*HEADER    SERINE PROTEINASE INHIBITOR             08-DEC-99   1DWM
*TITLE     SOLUTION STRUCTURE OF LINUM USITATISSINUM TRYPSIN INHIBITOR
*TITLE    2 (LUTI)
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: LINUM USITATISSINUM TRYPSIN INHIBITOR;
*COMPND   3 CHAIN: A;
*COMPND   4 SYNONYM: LUTI
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: LINUM USITATISSIMUM;
*SOURCE   3 ORGANISM_COMMON: FLAX;
*SOURCE   4 ORGAN: SEED
*KEYWDS    SERINE PROTEINASE INHIBITOR, TRYPSIN INHIBITOR
*EXPDTA    NMR, 20 STRUCTURES
*AUTHOR    T.CIERPICKI,J.OTLEWSKI




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER   1           H        SER   1  17.009  10.282  -9.340
    2    HA   SER   1           HA       SER   1  16.801   7.360  -8.774
    3   1HB   SER   1          1HB       SER   1  17.760   9.027  -7.171
    4   2HB   SER   1          2HB       SER   1  16.148   9.722  -6.930
    5    HG   SER   1           HG       SER   1  16.628   8.120  -5.370
    6    H    ARG   2           H        ARG   2  15.095   6.455  -9.891
    7    HA   ARG   2           HA       ARG   2  12.432   6.727  -8.795
    8   1HB   ARG   2          1HB       ARG   2  13.118   7.705 -11.514
    9   2HB   ARG   2          2HB       ARG   2  11.702   6.677 -11.424
   10   1HG   ARG   2          1HG       ARG   2  10.877   8.213  -9.576
   11   2HG   ARG   2          2HG       ARG   2  12.180   9.303 -10.062
   12   1HD   ARG   2          1HD       ARG   2   9.964   9.795 -11.087
   13   2HD   ARG   2          2HD       ARG   2  11.271   9.542 -12.230
   14    HE   ARG   2           HE       ARG   2   9.131   7.602 -11.590
   15   1HH1  ARG   2          1HH1      ARG   2  11.570   8.805 -13.829
   16   2HH1  ARG   2          2HH1      ARG   2  11.078   7.755 -15.094
   17   1HH2  ARG   2          1HH2      ARG   2   8.511   6.220 -13.291
   18   2HH2  ARG   2          2HH2      ARG   2   9.356   6.287 -14.802
   19    H    ARG   3           H        ARG   3  13.423   4.633  -8.108
   20    HA   ARG   3           HA       ARG   3  12.421   2.532  -9.869
   21   1HB   ARG   3          1HB       ARG   3  15.308   2.962  -9.266
   22   2HB   ARG   3          2HB       ARG   3  14.739   1.300  -9.209
   23   1HG   ARG   3          1HG       ARG   3  14.199   3.067 -11.580
   24   2HG   ARG   3          2HG       ARG   3  15.703   2.186 -11.395
   25   1HD   ARG   3          1HD       ARG   3  13.340   0.541 -10.914
   26   2HD   ARG   3          2HD       ARG   3  13.380   1.233 -12.529
   27    HE   ARG   3           HE       ARG   3  15.806   0.280 -12.498
   28   1HH1  ARG   3          1HH1      ARG   3  12.916  -1.260 -11.200
   29   2HH1  ARG   3          2HH1      ARG   3  13.526  -2.846 -11.439
   30   1HH2  ARG   3          1HH2      ARG   3  16.578  -1.838 -12.809
   31   2HH2  ARG   3          2HH2      ARG   3  15.590  -3.186 -12.354
   32    H    CYS   4           H        CYS   4  10.862   2.218  -8.274
   33    HA   CYS   4           HA       CYS   4  11.745   1.546  -5.590
   34   1HB   CYS   4          1HB       CYS   4   9.078   2.007  -6.873
   35   2HB   CYS   4          2HB       CYS   4   9.148   1.119  -5.356
   36   1HB   PRO   5          1HB       PRO   5  11.190  -3.700  -3.727
   37   2HB   PRO   5          2HB       PRO   5  12.752  -2.980  -4.113
   38   1HG   PRO   5          1HG       PRO   5  10.367  -1.724  -2.863
   39   2HG   PRO   5          2HG       PRO   5  12.063  -1.583  -2.387
   40   1HD   PRO   5          1HD       PRO   5  10.784   0.328  -3.798
   41   2HD   PRO   5          2HD       PRO   5  12.506  -0.032  -4.049
   42    H    GLY   6           H        GLY   6  10.510  -4.736  -6.280
   43   1HA   GLY   6          1HA       GLY   6   8.536  -5.882  -6.474
   44   2HA   GLY   6          2HA       GLY   6   7.767  -4.627  -5.557
   45    H    LYS   7           H        LYS   7   6.609  -5.933  -7.744
   46    HA   LYS   7           HA       LYS   7   6.858  -4.660 -10.209
   47   1HB   LYS   7          1HB       LYS   7   5.658  -6.760  -9.767
   48   2HB   LYS   7          2HB       LYS   7   4.384  -5.865  -8.981
   49   1HG   LYS   7          1HG       LYS   7   3.746  -4.814 -10.978
   50   2HG   LYS   7          2HG       LYS   7   5.167  -5.395 -11.843
   51   1HD   LYS   7          1HD       LYS   7   3.199  -7.312 -10.597
   52   2HD   LYS   7          2HD       LYS   7   2.866  -6.589 -12.158
   53   1HE   LYS   7          1HE       LYS   7   4.735  -7.564 -13.156
   54   2HE   LYS   7          2HE       LYS   7   5.462  -7.981 -11.605
   55   1HZ   LYS   7          1HZ       LYS   7   3.609  -9.548 -11.241
   56   2HZ   LYS   7          2HZ       LYS   7   3.029  -9.197 -12.797
   57   3HZ   LYS   7          3HZ       LYS   7   4.535  -9.940 -12.599
   58    H    ASN   8           H        ASN   8   5.864  -2.885 -11.174
   59    HA   ASN   8           HA       ASN   8   4.781  -0.904  -9.277
   60   1HB   ASN   8          1HB       ASN   8   6.207  -0.728 -11.907
   61   2HB   ASN   8          2HB       ASN   8   5.218   0.627 -11.373
   62   2HD2  ASN   8          2HD2      ASN   8   6.103   2.052 -10.005
   63   1HD2  ASN   8          1HD2      ASN   8   7.605   1.823  -9.186
   64    H    ALA   9           H        ALA   9   3.662  -3.010 -11.696
   65    HA   ALA   9           HA       ALA   9   1.048  -1.789 -11.625
   66   1HB   ALA   9          1HB       ALA   9   2.518  -2.109 -14.233
   67   2HB   ALA   9          2HB       ALA   9   0.825  -1.627 -14.057
   68   3HB   ALA   9          3HB       ALA   9   2.113  -0.573 -13.471
   69    H    TRP  10           H        TRP  10  -0.584  -3.261 -11.911
   70    HA   TRP  10           HA       TRP  10   0.282  -6.012 -12.624
   71   1HB   TRP  10          1HB       TRP  10  -1.660  -5.093 -10.528
   72   2HB   TRP  10          2HB       TRP  10  -1.561  -6.750 -11.083
   73    HD1  TRP  10           HD1      TRP  10   0.217  -8.254  -9.969
   74    HE1  TRP  10           HE1      TRP  10   2.052  -7.878  -8.212
   75    HE3  TRP  10           HE3      TRP  10   0.072  -3.164  -9.700
   76    HZ2  TRP  10           HZ2      TRP  10   3.273  -5.709  -6.901
   77    HZ3  TRP  10           HZ3      TRP  10   1.580  -2.004  -8.150
   78    HH2  TRP  10           HH2      TRP  10   3.153  -3.258  -6.766
   79   1HB   PRO  11          1HB       PRO  11  -1.968  -4.787 -17.748
   80   2HB   PRO  11          2HB       PRO  11  -1.283  -6.346 -17.282
   81   1HG   PRO  11          1HG       PRO  11   0.624  -5.054 -17.196
   82   2HG   PRO  11          2HG       PRO  11  -0.270  -3.593 -16.736
   83   1HD   PRO  11          1HD       PRO  11   0.488  -4.124 -14.658
   84   2HD   PRO  11          2HD       PRO  11   0.685  -5.836 -15.037
   85    H    GLU  12           H        GLU  12  -1.604  -7.611 -14.967
   86    HA   GLU  12           HA       GLU  12  -3.729  -9.137 -16.001
   87   1HB   GLU  12          1HB       GLU  12  -2.820 -10.975 -14.717
   88   2HB   GLU  12          2HB       GLU  12  -1.533 -10.075 -15.502
   89   1HG   GLU  12          1HG       GLU  12  -2.133  -9.157 -12.767
   90   2HG   GLU  12          2HG       GLU  12  -1.614 -10.831 -12.885
   91    H    LEU  13           H        LEU  13  -3.777  -7.050 -13.331
   92    HA   LEU  13           HA       LEU  13  -5.639  -8.602 -11.775
   93   1HB   LEU  13          1HB       LEU  13  -4.448  -5.870 -11.506
   94   2HB   LEU  13          2HB       LEU  13  -5.814  -6.323 -10.518
   95    HG   LEU  13           HG       LEU  13  -3.097  -7.619 -10.534
   96   1HD1  LEU  13          1HD1      LEU  13  -4.570  -5.867  -8.600
   97   2HD1  LEU  13          2HD1      LEU  13  -3.291  -6.933  -8.070
   98   3HD1  LEU  13          3HD1      LEU  13  -2.957  -5.689  -9.220
   99   1HD2  LEU  13          1HD2      LEU  13  -5.678  -8.488  -9.281
  100   2HD2  LEU  13          2HD2      LEU  13  -4.513  -9.420 -10.215
  101   3HD2  LEU  13          3HD2      LEU  13  -4.121  -8.916  -8.599
  102    H    VAL  14           H        VAL  14  -5.767  -6.397 -14.385
  103    HA   VAL  14           HA       VAL  14  -8.221  -5.148 -13.986
  104    HB   VAL  14           HB       VAL  14  -7.109  -6.100 -16.633
  105   1HG1  VAL  14          1HG1      VAL  14  -9.051  -3.898 -15.960
  106   2HG1  VAL  14          2HG1      VAL  14  -8.366  -4.196 -17.554
  107   3HG1  VAL  14          3HG1      VAL  14  -9.428  -5.392 -16.819
  108   1HG2  VAL  14          1HG2      VAL  14  -5.463  -4.756 -15.352
  109   2HG2  VAL  14          2HG2      VAL  14  -6.024  -3.937 -16.791
  110   3HG2  VAL  14          3HG2      VAL  14  -6.646  -3.476 -15.211
  111    H    GLY  15           H        GLY  15 -10.137  -6.097 -13.566
  112   1HA   GLY  15          1HA       GLY  15 -11.989  -7.318 -14.484
  113   2HA   GLY  15          2HA       GLY  15 -10.876  -8.524 -15.108
  114    H    LYS  16           H        LYS  16  -9.588  -7.880 -12.200
  115    HA   LYS  16           HA       LYS  16 -11.050 -10.102 -10.942
  116   1HB   LYS  16          1HB       LYS  16  -8.272  -9.067 -10.829
  117   2HB   LYS  16          2HB       LYS  16  -8.917  -9.656  -9.315
  118   1HG   LYS  16          1HG       LYS  16  -9.491 -11.514 -11.473
  119   2HG   LYS  16          2HG       LYS  16  -7.776 -11.105 -11.403
  120   1HD   LYS  16          1HD       LYS  16  -8.067 -11.534  -8.839
  121   2HD   LYS  16          2HD       LYS  16  -9.510 -12.419  -9.341
  122   1HE   LYS  16          1HE       LYS  16  -8.294 -14.053 -10.398
  123   2HE   LYS  16          2HE       LYS  16  -6.932 -12.985 -10.741
  124   1HZ   LYS  16          1HZ       LYS  16  -6.397 -13.039  -8.360
  125   2HZ   LYS  16          2HZ       LYS  16  -7.637 -14.162  -8.113
  126   3HZ   LYS  16          3HZ       LYS  16  -6.301 -14.571  -9.071
  127    H    SER  17           H        SER  17 -11.532  -9.991  -8.656
  128    HA   SER  17           HA       SER  17 -13.002  -7.720  -7.960
  129   1HB   SER  17          1HB       SER  17 -13.390  -8.747  -5.873
  130   2HB   SER  17          2HB       SER  17 -13.137 -10.098  -6.973
  131    HG   SER  17           HG       SER  17 -11.947 -10.167  -4.917
  132    H    GLY  18           H        GLY  18 -12.593  -5.901  -6.753
  133   1HA   GLY  18          1HA       GLY  18 -10.083  -4.757  -6.700
  134   2HA   GLY  18          2HA       GLY  18 -11.396  -4.284  -5.658
  135    H    ASN  19           H        ASN  19 -11.491  -6.968  -4.378
  136    HA   ASN  19           HA       ASN  19  -9.556  -6.423  -2.336
  137   1HB   ASN  19          1HB       ASN  19 -11.986  -7.774  -2.433
  138   2HB   ASN  19          2HB       ASN  19 -10.827  -9.081  -2.228
  139   2HD2  ASN  19          2HD2      ASN  19  -9.097  -8.555  -0.509
  140   1HD2  ASN  19          1HD2      ASN  19  -9.717  -7.881   0.956
  141    H    MET  20           H        MET  20  -9.968  -9.000  -4.760
  142    HA   MET  20           HA       MET  20  -7.644 -10.441  -4.000
  143   1HB   MET  20          1HB       MET  20  -9.590 -11.233  -5.478
  144   2HB   MET  20          2HB       MET  20  -8.814 -10.361  -6.787
  145   1HG   MET  20          1HG       MET  20  -8.044 -12.466  -7.073
  146   2HG   MET  20          2HG       MET  20  -6.706 -11.751  -6.198
  147   1HE   MET  20          1HE       MET  20  -5.871 -12.531  -4.029
  148   2HE   MET  20          2HE       MET  20  -6.210 -14.166  -3.459
  149   3HE   MET  20          3HE       MET  20  -5.600 -13.911  -5.093
  150    H    ALA  21           H        ALA  21  -8.237  -7.724  -6.137
  151    HA   ALA  21           HA       ALA  21  -5.723  -7.700  -7.413
  152   1HB   ALA  21          1HB       ALA  21  -7.942  -5.744  -7.080
  153   2HB   ALA  21          2HB       ALA  21  -7.236  -6.441  -8.540
  154   3HB   ALA  21          3HB       ALA  21  -6.389  -5.164  -7.684
  155    H    ALA  22           H        ALA  22  -6.974  -5.579  -4.830
  156    HA   ALA  22           HA       ALA  22  -4.611  -4.303  -4.194
  157   1HB   ALA  22          1HB       ALA  22  -6.699  -5.128  -2.171
  158   2HB   ALA  22          2HB       ALA  22  -6.874  -3.770  -3.282
  159   3HB   ALA  22          3HB       ALA  22  -5.593  -3.753  -2.078
  160    H    ALA  23           H        ALA  23  -5.838  -7.406  -3.023
  161    HA   ALA  23           HA       ALA  23  -3.807  -7.943  -1.153
  162   1HB   ALA  23          1HB       ALA  23  -5.419  -9.902  -2.792
  163   2HB   ALA  23          2HB       ALA  23  -5.913  -9.192  -1.255
  164   3HB   ALA  23          3HB       ALA  23  -4.516 -10.267  -1.320
  165    H    THR  24           H        THR  24  -4.105  -8.768  -4.600
  166    HA   THR  24           HA       THR  24  -1.761 -10.261  -4.859
  167    HB   THR  24           HB       THR  24  -3.059  -8.467  -6.901
  168    HG1  THR  24           HG1      THR  24  -4.508 -10.030  -6.188
  169   1HG2  THR  24          1HG2      THR  24  -1.178 -10.766  -7.239
  170   2HG2  THR  24          2HG2      THR  24  -2.130 -10.075  -8.539
  171   3HG2  THR  24          3HG2      THR  24  -0.876  -9.100  -7.755
  172    H    VAL  25           H        VAL  25  -2.278  -6.763  -5.029
  173    HA   VAL  25           HA       VAL  25   0.356  -6.116  -5.856
  174    HB   VAL  25           HB       VAL  25  -1.566  -4.394  -4.283
  175   1HG1  VAL  25          1HG1      VAL  25   1.124  -3.901  -5.065
  176   2HG1  VAL  25          2HG1      VAL  25   0.088  -2.967  -6.126
  177   3HG1  VAL  25          3HG1      VAL  25  -0.061  -2.783  -4.394
  178   1HG2  VAL  25          1HG2      VAL  25  -1.234  -4.731  -7.261
  179   2HG2  VAL  25          2HG2      VAL  25  -2.640  -5.175  -6.309
  180   3HG2  VAL  25          3HG2      VAL  25  -2.207  -3.489  -6.483
  181    H    GLU  26           H        GLU  26  -1.170  -5.948  -2.617
  182    HA   GLU  26           HA       GLU  26   1.234  -5.284  -1.278
  183   1HB   GLU  26          1HB       GLU  26  -1.373  -6.465  -0.338
  184   2HB   GLU  26          2HB       GLU  26  -0.061  -6.107   0.780
  185   1HG   GLU  26          1HG       GLU  26  -0.223  -3.836   0.473
  186   2HG   GLU  26          2HG       GLU  26  -1.070  -3.984  -1.068
  187    H    ARG  27           H        ARG  27  -0.061  -8.352  -2.346
  188    HA   ARG  27           HA       ARG  27   1.696  -9.880  -0.623
  189   1HB   ARG  27          1HB       ARG  27  -0.665 -10.440  -1.995
  190   2HB   ARG  27          2HB       ARG  27   0.535 -11.342  -2.877
  191   1HG   ARG  27          1HG       ARG  27   0.937 -11.716  -0.044
  192   2HG   ARG  27          2HG       ARG  27  -0.761 -11.958  -0.444
  193   1HD   ARG  27          1HD       ARG  27   1.606 -13.342  -1.693
  194   2HD   ARG  27          2HD       ARG  27   0.406 -14.052  -0.612
  195    HE   ARG  27           HE       ARG  27  -0.949 -13.014  -2.831
  196   1HH1  ARG  27          1HH1      ARG  27   1.341 -15.569  -2.085
  197   2HH1  ARG  27          2HH1      ARG  27   0.797 -16.574  -3.378
  198   1HH2  ARG  27          1HH2      ARG  27  -1.641 -14.351  -4.526
  199   2HH2  ARG  27          2HH2      ARG  27  -0.888 -15.893  -4.764
  200    H    GLU  28           H        GLU  28   1.394  -9.465  -4.169
  201    HA   GLU  28           HA       GLU  28   3.826 -10.783  -4.768
  202   1HB   GLU  28          1HB       GLU  28   2.061  -8.878  -6.278
  203   2HB   GLU  28          2HB       GLU  28   3.644  -9.261  -6.911
  204   1HG   GLU  28          1HG       GLU  28   2.892 -11.732  -6.571
  205   2HG   GLU  28          2HG       GLU  28   1.272 -11.030  -6.572
  206    H    ASN  29           H        ASN  29   3.069  -7.502  -3.823
  207    HA   ASN  29           HA       ASN  29   5.957  -6.877  -3.855
  208   1HB   ASN  29          1HB       ASN  29   4.800  -5.731  -5.660
  209   2HB   ASN  29          2HB       ASN  29   3.666  -5.022  -4.537
  210   2HD2  ASN  29          2HD2      ASN  29   5.385  -3.627  -6.339
  211   1HD2  ASN  29          1HD2      ASN  29   6.464  -2.688  -5.370
  212    H    ARG  30           H        ARG  30   6.048  -7.545  -1.693
  213    HA   ARG  30           HA       ARG  30   4.393  -6.598   0.359
  214   1HB   ARG  30          1HB       ARG  30   6.563  -8.342   0.151
  215   2HB   ARG  30          2HB       ARG  30   7.162  -7.072   1.196
  216   1HG   ARG  30          1HG       ARG  30   4.522  -7.781   2.061
  217   2HG   ARG  30          2HG       ARG  30   5.444  -9.255   1.780
  218   1HD   ARG  30          1HD       ARG  30   7.247  -7.619   3.133
  219   2HD   ARG  30          2HD       ARG  30   5.686  -7.239   3.861
  220    HE   ARG  30           HE       ARG  30   5.837  -9.212   4.956
  221   1HH1  ARG  30          1HH1      ARG  30   7.679  -9.523   1.973
  222   2HH1  ARG  30          2HH1      ARG  30   8.152 -11.128   2.295
  223   1HH2  ARG  30          1HH2      ARG  30   6.507 -11.349   5.376
  224   2HH2  ARG  30          2HH2      ARG  30   7.512 -12.181   4.236
  225    H    ASN  31           H        ASN  31   6.570  -4.785  -1.504
  226    HA   ASN  31           HA       ASN  31   7.238  -2.956   0.663
  227   1HB   ASN  31          1HB       ASN  31   8.971  -3.628  -0.968
  228   2HB   ASN  31          2HB       ASN  31   8.036  -2.857  -2.246
  229   2HD2  ASN  31          2HD2      ASN  31  10.030  -2.355   0.564
  230   1HD2  ASN  31          1HD2      ASN  31  10.256  -0.659   0.321
  231    H    VAL  32           H        VAL  32   4.551  -3.344  -1.211
  232    HA   VAL  32           HA       VAL  32   4.060  -0.444  -1.204
  233    HB   VAL  32           HB       VAL  32   2.749  -0.629  -3.246
  234   1HG1  VAL  32          1HG1      VAL  32   5.135  -0.083  -3.430
  235   2HG1  VAL  32          2HG1      VAL  32   5.515  -1.771  -3.570
  236   3HG1  VAL  32          3HG1      VAL  32   4.567  -0.995  -4.815
  237   1HG2  VAL  32          1HG2      VAL  32   3.436  -3.531  -3.038
  238   2HG2  VAL  32          2HG2      VAL  32   1.889  -2.769  -3.284
  239   3HG2  VAL  32          3HG2      VAL  32   3.066  -2.808  -4.590
  240    H    HIS  33           H        HIS  33   1.710   0.074  -1.337
  241    HA   HIS  33           HA       HIS  33   0.042  -1.909   0.029
  242   1HB   HIS  33          1HB       HIS  33   0.165  -0.752   1.908
  243   2HB   HIS  33          2HB       HIS  33   1.055   0.552   1.159
  244    HD1  HIS  33           HD1      HIS  33  -2.374  -0.498   2.188
  245    HD2  HIS  33           HD2      HIS  33  -0.510   2.789   0.464
  246    HE1  HIS  33           HE1      HIS  33  -4.055   1.360   2.292
  247    HE2  HIS  33           HE2      HIS  33  -2.782   3.380   1.505
  248    H    ALA  34           H        ALA  34  -1.905  -2.141  -0.891
  249    HA   ALA  34           HA       ALA  34  -2.658  -0.251  -2.982
  250   1HB   ALA  34          1HB       ALA  34  -3.577  -3.079  -2.528
  251   2HB   ALA  34          2HB       ALA  34  -4.036  -2.047  -3.884
  252   3HB   ALA  34          3HB       ALA  34  -2.354  -2.542  -3.674
  253    H    ILE  35           H        ILE  35  -4.643   0.672  -3.115
  254    HA   ILE  35           HA       ILE  35  -6.421   0.382  -0.759
  255    HB   ILE  35           HB       ILE  35  -6.049   2.874  -2.418
  256   1HG1  ILE  35          1HG1      ILE  35  -5.000   2.488   0.386
  257   2HG1  ILE  35          2HG1      ILE  35  -4.005   2.108  -1.009
  258   1HG2  ILE  35          1HG2      ILE  35  -7.458   2.353   0.199
  259   2HG2  ILE  35          2HG2      ILE  35  -7.219   3.944  -0.523
  260   3HG2  ILE  35          3HG2      ILE  35  -8.221   2.754  -1.343
  261   1HD1  ILE  35          1HD1      ILE  35  -5.215   4.804  -0.485
  262   2HD1  ILE  35          2HD1      ILE  35  -3.572   4.324  -0.104
  263   3HD1  ILE  35          3HD1      ILE  35  -4.098   4.351  -1.767
  264    H    VAL  36           H        VAL  36  -8.619   0.271  -1.153
