2HD2      LEU  88   6.097   6.622  15.667
  666   HD23  LEU  88          3HD2      LEU  88   5.118   5.921  14.379
  667    H    GLN  89           H        GLN  89   0.047   5.557  14.846
  668    HA   GLN  89           HA       GLN  89  -0.924   3.236  16.318
  669    HB2  GLN  89          2HB       GLN  89  -2.382   5.331  14.678
  670    HB3  GLN  89          1HB       GLN  89  -3.174   4.108  15.672
  671    HG2  GLN  89          2HG       GLN  89  -2.051   4.979  17.675
  672    HG3  GLN  89          1HG       GLN  89  -1.208   6.179  16.694
  673   HE21  GLN  89          1HE2      GLN  89  -2.955   6.976  18.818
  674   HE22  GLN  89          2HE2      GLN  89  -4.309   7.745  18.139
  675    H1   PN7 101          3HO       SAT 101   5.327  -8.304 -12.013
  676    H2   PN7 101          1H1       SAT 101   5.816  -6.748  -9.134
  677    H3   PN7 101          2H1       SAT 101   4.131  -7.250  -9.272
  678    H5   PN7 101          1HE1      SAT 101   6.995  -5.786 -10.971
  679    H6   PN7 101          2HE1      SAT 101   6.183  -5.341 -12.471
  680    H7   PN7 101          3HE1      SAT 101   6.577  -7.029 -12.149
  681    H8   PN7 101          2HE2      SAT 101   4.495  -4.211 -11.402
  682    H9   PN7 101          3HE2      SAT 101   4.883  -4.577  -9.722
  683    H10  PN7 101          1HE2      SAT 101   3.304  -5.012 -10.376
  684    H11  PN7 101          3H        SAT 101   2.974  -7.067 -11.519
  685    H12  PN7 101          5H        SAT 101   2.655  -4.432 -13.061
  686    H13  PN7 101          1H6       SAT 101   0.631  -5.913 -13.303
  687    H14  PN7 101          2H6       SAT 101   1.235  -5.441 -14.891
  688    H15  PN7 101          1H7       SAT 101   2.087  -7.957 -13.429
  689    H16  PN7 101          2H7       SAT 101   2.507  -7.502 -15.080
  690    H17  PN7 101          9H        SAT 101  -0.398  -8.453 -13.067
  691    H18  PN7 101          1H10      SAT 101  -0.478 -10.373 -15.360
  692    H19  PN7 101          2H10      SAT 101  -0.046 -10.897 -13.732
  693    H20  PN7 101          1H11      SAT 101  -2.514  -9.480 -13.551
  694    H21  PN7 101          2H11      SAT 101  -2.226 -11.196 -13.263
  695    H22  PN7 101          2HS1      SAT 101  -2.947 -11.741 -15.637


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