  265    HA   VAL  36           HA       VAL  36  -9.346  -0.325  -3.933
  266    HB   VAL  36           HB       VAL  36 -10.875  -0.837  -1.387
  267   1HG1  VAL  36          1HG1      VAL  36 -11.430  -1.520  -4.273
  268   2HG1  VAL  36          2HG1      VAL  36 -12.123  -2.434  -2.939
  269   3HG1  VAL  36          3HG1      VAL  36 -12.477  -0.718  -3.102
  270   1HG2  VAL  36          1HG2      VAL  36  -8.799  -2.134  -1.529
  271   2HG2  VAL  36          2HG2      VAL  36 -10.214  -3.167  -1.687
  272   3HG2  VAL  36          3HG2      VAL  36  -9.278  -2.725  -3.119
  273    H    LEU  37           H        LEU  37 -10.616   0.908  -5.122
  274    HA   LEU  37           HA       LEU  37 -12.561   2.707  -3.974
  275   1HB   LEU  37          1HB       LEU  37 -11.444   4.594  -5.450
  276   2HB   LEU  37          2HB       LEU  37 -11.080   4.365  -3.767
  277    HG   LEU  37           HG       LEU  37  -9.262   2.743  -5.331
  278   1HD1  LEU  37          1HD1      LEU  37  -9.663   5.538  -6.303
  279   2HD1  LEU  37          2HD1      LEU  37  -8.071   4.776  -6.364
  280   3HD1  LEU  37          3HD1      LEU  37  -9.439   4.053  -7.202
  281   1HD2  LEU  37          1HD2      LEU  37  -9.239   4.337  -3.019
  282   2HD2  LEU  37          2HD2      LEU  37  -7.929   3.387  -3.696
  283   3HD2  LEU  37          3HD2      LEU  37  -8.118   5.058  -4.130
  284    H    LYS  38           H        LYS  38 -14.018   3.560  -5.516
  285    HA   LYS  38           HA       LYS  38 -14.210   1.874  -7.868
  286   1HB   LYS  38          1HB       LYS  38 -16.045   3.288  -6.153
  287   2HB   LYS  38          2HB       LYS  38 -16.359   3.718  -7.823
  288   1HG   LYS  38          1HG       LYS  38 -17.198   1.718  -8.337
  289   2HG   LYS  38          2HG       LYS  38 -16.000   0.844  -7.399
  290   1HD   LYS  38          1HD       LYS  38 -17.223   1.638  -5.322
  291   2HD   LYS  38          2HD       LYS  38 -18.009   0.405  -6.309
  292   1HE   LYS  38          1HE       LYS  38 -18.596   3.316  -6.763
  293   2HE   LYS  38          2HE       LYS  38 -19.572   1.904  -7.161
  294   1HZ   LYS  38          1HZ       LYS  38 -19.011   2.855  -4.399
  295   2HZ   LYS  38          2HZ       LYS  38 -20.429   3.171  -5.265
  296   3HZ   LYS  38          3HZ       LYS  38 -20.041   1.584  -4.840
  297    H    GLU  39           H        GLU  39 -14.863   2.729  -9.952
  298    HA   GLU  39           HA       GLU  39 -13.020   4.505 -11.026
  299   1HB   GLU  39          1HB       GLU  39 -14.900   2.821 -12.053
  300   2HB   GLU  39          2HB       GLU  39 -15.613   4.379 -12.439
  301   1HG   GLU  39          1HG       GLU  39 -13.727   5.025 -13.720
  302   2HG   GLU  39          2HG       GLU  39 -12.778   3.654 -13.143
  303    H    GLY  40           H        GLY  40 -12.755   6.619 -10.806
  304   1HA   GLY  40          1HA       GLY  40 -13.514   8.827 -11.100
  305   2HA   GLY  40          2HA       GLY  40 -15.150   8.343 -10.702
  306    H    SER  41           H        SER  41 -13.044   6.888  -8.519
  307    HA   SER  41           HA       SER  41 -13.987   8.422  -6.361
  308   1HB   SER  41          1HB       SER  41 -13.366   6.282  -5.735
  309   2HB   SER  41          2HB       SER  41 -11.872   6.326  -6.671
  310    HG   SER  41           HG       SER  41 -12.010   6.701  -4.142
  311    H    ALA  42           H        ALA  42 -13.228  10.194  -5.390
  312    HA   ALA  42           HA       ALA  42 -11.252  11.812  -6.638
  313   1HB   ALA  42          1HB       ALA  42 -13.109  12.782  -5.408
  314   2HB   ALA  42          2HB       ALA  42 -11.577  13.308  -4.712
  315   3HB   ALA  42          3HB       ALA  42 -12.529  12.054  -3.912
  316    H    MET  43           H        MET  43  -9.406  10.362  -6.686
  317    HA   MET  43           HA       MET  43  -8.063  10.087  -4.070
  318   1HB   MET  43          1HB       MET  43  -8.014   8.439  -6.592
  319   2HB   MET  43          2HB       MET  43  -6.800   8.296  -5.362
  320   1HG   MET  43          1HG       MET  43  -9.715   7.868  -4.949
  321   2HG   MET  43          2HG       MET  43  -8.515   6.630  -5.147
  322   1HE   MET  43          1HE       MET  43 -10.655   8.199  -2.854
  323   2HE   MET  43          2HE       MET  43 -10.411   6.489  -2.499
  324   3HE   MET  43          3HE       MET  43 -10.009   7.708  -1.288
  325    H    THR  44           H        THR  44  -5.698  10.139  -4.151
  326    HA   THR  44           HA       THR  44  -4.804  12.556  -5.286
  327    HB   THR  44           HB       THR  44  -2.604  10.768  -4.719
  328    HG1  THR  44           HG1      THR  44  -4.466  10.933  -2.593
  329   1HG2  THR  44          1HG2      THR  44  -2.535  13.205  -4.424
  330   2HG2  THR  44          2HG2      THR  44  -3.670  13.038  -3.081
  331   3HG2  THR  44          3HG2      THR  44  -2.070  12.303  -2.980
  332    H    LYS  45           H        LYS  45  -2.917  12.768  -6.761
  333    HA   LYS  45           HA       LYS  45  -3.090  10.792  -8.948
  334   1HB   LYS  45          1HB       LYS  45  -3.055  13.772  -8.929
  335   2HB   LYS  45          2HB       LYS  45  -2.251  12.959 -10.264
  336   1HG   LYS  45          1HG       LYS  45  -5.122  12.532  -9.455
  337   2HG   LYS  45          2HG       LYS  45  -4.562  13.586 -10.757
  338   1HD   LYS  45          1HD       LYS  45  -3.387  11.443 -11.664
  339   2HD   LYS  45          2HD       LYS  45  -4.474  10.589 -10.567
  340   1HE   LYS  45          1HE       LYS  45  -6.137  10.747 -12.009
  341   2HE   LYS  45          2HE       LYS  45  -6.006  12.503 -12.054
  342   1HZ   LYS  45          1HZ       LYS  45  -4.191  12.201 -13.716
  343   2HZ   LYS  45          2HZ       LYS  45  -4.561  10.551 -13.755
  344   3HZ   LYS  45          3HZ       LYS  45  -5.719  11.683 -14.238
  345    H    ASP  46           H        ASP  46  -1.002  12.612  -6.854
  346    HA   ASP  46           HA       ASP  46   1.402  12.523  -8.187
  347   1HB   ASP  46          1HB       ASP  46   2.462  12.532  -5.949
  348   2HB   ASP  46          2HB       ASP  46   1.123  13.670  -6.058
  349    H    PHE  47           H        PHE  47   3.316  11.105  -7.448
  350    HA   PHE  47           HA       PHE  47   2.531   8.305  -7.901
  351   1HB   PHE  47          1HB       PHE  47   4.093   9.040  -9.499
  352   2HB   PHE  47          2HB       PHE  47   5.076   9.864  -8.299
  353    HD1  PHE  47           HD1      PHE  47   4.189   6.595  -9.722
  354    HD2  PHE  47           HD2      PHE  47   6.708   8.689  -6.995
  355    HE1  PHE  47           HE1      PHE  47   5.645   4.633  -9.551
  356    HE2  PHE  47           HE2      PHE  47   8.153   6.711  -6.813
  357    HZ   PHE  47           HZ       PHE  47   7.599   4.664  -8.075
  358    H    ARG  48           H        ARG  48   2.678   6.812  -6.358
  359    HA   ARG  48           HA       ARG  48   4.523   7.184  -4.102
  360   1HB   ARG  48          1HB       ARG  48   1.532   6.982  -3.906
  361   2HB   ARG  48          2HB       ARG  48   2.538   6.339  -2.623
  362   1HG   ARG  48          1HG       ARG  48   3.592   8.595  -2.438
  363   2HG   ARG  48          2HG       ARG  48   2.382   9.193  -3.578
  364   1HD   ARG  48          1HD       ARG  48   0.669   8.183  -1.956
  365   2HD   ARG  48          2HD       ARG  48   1.453   9.674  -1.490
  366    HE   ARG  48           HE       ARG  48   1.745   7.044  -0.296
  367   1HH1  ARG  48          1HH1      ARG  48   3.071  10.289  -0.544
  368   2HH1  ARG  48          2HH1      ARG  48   3.932  10.170   0.941
  369   1HH2  ARG  48          1HH2      ARG  48   2.916   6.905   1.658
  370   2HH2  ARG  48          2HH2      ARG  48   3.855   8.258   2.194
  371    H    CYS  49           H        CYS  49   5.720   5.413  -4.196
  372    HA   CYS  49           HA       CYS  49   5.018   3.010  -5.451
  373   1HB   CYS  49          1HB       CYS  49   7.017   2.081  -4.585
  374   2HB   CYS  49          2HB       CYS  49   7.072   3.247  -3.267
  375    H    ASP  50           H        ASP  50   4.703   4.044  -2.105
  376    HA   ASP  50           HA       ASP  50   3.915   1.432  -1.179
  377   1HB   ASP  50          1HB       ASP  50   3.409   2.581   0.949
  378   2HB   ASP  50          2HB       ASP  50   5.030   2.921   0.361
  379    H    ARG  51           H        ARG  51   2.306   3.688  -3.028
  380    HA   ARG  51           HA       ARG  51  -0.285   2.793  -1.997
  381   1HB   ARG  51          1HB       ARG  51   0.321   5.240  -1.676
  382   2HB   ARG  51          2HB       ARG  51   0.172   5.392  -3.424
  383   1HG   ARG  51          1HG       ARG  51  -2.165   4.492  -3.208
  384   2HG   ARG  51          2HG       ARG  51  -1.939   4.607  -1.461
  385   1HD   ARG  51          1HD       ARG  51  -3.064   6.584  -2.166
  386   2HD   ARG  51          2HD       ARG  51  -1.422   7.013  -1.751
  387    HE   ARG  51           HE       ARG  51  -2.059   6.470  -4.563
  388   1HH1  ARG  51          1HH1      ARG  51  -1.341   8.853  -2.066
  389   2HH1  ARG  51          2HH1      ARG  51  -0.945  10.075  -3.206
  390   1HH2  ARG  51          1HH2      ARG  51  -1.583   8.136  -6.024
  391   2HH2  ARG  51          2HH2      ARG  51  -1.015   9.662  -5.462
  392    H    VAL  52           H        VAL  52  -1.563   1.760  -3.367
  393    HA   VAL  52           HA       VAL  52  -1.145   2.090  -6.268
  394    HB   VAL  52           HB       VAL  52  -1.551  -0.572  -4.870
  395   1HG1  VAL  52          1HG1      VAL  52  -2.737  -0.469  -7.011
  396   2HG1  VAL  52          2HG1      VAL  52  -1.265   0.083  -7.790
  397   3HG1  VAL  52          3HG1      VAL  52  -1.338  -1.531  -7.106
  398   1HG2  VAL  52          1HG2      VAL  52   0.854   0.872  -5.528
  399   2HG2  VAL  52          2HG2      VAL  52   0.652  -0.673  -4.726
  400   3HG2  VAL  52          3HG2      VAL  52   0.761  -0.599  -6.478
  401    H    TRP  53           H        TRP  53  -2.999   2.773  -7.153
  402    HA   TRP  53           HA       TRP  53  -5.447   2.654  -5.658
  403   1HB   TRP  53          1HB       TRP  53  -4.812   3.682  -8.415
  404   2HB   TRP  53          2HB       TRP  53  -6.431   3.747  -7.740
  405    HD1  TRP  53           HD1      TRP  53  -4.353   6.233  -8.573
  406    HE1  TRP  53           HE1      TRP  53  -4.133   8.137  -6.854
  407    HE3  TRP  53           HE3      TRP  53  -6.025   3.799  -4.427
  408    HZ2  TRP  53           HZ2      TRP  53  -4.554   8.512  -4.108
  409    HZ3  TRP  53           HZ3      TRP  53  -6.133   5.008  -2.318
  410    HH2  TRP  53           HH2      TRP  53  -5.382   7.319  -2.133
  411    H    VAL  54           H        VAL  54  -7.080   1.293  -5.799
  412    HA   VAL  54           HA       VAL  54  -7.028  -0.726  -7.966
  413    HB   VAL  54           HB       VAL  54  -8.012  -0.918  -5.130
  414   1HG1  VAL  54          1HG1      VAL  54  -8.586  -2.638  -7.479
  415   2HG1  VAL  54          2HG1      VAL  54  -8.443  -3.370  -5.890
  416   3HG1  VAL  54          3HG1      VAL  54  -9.648  -2.135  -6.171
  417   1HG2  VAL  54          1HG2      VAL  54  -5.738  -2.119  -6.641
  418   2HG2  VAL  54          2HG2      VAL  54  -5.734  -1.315  -5.073
  419   3HG2  VAL  54          3HG2      VAL  54  -6.401  -2.936  -5.226
  420    H    ILE  55           H        ILE  55  -8.209   0.663  -9.317
  421    HA   ILE  55           HA       ILE  55 -10.735   1.734  -8.505
  422    HB   ILE  55           HB       ILE  55  -9.786   1.610 -11.335
  423   1HG1  ILE  55          1HG1      ILE  55  -8.746   3.218  -9.046
  424   2HG1  ILE  55          2HG1      ILE  55  -9.018   4.088 -10.548
  425   1HG2  ILE  55          1HG2      ILE  55 -12.079   2.301 -10.955
  426   2HG2  ILE  55          2HG2      ILE  55 -11.519   3.592  -9.883
  427   3HG2  ILE  55          3HG2      ILE  55 -11.094   3.608 -11.594
  428   1HD1  ILE  55          1HD1      ILE  55  -7.492   1.570 -10.771
  429   2HD1  ILE  55          2HD1      ILE  55  -7.320   3.106 -11.603
  430   3HD1  ILE  55          3HD1      ILE  55  -6.728   2.931  -9.957
  431    H    VAL  56           H        VAL  56 -12.543   0.621  -8.417
  432    HA   VAL  56           HA       VAL  56 -12.950  -1.615 -10.282
  433    HB   VAL  56           HB       VAL  56 -14.267  -2.716  -8.526
  434   1HG1  VAL  56          1HG1      VAL  56 -11.401  -2.381  -8.507
  435   2HG1  VAL  56          2HG1      VAL  56 -12.012  -2.644  -6.883
  436   3HG1  VAL  56          3HG1      VAL  56 -12.371  -3.806  -8.139
  437   1HG2  VAL  56          1HG2      VAL  56 -13.316  -0.449  -6.796
  438   2HG2  VAL  56          2HG2      VAL  56 -14.975  -0.824  -7.236
  439   3HG2  VAL  56          3HG2      VAL  56 -14.088  -1.911  -6.190
  440    H    ASN  57           H        ASN  57 -15.259  -2.182 -10.576
  441    HA   ASN  57           HA       ASN  57 -16.764   0.275 -11.090
  442   1HB   ASN  57          1HB       ASN  57 -16.576  -1.393 -12.868
  443   2HB   ASN  57          2HB       ASN  57 -18.239  -1.139 -12.424
  444   2HD2  ASN  57          2HD2      ASN  57 -17.472  -3.381 -13.814
  445   1HD2  ASN  57          1HD2      ASN  57 -17.631  -4.756 -12.782
  446    H    ASP  58           H        ASP  58 -19.346  -0.414 -10.929
  447    HA   ASP  58           HA       ASP  58 -19.942  -0.123  -8.223
  448   1HB   ASP  58          1HB       ASP  58 -21.395  -0.222 -10.700
  449   2HB   ASP  58          2HB       ASP  58 -22.219  -1.271  -9.555
  450    H    HIS  59           H        HIS  59 -19.359  -3.002 -10.067
  451    HA   HIS  59           HA       HIS  59 -20.605  -4.742  -8.096
  452   1HB   HIS  59          1HB       HIS  59 -20.733  -5.186 -10.543
  453   2HB   HIS  59          2HB       HIS  59 -19.005  -5.487 -10.554
  454    HD1  HIS  59           HD1      HIS  59 -18.665  -7.945 -10.661
  455    HD2  HIS  59           HD2      HIS  59 -21.887  -6.959  -8.247
  456    HE1  HIS  59           HE1      HIS  59 -19.470 -10.121  -9.722
  457    HE2  HIS  59           HE2      HIS  59 -21.506  -9.513  -8.366
  458    H    GLY  60           H        GLY  60 -17.764  -3.080  -8.075
  459   1HA   GLY  60          1HA       GLY  60 -15.961  -3.307  -6.703
  460   2HA   GLY  60          2HA       GLY  60 -16.590  -4.853  -6.153
  461    H    VAL  61           H        VAL  61 -16.171  -4.216  -9.556
  462    HA   VAL  61           HA       VAL  61 -14.034  -6.241  -9.650
  463    HB   VAL  61           HB       VAL  61 -15.648  -5.106 -11.940
  464   1HG1  VAL  61          1HG1      VAL  61 -13.853  -7.507 -11.693
  465   2HG1  VAL  61          2HG1      VAL  61 -14.902  -7.193 -13.071
  466   3HG1  VAL  61          3HG1      VAL  61 -13.590  -6.078 -12.692
  467   1HG2  VAL  61          1HG2      VAL  61 -16.132  -7.621 -10.347
  468   2HG2  VAL  61          2HG2      VAL  61 -17.154  -6.191 -10.390
  469   3HG2  VAL  61          3HG2      VAL  61 -16.965  -7.171 -11.838
  470    H    VAL  62           H        VAL  62 -11.996  -5.716 -10.294
  471    HA   VAL  62           HA       VAL  62 -11.257  -2.980 -10.445
  472    HB   VAL  62           HB       VAL  62  -9.597  -5.371 -11.233
  473   1HG1  VAL  62          1HG1      VAL  62  -8.852  -2.518 -10.551
  474   2HG1  VAL  62          2HG1      VAL  62  -7.704  -3.852 -10.666
  475   3HG1  VAL  62          3HG1      VAL  62  -8.632  -3.374 -12.079
  476   1HG2  VAL  62          1HG2      VAL  62 -10.644  -4.966  -8.736
  477   2HG2  VAL  62          2HG2      VAL  62  -9.175  -5.798  -9.114
  478   3HG2  VAL  62          3HG2      VAL  62  -9.117  -4.115  -8.621
  479    H    THR  63           H        THR  63 -11.824  -1.730 -12.110
  480    HA   THR  63           HA       THR  63 -11.948  -2.875 -14.811
  481    HB   THR  63           HB       THR  63 -13.049  -0.829 -15.442
  482    HG1  THR  63           HG1      THR  63 -12.163   0.787 -14.309
  483   1HG2  THR  63          1HG2      THR  63 -14.285  -2.638 -14.025
  484   2HG2  THR  63          2HG2      THR  63 -14.308  -1.368 -12.794
  485   3HG2  THR  63          3HG2      THR  63 -15.039  -1.086 -14.372
  486    H    SER  64           H        SER  64 -10.102  -0.529 -12.925
  487    HA   SER  64           HA       SER  64  -8.475   0.078 -15.306
  488   1HB   SER  64          1HB       SER  64  -9.395   1.969 -13.968
  489   2HB   SER  64          2HB       SER  64  -8.433   1.413 -12.622
  490    HG   SER  64           HG       SER  64  -7.563   2.475 -15.071
  491    H    VAL  65           H        VAL  65  -6.189   0.100 -15.099
  492    HA   VAL  65           HA       VAL  65  -5.175  -2.290 -13.956
  493    HB   VAL  65           HB       VAL  65  -3.416  -0.031 -14.873
  494   1HG1  VAL  65          1HG1      VAL  65  -3.195  -2.996 -14.636
  495   2HG1  VAL  65          2HG1      VAL  65  -2.179  -2.134 -15.794
  496   3HG1  VAL  65          3HG1      VAL  65  -2.103  -1.744 -14.081
  497   1HG2  VAL  65          1HG2      VAL  65  -4.893  -1.984 -16.630
  498   2HG2  VAL  65          2HG2      VAL  65  -5.145  -0.241 -16.590
  499   3HG2  VAL  65          3HG2      VAL  65  -3.622  -0.885 -17.164
  500   1HB   PRO  66          1HB       PRO  66  -3.451  -2.596  -8.679
  501   2HB   PRO  66          2HB       PRO  66  -5.131  -2.241  -9.098
  502   1HG   PRO  66          1HG       PRO  66  -3.217  -4.088 -10.404
  503   2HG   PRO  66          2HG       PRO  66  -4.939  -4.290 -10.082
  504   1HD   PRO  66          1HD       PRO  66  -3.842  -3.529 -12.525
  505   2HD   PRO  66          2HD       PRO  66  -5.525  -3.283 -12.031
  506    H    HIS  67           H        HIS  67  -2.288   0.825 -10.476
  507    HA   HIS  67           HA       HIS  67   0.264  -0.635 -10.322
  508   1HB   HIS  67          1HB       HIS  67   1.160   1.069 -12.007
  509   2HB   HIS  67          2HB       HIS  67   0.050  -0.140 -12.629
  510    HD1  HIS  67           HD1      HIS  67  -2.600   0.847 -12.502
  511    HD2  HIS  67           HD2      HIS  67   0.540   3.459 -13.069
  512    HE1  HIS  67           HE1      HIS  67  -3.649   2.917 -13.426
  513    HE2  HIS  67           HE2      HIS  67  -1.718   4.490 -13.791
  514    H    ILE  68           H        ILE  68   1.913   0.384  -9.295
  515    HA   ILE  68           HA       ILE  68   1.516   1.904  -7.121
  516    HB   ILE  68           HB       ILE  68   3.821   1.395  -8.889
  517   1HG1  ILE  68          1HG1      ILE  68   3.627   1.535  -5.884
  518   2HG1  ILE  68          2HG1      ILE  68   3.218   0.117  -6.828
  519   1HG2  ILE  68          1HG2      ILE  68   3.845   3.816  -7.102
  520   2HG2  ILE  68          2HG2      ILE  68   5.301   3.039  -7.714
  521   3HG2  ILE  68          3HG2      ILE  68   4.154   3.714  -8.831
  522   1HD1  ILE  68          1HD1      ILE  68   5.822   0.991  -7.586
  523   2HD1  ILE  68          2HD1      ILE  68   5.737   0.852  -5.839
  524   3HD1  ILE  68          3HD1      ILE  68   5.322  -0.523  -6.854
  525    H    THR  69           H        THR  69   0.293   3.681  -6.977
  526    HA   THR  69           HA       THR  69   1.135   6.094  -8.399
  527    HB   THR  69           HB       THR  69  -1.605   4.843  -8.724
  528    HG1  THR  69           HG1      THR  69  -0.931   4.436 -10.657
  529   1HG2  THR  69          1HG2      THR  69  -0.767   7.682  -9.227
  530   2HG2  THR  69          2HG2      THR  69  -2.054   6.894 -10.137
  531   3HG2  THR  69          3HG2      THR  69  -2.193   7.072  -8.398

  No H/Q in entry =         531
  Start of MODEL    2
    1    H    SER   1           H        SER   1  19.184   7.795  -4.524
    2    HA   SER   1           HA       SER   1  18.170   5.010  -4.739
    3   1HB   SER   1          1HB       SER   1  17.470   5.279  -2.436
    4   2HB   SER   1          2HB       SER   1  19.074   5.969  -2.629
    5    HG   SER   1           HG       SER   1  16.622   7.451  -2.689
    6    H    ARG   2           H        ARG   2  16.755   5.182  -6.598
    7    HA   ARG   2           HA       ARG   2  13.976   5.972  -6.012
    8   1HB   ARG   2          1HB       ARG   2  15.770   7.448  -7.646
    9   2HB   ARG   2          2HB       ARG   2  14.643   6.693  -8.745
   10   1HG   ARG   2          1HG       ARG   2  12.846   7.847  -7.959
   11   2HG   ARG   2          2HG       ARG   2  13.529   8.055  -6.347
   12   1HD   ARG   2          1HD       ARG   2  14.451  10.003  -6.870
   13   2HD   ARG   2          2HD       ARG   2  15.156   9.389  -8.359
   14    HE   ARG   2           HE       ARG   2  13.488  10.413  -9.492
   15   1HH1  ARG   2          1HH1      ARG   2  12.333   9.818  -6.216
   16   2HH1  ARG   2          2HH1      ARG   2  10.831  10.598  -6.495
   17   1HH2  ARG   2          1HH2      ARG   2  11.489  11.473  -9.807
   18   2HH2  ARG   2          2HH2      ARG   2  10.345  11.553  -8.506
   19    H    ARG   3           H        ARG   3  14.377   3.488  -5.817
   20    HA   ARG   3           HA       ARG   3  13.140   2.355  -8.189
   21   1HB   ARG   3          1HB       ARG   3  15.877   1.568  -7.201
   22   2HB   ARG   3          2HB       ARG   3  14.845   0.348  -7.934
   23   1HG   ARG   3          1HG       ARG   3  15.671   2.924  -9.276
   24   2HG   ARG   3          2HG       ARG   3  16.436   1.355  -9.506
   25   1HD   ARG   3          1HD       ARG   3  14.381   0.426 -10.379
   26   2HD   ARG   3          2HD       ARG   3  13.534   1.932 -10.067
   27    HE   ARG   3           HE       ARG   3  15.824   2.195 -11.807
   28   1HH1  ARG   3          1HH1      ARG   3  12.360   1.586 -11.638
   29   2HH1  ARG   3          2HH1      ARG   3  12.090   2.093 -13.258
   30   1HH2  ARG   3          1HH2      ARG   3  15.424   2.848 -13.953
   31   2HH2  ARG   3          2HH2      ARG   3  13.808   2.799 -14.578
   32    H    CYS   4           H        CYS   4  11.345   2.101  -6.922
   33    HA   CYS   4           HA       CYS   4  11.424   0.807  -4.391
   34   1HB   CYS   4          1HB       CYS   4   9.074   0.990  -4.348
   35   2HB   CYS   4          2HB       CYS   4   8.959   1.035  -6.106
   36   1HB   PRO   5          1HB       PRO   5  10.828  -4.654  -3.571
   37   2HB   PRO   5          2HB       PRO   5  12.414  -3.900  -3.773
   38   1HG   PRO   5          1HG       PRO   5  10.004  -2.840  -2.392
   39   2HG   PRO   5          2HG       PRO   5  11.689  -2.802  -1.857
   40   1HD   PRO   5          1HD       PRO   5  10.454  -0.664  -2.988
   41   2HD   PRO   5          2HD       PRO   5  12.187  -0.981  -3.183
   42    H    GLY   6           H        GLY   6  10.242  -5.277  -6.140
   43   1HA   GLY   6          1HA       GLY   6   8.264  -6.346  -6.565
   44   2HA   GLY   6          2HA       GLY   6   7.440  -5.162  -5.577
   45    H    LYS   7           H        LYS   7   6.295  -6.150  -7.838
   46    HA   LYS   7           HA       LYS   7   6.735  -4.715 -10.203
   47   1HB   LYS   7          1HB       LYS   7   5.436  -6.795  -9.975
   48   2HB   LYS   7          2HB       LYS   7   4.158  -5.901  -9.196
   49   1HG   LYS   7          1HG       LYS   7   3.597  -4.750 -11.114
   50   2HG   LYS   7          2HG       LYS   7   5.114  -5.136 -11.925
   51   1HD   LYS   7          1HD       LYS   7   3.218  -7.328 -11.102
   52   2HD   LYS   7          2HD       LYS   7   2.906  -6.397 -12.556
   53   1HE   LYS   7          1HE       LYS   7   5.190  -6.948 -13.355
   54   2HE   LYS   7          2HE       LYS   7   5.372  -7.997 -11.943
   55   1HZ   LYS   7          1HZ       LYS   7   3.468  -9.287 -12.734
   56   2HZ   LYS   7          2HZ       LYS   7   3.344  -8.295 -14.103
   57   3HZ   LYS   7          3HZ       LYS   7   4.715  -9.260 -13.872
   58    H    ASN   8           H        ASN   8   5.520  -2.996 -11.184
   59    HA   ASN   8           HA       ASN   8   4.435  -1.059  -9.205
   60   1HB   ASN   8          1HB       ASN   8   6.282  -0.765 -11.537
   61   2HB   ASN   8          2HB       ASN   8   5.150   0.548 -11.227
   62   2HD2  ASN   8          2HD2      ASN   8   7.920  -1.178 -10.045
   63   1HD2  ASN   8          1HD2      ASN   8   8.316  -0.053  -8.796
   64    H    ALA   9           H        ALA   9   3.501  -3.019 -11.742
   65    HA   ALA   9           HA       ALA   9   0.979  -1.641 -11.978
   66   1HB   ALA   9          1HB       ALA   9   2.796  -2.005 -14.341
   67   2HB   ALA   9          2HB       ALA   9   2.151  -0.492 -13.706
   68   3HB   ALA   9          3HB       ALA   9   1.070  -1.655 -14.475
   69    H    TRP  10           H        TRP  10  -0.557  -3.145 -11.906
   70    HA   TRP  10           HA       TRP  10   0.162  -5.912 -12.671
   71   1HB   TRP  10          1HB       TRP  10  -1.758  -4.832 -10.628
   72   2HB   TRP  10          2HB       TRP  10  -1.741  -6.499 -11.161
   73    HD1  TRP  10           HD1      TRP  10   0.033  -8.099 -10.115
   74    HE1  TRP  10           HE1      TRP  10   1.885  -7.797  -8.354
   75    HE3  TRP  10           HE3      TRP  10  -0.034  -3.019  -9.721
   76    HZ2  TRP  10           HZ2      TRP  10   3.152  -5.668  -6.986
   77    HZ3  TRP  10           HZ3      TRP  10   1.513  -1.914  -8.172
   78    HH2  TRP  10           HH2      TRP  10   3.068  -3.222  -6.816
   79   1HB   PRO  11          1HB       PRO  11  -1.898  -6.042 -17.797
   80   2HB   PRO  11          2HB       PRO  11  -1.507  -4.347 -17.513
   81   1HG   PRO  11          1HG       PRO  11  -0.023  -6.794 -16.659
   82   2HG   PRO  11          2HG       PRO  11   0.607  -5.259 -17.284
   83   1HD   PRO  11          1HD       PRO  11   0.671  -5.867 -14.682
   84   2HD   PRO  11          2HD       PRO  11   0.400  -4.197 -15.239
   85    H    GLU  12           H        GLU  12  -1.604  -7.625 -15.054
   86    HA   GLU  12           HA       GLU  12  -3.717  -9.195 -16.077
   87   1HB   GLU  12          1HB       GLU  12  -1.540 -10.139 -15.629
   88   2HB   GLU  12          2HB       GLU  12  -2.773 -11.005 -14.728
   89   1HG   GLU  12          1HG       GLU  12  -1.981  -9.073 -12.921
   90   2HG   GLU  12          2HG       GLU  12  -1.467 -10.754 -12.969
   91    H    LEU  13           H        LEU  13  -3.716  -7.110 -13.391
   92    HA   LEU  13           HA       LEU  13  -5.572  -8.659 -11.824
   93   1HB   LEU  13          1HB       LEU  13  -4.422  -5.892 -11.578
   94   2HB   LEU  13          2HB       LEU  13  -5.737  -6.417 -10.547
   95    HG   LEU  13           HG       LEU  13  -2.995  -7.665 -10.686
   96   1HD1  LEU  13          1HD1      LEU  13  -3.210  -5.443  -9.506
   97   2HD1  LEU  13          2HD1      LEU  13  -4.318  -6.215  -8.410
   98   3HD1  LEU  13          3HD1      LEU  13  -2.660  -6.772  -8.500
   99   1HD2  LEU  13          1HD2      LEU  13  -5.499  -8.479  -9.248
  100   2HD2  LEU  13          2HD2      LEU  13  -4.418  -9.434 -10.249
  101   3HD2  LEU  13          3HD2      LEU  13  -3.918  -8.906  -8.680
  102    H    VAL  14           H        VAL  14  -5.724  -6.473 -14.438
  103    HA   VAL  14           HA       VAL  14  -8.159  -5.203 -14.039
  104    HB   VAL  14           HB       VAL  14  -7.087  -6.217 -16.678
  105   1HG1  VAL  14          1HG1      VAL  14  -9.032  -4.003 -16.027
  106   2HG1  VAL  14          2HG1      VAL  14  -8.351  -4.311 -17.623
  107   3HG1  VAL  14          3HG1      VAL  14  -9.400  -5.510 -16.867
  108   1HG2  VAL  14          1HG2      VAL  14  -5.553  -4.714 -15.172
  109   2HG2  VAL  14          2HG2      VAL  14  -5.792  -4.333 -16.870
  110   3HG2  VAL  14          3HG2      VAL  14  -6.673  -3.447 -15.633
  111    H    GLY  15           H        GLY  15 -10.030  -6.170 -13.482
  112   1HA   GLY  15          1HA       GLY  15 -11.938  -7.375 -14.371
  113   2HA   GLY  15          2HA       GLY  15 -10.846  -8.611 -14.971
  114    H    LYS  16           H        LYS  16  -9.470  -7.910 -12.136
  115    HA   LYS  16           HA       LYS  16 -10.917 -10.073 -10.772
  116   1HB   LYS  16          1HB       LYS  16  -8.157  -9.119 -10.846
  117   2HB   LYS  16          2HB       LYS  16  -8.709  -9.348  -9.205
  118   1HG   LYS  16          1HG       LYS  16  -9.088 -11.470 -11.308
  119   2HG   LYS  16          2HG       LYS  16  -7.567 -11.275 -10.434
  120   1HD   LYS  16          1HD       LYS  16  -9.178 -11.307  -8.330
  121   2HD   LYS  16          2HD       LYS  16 -10.246 -12.131  -9.444
  122   1HE   LYS  16          1HE       LYS  16  -8.253 -13.663  -9.938
  123   2HE   LYS  16          2HE       LYS  16  -7.529 -12.976  -8.486
  124   1HZ   LYS  16          1HZ       LYS  16  -9.874 -13.655  -7.493
  125   2HZ   LYS  16          2HZ       LYS  16  -9.833 -14.746  -8.781
  126   3HZ   LYS  16          3HZ       LYS  16  -8.605 -14.771  -7.625
  127    H    SER  17           H        SER  17 -11.402  -9.882  -8.484
  128    HA   SER  17           HA       SER  17 -12.880  -7.574  -7.890
  129   1HB   SER  17          1HB       SER  17 -13.385  -8.575  -5.847
  130   2HB   SER  17          2HB       SER  17 -12.997  -9.968  -6.860
  131    HG   SER  17           HG       SER  17 -11.968  -9.981  -4.773
  132    H    GLY  18           H        GLY  18 -12.451  -5.722  -6.737
  133   1HA   GLY  18          1HA       GLY  18  -9.952  -4.585  -6.664
  134   2HA   GLY  18          2HA       GLY  18 -11.260  -4.158  -5.603
  135    H    ASN  19           H        ASN  19 -11.398  -6.749  -4.310
  136    HA   ASN  19           HA       ASN  19  -9.463  -6.303  -2.268
  137   1HB   ASN  19          1HB       ASN  19 -11.827  -7.931  -2.645
  138   2HB   ASN  19          2HB       ASN  19 -10.533  -8.943  -2.019
  139   2HD2  ASN  19          2HD2      ASN  19 -10.661  -9.117   0.106
  140   1HD2  ASN  19          1HD2      ASN  19 -11.116  -7.852   1.189
  141    H    MET  20           H        MET  20  -9.858  -8.794  -4.766
  142    HA   MET  20           HA       MET  20  -7.522 -10.243  -4.060
  143   1HB   MET  20          1HB       MET  20  -9.590 -10.467  -6.014
  144   2HB   MET  20          2HB       MET  20  -8.080 -10.440  -6.885
  145   1HG   MET  20          1HG       MET  20  -8.189 -12.637  -6.513
  146   2HG   MET  20          2HG       MET  20  -7.376 -12.205  -5.037
  147   1HE   MET  20          1HE       MET  20  -8.287 -12.240  -2.784
  148   2HE   MET  20          2HE       MET  20  -9.590 -11.080  -3.047
  149   3HE   MET  20          3HE       MET  20  -9.935 -12.640  -2.299
  150    H    ALA  21           H        ALA  21  -8.137  -7.458  -6.092
  151    HA   ALA  21           HA       ALA  21  -5.681  -7.386  -7.453
  152   1HB   ALA  21          1HB       ALA  21  -7.752  -5.328  -6.790
  153   2HB   ALA  21          2HB       ALA  21  -6.263  -4.870  -7.619
  154   3HB   ALA  21          3HB       ALA  21  -7.349  -6.045  -8.342
  155    H    ALA  22           H        ALA  22  -6.766  -5.465  -4.639
  156    HA   ALA  22           HA       ALA  22  -4.303  -4.320  -4.054
  157   1HB   ALA  22          1HB       ALA  22  -6.429  -5.071  -2.051
  158   2HB   ALA  22          2HB       ALA  22  -6.469  -3.627  -3.059
  159   3HB   ALA  22          3HB       ALA  22  -5.190  -3.830  -1.859
  160    H    ALA  23           H        ALA  23  -5.681  -7.387  -2.990
  161    HA   ALA  23           HA       ALA  23  -3.668  -8.101  -1.163
  162   1HB   ALA  23          1HB       ALA  23  -5.342  -9.930  -2.891
  163   2HB   ALA  23          2HB       ALA  23  -4.479 -10.379  -1.420
  164   3HB   ALA  23          3HB       ALA  23  -5.832  -9.247  -1.342
  165    H    THR  24           H        THR  24  -3.997  -8.770  -4.647
  166    HA   THR  24           HA       THR  24  -1.685 -10.318  -4.958
  167    HB   THR  24           HB       THR  24  -2.947  -8.401  -6.929
  168    HG1  THR  24           HG1      THR  24  -4.497  -9.839  -6.601
  169   1HG2  THR  24          1HG2      THR  24  -1.100 -10.727  -7.385
  170   2HG2  THR  24          2HG2      THR  24  -2.034  -9.934  -8.644
  171   3HG2  THR  24          3HG2      THR  24  -0.798  -9.037  -7.772
  172    H    VAL  25           H        VAL  25  -2.143  -6.806  -5.123
  173    HA   VAL  25           HA       VAL  25   0.509  -6.179  -5.876
  174    HB   VAL  25           HB       VAL  25  -1.332  -4.426  -4.235
  175   1HG1  VAL  25          1HG1      VAL  25   1.296  -4.056  -5.329
  176   2HG1  VAL  25          2HG1      VAL  25   0.173  -2.940  -6.096
  177   3HG1  VAL  25          3HG1      VAL  25   0.330  -2.975  -4.353
  178   1HG2  VAL  25          1HG2      VAL  25  -1.453  -5.252  -7.084
  179   2HG2  VAL  25          2HG2      VAL  25  -2.716  -4.730  -5.980
  180   3HG2  VAL  25          3HG2      VAL  25  -1.702  -3.539  -6.753
  181    H    GLU  26           H        GLU  26  -1.065  -6.161  -2.672
  182    HA   GLU  26           HA       GLU  26   1.273  -5.498  -1.232
  183   1HB   GLU  26          1HB       GLU  26  -1.275  -6.884  -0.415
  184   2HB   GLU  26          2HB       GLU  26  -0.031  -6.407   0.734
  185   1HG   GLU  26          1HG       GLU  26  -0.579  -4.248   0.675
  186   2HG   GLU  26          2HG       GLU  26  -0.866  -4.254  -1.063
  187    H    ARG  27           H        ARG  27   0.061  -8.567  -2.442
  188    HA   ARG  27           HA       ARG  27   1.824 -10.142  -0.784
  189   1HB   ARG  27          1HB       ARG  27  -0.385 -10.658  -2.551
  190   2HB   ARG  27          2HB       ARG  27   0.962 -11.621  -3.084
  191   1HG   ARG  27          1HG       ARG  27   0.816 -11.849  -0.240
  192   2HG   ARG  27          2HG       ARG  27  -0.807 -12.041  -0.902
  193   1HD   ARG  27          1HD       ARG  27   1.612 -13.543  -1.891
  194   2HD   ARG  27          2HD       ARG  27   0.470 -14.139  -0.684
  195    HE   ARG  27           HE       ARG  27  -0.703 -13.312  -3.215
  196   1HH1  ARG  27          1HH1      ARG  27   0.618 -15.995  -1.356
  197   2HH1  ARG  27          2HH1      ARG  27  -0.207 -17.177  -2.293
  198   1HH2  ARG  27          1HH2      ARG  27  -1.778 -14.902  -4.425
  199   2HH2  ARG  27          2HH2      ARG  27  -1.559 -16.575  -4.028
  200    H    GLU  28           H        GLU  28   1.674  -9.494  -4.295
  201    HA   GLU  28           HA       GLU  28   4.192 -10.659  -4.856
  202   1HB   GLU  28          1HB       GLU  28   4.030  -9.529  -7.016
  203   2HB   GLU  28          2HB       GLU  28   2.714  -8.523  -6.412
  204   1HG   GLU  28          1HG       GLU  28   2.488 -11.512  -6.420
  205   2HG   GLU  28          2HG       GLU  28   1.213 -10.311  -6.373
  206    H    ASN  29           H        ASN  29   3.195  -7.408  -3.941
  207    HA   ASN  29           HA       ASN  29   6.046  -6.632  -3.756
  208   1HB   ASN  29          1HB       ASN  29   4.874  -5.443  -5.573
  209   2HB   ASN  29          2HB       ASN  29   3.684  -4.850  -4.414
  210   2HD2  ASN  29          2HD2      ASN  29   5.433  -3.297  -6.094
  211   1HD2  ASN  29          1HD2      ASN  29   6.409  -2.351  -5.028
  212    H    ARG  30           H        ARG  30   5.912  -7.529  -1.613
  213    HA   ARG  30           HA       ARG  30   4.154  -6.623   0.379
  214   1HB   ARG  30          1HB       ARG  30   6.038  -8.536   0.261
  215   2HB   ARG  30          2HB       ARG  30   6.937  -7.343   1.169
  216   1HG   ARG  30          1HG       ARG  30   5.799  -7.723   3.031
  217   2HG   ARG  30          2HG       ARG  30   4.237  -7.695   2.222
  218   1HD   ARG  30          1HD       ARG  30   5.681 -10.100   1.493
  219   2HD   ARG  30          2HD       ARG  30   5.650  -9.907   3.237
  220    HE   ARG  30           HE       ARG  30   3.493 -10.664   1.601
  221   1HH1  ARG  30          1HH1      ARG  30   4.227  -8.711   4.443
  222   2HH1  ARG  30          2HH1      ARG  30   2.635  -8.878   5.075
  223   1HH2  ARG  30          1HH2      ARG  30   1.396 -10.866   2.505
  224   2HH2  ARG  30          2HH2      ARG  30   1.047 -10.093   4.013
  225    H    ASN  31           H        ASN  31   6.374  -4.716  -1.244
  226    HA   ASN  31           HA       ASN  31   7.086  -3.124   1.091
  227   1HB   ASN  31          1HB       ASN  31   8.780  -3.628  -0.629
  228   2HB   ASN  31          2HB       ASN  31   7.823  -2.753  -1.816
  229   2HD2  ASN  31          2HD2      ASN  31   9.986  -2.500   0.857
  230   1HD2  ASN  31          1HD2      ASN  31  10.168  -0.778   0.797
  231    H    VAL  32           H        VAL  32   4.463  -3.281  -1.006
  232    HA   VAL  32           HA       VAL  32   3.769  -0.490  -0.391
  233    HB   VAL  32           HB       VAL  32   2.986  -0.067  -2.611
  234   1HG1  VAL  32          1HG1      VAL  32   5.376   0.365  -2.174
  235   2HG1  VAL  32          2HG1      VAL  32   5.763  -1.265  -2.725
  236   3HG1  VAL  32          3HG1      VAL  32   5.103  -0.104  -3.840
  237   1HG2  VAL  32          1HG2      VAL  32   3.486  -2.972  -3.011
  238   2HG2  VAL  32          2HG2      VAL  32   2.142  -1.970  -3.530
  239   3HG2  VAL  32          3HG2      VAL  32   3.673  -1.900  -4.395
  240    H    HIS  33           H        HIS  33   1.432  -0.035  -0.874
  241    HA   HIS  33           HA       HIS  33  -0.242  -2.421  -0.544
  242   1HB   HIS  33          1HB       HIS  33  -1.637  -0.724   1.021
  243   2HB   HIS  33          2HB       HIS  33  -0.458  -1.876   1.625
  244    HD1  HIS  33           HD1      HIS  33   1.439  -0.957   2.937
  245    HD2  HIS  33           HD2      HIS  33  -0.569   1.978   0.793
  246    HE1  HIS  33           HE1      HIS  33   2.432   1.223   3.692
  247    HE2  HIS  33           HE2      HIS  33   1.246   2.987   2.335
  248    H    ALA  34           H        ALA  34  -2.328  -2.319  -1.384
  249    HA   ALA  34           HA       ALA  34  -2.735  -0.042  -3.222
  250   1HB   ALA  34          1HB       ALA  34  -4.375  -2.372  -3.739
  251   2HB   ALA  34          2HB       ALA  34  -2.659  -2.747  -3.777
  252   3HB   ALA  34          3HB       ALA  34  -3.310  -1.482  -4.811
  253    H    ILE  35           H        ILE  35  -4.592   1.095  -3.225
  254    HA   ILE  35           HA       ILE  35  -6.502   0.527  -1.038
  255    HB   ILE  35           HB       ILE  35  -6.085   3.114  -2.556
  256   1HG1  ILE  35          1HG1      ILE  35  -5.020   2.139   0.104
  257   2HG1  ILE  35          2HG1      ILE  35  -5.139   3.854  -0.289
  258   1HG2  ILE  35          1HG2      ILE  35  -7.757   2.415  -0.139
  259   2HG2  ILE  35          2HG2      ILE  35  -7.425   4.066  -0.675
  260   3HG2  ILE  35          3HG2      ILE  35  -8.321   2.969  -1.717
  261   1HD1  ILE  35          1HD1      ILE  35  -3.785   3.095  -2.434
  262   2HD1  ILE  35          2HD1      ILE  35  -3.019   3.474  -0.893
  263   3HD1  ILE  35          3HD1      ILE  35  -3.288   1.804  -1.340
  264    H    VAL  36           H        VAL  36  -8.408  -0.308  -1.614
  265    HA   VAL  36           HA       VAL  36  -9.185  -0.404  -4.384
  266    HB   VAL  36           HB       VAL  36  -9.504  -2.275  -2.709
  267   1HG1  VAL  36          1HG1      VAL  36 -10.505  -0.727  -0.959
  268   2HG1  VAL  36          2HG1      VAL  36 -12.000  -0.792  -1.894
  269   3HG1  VAL  36          3HG1      VAL  36 -11.313  -2.265  -1.217
  270   1HG2  VAL  36          1HG2      VAL  36 -11.886  -1.369  -4.314
  271   2HG2  VAL  36          2HG2      VAL  36 -10.530  -2.324  -4.892
  272   3HG2  VAL  36          3HG2      VAL  36 -11.633  -3.002  -3.705
  273    H    LEU  37           H        LEU  37 -10.564   0.855  -5.423
  274    HA   LEU  37           HA       LEU  37 -12.658   2.320  -4.056
  275   1HB   LEU  37          1HB       LEU  37 -11.765   4.465  -5.278
  276   2HB   LEU  37          2HB       LEU  37 -11.249   4.030  -3.674
  277    HG   LEU  37           HG       LEU  37  -9.297   2.791  -5.091
  278   1HD1  LEU  37          1HD1      LEU  37 -10.133   5.141  -6.783
  279   2HD1  LEU  37          2HD1      LEU  37  -8.601   4.266  -6.921
  280   3HD1  LEU  37          3HD1      LEU  37 -10.123   3.437  -7.237
  281   1HD2  LEU  37          1HD2      LEU  37  -9.566   5.278  -3.627
  282   2HD2  LEU  37          2HD2      LEU  37  -8.241   4.127  -3.693
  283   3HD2  LEU  37          3HD2      LEU  37  -8.372   5.401  -4.906
  284    H    LYS  38           H        LYS  38 -14.211   3.201  -5.518
  285    HA   LYS  38           HA       LYS  38 -14.217   1.795  -8.066
  286   1HB   LYS  38          1HB       LYS  38 -16.312   3.276  -6.517
  287   2HB   LYS  38          2HB       LYS  38 -16.586   2.811  -8.184
  288   1HG   LYS  38          1HG       LYS  38 -15.977   0.452  -7.435
  289   2HG   LYS  38          2HG       LYS  38 -17.541   1.097  -7.039
  290   1HD   LYS  38          1HD       LYS  38 -15.374   0.257  -5.268
  291   2HD   LYS  38          2HD       LYS  38 -15.934   1.870  -4.885
  292   1HE   LYS  38          1HE       LYS  38 -17.569   0.922  -3.742
  293   2HE   LYS  38          2HE       LYS  38 -18.298   0.450  -5.266
  294   1HZ   LYS  38          1HZ       LYS  38 -16.968  -1.629  -5.135
  295   2HZ   LYS  38          2HZ       LYS  38 -16.464  -1.166  -3.587
  296   3HZ   LYS  38          3HZ       LYS  38 -18.099  -1.456  -3.891
  297    H    GLU  39           H        GLU  39 -14.743   2.772 -10.066
  298    HA   GLU  39           HA       GLU  39 -13.186   4.899 -10.826
  299   1HB   GLU  39          1HB       GLU  39 -14.202   3.400 -12.431
  300   2HB   GLU  39          2HB       GLU  39 -14.601   5.060 -12.838
  301   1HG   GLU  39          1HG       GLU  39 -16.335   2.884 -12.501
  302   2HG   GLU  39          2HG       GLU  39 -16.632   3.904 -11.100
  303    H    GLY  40           H        GLY  40 -13.177   6.967 -10.226
  304   1HA   GLY  40          1HA       GLY  40 -14.294   9.093 -10.359
  305   2HA   GLY  40          2HA       GLY  40 -15.785   8.332  -9.840
  306    H    SER  41           H        SER  41 -13.407   6.946  -7.997
  307    HA   SER  41           HA       SER  41 -14.203   8.356  -5.652
  308   1HB   SER  41          1HB       SER  41 -13.590   6.007  -5.533
  309   2HB   SER  41          2HB       SER  41 -11.970   6.372  -6.135
  310    HG   SER  41           HG       SER  41 -13.111   6.965  -3.627
  311    H    ALA  42           H        ALA  42 -12.042   8.792  -4.126
  312    HA   ALA  42           HA       ALA  42 -10.859  11.156  -5.363
  313   1HB   ALA  42          1HB       ALA  42  -9.927  11.466  -3.015
  314   2HB   ALA  42          2HB       ALA  42 -10.938  10.101  -2.546
  315   3HB   ALA  42          3HB       ALA  42 -11.680  11.563  -3.206
  316    H    MET  43           H        MET  43  -9.187  10.673  -6.637
  317    HA   MET  43           HA       MET  43  -7.063   8.948  -5.537
  318   1HB   MET  43          1HB       MET  43  -6.685   8.527  -8.143
  319   2HB   MET  43          2HB       MET  43  -7.713   7.524  -7.138
  320   1HG   MET  43          1HG       MET  43  -9.615   8.173  -8.115
  321   2HG   MET  43          2HG       MET  43  -9.077   9.827  -8.387
  322   1HE   MET  43          1HE       MET  43  -8.191  10.782 -10.252
  323   2HE   MET  43          2HE       MET  43  -6.641   9.949 -10.405
  324   3HE   MET  43          3HE       MET  43  -7.731  10.014 -11.777
  325    H    THR  44           H        THR  44  -5.627  10.449  -4.919
  326    HA   THR  44           HA       THR  44  -5.116  12.860  -6.234
  327    HB   THR  44           HB       THR  44  -2.817  12.655  -5.040
  328    HG1  THR  44           HG1      THR  44  -3.351  10.211  -4.848
  329   1HG2  THR  44          1HG2      THR  44  -5.322  12.491  -3.381
  330   2HG2  THR  44          2HG2      THR  44  -3.744  13.073  -2.844
  331   3HG2  THR  44          3HG2      THR  44  -4.631  13.949  -4.087
  332    H    LYS  45           H        LYS  45  -3.500  13.495  -7.669
  333    HA   LYS  45           HA       LYS  45  -2.808  11.471  -9.622
  334   1HB   LYS  45          1HB       LYS  45  -2.621  14.452  -9.440
  335   2HB   LYS  45          2HB       LYS  45  -1.603  13.624 -10.611
  336   1HG   LYS  45          1HG       LYS  45  -3.475  12.695 -11.725
  337   2HG   LYS  45          2HG       LYS  45  -4.588  13.266 -10.477
  338   1HD   LYS  45          1HD       LYS  45  -4.353  15.502 -11.112
  339   2HD   LYS  45          2HD       LYS  45  -2.879  15.192 -12.034
  340   1HE   LYS  45          1HE       LYS  45  -4.446  13.659 -13.476
  341   2HE   LYS  45          2HE       LYS  45  -5.724  14.644 -12.761
  342   1HZ   LYS  45          1HZ       LYS  45  -3.399  15.678 -14.301
  343   2HZ   LYS  45          2HZ       LYS  45  -4.982  15.524 -14.882
  344   3HZ   LYS  45          3HZ       LYS  45  -4.643  16.621 -13.637
  345    H    ASP  46           H        ASP  46  -1.231  13.136  -7.006
  346    HA   ASP  46           HA       ASP  46   1.411  13.033  -7.679
  347   1HB   ASP  46          1HB       ASP  46   0.020  13.522  -5.353
  348   2HB   ASP  46          2HB       ASP  46   0.882  12.048  -4.930
  349    H    PHE  47           H        PHE  47   3.129  11.493  -7.021
  350    HA   PHE  47           HA       PHE  47   2.255   8.739  -7.623
  351   1HB   PHE  47          1HB       PHE  47   3.819   9.613  -9.210
  352   2HB   PHE  47          2HB       PHE  47   4.927  10.102  -7.931
  353    HD1  PHE  47           HD1      PHE  47   6.186   8.411  -6.669
  354    HD2  PHE  47           HD2      PHE  47   3.697   7.338  -9.954
  355    HE1  PHE  47           HE1      PHE  47   7.267   6.224  -6.767
  356    HE2  PHE  47           HE2      PHE  47   4.784   5.141 -10.058
  357    HZ   PHE  47           HZ       PHE  47   6.564   4.566  -8.451
  358    H    ARG  48           H        ARG  48   2.647   7.069  -6.285
  359    HA   ARG  48           HA       ARG  48   4.488   7.325  -4.046
  360   1HB   ARG  48          1HB       ARG  48   1.515   7.349  -3.752
  361   2HB   ARG  48          2HB       ARG  48   2.429   6.391  -2.596
  362   1HG   ARG  48          1HG       ARG  48   3.634   8.291  -1.838
  363   2HG   ARG  48          2HG       ARG  48   2.990   9.297  -3.136
  364   1HD   ARG  48          1HD       ARG  48   0.737   8.992  -2.206
  365   2HD   ARG  48          2HD       ARG  48   1.843   9.799  -1.120
  366    HE   ARG  48           HE       ARG  48   1.584   6.920  -0.760
  367   1HH1  ARG  48          1HH1      ARG  48   0.483  10.101   0.266
  368   2HH1  ARG  48          2HH1      ARG  48  -0.082   9.519   1.782
  369   1HH2  ARG  48          1HH2      ARG  48   0.818   6.190   1.247
  370   2HH2  ARG  48          2HH2      ARG  48   0.094   7.321   2.340
  371    H    CYS  49           H        CYS  49   5.634   5.521  -4.235
  372    HA   CYS  49           HA       CYS  49   4.864   3.225  -5.610
  373   1HB   CYS  49          1HB       CYS  49   6.989   3.740  -3.563
  374   2HB   CYS  49          2HB       CYS  49   6.775   2.133  -4.267
  375    H    ASP  50           H        ASP  50   4.595   4.014  -2.196
  376    HA   ASP  50           HA       ASP  50   3.683   1.398  -1.463
  377   1HB   ASP  50          1HB       ASP  50   3.326   2.343   0.741
  378   2HB   ASP  50          2HB       ASP  50   4.913   2.765   0.115
  379    H    ARG  51           H        ARG  51   2.161   3.844  -3.135
  380    HA   ARG  51           HA       ARG  51  -0.458   3.031  -2.082
  381   1HB   ARG  51          1HB       ARG  51   0.251   5.425  -1.678
  382   2HB   ARG  51          2HB       ARG  51   0.164   5.664  -3.419
  383   1HG   ARG  51          1HG       ARG  51  -2.259   4.788  -3.204
  384   2HG   ARG  51          2HG       ARG  51  -2.030   5.064  -1.475
  385   1HD   ARG  51          1HD       ARG  51  -3.038   7.012  -2.291
  386   2HD   ARG  51          2HD       ARG  51  -1.339   7.399  -2.044
  387    HE   ARG  51           HE       ARG  51  -2.204   6.583  -4.736
  388   1HH1  ARG  51          1HH1      ARG  51  -1.247   9.200  -2.586
  389   2HH1  ARG  51          2HH1      ARG  51  -0.918  10.285  -3.880
  390   1HH2  ARG  51          1HH2      ARG  51  -1.809   8.073  -6.424
  391   2HH2  ARG  51          2HH2      ARG  51  -1.223   9.658  -6.041
  392    H    VAL  52           H        VAL  52  -1.372   1.673  -3.447
  393    HA   VAL  52           HA       VAL  52  -1.099   2.172  -6.356
  394    HB   VAL  52           HB       VAL  52  -1.616  -0.410  -4.896
  395   1HG1  VAL  52          1HG1      VAL  52  -1.672   0.242  -7.823
  396   2HG1  VAL  52          2HG1      VAL  52  -1.442  -1.396  -7.225
  397   3HG1  VAL  52          3HG1      VAL  52  -2.929  -0.529  -6.857
  398   1HG2  VAL  52          1HG2      VAL  52   0.784   0.802  -5.367
  399   2HG2  VAL  52          2HG2      VAL  52   0.529  -0.908  -5.113
  400   3HG2  VAL  52          3HG2      VAL  52   0.625  -0.279  -6.749
  401    H    TRP  53           H        TRP  53  -2.875   3.039  -7.225
  402    HA   TRP  53           HA       TRP  53  -5.386   3.006  -5.814
  403   1HB   TRP  53          1HB       TRP  53  -4.514   4.123  -8.472
  404   2HB   TRP  53          2HB       TRP  53  -6.199   4.162  -7.986
  405    HD1  TRP  53           HD1      TRP  53  -4.018   6.660  -8.474
  406    HE1  TRP  53           HE1      TRP  53  -4.023   8.518  -6.689
  407    HE3  TRP  53           HE3      TRP  53  -6.225   4.104  -4.654
  408    HZ2  TRP  53           HZ2      TRP  53  -4.840   8.826  -4.001
  409    HZ3  TRP  53           HZ3      TRP  53  -6.575   5.234  -2.515
  410    HH2  TRP  53           HH2      TRP  53  -5.905   7.562  -2.197
  411    H    VAL  54           H        VAL  54  -7.046   1.619  -6.057
  412    HA   VAL  54           HA       VAL  54  -6.938  -0.228  -8.375
  413    HB   VAL  54           HB       VAL  54  -7.693  -0.692  -5.511
  414   1HG1  VAL  54          1HG1      VAL  54  -8.686  -2.177  -7.914
  415   2HG1  VAL  54          2HG1      VAL  54  -8.519  -2.977  -6.352
  416   3HG1  VAL  54          3HG1      VAL  54  -9.597  -1.601  -6.530
  417   1HG2  VAL  54          1HG2      VAL  54  -5.377  -1.137  -6.283
  418   2HG2  VAL  54          2HG2      VAL  54  -6.214  -2.572  -5.688
  419   3HG2  VAL  54          3HG2      VAL  54  -6.041  -2.311  -7.421
  420    H    ILE  55           H        ILE  55  -8.284   0.763  -9.777
  421    HA   ILE  55           HA       ILE  55 -10.783   1.917  -8.897
  422    HB   ILE  55           HB       ILE  55  -9.992   1.520 -11.747
  423   1HG1  ILE  55          1HG1      ILE  55  -8.107   2.635 -10.505
  424   2HG1  ILE  55          2HG1      ILE  55  -8.868   3.654 -11.708
  425   1HG2  ILE  55          1HG2      ILE  55 -11.819   3.415 -10.320
  426   2HG2  ILE  55          2HG2      ILE  55 -11.328   3.636 -12.000
  427   3HG2  ILE  55          3HG2      ILE  55 -12.231   2.200 -11.523
  428   1HD1  ILE  55          1HD1      ILE  55 -10.174   4.040  -9.181
  429   2HD1  ILE  55          2HD1      ILE  55  -8.432   4.249  -9.038
  430   3HD1  ILE  55          3HD1      ILE  55  -9.338   5.184 -10.220
  431    H    VAL  56           H        VAL  56 -12.617   0.821  -8.703
  432    HA   VAL  56           HA       VAL  56 -13.006  -1.580 -10.341
  433    HB   VAL  56           HB       VAL  56 -14.160  -2.648  -8.498
  434   1HG1  VAL  56          1HG1      VAL  56 -11.333  -1.768  -8.052
  435   2HG1  VAL  56          2HG1      VAL  56 -12.149  -2.789  -6.877
  436   3HG1  VAL  56          3HG1      VAL  56 -11.965  -3.334  -8.515
  437   1HG2  VAL  56          1HG2      VAL  56 -13.796  -0.020  -7.187
  438   2HG2  VAL  56          2HG2      VAL  56 -15.113  -1.179  -7.096
  439   3HG2  VAL  56          3HG2      VAL  56 -13.650  -1.442  -6.173
  440    H    ASN  57           H        ASN  57 -15.331  -2.269 -10.404
  441    HA   ASN  57           HA       ASN  57 -16.930   0.083 -11.107
  442   1HB   ASN  57          1HB       ASN  57 -18.411  -1.496 -12.228
  443   2HB   ASN  57          2HB       ASN  57 -16.741  -1.776 -12.700
  444   2HD2  ASN  57          2HD2      ASN  57 -17.706  -3.858 -13.383
  445   1HD2  ASN  57          1HD2      ASN  57 -17.825  -5.108 -12.207
  446    H    ASP  58           H        ASP  58 -19.483  -0.709 -10.773
  447    HA   ASP  58           HA       ASP  58 -19.969  -0.122  -8.079
  448   1HB   ASP  58          1HB       ASP  58 -21.560  -0.684 -10.477
  449   2HB   ASP  58          2HB       ASP  58 -22.331  -1.295  -9.022
  450    H    HIS  59           H        HIS  59 -19.284  -3.152  -9.564
  451    HA   HIS  59           HA       HIS  59 -20.446  -4.644  -7.335
  452   1HB   HIS  59          1HB       HIS  59 -19.684  -5.266 -10.131
  453   2HB   HIS  59          2HB       HIS  59 -19.348  -6.539  -8.967
  454    HD1  HIS  59           HD1      HIS  59 -21.239  -8.031  -8.422
  455    HD2  HIS  59           HD2      HIS  59 -22.521  -4.415 -10.011
  456    HE1  HIS  59           HE1      HIS  59 -23.730  -8.255  -8.672
  457    HE2  HIS  59           HE2      HIS  59 -24.493  -6.038  -9.604
  458    H    GLY  60           H        GLY  60 -17.563  -3.110  -7.933
  459   1HA   GLY  60          1HA       GLY  60 -15.703  -3.184  -6.572
  460   2HA   GLY  60          2HA       GLY  60 -16.230  -4.726  -5.919
  461    H    VAL  61           H        VAL  61 -16.106  -4.237  -9.363
  462    HA   VAL  61           HA       VAL  61 -13.964  -6.230  -9.547
  463    HB   VAL  61           HB       VAL  61 -15.650  -5.109 -11.786
  464   1HG1  VAL  61          1HG1      VAL  61 -13.592  -6.166 -12.512
  465   2HG1  VAL  61          2HG1      VAL  61 -14.002  -7.610 -11.580
  466   3HG1  VAL  61          3HG1      VAL  61 -14.992  -7.133 -12.960
  467   1HG2  VAL  61          1HG2      VAL  61 -16.131  -7.551 -10.092
  468   2HG2  VAL  61          2HG2      VAL  61 -17.152  -6.116 -10.173
  469   3HG2  VAL  61          3HG2      VAL  61 -17.005  -7.168 -11.576
  470    H    VAL  62           H        VAL  62 -11.964  -5.705 -10.255
  471    HA   VAL  62           HA       VAL  62 -11.241  -2.960 -10.488
  472    HB   VAL  62           HB       VAL  62  -9.560  -5.367 -11.188
  473   1HG1  VAL  62          1HG1      VAL  62  -8.663  -3.280 -12.091
  474   2HG1  VAL  62          2HG1      VAL  62  -8.770  -2.531 -10.497
  475   3HG1  VAL  62          3HG1      VAL  62  -7.681  -3.884 -10.774
  476   1HG2  VAL  62          1HG2      VAL  62 -10.626  -4.859  -8.714
  477   2HG2  VAL  62          2HG2      VAL  62  -9.139  -5.705  -9.032
  478   3HG2  VAL  62          3HG2      VAL  62  -9.101  -4.011  -8.632
  479    H    THR  63           H        THR  63 -11.665  -1.738 -12.209
  480    HA   THR  63           HA       THR  63 -11.773  -2.969 -14.882
  481    HB   THR  63           HB       THR  63 -12.886  -0.953 -15.591
  482    HG1  THR  63           HG1      THR  63 -12.134   0.739 -14.535
  483   1HG2  THR  63          1HG2      THR  63 -14.217  -2.674 -14.300
  484   2HG2  THR  63          2HG2      THR  63 -14.099  -1.581 -12.921
  485   3HG2  THR  63          3HG2      THR  63 -14.898  -1.050 -14.405
  486    H    SER  64           H        SER  64  -9.983  -0.588 -12.988
  487    HA   SER  64           HA       SER  64  -8.353   0.095 -15.331
  488   1HB   SER  64          1HB       SER  64  -9.300   1.850 -13.742
  489   2HB   SER  64          2HB       SER  64  -8.103   1.288 -12.574
  490    HG   SER  64           HG       SER  64  -6.485   1.918 -13.946
  491    H    VAL  65           H        VAL  65  -6.124  -0.088 -15.321
  492    HA   VAL  65           HA       VAL  65  -5.088  -2.470 -14.203
  493    HB   VAL  65           HB       VAL  65  -3.484  -0.198 -15.371
  494   1HG1  VAL  65          1HG1      VAL  65  -2.866  -2.936 -14.501
  495   2HG1  VAL  65          2HG1      VAL  65  -2.278  -2.527 -16.115
  496   3HG1  VAL  65          3HG1      VAL  65  -1.829  -1.539 -14.738
  497   1HG2  VAL  65          1HG2      VAL  65  -4.903  -2.455 -16.766
  498   2HG2  VAL  65          2HG2      VAL  65  -5.228  -0.746 -16.939
  499   3HG2  VAL  65          3HG2      VAL  65  -3.715  -1.414 -17.516
  500   1HB   PRO  66          1HB       PRO  66  -4.384  -2.222  -8.742
  501   2HB   PRO  66          2HB       PRO  66  -3.116  -3.174  -9.498
  502   1HG   PRO  66          1HG       PRO  66  -4.893  -4.416 -10.198
  503   2HG   PRO  66          2HG       PRO  66  -6.009  -3.078 -10.070
  504   1HD   PRO  66          1HD       PRO  66  -5.824  -3.116 -12.349
  505   2HD   PRO  66          2HD       PRO  66  -4.211  -3.805 -12.311
  506    H    HIS  67           H        HIS  67  -2.423   0.787 -10.536
  507    HA   HIS  67           HA       HIS  67   0.228  -0.485 -10.601
  508   1HB   HIS  67          1HB       HIS  67   1.014   1.238 -12.183
  509   2HB   HIS  67          2HB       HIS  67  -0.254   0.226 -12.875
  510    HD1  HIS  67           HD1      HIS  67  -0.030   2.672 -14.364
  511    HD2  HIS  67           HD2      HIS  67  -2.199   2.611 -10.825
  512    HE1  HIS  67           HE1      HIS  67  -1.574   4.654 -14.469
  513    HE2  HIS  67           HE2      HIS  67  -2.947   4.516 -12.368
  514    H    ILE  68           H        ILE  68   1.863   0.552  -9.583
  515    HA   ILE  68           HA       ILE  68   1.399   1.920  -7.273
  516    HB   ILE  68           HB       ILE  68   3.723   1.266  -8.915
  517   1HG1  ILE  68          1HG1      ILE  68   3.448   1.730  -5.966
  518   2HG1  ILE  68          2HG1      ILE  68   3.054   0.229  -6.757
  519   1HG2  ILE  68          1HG2      ILE  68   3.804   3.915  -7.489
  520   2HG2  ILE  68          2HG2      ILE  68   5.245   2.971  -7.795
  521   3HG2  ILE  68          3HG2      ILE  68   4.270   3.484  -9.133
  522   1HD1  ILE  68          1HD1      ILE  68   5.811   1.465  -6.742
  523   2HD1  ILE  68          2HD1      ILE  68   5.240   0.178  -5.705
  524   3HD1  ILE  68          3HD1      ILE  68   5.329  -0.090  -7.416
  525    H    THR  69           H        THR  69   0.320   3.746  -7.046
  526    HA   THR  69           HA       THR  69   1.269   6.185  -8.295
  527    HB   THR  69           HB       THR  69  -1.424   5.004  -8.964
  528    HG1  THR  69           HG1      THR  69   0.023   4.567 -10.541
  529   1HG2  THR  69          1HG2      THR  69  -0.607   7.883  -9.115
  530   2HG2  THR  69          2HG2      THR  69  -1.872   7.185 -10.125
  531   3HG2  THR  69          3HG2      THR  69  -2.042   7.203  -8.388

  No H/Q in entry =         531
  Start of MODEL    3
    1    H    SER   1           H        SER   1  17.578   8.228 -12.240
    2    HA   SER   1           HA       SER   1  17.379   6.185 -11.117
    3   1HB   SER   1          1HB       SER   1  16.700   6.132  -8.803
    4   2HB   SER   1          2HB       SER   1  17.599   7.607  -9.135
    5    HG   SER   1           HG       SER   1  15.461   8.632  -9.431
    6    H    ARG   2           H        ARG   2  14.101   6.815 -10.059
    7    HA   ARG   2           HA       ARG   2  12.075   5.864 -10.406
    8   1HB   ARG   2          1HB       ARG   2  13.135   5.618 -13.227
    9   2HB   ARG   2          2HB       ARG   2  11.441   5.513 -12.754
   10   1HG   ARG   2          1HG       ARG   2  12.254   7.942 -11.684
   11   2HG   ARG   2          2HG       ARG   2  13.139   7.838 -13.207
   12   1HD   ARG   2          1HD       ARG   2  11.137   8.882 -13.777
   13   2HD   ARG   2          2HD       ARG   2  10.898   7.203 -14.263
   14    HE   ARG   2           HE       ARG   2   9.961   7.709 -11.599
   15   1HH1  ARG   2          1HH1      ARG   2   9.113   8.047 -14.996
   16   2HH1  ARG   2          2HH1      ARG   2   7.420   8.032 -14.682
   17   1HH2  ARG   2          1HH2      ARG   2   7.714   7.694 -11.218
   18   2HH2  ARG   2          2HH2      ARG   2   6.619   7.837 -12.554
   19    H    ARG   3           H        ARG   3  12.653   4.052  -9.060
   20    HA   ARG   3           HA       ARG   3  12.038   1.571 -10.249
   21   1HB   ARG   3          1HB       ARG   3  14.723   2.190 -10.610
   22   2HB   ARG   3          2HB       ARG   3  14.762   1.219  -9.163
   23   1HG   ARG   3          1HG       ARG   3  14.884  -0.486 -10.574
   24   2HG   ARG   3          2HG       ARG   3  13.133  -0.313 -10.687
   25   1HD   ARG   3          1HD       ARG   3  13.477   1.205 -12.607
   26   2HD   ARG   3          2HD       ARG   3  15.200   0.855 -12.551
   27    HE   ARG   3           HE       ARG   3  14.235  -1.599 -12.773
   28   1HH1  ARG   3          1HH1      ARG   3  13.285   1.315 -14.514
   29   2HH1  ARG   3          2HH1      ARG   3  12.788   0.440 -15.907
   30   1HH2  ARG   3          1HH2      ARG   3  13.575  -2.715 -14.644
   31   2HH2  ARG   3          2HH2      ARG   3  12.954  -1.830 -15.997
   32    H    CYS   4           H        CYS   4  10.607   1.269  -8.608
   33    HA   CYS   4           HA       CYS   4  11.663   1.287  -5.867
   34   1HB   CYS   4          1HB       CYS   4   9.357   1.504  -5.117
   35   2HB   CYS   4          2HB       CYS   4   8.791   1.396  -6.786
   36   1HB   PRO   5          1HB       PRO   5   9.994  -2.613  -2.883
   37   2HB   PRO   5          2HB       PRO   5  11.487  -3.490  -3.147
   38   1HG   PRO   5          1HG       PRO   5  11.490  -1.089  -1.990
   39   2HG   PRO   5          2HG       PRO   5  12.774  -1.575  -3.113
   40   1HD   PRO   5          1HD       PRO   5  12.124   0.350  -4.173
   41   2HD   PRO   5          2HD       PRO   5  10.461   0.261  -3.557
   42    H    GLY   6           H        GLY   6  10.106  -4.855  -5.570
   43   1HA   GLY   6          1HA       GLY   6   8.176  -5.977  -6.022
   44   2HA   GLY   6          2HA       GLY   6   7.301  -4.702  -5.232
   45    H    LYS   7           H        LYS   7   6.069  -5.792  -7.281
   46    HA   LYS   7           HA       LYS   7   6.700  -4.668  -9.824
   47   1HB   LYS   7          1HB       LYS   7   5.466  -6.731  -9.471
   48   2HB   LYS   7          2HB       LYS   7   4.103  -5.849  -8.840
   49   1HG   LYS   7          1HG       LYS   7   3.655  -4.828 -10.895
   50   2HG   LYS   7          2HG       LYS   7   5.194  -5.321 -11.588
   51   1HD   LYS   7          1HD       LYS   7   2.635  -6.723 -11.454
   52   2HD   LYS   7          2HD       LYS   7   4.004  -6.968 -12.534
   53   1HE   LYS   7          1HE       LYS   7   5.138  -8.271 -10.794
   54   2HE   LYS   7          2HE       LYS   7   3.756  -8.039  -9.716
   55   1HZ   LYS   7          1HZ       LYS   7   2.374  -9.210 -11.332
   56   2HZ   LYS   7          2HZ       LYS   7   3.734  -9.481 -12.306
   57   3HZ   LYS   7          3HZ       LYS   7   3.647 -10.171 -10.766
   58    H    ASN   8           H        ASN   8   5.641  -2.981 -10.960
   59    HA   ASN   8           HA       ASN   8   4.408  -0.954  -9.182
   60   1HB   ASN   8          1HB       ASN   8   5.312   0.723 -10.614
   61   2HB   ASN   8          2HB       ASN   8   5.799  -0.472 -11.817
   62   2HD2  ASN   8          2HD2      ASN   8   7.942   0.260 -11.728
   63   1HD2  ASN   8          1HD2      ASN   8   8.963  -0.134 -10.391
   64    H    ALA   9           H        ALA   9   3.443  -3.133 -11.459
   65    HA   ALA   9           HA       ALA   9   0.965  -1.762 -11.897
   66   1HB   ALA   9          1HB       ALA   9   2.691  -2.397 -14.285
   67   2HB   ALA   9          2HB       ALA   9   1.049  -1.751 -14.316
   68   3HB   ALA   9          3HB       ALA   9   2.365  -0.782 -13.658
   69    H    TRP  10           H        TRP  10  -0.601  -3.268 -11.793
   70    HA   TRP  10           HA       TRP  10   0.138  -6.066 -12.454
   71   1HB   TRP  10          1HB       TRP  10  -1.823  -4.982 -10.446
   72   2HB   TRP  10          2HB       TRP  10  -1.728  -6.671 -10.913
   73    HD1  TRP  10           HD1      TRP  10   0.053  -8.141  -9.740
   74    HE1  TRP  10           HE1      TRP  10   1.836  -7.704  -7.945
   75    HE3  TRP  10           HE3      TRP  10  -0.141  -3.051  -9.598
   76    HZ2  TRP  10           HZ2      TRP  10   2.998  -5.496  -6.645
   77    HZ3  TRP  10           HZ3      TRP  10   1.322  -1.837  -8.051
   78    HH2  TRP  10           HH2      TRP  10   2.861  -3.040  -6.587
   79   1HB   PRO  11          1HB       PRO  11  -1.830  -6.153 -17.559
   80   2HB   PRO  11          2HB       PRO  11  -1.557  -4.422 -17.362
   81   1HG   PRO  11          1HG       PRO  11   0.093  -6.712 -16.412
   82   2HG   PRO  11          2HG       PRO  11   0.606  -5.140 -17.052
   83   1HD   PRO  11          1HD       PRO  11   0.700  -5.686 -14.457
   84   2HD   PRO  11          2HD       PRO  11   0.257  -4.064 -15.027
   85    H    GLU  12           H        GLU  12  -1.681  -7.660 -14.781
   86    HA   GLU  12           HA       GLU  12  -3.766  -9.215 -15.869
   87   1HB   GLU  12          1HB       GLU  12  -1.622 -10.172 -15.279
   88   2HB   GLU  12          2HB       GLU  12  -2.923 -11.011 -14.446
   89   1HG   GLU  12          1HG       GLU  12  -2.206  -9.059 -12.624
   90   2HG   GLU  12          2HG       GLU  12  -1.735 -10.753 -12.606
   91    H    LEU  13           H        LEU  13  -3.876  -7.057 -13.254
   92    HA   LEU  13           HA       LEU  13  -5.837  -8.533 -11.742
   93   1HB   LEU  13          1HB       LEU  13  -4.608  -5.819 -11.483
   94   2HB   LEU  13          2HB       LEU  13  -5.990  -6.250 -10.514
   95    HG   LEU  13           HG       LEU  13  -3.263  -7.527 -10.466
   96   1HD1  LEU  13          1HD1      LEU  13  -4.827  -5.874  -8.518
   97   2HD1  LEU  13          2HD1      LEU  13  -3.453  -6.838  -8.033
   98   3HD1  LEU  13          3HD1      LEU  13  -3.263  -5.542  -9.185
   99   1HD2  LEU  13          1HD2      LEU  13  -5.864  -8.455  -9.321
  100   2HD2  LEU  13          2HD2      LEU  13  -4.636  -9.360 -10.198
  101   3HD2  LEU  13          3HD2      LEU  13  -4.332  -8.856  -8.550
  102    H    VAL  14           H        VAL  14  -5.818  -6.412 -14.410
  103    HA   VAL  14           HA       VAL  14  -8.250  -5.081 -14.123
  104    HB   VAL  14           HB       VAL  14  -7.065  -6.143 -16.703
  105   1HG1  VAL  14          1HG1      VAL  14  -9.061  -3.941 -16.161
  106   2HG1  VAL  14          2HG1      VAL  14  -8.283  -4.228 -17.718
  107   3HG1  VAL  14          3HG1      VAL  14  -9.350  -5.445 -17.035
  108   1HG2  VAL  14          1HG2      VAL  14  -5.522  -4.698 -15.283
  109   2HG2  VAL  14          2HG2      VAL  14  -5.870  -4.128 -16.899
  110   3HG2  VAL  14          3HG2      VAL  14  -6.683  -3.400 -15.517
  111    H    GLY  15           H        GLY  15 -10.187  -5.984 -13.703
  112   1HA   GLY  15          1HA       GLY  15 -12.068  -7.180 -14.566
  113   2HA   GLY  15          2HA       GLY  15 -10.991  -8.387 -15.243
  114    H    LYS  16           H        LYS  16  -9.541  -7.943 -12.431
  115    HA   LYS  16           HA       LYS  16 -10.956 -10.165 -11.183
  116   1HB   LYS  16          1HB       LYS  16  -8.403  -9.903 -11.454
  117   2HB   LYS  16          2HB       LYS  16  -8.488  -8.814 -10.090
  118   1HG   LYS  16          1HG       LYS  16  -9.019 -10.457  -8.604
  119   2HG   LYS  16          2HG       LYS  16  -9.776 -11.495  -9.813
  120   1HD   LYS  16          1HD       LYS  16  -6.803 -10.939  -9.685
  121   2HD   LYS  16          2HD       LYS  16  -7.573 -12.312  -8.908
  122   1HE   LYS  16          1HE       LYS  16  -7.215 -13.398 -10.813
  123   2HE   LYS  16          2HE       LYS  16  -8.570 -12.485 -11.468
  124   1HZ   LYS  16          1HZ       LYS  16  -5.747 -11.550 -11.582
  125   2HZ   LYS  16          2HZ       LYS  16  -6.503 -12.424 -12.813
  126   3HZ   LYS  16          3HZ       LYS  16  -7.078 -10.898 -12.392
  127    H    SER  17           H        SER  17 -11.373 -10.098  -8.820
  128    HA   SER  17           HA       SER  17 -12.990  -7.881  -8.159
  129   1HB   SER  17          1HB       SER  17 -13.554  -9.027  -6.240
  130   2HB   SER  17          2HB       SER  17 -12.978 -10.361  -7.235
  131    HG   SER  17           HG       SER  17 -12.095 -10.352  -5.100
  132    H    GLY  18           H        GLY  18 -12.623  -6.068  -6.941
  133   1HA   GLY  18          1HA       GLY  18 -10.101  -4.949  -6.780
  134   2HA   GLY  18          2HA       GLY  18 -11.468  -4.465  -5.791
  135    H    ASN  19           H        ASN  19 -11.690  -7.120  -4.513
  136    HA   ASN  19           HA       ASN  19  -9.943  -6.613  -2.333
  137   1HB   ASN  19          1HB       ASN  19 -12.279  -7.771  -2.371
  138   2HB   ASN  19          2HB       ASN  19 -11.384  -9.240  -2.747
  139   2HD2  ASN  19          2HD2      ASN  19 -12.321  -9.970  -0.701
  140   1HD2  ASN  19          1HD2      ASN  19 -11.512  -9.555   0.767
  141    H    MET  20           H        MET  20 -10.125  -9.300  -4.662
  142    HA   MET  20           HA       MET  20  -7.788 -10.603  -3.779
  143   1HB   MET  20          1HB       MET  20  -9.719 -10.943  -5.835
  144   2HB   MET  20          2HB       MET  20  -8.161 -10.996  -6.620
  145   1HG   MET  20          1HG       MET  20  -7.568 -12.937  -5.671
  146   2HG   MET  20          2HG       MET  20  -8.408 -12.613  -4.156
  147   1HE   MET  20          1HE       MET  20  -9.146 -13.067  -7.950
  148   2HE   MET  20          2HE       MET  20 -10.757 -13.757  -7.943
  149   3HE   MET  20          3HE       MET  20 -10.514 -12.086  -7.444
  150    H    ALA  21           H        ALA  21  -8.322  -8.115  -6.228
  151    HA   ALA  21           HA       ALA  21  -5.743  -8.049  -7.284
  152   1HB   ALA  21          1HB       ALA  21  -8.091  -6.304  -7.325
  153   2HB   ALA  21          2HB       ALA  21  -6.567  -5.455  -7.531
  154   3HB   ALA  21          3HB       ALA  21  -6.999  -6.761  -8.624
  155    H    ALA  22           H        ALA  22  -7.177  -6.095  -4.700
  156    HA   ALA  22           HA       ALA  22  -4.917  -4.589  -4.059
  157   1HB   ALA  22          1HB       ALA  22  -7.036  -5.587  -2.149
  158   2HB   ALA  22          2HB       ALA  22  -7.153  -4.141  -3.150
  159   3HB   ALA  22          3HB       ALA  22  -5.936  -4.233  -1.877
  160    H    ALA  23           H        ALA  23  -5.962  -7.756  -2.817
  161    HA   ALA  23           HA       ALA  23  -3.849  -8.120  -0.991
  162   1HB   ALA  23          1HB       ALA  23  -5.888  -9.464  -0.957
  163   2HB   ALA  23          2HB       ALA  23  -4.454 -10.484  -1.039
  164   3HB   ALA  23          3HB       ALA  23  -5.430 -10.215  -2.485
  165    H    THR  24           H        THR  24  -4.168  -8.854  -4.435
  166    HA   THR  24           HA       THR  24  -1.828 -10.361  -4.758
  167    HB   THR  24           HB       THR  24  -3.079  -8.472  -6.761
  168    HG1  THR  24           HG1      THR  24  -4.698  -9.798  -6.545
  169   1HG2  THR  24          1HG2      THR  24  -0.877  -9.338  -7.447
  170   2HG2  THR  24          2HG2      THR  24  -1.499 -10.975  -7.243
  171   3HG2  THR  24          3HG2      THR  24  -2.202  -9.911  -8.456
  172    H    VAL  25           H        VAL  25  -2.377  -6.860  -4.991
  173    HA   VAL  25           HA       VAL  25   0.278  -6.196  -5.724
  174    HB   VAL  25           HB       VAL  25  -1.688  -4.446  -4.229
  175   1HG1  VAL  25          1HG1      VAL  25   1.005  -3.993  -5.109
  176   2HG1  VAL  25          2HG1      VAL  25  -0.097  -2.977  -6.029
  177   3HG1  VAL  25          3HG1      VAL  25  -0.101  -2.916  -4.285
  178   1HG2  VAL  25          1HG2      VAL  25  -1.402  -5.045  -7.164
  179   2HG2  VAL  25          2HG2      VAL  25  -2.828  -5.153  -6.152
  180   3HG2  VAL  25          3HG2      VAL  25  -2.184  -3.583  -6.567
  181    H    GLU  26           H        GLU  26  -1.352  -6.130  -2.551
  182    HA   GLU  26           HA       GLU  26   0.922  -5.281  -1.093
  183   1HB   GLU  26          1HB       GLU  26  -0.280  -5.769   0.856
  184   2HB   GLU  26          2HB       GLU  26  -1.258  -7.006   0.072
  185   1HG   GLU  26          1HG       GLU  26  -1.623  -4.423  -1.215
  186   2HG   GLU  26          2HG       GLU  26  -2.790  -5.562  -0.549
  187    H    ARG  27           H        ARG  27  -0.152  -8.461  -2.132
  188    HA   ARG  27           HA       ARG  27   1.735  -9.862  -0.450
  189   1HB   ARG  27          1HB       ARG  27  -0.261 -10.627  -2.540
  190   2HB   ARG  27          2HB       ARG  27   1.028 -11.752  -2.191
  191   1HG   ARG  27          1HG       ARG  27  -0.137 -10.802   0.278
  192   2HG   ARG  27          2HG       ARG  27  -1.380 -11.424  -0.809
  193   1HD   ARG  27          1HD       ARG  27   1.153 -12.916  -0.158
  194   2HD   ARG  27          2HD       ARG  27  -0.351 -13.105   0.744
  195    HE   ARG  27           HE       ARG  27  -1.097 -13.525  -1.845
  196   1HH1  ARG  27          1HH1      ARG  27   1.326 -14.947   0.271
  197   2HH1  ARG  27          2HH1      ARG  27   1.259 -16.480  -0.509
  198   1HH2  ARG  27          1HH2      ARG  27  -1.166 -15.566  -2.850
  199   2HH2  ARG  27          2HH2      ARG  27  -0.150 -16.844  -2.270
  200    H    GLU  28           H        GLU  28   1.440  -9.425  -3.992
  201    HA   GLU  28           HA       GLU  28   3.968 -10.548  -4.577
  202   1HB   GLU  28          1HB       GLU  28   2.138  -8.706  -6.103
  203   2HB   GLU  28          2HB       GLU  28   3.689  -9.199  -6.763
  204   1HG   GLU  28          1HG       GLU  28   2.970 -11.573  -6.483
  205   2HG   GLU  28          2HG       GLU  28   1.374 -10.976  -6.032
  206    H    ASN  29           H        ASN  29   2.982  -7.339  -3.588
  207    HA   ASN  29           HA       ASN  29   5.821  -6.515  -3.651
  208   1HB   ASN  29          1HB       ASN  29   4.578  -5.352  -5.399
  209   2HB   ASN  29          2HB       ASN  29   3.405  -4.781  -4.222
  210   2HD2  ASN  29          2HD2      ASN  29   5.047  -3.190  -5.966
  211   1HD2  ASN  29          1HD2      ASN  29   6.063  -2.231  -4.954
  212    H    ARG  30           H        ARG  30   5.853  -7.369  -1.483
  213    HA   ARG  30           HA       ARG  30   4.220  -6.332   0.590
  214   1HB   ARG  30          1HB       ARG  30   6.552  -8.080   0.358
  215   2HB   ARG  30          2HB       ARG  30   6.642  -7.068   1.788
  216   1HG   ARG  30          1HG       ARG  30   4.597  -7.888   2.634
  217   2HG   ARG  30          2HG       ARG  30   4.220  -8.718   1.120
  218   1HD   ARG  30          1HD       ARG  30   5.829 -10.339   1.464
  219   2HD   ARG  30          2HD       ARG  30   6.719  -9.387   2.636
  220    HE   ARG  30           HE       ARG  30   4.844  -9.728   4.196
  221   1HH1  ARG  30          1HH1      ARG  30   5.304 -12.032   1.568
  222   2HH1  ARG  30          2HH1      ARG  30   4.502 -13.300   2.405
  223   1HH2  ARG  30          1HH2      ARG  30   3.789 -11.441   5.267
  224   2HH2  ARG  30          2HH2      ARG  30   3.652 -12.984   4.493
  225    H    ASN  31           H        ASN  31   6.435  -4.657  -1.263
  226    HA   ASN  31           HA       ASN  31   7.423  -2.990   0.907
  227   1HB   ASN  31          1HB       ASN  31   8.914  -3.702  -0.943
  228   2HB   ASN  31          2HB       ASN  31   7.923  -2.791  -2.075
  229   2HD2  ASN  31          2HD2      ASN  31   8.174  -0.597  -2.211
  230   1HD2  ASN  31          1HD2      ASN  31   9.353   0.274  -1.301
  231    H    VAL  32           H        VAL  32   4.702  -3.127  -1.108
  232    HA   VAL  32           HA       VAL  32   4.060  -0.329  -0.466
  233    HB   VAL  32           HB       VAL  32   3.358   0.210  -2.640
  234   1HG1  VAL  32          1HG1      VAL  32   5.930  -1.352  -2.895
  235   2HG1  VAL  32          2HG1      VAL  32   5.355  -0.202  -4.057
  236   3HG1  VAL  32          3HG1      VAL  32   5.772   0.333  -2.444
  237   1HG2  VAL  32          1HG2      VAL  32   3.412  -2.723  -3.151
  238   2HG2  VAL  32          2HG2      VAL  32   2.161  -1.541  -3.473
  239   3HG2  VAL  32          3HG2      VAL  32   3.578  -1.600  -4.504
  240    H    HIS  33           H        HIS  33   1.685   0.108  -0.929
  241    HA   HIS  33           HA       HIS  33   0.057  -2.325  -0.556
  242   1HB   HIS  33          1HB       HIS  33  -1.103  -1.479   1.301
  243   2HB   HIS  33          2HB       HIS  33   0.580  -1.163   1.654
  244    HD1  HIS  33           HD1      HIS  33  -1.658   0.396   3.052
  245    HD2  HIS  33           HD2      HIS  33   0.258   1.689  -0.371
  246    HE1  HIS  33           HE1      HIS  33  -1.940   2.894   3.022
  247    HE2  HIS  33           HE2      HIS  33  -0.840   3.642   0.883
  248    H    ALA  34           H        ALA  34  -2.106  -2.185  -1.207
  249    HA   ALA  34           HA       ALA  34  -2.611   0.037  -3.076
  250   1HB   ALA  34          1HB       ALA  34  -3.786  -2.722  -3.305
  251   2HB   ALA  34          2HB       ALA  34  -2.248  -2.268  -4.035
  252   3HB   ALA  34          3HB       ALA  34  -3.723  -1.439  -4.513
  253    H    ILE  35           H        ILE  35  -4.501   1.115  -3.006
  254    HA   ILE  35           HA       ILE  35  -6.345   0.448  -0.797
  255    HB   ILE  35           HB       ILE  35  -6.158   3.046  -2.299
  256   1HG1  ILE  35          1HG1      ILE  35  -5.121   3.633   0.136
  257   2HG1  ILE  35          2HG1      ILE  35  -4.546   1.979  -0.034
  258   1HG2  ILE  35          1HG2      ILE  35  -7.483   2.284   0.291
  259   2HG2  ILE  35          2HG2      ILE  35  -7.360   3.926  -0.333
  260   3HG2  ILE  35          3HG2      ILE  35  -8.281   2.720  -1.222
  261   1HD1  ILE  35          1HD1      ILE  35  -3.862   3.008  -2.453
  262   2HD1  ILE  35          2HD1      ILE  35  -3.750   4.424  -1.414
  263   3HD1  ILE  35          3HD1      ILE  35  -2.824   2.978  -1.030
  264    H    VAL  36           H        VAL  36  -8.372  -0.211  -1.265
  265    HA   VAL  36           HA       VAL  36  -9.132  -0.509  -4.033
  266    HB   VAL  36           HB       VAL  36 -10.667  -1.169  -1.522
  267   1HG1  VAL  36          1HG1      VAL  36 -11.176  -1.846  -4.420
  268   2HG1  VAL  36          2HG1      VAL  36 -11.962  -2.662  -3.068
  269   3HG1  VAL  36          3HG1      VAL  36 -12.221  -0.940  -3.324
  270   1HG2  VAL  36          1HG2      VAL  36  -8.985  -2.908  -3.328
  271   2HG2  VAL  36          2HG2      VAL  36  -8.596  -2.429  -1.674
  272   3HG2  VAL  36          3HG2      VAL  36  -9.975  -3.482  -1.983
  273    H    LEU  37           H        LEU  37 -10.363   0.791  -5.189
  274    HA   LEU  37           HA       LEU  37 -12.285   2.594  -3.928
  275   1HB   LEU  37          1HB       LEU  37 -11.252   4.435  -5.463
  276   2HB   LEU  37          2HB       LEU  37 -10.618   4.139  -3.871
  277    HG   LEU  37           HG       LEU  37  -8.963   2.523  -5.214
  278   1HD1  LEU  37          1HD1      LEU  37 -10.068   2.907  -7.357
  279   2HD1  LEU  37          2HD1      LEU  37  -9.683   4.604  -7.267
  280   3HD1  LEU  37          3HD1      LEU  37  -8.397   3.400  -7.374
  281   1HD2  LEU  37          1HD2      LEU  37  -8.775   5.502  -4.911
  282   2HD2  LEU  37          2HD2      LEU  37  -8.116   4.231  -3.878
  283   3HD2  LEU  37          3HD2      LEU  37  -7.473   4.485  -5.505
  284    H    LYS  38           H        LYS  38 -13.941   3.173  -5.314
  285    HA   LYS  38           HA       LYS  38 -14.095   1.629  -7.768
  286   1HB   LYS  38          1HB       LYS  38 -15.967   1.483  -6.273
  287   2HB   LYS  38          2HB       LYS  38 -16.460   2.222  -7.788
  288   1HG   LYS  38          1HG       LYS  38 -15.711   4.364  -6.094
  289   2HG   LYS  38          2HG       LYS  38 -17.303   3.926  -6.692
  290   1HD   LYS  38          1HD       LYS  38 -17.845   3.689  -4.554
  291   2HD   LYS  38          2HD       LYS  38 -17.046   2.127  -4.652
  292   1HE   LYS  38          1HE       LYS  38 -15.240   4.409  -4.089
  293   2HE   LYS  38          2HE       LYS  38 -16.467   4.101  -2.871
  294   1HZ   LYS  38          1HZ       LYS  38 -14.772   1.905  -3.904
  295   2HZ   LYS  38          2HZ       LYS  38 -14.273   2.904  -2.636
  296   3HZ   LYS  38          3HZ       LYS  38 -15.675   1.977  -2.475
  297    H    GLU  39           H        GLU  39 -14.850   2.552  -9.759
  298    HA   GLU  39           HA       GLU  39 -13.385   4.629 -10.733
  299   1HB   GLU  39          1HB       GLU  39 -15.113   2.925 -11.849
  300   2HB   GLU  39          2HB       GLU  39 -16.158   4.334 -11.838
  301   1HG   GLU  39          1HG       GLU  39 -13.453   4.879 -12.865
  302   2HG   GLU  39          2HG       GLU  39 -14.323   3.642 -13.764
  303    H    GLY  40           H        GLY  40 -13.303   6.753 -10.320
  304   1HA   GLY  40          1HA       GLY  40 -14.281   8.896 -10.266
  305   2HA   GLY  40          2HA       GLY  40 -15.808   8.205  -9.748
  306    H    SER  41           H        SER  41 -13.309   6.766  -8.013
  307    HA   SER  41           HA       SER  41 -14.099   8.055  -5.595
  308   1HB   SER  41          1HB       SER  41 -13.412   5.776  -5.443
  309   2HB   SER  41          2HB       SER  41 -11.897   6.117  -6.280
  310    HG   SER  41           HG       SER  41 -12.030   5.961  -3.797
  311    H    ALA  42           H        ALA  42 -12.102   8.680  -4.070
  312    HA   ALA  42           HA       ALA  42 -10.888  11.023  -5.338
  313   1HB   ALA  42          1HB       ALA  42 -10.310  11.706  -3.087
  314   2HB   ALA  42          2HB       ALA  42 -10.863  10.157  -2.443
  315   3HB   ALA  42          3HB       ALA  42 -12.016  11.272  -3.172
  316    H    MET  43           H        MET  43  -9.160  10.421  -6.495
  317    HA   MET  43           HA       MET  43  -7.061   8.852  -5.125
  318   1HB   MET  43          1HB       MET  43  -6.548   8.158  -7.620
  319   2HB   MET  43          2HB       MET  43  -7.716   7.296  -6.630
  320   1HG   MET  43          1HG       MET  43  -9.453   8.918  -7.712
  321   2HG   MET  43          2HG       MET  43  -8.182   9.190  -8.894
  322   1HE   MET  43          1HE       MET  43  -6.730   6.813  -9.236
  323   2HE   MET  43          2HE       MET  43  -7.428   5.484  -8.319
  324   3HE   MET  43          3HE       MET  43  -7.571   5.522 -10.068
  325    H    THR  44           H        THR  44  -5.608  10.342  -4.616
  326    HA   THR  44           HA       THR  44  -5.119  12.722  -5.976
  327    HB   THR  44           HB       THR  44  -2.663  12.191  -4.885
  328    HG1  THR  44           HG1      THR  44  -3.180  10.989  -2.930
  329   1HG2  THR  44          1HG2      THR  44  -4.117  14.060  -4.258
  330   2HG2  THR  44          2HG2      THR  44  -5.075  12.959  -3.265
  331   3HG2  THR  44          3HG2      THR  44  -3.382  13.259  -2.869
  332    H    LYS  45           H        LYS  45  -3.446  13.364  -7.384
  333    HA   LYS  45           HA       LYS  45  -2.818  11.337  -9.372
  334   1HB   LYS  45          1HB       LYS  45  -2.682  14.318  -9.231
  335   2HB   LYS  45          2HB       LYS  45  -1.710  13.495 -10.439
  336   1HG   LYS  45          1HG       LYS  45  -4.479  12.543 -10.402
  337   2HG   LYS  45          2HG       LYS  45  -4.352  14.279 -10.662
  338   1HD   LYS  45          1HD       LYS  45  -4.335  13.073 -12.775
  339   2HD   LYS  45          2HD       LYS  45  -2.805  13.913 -12.515
  340   1HE   LYS  45          1HE       LYS  45  -1.792  11.796 -11.754
  341   2HE   LYS  45          2HE       LYS  45  -2.426  11.685 -13.389
  342   1HZ   LYS  45          1HZ       LYS  45  -4.456  10.656 -12.434
  343   2HZ   LYS  45          2HZ       LYS  45  -3.053   9.741 -12.234
  344   3HZ   LYS  45          3HZ       LYS  45  -3.685  10.604 -10.935
  345    H    ASP  46           H        ASP  46  -1.227  13.111  -6.853
  346    HA   ASP  46           HA       ASP  46   1.404  13.073  -7.561
  347   1HB   ASP  46          1HB       ASP  46   0.260  12.381  -4.841
  348   2HB   ASP  46          2HB       ASP  46   1.930  12.859  -5.146
  349    H    PHE  47           H        PHE  47   2.999  11.598  -7.802
  350    HA   PHE  47           HA       PHE  47   2.239   8.817  -7.978
  351   1HB   PHE  47          1HB       PHE  47   3.650   9.672  -9.695
  352   2HB   PHE  47          2HB       PHE  47   4.809  10.294  -8.527
  353    HD1  PHE  47           HD1      PHE  47   6.395   8.830  -7.434
  354    HD2  PHE  47           HD2      PHE  47   3.545   7.294 -10.205
  355    HE1  PHE  47           HE1      PHE  47   7.642   6.732  -7.551
  356    HE2  PHE  47           HE2      PHE  47   4.800   5.199 -10.332
  357    HZ   PHE  47           HZ       PHE  47   6.835   4.892  -9.004
  358    H    ARG  48           H        ARG  48   2.654   7.219  -6.576
  359    HA   ARG  48           HA       ARG  48   4.700   7.530  -4.502
  360   1HB   ARG  48          1HB       ARG  48   1.900   6.745  -3.719
  361   2HB   ARG  48          2HB       ARG  48   3.265   7.101  -2.673
  362   1HG   ARG  48          1HG       ARG  48   3.044   9.466  -3.893
  363   2HG   ARG  48          2HG       ARG  48   1.383   8.914  -4.079
  364   1HD   ARG  48          1HD       ARG  48   1.525  10.180  -2.100
  365   2HD   ARG  48          2HD       ARG  48   2.978   9.333  -1.564
  366    HE   ARG  48           HE       ARG  48   1.170   7.338  -1.691
  367   1HH1  ARG  48          1HH1      ARG  48   1.051  10.504  -0.179
  368   2HH1  ARG  48          2HH1      ARG  48  -0.001   9.974   1.074
  369   1HH2  ARG  48          1HH2      ARG  48  -0.205   6.664  -0.018
  370   2HH2  ARG  48          2HH2      ARG  48  -0.718   7.809   1.175
  371    H    CYS  49           H        CYS  49   5.898   5.767  -4.798
  372    HA   CYS  49           HA       CYS  49   5.059   3.434  -6.061
  373   1HB   CYS  49          1HB       CYS  49   7.392   3.949  -4.238
  374   2HB   CYS  49          2HB       CYS  49   7.169   2.421  -5.083
  375    H    ASP  50           H        ASP  50   5.064   4.307  -2.674
  376    HA   ASP  50           HA       ASP  50   4.454   1.657  -1.767
  377   1HB   ASP  50          1HB       ASP  50   5.673   3.150  -0.328
  378   2HB   ASP  50          2HB       ASP  50   4.158   2.667   0.427
  379    H    ARG  51           H        ARG  51   2.587   3.821  -3.437
  380    HA   ARG  51           HA       ARG  51   0.142   2.826  -2.152
  381   1HB   ARG  51          1HB       ARG  51   0.654   5.264  -1.759
  382   2HB   ARG  51          2HB       ARG  51   0.450   5.506  -3.487
  383   1HG   ARG  51          1HG       ARG  51  -1.880   4.506  -3.197
  384   2HG   ARG  51          2HG       ARG  51  -1.573   4.665  -1.466
  385   1HD   ARG  51          1HD       ARG  51  -1.079   7.071  -1.874
  386   2HD   ARG  51          2HD       ARG  51  -2.747   6.600  -2.087
  387    HE   ARG  51           HE       ARG  51  -1.864   6.411  -4.588
  388   1HH1  ARG  51          1HH1      ARG  51  -1.394   8.970  -2.212
  389   2HH1  ARG  51          2HH1      ARG  51  -1.249  10.192  -3.413
  390   1HH2  ARG  51          1HH2      ARG  51  -1.707   8.077  -6.138
  391   2HH2  ARG  51          2HH2      ARG  51  -1.405   9.695  -5.631
  392    H    VAL  52           H        VAL  52  -1.223   1.791  -3.431
  393    HA   VAL  52           HA       VAL  52  -1.020   2.198  -6.358
  394    HB   VAL  52           HB       VAL  52  -1.464  -0.457  -4.989
  395   1HG1  VAL  52          1HG1      VAL  52  -1.381   0.358  -7.872
  396   2HG1  VAL  52          2HG1      VAL  52  -1.135  -1.304  -7.365
  397   3HG1  VAL  52          3HG1      VAL  52  -2.653  -0.488  -7.023
  398   1HG2  VAL  52          1HG2      VAL  52   0.939   0.573  -6.457
  399   2HG2  VAL  52          2HG2      VAL  52   0.839   0.241  -4.737
  400   3HG2  VAL  52          3HG2      VAL  52   0.733  -1.067  -5.901
  401    H    TRP  53           H        TRP  53  -2.882   3.042  -7.060
  402    HA   TRP  53           HA       TRP  53  -5.301   2.844  -5.503
  403   1HB   TRP  53          1HB       TRP  53  -4.716   4.054  -8.209
  404   2HB   TRP  53          2HB       TRP  53  -6.313   4.065  -7.493
  405    HD1  TRP  53           HD1      TRP  53  -4.156   6.564  -8.210
  406    HE1  TRP  53           HE1      TRP  53  -3.953   8.398  -6.414
  407    HE3  TRP  53           HE3      TRP  53  -5.977   3.986  -4.217
  408    HZ2  TRP  53           HZ2      TRP  53  -4.492   8.683  -3.656
  409    HZ3  TRP  53           HZ3      TRP  53  -6.130   5.109  -2.048
  410    HH2  TRP  53           HH2      TRP  53  -5.387   7.407  -1.763
  411    H    VAL  54           H        VAL  54  -7.004   1.500  -5.798
  412    HA   VAL  54           HA       VAL  54  -6.856  -0.365  -8.102
  413    HB   VAL  54           HB       VAL  54  -7.771  -0.783  -5.267
  414   1HG1  VAL  54          1HG1      VAL  54  -8.475  -2.349  -7.716
  415   2HG1  VAL  54          2HG1      VAL  54  -8.351  -3.143  -6.147
  416   3HG1  VAL  54          3HG1      VAL  54  -9.512  -1.845  -6.381
  417   1HG2  VAL  54          1HG2      VAL  54  -5.403  -1.110  -5.723
  418   2HG2  VAL  54          2HG2      VAL  54  -6.193  -2.629  -5.310
  419   3HG2  VAL  54          3HG2      VAL  54  -5.805  -2.264  -6.992
  420    H    ILE  55           H        ILE  55  -8.153   0.702  -9.521
  421    HA   ILE  55           HA       ILE  55 -10.682   1.830  -8.703
  422    HB   ILE  55           HB       ILE  55  -9.638   1.564 -11.497
  423   1HG1  ILE  55          1HG1      ILE  55  -9.125   3.632  -9.382
  424   2HG1  ILE  55          2HG1      ILE  55  -9.163   4.106 -11.056
  425   1HG2  ILE  55          1HG2      ILE  55 -11.798   3.263 -10.287
  426   2HG2  ILE  55          2HG2      ILE  55 -11.171   3.469 -11.921
  427   3HG2  ILE  55          3HG2      ILE  55 -11.990   1.977 -11.477
  428   1HD1  ILE  55          1HD1      ILE  55  -7.479   1.901 -11.026
  429   2HD1  ILE  55          2HD1      ILE  55  -7.041   3.597 -11.157
  430   3HD1  ILE  55          3HD1      ILE  55  -7.077   2.817  -9.582
  431    H    VAL  56           H        VAL  56 -12.502   0.728  -8.576
  432    HA   VAL  56           HA       VAL  56 -12.881  -1.585 -10.339
  433    HB   VAL  56           HB       VAL  56 -14.178  -2.670  -8.551
  434   1HG1  VAL  56          1HG1      VAL  56 -11.335  -1.976  -7.830
  435   2HG1  VAL  56          2HG1      VAL  56 -12.278  -3.256  -7.091
  436   3HG1  VAL  56          3HG1      VAL  56 -11.888  -3.341  -8.784
  437   1HG2  VAL  56          1HG2      VAL  56 -13.185  -0.401  -6.833
  438   2HG2  VAL  56          2HG2      VAL  56 -14.859  -0.685  -7.306
  439   3HG2  VAL  56          3HG2      VAL  56 -14.039  -1.827  -6.253
  440    H    ASN  57           H        ASN  57 -15.162  -2.167 -10.682
  441    HA   ASN  57           HA       ASN  57 -16.701   0.254 -11.207
  442   1HB   ASN  57          1HB       ASN  57 -16.510  -1.472 -12.937
  443   2HB   ASN  57          2HB       ASN  57 -18.184  -1.204 -12.482
  444   2HD2  ASN  57          2HD2      ASN  57 -17.312  -3.494 -13.804
  445   1HD2  ASN  57          1HD2      ASN  57 -17.520  -4.837 -12.738
  446    H    ASP  58           H        ASP  58 -19.229  -0.213 -10.953
  447    HA   ASP  58           HA       ASP  58 -19.804   0.040  -8.244
  448   1HB   ASP  58          1HB       ASP  58 -21.541  -0.686 -10.606
  449   2HB   ASP  58          2HB       ASP  58 -22.210  -0.462  -8.991
  450    H    HIS  59           H        HIS  59 -19.307  -2.849 -10.085
  451    HA   HIS  59           HA       HIS  59 -20.687  -4.537  -8.174
  452   1HB   HIS  59          1HB       HIS  59 -19.818  -4.779 -10.905
  453   2HB   HIS  59          2HB       HIS  59 -19.078  -6.073  -9.977
  454    HD1  HIS  59           HD1      HIS  59 -20.844  -7.543  -8.521
  455    HD2  HIS  59           HD2      HIS  59 -22.389  -5.250 -11.621
  456    HE1  HIS  59           HE1      HIS  59 -23.130  -8.490  -8.984
  457    HE2  HIS  59           HE2      HIS  59 -24.064  -7.057 -10.833
  458    H    GLY  60           H        GLY  60 -17.458  -3.374  -8.770
  459   1HA   GLY  60          1HA       GLY  60 -15.895  -3.447  -6.967
  460   2HA   GLY  60          2HA       GLY  60 -16.503  -5.027  -6.510
  461    H    VAL  61           H        VAL  61 -16.033  -4.322  -9.885
  462    HA   VAL  61           HA       VAL  61 -13.818  -6.243  -9.956
  463    HB   VAL  61           HB       VAL  61 -15.425  -5.124 -12.256
  464   1HG1  VAL  61          1HG1      VAL  61 -13.543  -7.450 -12.084
  465   2HG1  VAL  61          2HG1      VAL  61 -14.494  -7.020 -13.502
  466   3HG1  VAL  61          3HG1      VAL  61 -13.231  -5.936 -12.925
  467   1HG2  VAL  61          1HG2      VAL  61 -15.762  -7.718 -10.756
  468   2HG2  VAL  61          2HG2      VAL  61 -16.904  -6.375 -10.805
  469   3HG2  VAL  61          3HG2      VAL  61 -16.580  -7.309 -12.264
  470    H    VAL  62           H        VAL  62 -11.805  -5.678 -10.736
  471    HA   VAL  62           HA       VAL  62 -11.145  -2.902 -10.676
  472    HB   VAL  62           HB       VAL  62  -9.400  -5.192 -11.583
  473   1HG1  VAL  62          1HG1      VAL  62  -8.864  -2.307 -10.920
  474   2HG1  VAL  62          2HG1      VAL  62  -7.619  -3.536 -10.710
  475   3HG1  VAL  62          3HG1      VAL  62  -8.333  -3.274 -12.297
  476   1HG2  VAL  62          1HG2      VAL  62 -10.442  -5.225  -9.172
  477   2HG2  VAL  62          2HG2      VAL  62  -8.742  -5.533  -9.420
  478   3HG2  VAL  62          3HG2      VAL  62  -9.273  -3.957  -8.861
  479    H    THR  63           H        THR  63 -11.632  -1.548 -12.285
  480    HA   THR  63           HA       THR  63 -11.822  -2.541 -15.033
  481    HB   THR  63           HB       THR  63 -12.772  -0.337 -15.531
  482    HG1  THR  63           HG1      THR  63 -12.815   1.247 -14.088
  483   1HG2  THR  63          1HG2      THR  63 -14.300  -2.053 -14.750
  484   2HG2  THR  63          2HG2      THR  63 -14.020  -1.554 -13.082
  485   3HG2  THR  63          3HG2      THR  63 -14.799  -0.449 -14.215
  486    H    SER  64           H        SER  64  -9.769  -0.461 -13.061
  487    HA   SER  64           HA       SER  64  -8.173   0.181 -15.464
  488   1HB   SER  64          1HB       SER  64  -8.944   2.135 -14.231
  489   2HB   SER  64          2HB       SER  64  -8.220   1.505 -12.768
  490    HG   SER  64           HG       SER  64  -6.232   1.912 -13.532
  491    H    VAL  65           H        VAL  65  -5.956  -0.058 -15.421
  492    HA   VAL  65           HA       VAL  65  -4.992  -2.414 -14.221
  493    HB   VAL  65           HB       VAL  65  -3.295  -0.206 -15.367
  494   1HG1  VAL  65          1HG1      VAL  65  -2.774  -2.925 -14.419
  495   2HG1  VAL  65          2HG1      VAL  65  -2.171  -2.620 -16.052
  496   3HG1  VAL  65          3HG1      VAL  65  -1.681  -1.586 -14.717
  497   1HG2  VAL  65          1HG2      VAL  65  -4.704  -2.443 -16.794
  498   2HG2  VAL  65          2HG2      VAL  65  -5.038  -0.732 -16.968
  499   3HG2  VAL  65          3HG2      VAL  65  -3.506  -1.388 -17.507
  500   1HB   PRO  66          1HB       PRO  66  -3.442  -2.629  -8.932
  501   2HB   PRO  66          2HB       PRO  66  -5.102  -2.051  -9.062
  502   1HG   PRO  66          1HG       PRO  66  -3.687  -4.078 -10.727
  503   2HG   PRO  66          2HG       PRO  66  -5.332  -4.116 -10.068
  504   1HD   PRO  66          1HD       PRO  66  -4.864  -3.525 -12.624
  505   2HD   PRO  66          2HD       PRO  66  -6.124  -2.712 -11.713
  506    H    HIS  67           H        HIS  67  -2.414   0.844 -10.832
  507    HA   HIS  67           HA       HIS  67   0.165  -0.565 -10.626
  508   1HB   HIS  67          1HB       HIS  67   1.084   1.004 -12.259
  509   2HB   HIS  67          2HB       HIS  67  -0.281   0.139 -12.944
  510    HD1  HIS  67           HD1      HIS  67   0.300   2.586 -14.410
  511    HD2  HIS  67           HD2      HIS  67  -2.024   2.691 -10.971
  512    HE1  HIS  67           HE1      HIS  67  -1.026   4.720 -14.542
  513    HE2  HIS  67           HE2      HIS  67  -2.460   4.723 -12.470
  514    H    ILE  68           H        ILE  68   1.918   0.659  -9.848
  515    HA   ILE  68           HA       ILE  68   1.501   1.985  -7.480
  516    HB   ILE  68           HB       ILE  68   3.761   1.392  -9.210
  517   1HG1  ILE  68          1HG1      ILE  68   3.542   1.894  -6.257
  518   2HG1  ILE  68          2HG1      ILE  68   3.328   0.342  -7.040
  519   1HG2  ILE  68          1HG2      ILE  68   3.872   4.050  -7.796
  520   2HG2  ILE  68          2HG2      ILE  68   5.283   3.163  -8.357
  521   3HG2  ILE  68          3HG2      ILE  68   4.100   3.674  -9.504
  522   1HD1  ILE  68          1HD1      ILE  68   5.906   1.911  -7.033
  523   2HD1  ILE  68          2HD1      ILE  68   5.532   0.533  -6.024
  524   3HD1  ILE  68          3HD1      ILE  68   5.616   0.355  -7.758
  525    H    THR  69           H        THR  69   0.472   3.829  -7.110
  526    HA   THR  69           HA       THR  69   1.241   6.255  -8.466
  527    HB   THR  69           HB       THR  69  -1.400   4.929  -9.043
  528    HG1  THR  69           HG1      THR  69   0.054   4.712 -10.673
  529   1HG2  THR  69          1HG2      THR  69  -0.860   7.886  -9.166
  530   2HG2  THR  69          2HG2      THR  69  -2.143   7.078 -10.059
  531   3HG2  THR  69          3HG2      THR  69  -2.151   7.071  -8.314

  No H/Q in entry =         531
  Start of MODEL    4
    1    H    SER   1           H        SER   1  12.016   7.892 -14.932
    2    HA   SER   1           HA       SER   1  13.092   5.260 -14.313
    3   1HB   SER   1          1HB       SER   1  13.166   7.897 -12.709
    4   2HB   SER   1          2HB       SER   1  14.008   6.446 -12.185
    5    HG   SER   1           HG       SER   1  14.382   7.729 -14.706
    6    H    ARG   2           H        ARG   2  12.852   3.798 -12.575
    7    HA   ARG   2           HA       ARG   2  10.384   3.816 -10.995
    8   1HB   ARG   2          1HB       ARG   2  10.523   2.824 -13.672
    9   2HB   ARG   2          2HB       ARG   2  10.392   1.432 -12.635
   10   1HG   ARG   2          1HG       ARG   2   8.222   1.764 -12.385
   11   2HG   ARG   2          2HG       ARG   2   8.526   3.352 -11.695
   12   1HD   ARG   2          1HD       ARG   2   8.585   4.367 -13.908
   13   2HD   ARG   2          2HD       ARG   2   8.330   2.772 -14.633
   14    HE   ARG   2           HE       ARG   2   6.240   3.255 -12.832
   15   1HH1  ARG   2          1HH1      ARG   2   7.437   4.391 -15.933
   16   2HH1  ARG   2          2HH1      ARG   2   5.883   4.943 -16.446
   17   1HH2  ARG   2          1HH2      ARG   2   4.183   3.842 -13.600
   18   2HH2  ARG   2          2HH2      ARG   2   4.039   4.658 -15.123
   19    H    ARG   3           H        ARG   3  12.143   3.676  -9.395
   20    HA   ARG   3           HA       ARG   3  13.273   0.967  -9.151
   21   1HB   ARG   3          1HB       ARG   3  14.227   3.625  -8.516
   22   2HB   ARG   3          2HB       ARG   3  14.239   2.647  -7.060
   23   1HG   ARG   3          1HG       ARG   3  15.343   0.973  -8.977
   24   2HG   ARG   3          2HG       ARG   3  15.951   2.572  -9.413
   25   1HD   ARG   3          1HD       ARG   3  16.312   2.568  -6.690
   26   2HD   ARG   3          2HD       ARG   3  16.500   0.858  -7.086
   27    HE   ARG   3           HE       ARG   3  18.041   2.411  -8.870
   28   1HH1  ARG   3          1HH1      ARG   3  17.971   1.416  -5.503
   29   2HH1  ARG   3          2HH1      ARG   3  19.679   1.517  -5.323
   30   1HH2  ARG   3          1HH2      ARG   3  20.297   2.538  -8.607
   31   2HH2  ARG   3          2HH2      ARG   3  21.007   2.125  -7.080
   32    H    CYS   4           H        CYS   4  11.081   0.213  -8.652
   33    HA   CYS   4           HA       CYS   4  10.302   0.828  -5.889
   34   1HB   CYS   4          1HB       CYS   4   8.776   0.198  -8.328
   35   2HB   CYS   4          2HB       CYS   4   8.104  -0.436  -6.840
   36   1HB   PRO   5          1HB       PRO   5  10.295  -2.964  -2.374
   37   2HB   PRO   5          2HB       PRO   5  11.989  -3.169  -2.695
   38   1HG   PRO   5          1HG       PRO   5  10.969  -0.814  -1.851
   39   2HG   PRO   5          2HG       PRO   5  12.322  -0.928  -2.968
   40   1HD   PRO   5          1HD       PRO   5  10.949   0.418  -4.190
   41   2HD   PRO   5          2HD       PRO   5   9.454  -0.344  -3.597
   42    H    GLY   6           H        GLY   6   9.763  -3.597  -6.644
   43   1HA   GLY   6          1HA       GLY   6   8.447  -5.787  -6.483
   44   2HA   GLY   6          2HA       GLY   6   7.412  -4.884  -5.400
   45    H    LYS   7           H        LYS   7   6.787  -6.113  -7.973
   46    HA   LYS   7           HA       LYS   7   6.688  -4.691 -10.209
   47   1HB   LYS   7          1HB       LYS   7   5.460  -6.800  -9.764
   48   2HB   LYS   7          2HB       LYS   7   4.204  -5.865  -8.992
   49   1HG   LYS   7          1HG       LYS   7   3.580  -4.800 -10.993
   50   2HG   LYS   7          2HG       LYS   7   5.041  -5.362 -11.811
   51   1HD   LYS   7          1HD       LYS   7   3.199  -7.413 -10.702
   52   2HD   LYS   7          2HD       LYS   7   2.683  -6.577 -12.163
   53   1HE   LYS   7          1HE       LYS   7   4.891  -7.216 -13.187
   54   2HE   LYS   7          2HE       LYS   7   5.227  -8.119 -11.712
   55   1HZ   LYS   7          1HZ       LYS   7   3.191  -9.427 -12.150
   56   2HZ   LYS   7          2HZ       LYS   7   3.049  -8.639 -13.645
   57   3HZ   LYS   7          3HZ       LYS   7   4.404  -9.627 -13.306
   58    H    ASN   8           H        ASN   8   5.638  -2.945 -11.137
   59    HA   ASN   8           HA       ASN   8   4.428  -1.030  -9.244
   60   1HB   ASN   8          1HB       ASN   8   5.233   0.712 -10.929
   61   2HB   ASN   8          2HB       ASN   8   6.443  -0.130  -9.980
   62   2HD2  ASN   8          2HD2      ASN   8   8.098  -1.014 -11.008
   63   1HD2  ASN   8          1HD2      ASN   8   8.121  -1.417 -12.689
   64    H    ALA   9           H        ALA   9   3.494  -3.062 -11.625
   65    HA   ALA   9           HA       ALA   9   1.024  -1.667 -11.991
   66   1HB   ALA   9          1HB       ALA   9   2.749  -2.249 -14.379
   67   2HB   ALA   9          2HB       ALA   9   1.087  -1.644 -14.421
   68   3HB   ALA   9          3HB       ALA   9   2.371  -0.650 -13.742
   69    H    TRP  10           H        TRP  10  -0.513  -3.151 -11.776
   70    HA   TRP  10           HA       TRP  10   0.179  -5.950 -12.458
   71   1HB   TRP  10          1HB       TRP  10  -1.807  -4.866 -10.436
   72   2HB   TRP  10          2HB       TRP  10  -1.637  -6.544 -10.948
   73    HD1  TRP  10           HD1      TRP  10   0.165  -8.027  -9.918
   74    HE1  TRP  10           HE1      TRP  10   2.012  -7.660  -8.165
   75    HE3  TRP  10           HE3      TRP  10  -0.095  -2.952  -9.492
   76    HZ2  TRP  10           HZ2      TRP  10   3.199  -5.494  -6.798
   77    HZ3  TRP  10           HZ3      TRP  10   1.421  -1.802  -7.948
   78    HH2  TRP  10           HH2      TRP  10   3.030  -3.052  -6.610
   79   1HB   PRO  11          1HB       PRO  11  -1.822  -6.171 -17.621
   80   2HB   PRO  11          2HB       PRO  11  -1.407  -4.488 -17.319
   81   1HG   PRO  11          1HG       PRO  11   0.018  -6.952 -16.427
   82   2HG   PRO  11          2HG       PRO  11   0.683  -5.446 -17.074
   83   1HD   PRO  11          1HD       PRO  11   0.710  -5.994 -14.458
   84   2HD   PRO  11          2HD       PRO  11   0.463  -4.341 -15.069
   85    H    GLU  12           H        GLU  12  -1.572  -7.707 -14.742
   86    HA   GLU  12           HA       GLU  12  -3.606  -9.344 -15.786
   87   1HB   GLU  12          1HB       GLU  12  -2.742 -11.047 -14.243
   88   2HB   GLU  12          2HB       GLU  12  -1.468 -10.267 -15.156
   89   1HG   GLU  12          1HG       GLU  12  -2.066  -9.001 -12.549
   90   2HG   GLU  12          2HG       GLU  12  -1.503 -10.671 -12.448
   91    H    LEU  13           H        LEU  13  -3.678  -7.160 -13.147
   92    HA   LEU  13           HA       LEU  13  -5.684  -8.584 -11.659
   93   1HB   LEU  13          1HB       LEU  13  -4.481  -5.834 -11.426
   94   2HB   LEU  13          2HB       LEU  13  -5.839  -6.320 -10.448
   95    HG   LEU  13           HG       LEU  13  -3.087  -7.543 -10.421
   96   1HD1  LEU  13          1HD1      LEU  13  -4.643  -5.970  -8.401
   97   2HD1  LEU  13          2HD1      LEU  13  -3.133  -6.791  -8.056
   98   3HD1  LEU  13          3HD1      LEU  13  -3.198  -5.481  -9.202
   99   1HD2  LEU  13          1HD2      LEU  13  -5.687  -8.539  -9.374
  100   2HD2  LEU  13          2HD2      LEU  13  -4.308  -9.418 -10.030
  101   3HD2  LEU  13          3HD2      LEU  13  -4.250  -8.776  -8.412
  102    H    VAL  14           H        VAL  14  -5.620  -6.445 -14.336
  103    HA   VAL  14           HA       VAL  14  -8.078  -5.159 -14.099
  104    HB   VAL  14           HB       VAL  14  -6.782  -6.166 -16.649
  105   1HG1  VAL  14          1HG1      VAL  14  -8.927  -4.100 -16.144
  106   2HG1  VAL  14          2HG1      VAL  14  -8.021  -4.227 -17.666
  107   3HG1  VAL  14          3HG1      VAL  14  -9.034  -5.575 -17.131
  108   1HG2  VAL  14          1HG2      VAL  14  -5.323  -4.697 -15.202
  109   2HG2  VAL  14          2HG2      VAL  14  -5.697  -4.069 -16.804
  110   3HG2  VAL  14          3HG2      VAL  14  -6.537  -3.438 -15.388
  111    H    GLY  15           H        GLY  15 -10.062  -6.037 -13.860
  112   1HA   GLY  15          1HA       GLY  15 -11.862  -7.270 -14.737
  113   2HA   GLY  15          2HA       GLY  15 -10.775  -8.463 -15.414
  114    H    LYS  16           H        LYS  16  -9.410  -8.030 -12.550
  115    HA   LYS  16           HA       LYS  16 -10.810 -10.270 -11.336
  116   1HB   LYS  16          1HB       LYS  16  -8.138  -9.205 -11.292
  117   2HB   LYS  16          2HB       LYS  16  -8.735  -9.262  -9.643
  118   1HG   LYS  16          1HG       LYS  16  -9.157 -11.584  -9.813
  119   2HG   LYS  16          2HG       LYS  16  -8.803 -11.618 -11.536
  120   1HD   LYS  16          1HD       LYS  16  -6.472 -10.651 -10.709
  121   2HD   LYS  16          2HD       LYS  16  -6.984 -11.318  -9.157
  122   1HE   LYS  16          1HE       LYS  16  -7.442 -13.487 -10.563
  123   2HE   LYS  16          2HE       LYS  16  -5.813 -13.065 -10.032
  124   1HZ   LYS  16          1HZ       LYS  16  -5.440 -12.046 -12.233
  125   2HZ   LYS  16          2HZ       LYS  16  -5.772 -13.718 -12.318
  126   3HZ   LYS  16          3HZ       LYS  16  -6.943 -12.539 -12.731
  127    H    SER  17           H        SER  17 -10.950 -10.083  -8.812
  128    HA   SER  17           HA       SER  17 -12.838  -7.966  -8.290
  129   1HB   SER  17          1HB       SER  17 -13.283  -9.087  -6.247
  130   2HB   SER  17          2HB       SER  17 -12.894 -10.361  -7.380
  131    HG   SER  17           HG       SER  17 -11.757 -10.673  -5.463
  132    H    GLY  18           H        GLY  18 -12.606  -6.211  -6.891
  133   1HA   GLY  18          1HA       GLY  18 -10.153  -4.935  -6.752
  134   2HA   GLY  18          2HA       GLY  18 -11.501  -4.575  -5.715
  135    H    ASN  19           H        ASN  19 -11.538  -7.277  -4.560
  136    HA   ASN  19           HA       ASN  19  -9.702  -6.815  -2.428
  137   1HB   ASN  19          1HB       ASN  19 -11.830  -8.779  -3.055
  138   2HB   ASN  19          2HB       ASN  19 -10.496  -9.446  -2.138
  139   2HD2  ASN  19          2HD2      ASN  19 -13.119  -7.157  -2.102
  140   1HD2  ASN  19          1HD2      ASN  19 -13.047  -6.849  -0.403
  141    H    MET  20           H        MET  20  -9.851  -9.352  -4.937
  142    HA   MET  20           HA       MET  20  -7.407 -10.577  -4.195
  143   1HB   MET  20          1HB       MET  20  -9.359 -11.277  -5.897
  144   2HB   MET  20          2HB       MET  20  -8.261 -10.593  -7.067
  145   1HG   MET  20          1HG       MET  20  -7.203 -12.545  -7.120
  146   2HG   MET  20          2HG       MET  20  -6.639 -12.201  -5.485
  147   1HE   MET  20          1HE       MET  20  -7.789 -13.026  -3.272
  148   2HE   MET  20          2HE       MET  20  -9.307 -12.285  -3.784
  149   3HE   MET  20          3HE       MET  20  -9.286 -13.961  -3.241
  150    H    ALA  21           H        ALA  21  -8.173  -7.788  -6.156
  151    HA   ALA  21           HA       ALA  21  -5.710  -7.518  -7.456
  152   1HB   ALA  21          1HB       ALA  21  -7.932  -5.620  -6.827
  153   2HB   ALA  21          2HB       ALA  21  -7.428  -6.287  -8.394
  154   3HB   ALA  21          3HB       ALA  21  -6.448  -5.060  -7.601
  155    H    ALA  22           H        ALA  22  -6.991  -5.716  -4.677
  156    HA   ALA  22           HA       ALA  22  -4.631  -4.401  -4.001
  157   1HB   ALA  22          1HB       ALA  22  -5.641  -4.216  -1.697
  158   2HB   ALA  22          2HB       ALA  22  -6.679  -3.680  -3.024
  159   3HB   ALA  22          3HB       ALA  22  -6.950  -5.262  -2.286
  160    H    ALA  23           H        ALA  23  -5.789  -7.606  -3.105
  161    HA   ALA  23           HA       ALA  23  -3.788  -8.172  -1.175
  162   1HB   ALA  23          1HB       ALA  23  -5.361 -10.098  -2.894
  163   2HB   ALA  23          2HB       ALA  23  -5.883  -9.437  -1.343
  164   3HB   ALA  23          3HB       ALA  23  -4.475 -10.497  -1.416
  165    H    THR  24           H        THR  24  -4.032  -8.834  -4.660
  166    HA   THR  24           HA       THR  24  -1.665 -10.308  -4.943
  167    HB   THR  24           HB       THR  24  -2.998  -8.457  -6.913
  168    HG1  THR  24           HG1      THR  24  -3.296 -11.250  -6.462
  169   1HG2  THR  24          1HG2      THR  24  -0.973 -10.627  -7.347
  170   2HG2  THR  24          2HG2      THR  24  -1.981  -9.949  -8.634
  171   3HG2  THR  24          3HG2      THR  24  -0.836  -8.927  -7.782
  172    H    VAL  25           H        VAL  25  -2.246  -6.817  -5.093
  173    HA   VAL  25           HA       VAL  25   0.403  -6.107  -5.827
  174    HB   VAL  25           HB       VAL  25  -1.602  -4.424  -4.304
  175   1HG1  VAL  25          1HG1      VAL  25   1.096  -3.896  -5.234
  176   2HG1  VAL  25          2HG1      VAL  25  -0.071  -2.798  -5.965
  177   3HG1  VAL  25          3HG1      VAL  25   0.028  -2.939  -4.233
  178   1HG2  VAL  25          1HG2      VAL  25  -1.332  -5.103  -7.205
  179   2HG2  VAL  25          2HG2      VAL  25  -2.766  -4.935  -6.202
  180   3HG2  VAL  25          3HG2      VAL  25  -1.918  -3.501  -6.737
  181    H    GLU  26           H        GLU  26  -1.224  -6.107  -2.652
  182    HA   GLU  26           HA       GLU  26   1.081  -5.302  -1.193
  183   1HB   GLU  26          1HB       GLU  26  -0.134  -5.897   0.784
  184   2HB   GLU  26          2HB       GLU  26  -1.240  -6.911  -0.137
  185   1HG   GLU  26          1HG       GLU  26  -1.321  -4.285  -1.258
  186   2HG   GLU  26          2HG       GLU  26  -2.604  -5.226  -0.498
  187    H    ARG  27           H        ARG  27  -0.010  -8.434  -2.329
  188    HA   ARG  27           HA       ARG  27   1.821  -9.881  -0.603
  189   1HB   ARG  27          1HB       ARG  27  -0.264 -10.604  -2.598
  190   2HB   ARG  27          2HB       ARG  27   1.085 -11.694  -2.493
  191   1HG   ARG  27          1HG       ARG  27   0.523 -12.506  -0.509
  192   2HG   ARG  27          2HG       ARG  27   0.013 -10.940   0.125
  193   1HD   ARG  27          1HD       ARG  27  -1.828 -12.405   0.034
  194   2HD   ARG  27          2HD       ARG  27  -2.096 -11.127  -1.154
  195    HE   ARG  27           HE       ARG  27  -0.994 -13.064  -2.665
  196   1HH1  ARG  27          1HH1      ARG  27  -3.576 -13.231  -0.273
  197   2HH1  ARG  27          2HH1      ARG  27  -4.370 -14.530  -1.078
  198   1HH2  ARG  27          1HH2      ARG  27  -2.037 -14.823  -3.656
  199   2HH2  ARG  27          2HH2      ARG  27  -3.469 -15.483  -2.942
  200    H    GLU  28           H        GLU  28   1.560  -9.362  -4.125
  201    HA   GLU  28           HA       GLU  28   4.073 -10.523  -4.728
  202   1HB   GLU  28          1HB       GLU  28   2.270  -8.606  -6.188
  203   2HB   GLU  28          2HB       GLU  28   3.840  -9.033  -6.851
  204   1HG   GLU  28          1HG       GLU  28   2.987 -11.495  -6.488
  205   2HG   GLU  28          2HG       GLU  28   1.406 -10.707  -6.492
  206    H    ASN  29           H        ASN  29   3.087  -7.267  -3.830
  207    HA   ASN  29           HA       ASN  29   5.941  -6.490  -3.715
  208   1HB   ASN  29          1HB       ASN  29   4.805  -5.343  -5.544
  209   2HB   ASN  29          2HB       ASN  29   3.573  -4.750  -4.443
  210   2HD2  ASN  29          2HD2      ASN  29   5.197  -3.121  -6.078
  211   1HD2  ASN  29          1HD2      ASN  29   6.293  -2.242  -5.085
  212    H    ARG  30           H        ARG  30   5.864  -7.299  -1.540
  213    HA   ARG  30           HA       ARG  30   4.117  -6.300   0.446
  214   1HB   ARG  30          1HB       ARG  30   6.672  -7.807   0.388
  215   2HB   ARG  30          2HB       ARG  30   6.384  -6.902   1.857
  216   1HG   ARG  30          1HG       ARG  30   4.119  -8.606   0.857
  217   2HG   ARG  30          2HG       ARG  30   5.587  -9.379   1.444
  218   1HD   ARG  30          1HD       ARG  30   4.942  -9.165   3.480
  219   2HD   ARG  30          2HD       ARG  30   5.101  -7.427   3.362
  220    HE   ARG  30           HE       ARG  30   2.604  -8.844   2.613
  221   1HH1  ARG  30          1HH1      ARG  30   4.256  -6.431   4.600
  222   2HH1  ARG  30          2HH1      ARG  30   2.775  -5.784   5.218
  223   1HH2  ARG  30          1HH2      ARG  30   0.679  -7.965   3.477
  224   2HH2  ARG  30          2HH2      ARG  30   0.772  -6.710   4.664
  225    H    ASN  31           H        ASN  31   6.400  -4.560  -1.297
  226    HA   ASN  31           HA       ASN  31   7.099  -2.792   0.915
  227   1HB   ASN  31          1HB       ASN  31   8.785  -3.518  -0.798
  228   2HB   ASN  31          2HB       ASN  31   7.882  -2.604  -2.003
  229   2HD2  ASN  31          2HD2      ASN  31   9.930  -2.415   0.814
  230   1HD2  ASN  31          1HD2      ASN  31  10.232  -0.718   0.711
  231    H    VAL  32           H        VAL  32   4.420  -3.103  -0.961
  232    HA   VAL  32           HA       VAL  32   3.885  -0.230  -0.782
  233    HB   VAL  32           HB       VAL  32   2.878  -0.136  -2.929
  234   1HG1  VAL  32          1HG1      VAL  32   5.305   0.166  -2.868
  235   2HG1  VAL  32          2HG1      VAL  32   5.544  -1.515  -3.146
  236   3HG1  VAL  32          3HG1      VAL  32   4.795  -0.571  -4.401
  237   1HG2  VAL  32          1HG2      VAL  32   3.252  -3.110  -2.961
  238   2HG2  VAL  32          2HG2      VAL  32   1.810  -2.169  -3.266
  239   3HG2  VAL  32          3HG2      VAL  32   3.097  -2.212  -4.464
  240    H    HIS  33           H        HIS  33   1.509   0.214  -1.153
  241    HA   HIS  33           HA       HIS  33  -0.170  -1.957  -0.184
  242   1HB   HIS  33          1HB       HIS  33  -0.673  -1.042   1.755
  243   2HB   HIS  33          2HB       HIS  33   0.722   0.014   1.566
  244    HD1  HIS  33           HD1      HIS  33  -2.885  -0.034   2.004
  245    HD2  HIS  33           HD2      HIS  33  -0.108   2.652   0.496
  246    HE1  HIS  33           HE1      HIS  33  -4.042   2.193   1.977
  247    HE2  HIS  33           HE2      HIS  33  -2.244   3.835   1.340
  248    H    ALA  34           H        ALA  34  -2.001  -2.150  -1.313
  249    HA   ALA  34           HA       ALA  34  -2.668  -0.001  -3.180
  250   1HB   ALA  34          1HB       ALA  34  -3.590  -2.856  -3.097
  251   2HB   ALA  34          2HB       ALA  34  -3.979  -1.677  -4.370
  252   3HB   ALA  34          3HB       ALA  34  -2.306  -2.207  -4.118
  253    H    ILE  35           H        ILE  35  -4.544   1.097  -3.146
  254    HA   ILE  35           HA       ILE  35  -6.413   0.530  -0.929
  255    HB   ILE  35           HB       ILE  35  -6.132   3.104  -2.477
  256   1HG1  ILE  35          1HG1      ILE  35  -5.049   2.513   0.260
  257   2HG1  ILE  35          2HG1      ILE  35  -4.052   2.445  -1.175
  258   1HG2  ILE  35          1HG2      ILE  35  -8.310   2.794  -1.403
  259   2HG2  ILE  35          2HG2      ILE  35  -7.506   2.443   0.125
  260   3HG2  ILE  35          3HG2      ILE  35  -7.395   4.044  -0.577
  261   1HD1  ILE  35          1HD1      ILE  35  -5.580   4.930  -0.471
  262   2HD1  ILE  35          2HD1      ILE  35  -4.007   4.567   0.224
  263   3HD1  ILE  35          3HD1      ILE  35  -4.146   4.725  -1.500
  264    H    VAL  36           H        VAL  36  -8.316  -0.336  -1.487
  265    HA   VAL  36           HA       VAL  36  -9.111  -0.452  -4.249
  266    HB   VAL  36           HB       VAL  36  -9.412  -2.317  -2.573
  267   1HG1  VAL  36          1HG1      VAL  36 -10.405  -0.761  -0.813
  268   2HG1  VAL  36          2HG1      VAL  36 -11.904  -0.837  -1.739
  269   3HG1  VAL  36          3HG1      VAL  36 -11.210  -2.305  -1.069
  270   1HG2  VAL  36          1HG2      VAL  36 -11.801  -1.386  -4.182
  271   2HG2  VAL  36          2HG2      VAL  36 -10.445  -2.394  -4.749
  272   3HG2  VAL  36          3HG2      VAL  36 -11.572  -3.037  -3.533
  273    H    LEU  37           H        LEU  37 -10.468   0.810  -5.296
  274    HA   LEU  37           HA       LEU  37 -12.575   2.264  -3.942
  275   1HB   LEU  37          1HB       LEU  37 -11.714   4.436  -5.023
  276   2HB   LEU  37          2HB       LEU  37 -11.064   3.921  -3.492
  277    HG   LEU  37           HG       LEU  37  -9.213   2.794  -5.081
  278   1HD1  LEU  37          1HD1      LEU  37 -10.351   5.063  -6.688
  279   2HD1  LEU  37          2HD1      LEU  37  -8.727   4.427  -6.924
  280   3HD1  LEU  37          3HD1      LEU  37 -10.125   3.399  -7.185
  281   1HD2  LEU  37          1HD2      LEU  37  -9.451   5.332  -3.655
  282   2HD2  LEU  37          2HD2      LEU  37  -8.158   4.126  -3.684
  283   3HD2  LEU  37          3HD2      LEU  37  -8.263   5.366  -4.955
  284    H    LYS  38           H        LYS  38 -14.165   2.928  -5.348
  285    HA   LYS  38           HA       LYS  38 -14.015   1.757  -7.998
  286   1HB   LYS  38          1HB       LYS  38 -16.449   2.201  -8.114
  287   2HB   LYS  38          2HB       LYS  38 -15.962   1.211  -6.764
  288   1HG   LYS  38          1HG       LYS  38 -15.974   3.376  -5.364
  289   2HG   LYS  38          2HG       LYS  38 -17.483   2.624  -5.830
  290   1HD   LYS  38          1HD       LYS  38 -16.733   4.441  -7.896
  291   2HD   LYS  38          2HD       LYS  38 -16.595   5.276  -6.357
  292   1HE   LYS  38          1HE       LYS  38 -18.789   5.566  -7.296
  293   2HE   LYS  38          2HE       LYS  38 -19.009   3.823  -7.431
  294   1HZ   LYS  38          1HZ       LYS  38 -18.562   5.219  -4.841
  295   2HZ   LYS  38          2HZ       LYS  38 -20.094   4.903  -5.480
  296   3HZ   LYS  38          3HZ       LYS  38 -19.076   3.612  -5.088
  297    H    GLU  39           H        GLU  39 -14.797   2.859  -9.896
  298    HA   GLU  39           HA       GLU  39 -13.463   5.140 -10.547
  299   1HB   GLU  39          1HB       GLU  39 -14.608   3.643 -12.135
  300   2HB   GLU  39          2HB       GLU  39 -16.162   4.332 -11.663
  301   1HG   GLU  39          1HG       GLU  39 -14.569   6.548 -12.392
  302   2HG   GLU  39          2HG       GLU  39 -14.147   5.263 -13.514
  303    H    GLY  40           H        GLY  40 -13.580   7.211  -9.917
  304   1HA   GLY  40          1HA       GLY  40 -14.849   9.214  -9.753
  305   2HA   GLY  40          2HA       GLY  40 -16.211   8.329  -9.086
  306    H    SER  41           H        SER  41 -13.651   6.953  -7.588
  307    HA   SER  41           HA       SER  41 -14.109   8.309  -5.138
  308   1HB   SER  41          1HB       SER  41 -13.496   6.026  -5.016
  309   2HB   SER  41          2HB       SER  41 -12.065   6.271  -6.022
  310    HG   SER  41           HG       SER  41 -12.032   6.212  -3.481
  311    H    ALA  42           H        ALA  42 -11.898   8.854  -3.857
  312    HA   ALA  42           HA       ALA  42 -10.797  11.171  -5.280
  313   1HB   ALA  42          1HB       ALA  42  -9.909  11.810  -3.105
  314   2HB   ALA  42          2HB       ALA  42 -10.459  10.283  -2.407
  315   3HB   ALA  42          3HB       ALA  42 -11.632  11.461  -2.995
  316    H    MET  43           H        MET  43  -9.227  10.554  -6.643
  317    HA   MET  43           HA       MET  43  -7.033   8.906  -5.538
  318   1HB   MET  43          1HB       MET  43  -6.730   8.282  -8.053
  319   2HB   MET  43          2HB       MET  43  -7.896   7.441  -7.054
  320   1HG   MET  43          1HG       MET  43  -9.638   9.035  -7.955
  321   2HG   MET  43          2HG       MET  43  -8.417   9.617  -9.081
  322   1HE   MET  43          1HE       MET  43 -10.546   7.002  -7.700
  323   2HE   MET  43          2HE       MET  43 -11.491   7.135  -9.188
  324   3HE   MET  43          3HE       MET  43 -10.595   5.664  -8.841
  325    H    THR  44           H        THR  44  -5.598  10.443  -5.030
  326    HA   THR  44           HA       THR  44  -5.139  12.795  -6.488
  327    HB   THR  44           HB       THR  44  -2.768  12.537  -5.300
  328    HG1  THR  44           HG1      THR  44  -4.186  10.850  -3.568
  329   1HG2  THR  44          1HG2      THR  44  -5.343  12.895  -3.781
  330   2HG2  THR  44          2HG2      THR  44  -3.739  13.228  -3.141
  331   3HG2  THR  44          3HG2      THR  44  -4.344  14.151  -4.527
  332    H    LYS  45           H        LYS  45  -3.503  13.364  -7.942
  333    HA   LYS  45           HA       LYS  45  -2.797  11.226  -9.782
  334   1HB   LYS  45          1HB       LYS  45  -2.741  14.208  -9.813
  335   2HB   LYS  45          2HB       LYS  45  -1.620  13.365 -10.869
  336   1HG   LYS  45          1HG       LYS  45  -3.947  12.036 -11.430
  337   2HG   LYS  45          2HG       LYS  45  -4.544  13.623 -10.967
  338   1HD   LYS  45          1HD       LYS  45  -2.239  13.677 -12.845
  339   2HD   LYS  45          2HD       LYS  45  -3.719  12.936 -13.439
  340   1HE   LYS  45          1HE       LYS  45  -4.640  15.245 -12.182
  341   2HE   LYS  45          2HE       LYS  45  -3.134  15.720 -12.961
  342   1HZ   LYS  45          1HZ       LYS  45  -3.954  14.843 -15.048
  343   2HZ   LYS  45          2HZ       LYS  45  -5.417  14.384 -14.310
  344   3HZ   LYS  45          3HZ       LYS  45  -4.990  16.013 -14.435
  345    H    ASP  46           H        ASP  46  -1.274  13.044  -7.258
  346    HA   ASP  46           HA       ASP  46   1.378  13.008  -7.892
  347   1HB   ASP  46          1HB       ASP  46  -0.061  12.594  -5.263
  348   2HB   ASP  46          2HB       ASP  46   1.688  12.448  -5.360
  349    H    PHE  47           H        PHE  47   3.135  11.550  -7.263
  350    HA   PHE  47           HA       PHE  47   2.375   8.760  -7.824
  351   1HB   PHE  47          1HB       PHE  47   3.967   9.664  -9.376
  352   2HB   PHE  47          2HB       PHE  47   4.980  10.242  -8.068
  353    HD1  PHE  47           HD1      PHE  47   3.830   7.235  -9.852
  354    HD2  PHE  47           HD2      PHE  47   6.510   8.804  -6.941
  355    HE1  PHE  47           HE1      PHE  47   5.080   5.140  -9.882
  356    HE2  PHE  47           HE2      PHE  47   7.758   6.685  -6.954
  357    HZ   PHE  47           HZ       PHE  47   7.038   4.839  -8.413
  358    H    ARG  48           H        ARG  48   2.632   7.177  -6.389
  359    HA   ARG  48           HA       ARG  48   4.450   7.496  -4.124
  360   1HB   ARG  48          1HB       ARG  48   1.468   7.438  -3.908
  361   2HB   ARG  48          2HB       ARG  48   2.378   6.506  -2.735
  362   1HG   ARG  48          1HG       ARG  48   3.524   8.437  -1.965
  363   2HG   ARG  48          2HG       ARG  48   2.882   9.417  -3.270
  364   1HD   ARG  48          1HD       ARG  48   0.593   9.096  -2.355
  365   2HD   ARG  48          2HD       ARG  48   1.711   9.857  -1.226
  366    HE   ARG  48           HE       ARG  48   1.756   7.113  -0.729
  367   1HH1  ARG  48          1HH1      ARG  48  -0.391   9.865  -0.387
  368   2HH1  ARG  48          2HH1      ARG  48  -1.192   9.205   0.988
  369   1HH2  ARG  48          1HH2      ARG  48   0.676   6.248   1.074
  370   2HH2  ARG  48          2HH2      ARG  48  -0.577   7.174   1.832
  371    H    CYS  49           H        CYS  49   5.681   5.772  -4.412
  372    HA   CYS  49           HA       CYS  49   4.956   3.420  -5.708
  373   1HB   CYS  49          1HB       CYS  49   7.275   4.197  -5.382
  374   2HB   CYS  49          2HB       CYS  49   7.150   3.779  -3.682
  375    H    ASP  50           H        ASP  50   4.852   4.259  -2.296
  376    HA   ASP  50           HA       ASP  50   4.145   1.576  -1.497
  377   1HB   ASP  50          1HB       ASP  50   3.785   2.560   0.713
  378   2HB   ASP  50          2HB       ASP  50   5.382   2.988   0.088
  379    H    ARG  51           H        ARG  51   2.409   3.746  -3.215
  380    HA   ARG  51           HA       ARG  51  -0.105   2.848  -2.029
  381   1HB   ARG  51          1HB       ARG  51   0.419   5.278  -1.577
  382   2HB   ARG  51          2HB       ARG  51   0.370   5.517  -3.317
  383   1HG   ARG  51          1HG       ARG  51  -2.020   4.573  -3.246
  384   2HG   ARG  51          2HG       ARG  51  -1.866   4.758  -1.493
  385   1HD   ARG  51          1HD       ARG  51  -2.899   6.743  -2.177
  386   2HD   ARG  51          2HD       ARG  51  -1.209   7.132  -1.882
  387    HE   ARG  51           HE       ARG  51  -1.729   6.475  -4.631
  388   1HH1  ARG  51          1HH1      ARG  51  -1.810   9.056  -2.247
  389   2HH1  ARG  51          2HH1      ARG  51  -1.716  10.296  -3.434
  390   1HH2  ARG  51          1HH2      ARG  51  -1.478   8.156  -6.173
  391   2HH2  ARG  51          2HH2      ARG  51  -1.634   9.798  -5.651
  392    H    VAL  52           H        VAL  52  -1.401   1.825  -3.398
  393    HA   VAL  52           HA       VAL  52  -1.041   2.269  -6.301
  394    HB   VAL  52           HB       VAL  52  -1.566  -0.402  -4.982
  395   1HG1  VAL  52          1HG1      VAL  52  -1.371   0.424  -7.860
  396   2HG1  VAL  52          2HG1      VAL  52  -1.209  -1.253  -7.322
  397   3HG1  VAL  52          3HG1      VAL  52  -2.716  -0.383  -7.045
  398   1HG2  VAL  52          1HG2      VAL  52   0.908   0.946  -5.513
  399   2HG2  VAL  52          2HG2      VAL  52   0.618  -0.633  -4.806
  400   3HG2  VAL  52          3HG2      VAL  52   0.774  -0.450  -6.553
  401    H    TRP  53           H        TRP  53  -2.857   3.066  -7.147
  402    HA   TRP  53           HA       TRP  53  -5.340   2.960  -5.693
  403   1HB   TRP  53          1HB       TRP  53  -4.582   4.086  -8.388
  404   2HB   TRP  53          2HB       TRP  53  -6.237   4.118  -7.809
  405    HD1  TRP  53           HD1      TRP  53  -4.099   6.626  -8.429
  406    HE1  TRP  53           HE1      TRP  53  -4.019   8.491  -6.654
  407    HE3  TRP  53           HE3      TRP  53  -6.098   4.083  -4.489
  408    HZ2  TRP  53           HZ2      TRP  53  -4.697   8.820  -3.936
  409    HZ3  TRP  53           HZ3      TRP  53  -6.358   5.235  -2.359
  410    HH2  TRP  53           HH2      TRP  53  -5.664   7.556  -2.065
  411    H    VAL  54           H        VAL  54  -6.991   1.576  -5.940
  412    HA   VAL  54           HA       VAL  54  -6.844  -0.339  -8.203
  413    HB   VAL  54           HB       VAL  54  -7.780  -0.668  -5.364
  414   1HG1  VAL  54          1HG1      VAL  54  -8.526  -2.248  -7.802
  415   2HG1  VAL  54          2HG1      VAL  54  -8.323  -3.091  -6.241
  416   3HG1  VAL  54          3HG1      VAL  54  -9.506  -1.782  -6.396
  417   1HG2  VAL  54          1HG2      VAL  54  -5.404  -1.000  -5.829
  418   2HG2  VAL  54          2HG2      VAL  54  -6.209  -2.489  -5.301
  419   3HG2  VAL  54          3HG2      VAL  54  -5.823  -2.245  -7.013
  420    H    ILE  55           H        ILE  55  -8.095   0.731  -9.655
  421    HA   ILE  55           HA       ILE  55 -10.614   1.928  -8.917
  422    HB   ILE  55           HB       ILE  55  -9.826   1.393 -11.742
  423   1HG1  ILE  55          1HG1      ILE  55  -7.827   2.324 -10.738
  424   2HG1  ILE  55          2HG1      ILE  55  -8.570   3.550 -11.731
  425   1HG2  ILE  55          1HG2      ILE  55 -11.398   3.558 -10.373
  426   2HG2  ILE  55          2HG2      ILE  55 -10.971   3.565 -12.097
  427   3HG2  ILE  55          3HG2      ILE  55 -12.001   2.282 -11.432
  428   1HD1  ILE  55          1HD1      ILE  55  -9.686   4.232  -9.433
  429   2HD1  ILE  55          2HD1      ILE  55  -8.302   3.355  -8.780
  430   3HD1  ILE  55          3HD1      ILE  55  -8.046   4.730  -9.830
  431    H    VAL  56           H        VAL  56 -12.443   0.857  -8.678
  432    HA   VAL  56           HA       VAL  56 -12.898  -1.565 -10.271
  433    HB   VAL  56           HB       VAL  56 -14.165  -2.514  -8.404
  434   1HG1  VAL  56          1HG1      VAL  56 -11.346  -1.705  -7.659
  435   2HG1  VAL  56          2HG1      VAL  56 -12.293  -3.020  -6.896
  436   3HG1  VAL  56          3HG1      VAL  56 -11.841  -3.119  -8.610
  437   1HG2  VAL  56          1HG2      VAL  56 -13.236  -0.087  -6.888
  438   2HG2  VAL  56          2HG2      VAL  56 -14.893  -0.472  -7.324
  439   3HG2  VAL  56          3HG2      VAL  56 -14.032  -1.477  -6.167
  440    H    ASN  57           H        ASN  57 -15.217  -2.142 -10.476
  441    HA   ASN  57           HA       ASN  57 -16.729   0.269 -11.161
  442   1HB   ASN  57          1HB       ASN  57 -18.252  -1.279 -12.294
  443   2HB   ASN  57          2HB       ASN  57 -16.609  -1.510 -12.859
  444   2HD2  ASN  57          2HD2      ASN  57 -17.460  -3.587 -13.579
  445   1HD2  ASN  57          1HD2      ASN  57 -17.745  -4.869 -12.444
  446    H    ASP  58           H        ASP  58 -19.304  -0.441 -10.908
  447    HA   ASP  58           HA       ASP  58 -19.830   0.024  -8.187
  448   1HB   ASP  58          1HB       ASP  58 -21.396  -0.289 -10.654
  449   2HB   ASP  58          2HB       ASP  58 -22.192  -1.012  -9.265
  450    H    HIS  59           H        HIS  59 -19.221  -2.916  -9.854
  451    HA   HIS  59           HA       HIS  59 -20.532  -4.536  -7.806
  452   1HB   HIS  59          1HB       HIS  59 -19.178  -5.310 -10.421
  453   2HB   HIS  59          2HB       HIS  59 -19.834  -6.416  -9.216
  454    HD1  HIS  59           HD1      HIS  59 -21.521  -3.275 -10.500
  455    HD2  HIS  59           HD2      HIS  59 -22.075  -7.388 -10.296
  456    HE1  HIS  59           HE1      HIS  59 -23.807  -3.680 -11.435
  457    HE2  HIS  59           HE2      HIS  59 -24.121  -6.185 -11.321
  458    H    GLY  60           H        GLY  60 -17.583  -3.018  -8.086
  459   1HA   GLY  60          1HA       GLY  60 -15.797  -3.214  -6.674
  460   2HA   GLY  60          2HA       GLY  60 -16.417  -4.747  -6.069
  461    H    VAL  61           H        VAL  61 -16.080  -4.184  -9.498
  462    HA   VAL  61           HA       VAL  61 -13.938  -6.194  -9.596
  463    HB   VAL  61           HB       VAL  61 -15.572  -5.100 -11.888
  464   1HG1  VAL  61          1HG1      VAL  61 -13.849  -7.547 -11.613
  465   2HG1  VAL  61          2HG1      VAL  61 -14.838  -7.151 -13.018
  466   3HG1  VAL  61          3HG1      VAL  61 -13.488  -6.111 -12.575
  467   1HG2  VAL  61          1HG2      VAL  61 -16.056  -7.548 -10.195
  468   2HG2  VAL  61          2HG2      VAL  61 -17.105  -6.127 -10.336
  469   3HG2  VAL  61          3HG2      VAL  61 -16.872  -7.191 -11.723
  470    H    VAL  62           H        VAL  62 -11.930  -5.713 -10.413
  471    HA   VAL  62           HA       VAL  62 -11.181  -2.962 -10.547
  472    HB   VAL  62           HB       VAL  62  -9.564  -5.399 -11.317
  473   1HG1  VAL  62          1HG1      VAL  62  -8.783  -2.509 -10.840
  474   2HG1  VAL  62          2HG1      VAL  62  -7.631  -3.867 -10.832
  475   3HG1  VAL  62          3HG1      VAL  62  -8.546  -3.506 -12.299
  476   1HG2  VAL  62          1HG2      VAL  62 -10.480  -4.551  -8.767
  477   2HG2  VAL  62          2HG2      VAL  62  -9.338  -5.824  -9.164
  478   3HG2  VAL  62          3HG2      VAL  62  -8.754  -4.204  -8.849
  479    H    THR  63           H        THR  63 -11.729  -1.717 -12.225
  480    HA   THR  63           HA       THR  63 -11.890  -2.868 -14.923
  481    HB   THR  63           HB       THR  63 -12.948  -0.772 -15.549
  482    HG1  THR  63           HG1      THR  63 -12.092   0.791 -14.335
  483   1HG2  THR  63          1HG2      THR  63 -14.101  -1.824 -12.980
  484   2HG2  THR  63          2HG2      THR  63 -14.938  -0.810 -14.163
  485   3HG2  THR  63          3HG2      THR  63 -14.419  -2.439 -14.605
  486    H    SER  64           H        SER  64  -9.905  -0.719 -12.988
  487    HA   SER  64           HA       SER  64  -8.341  -0.008 -15.389
  488   1HB   SER  64          1HB       SER  64  -9.301   1.787 -13.764
  489   2HB   SER  64          2HB       SER  64  -7.989   1.262 -12.701
  490    HG   SER  64           HG       SER  64  -7.658   3.048 -14.379
  491    H    VAL  65           H        VAL  65  -6.049  -0.003 -15.208
  492    HA   VAL  65           HA       VAL  65  -5.037  -2.429 -14.105
  493    HB   VAL  65           HB       VAL  65  -3.318  -0.179 -15.127
  494   1HG1  VAL  65          1HG1      VAL  65  -2.939  -3.011 -14.434
  495   2HG1  VAL  65          2HG1      VAL  65  -2.279  -2.555 -16.007
  496   3HG1  VAL  65          3HG1      VAL  65  -1.782  -1.695 -14.552
  497   1HG2  VAL  65          1HG2      VAL  65  -4.844  -2.203 -16.735
  498   2HG2  VAL  65          2HG2      VAL  65  -4.996  -0.454 -16.820
  499   3HG2  VAL  65          3HG2      VAL  65  -3.518  -1.240 -17.368
  500   1HB   PRO  66          1HB       PRO  66  -4.483  -2.078  -8.616
  501   2HB   PRO  66          2HB       PRO  66  -3.167  -3.023  -9.319
  502   1HG   PRO  66          1HG       PRO  66  -4.805  -4.334 -10.047
  503   2HG   PRO  66          2HG       PRO  66  -6.012  -3.071 -10.011
  504   1HD   PRO  66          1HD       PRO  66  -4.062  -3.751 -12.143
  505   2HD   PRO  66          2HD       PRO  66  -5.709  -3.144 -12.280
  506    H    HIS  67           H        HIS  67  -2.312   0.850 -10.599
  507    HA   HIS  67           HA       HIS  67   0.259  -0.583 -10.571
  508   1HB   HIS  67          1HB       HIS  67   1.087   1.089 -12.265
  509   2HB   HIS  67          2HB       HIS  67  -0.120  -0.042 -12.863
  510    HD1  HIS  67           HD1      HIS  67  -2.735   1.188 -12.364
  511    HD2  HIS  67           HD2      HIS  67   0.545   3.399 -13.528
  512    HE1  HIS  67           HE1      HIS  67  -3.680   3.363 -13.130
  513    HE2  HIS  67           HE2      HIS  67  -1.664   4.752 -13.718
  514    H    ILE  68           H        ILE  68   1.925   0.418  -9.559
  515    HA   ILE  68           HA       ILE  68   1.562   1.884  -7.341
  516    HB   ILE  68           HB       ILE  68   3.840   1.318  -9.103
  517   1HG1  ILE  68          1HG1      ILE  68   4.151   1.713  -6.207
  518   2HG1  ILE  68          2HG1      ILE  68   3.031   0.439  -6.640
  519   1HG2  ILE  68          1HG2      ILE  68   3.894   3.881  -7.503
  520   2HG2  ILE  68          2HG2      ILE  68   5.350   2.976  -7.929
  521   3HG2  ILE  68          3HG2      ILE  68   4.323   3.566  -9.197
  522   1HD1  ILE  68          1HD1      ILE  68   5.674   0.451  -7.991
  523   2HD1  ILE  68          2HD1      ILE  68   5.656   0.090  -6.278
  524   3HD1  ILE  68          3HD1      ILE  68   4.696  -0.874  -7.365
  525    H    THR  69           H        THR  69   0.536   3.712  -7.024
  526    HA   THR  69           HA       THR  69   1.380   6.148  -8.320
  527    HB   THR  69           HB       THR  69  -1.322   4.931  -8.918
  528    HG1  THR  69           HG1      THR  69   0.709   6.054 -10.567
  529   1HG2  THR  69          1HG2      THR  69  -0.548   7.823  -8.973
  530   2HG2  THR  69          2HG2      THR  69  -1.689   7.164 -10.145
  531   3HG2  THR  69          3HG2      THR  69  -2.050   7.063  -8.436

  No H/Q in entry =         531
  Start of MODEL    5
    1    H    SER   1           H        SER   1  12.416   7.788  -3.335
    2    HA   SER   1           HA       SER   1  11.063   9.109  -4.707
    3   1HB   SER   1          1HB       SER   1  11.944  10.778  -6.212
    4   2HB   SER   1          2HB       SER   1  12.903  10.708  -4.739
    5    HG   SER   1           HG       SER   1  14.320   9.222  -5.983
    6    H    ARG   2           H        ARG   2  12.982   8.185  -7.527
    7    HA   ARG   2           HA       ARG   2  10.747   6.511  -8.534
    8   1HB   ARG   2          1HB       ARG   2  11.947   6.729 -10.765
    9   2HB   ARG   2          2HB       ARG   2  11.157   8.169 -10.141
   10   1HG   ARG   2          1HG       ARG   2  13.309   9.021  -9.344
   11   2HG   ARG   2          2HG       ARG   2  14.105   7.580  -9.980
   12   1HD   ARG   2          1HD       ARG   2  12.982   8.284 -12.216
   13   2HD   ARG   2          2HD       ARG   2  12.819   9.860 -11.435
   14    HE   ARG   2           HE       ARG   2  15.437   9.269 -11.066
   15   1HH1  ARG   2          1HH1      ARG   2  13.367   9.340 -13.910
   16   2HH1  ARG   2          2HH1      ARG   2  14.665   9.745 -14.966
   17   1HH2  ARG   2          1HH2      ARG   2  17.128   9.800 -12.494
   18   2HH2  ARG   2          2HH2      ARG   2  16.790  10.003 -14.181
   19    H    ARG   3           H        ARG   3  12.095   5.362  -6.603
   20    HA   ARG   3           HA       ARG   3  13.439   3.161  -7.956
   21   1HB   ARG   3          1HB       ARG   3  14.812   4.847  -5.855
   22   2HB   ARG   3          2HB       ARG   3  15.358   3.236  -6.315
   23   1HG   ARG   3          1HG       ARG   3  15.865   3.955  -8.534
   24   2HG   ARG   3          2HG       ARG   3  15.138   5.528  -8.245
   25   1HD   ARG   3          1HD       ARG   3  16.801   5.887  -6.424
   26   2HD   ARG   3          2HD       ARG   3  17.616   4.445  -7.002
   27    HE   ARG   3           HE       ARG   3  17.194   6.927  -8.566
   28   1HH1  ARG   3          1HH1      ARG   3  19.120   4.059  -7.858
   29   2HH1  ARG   3          2HH1      ARG   3  20.362   4.500  -8.956
   30   1HH2  ARG   3          1HH2      ARG   3  18.863   7.456 -10.031
   31   2HH2  ARG   3          2HH2      ARG   3  20.229   6.403 -10.192
   32    H    CYS   4           H        CYS   4  11.523   2.092  -7.252
   33    HA   CYS   4           HA       CYS   4  11.619   1.404  -4.391
   34   1HB   CYS   4          1HB       CYS   4   9.263   1.467  -4.202
   35   2HB   CYS   4          2HB       CYS   4   9.048   1.636  -5.943
   36   1HB   PRO   5          1HB       PRO   5  11.108  -4.072  -3.619
   37   2HB   PRO   5          2HB       PRO   5  12.637  -3.212  -3.810
   38   1HG   PRO   5          1HG       PRO   5  10.156  -2.340  -2.422
   39   2HG   PRO   5          2HG       PRO   5  11.830  -2.208  -1.868
   40   1HD   PRO   5          1HD       PRO   5  10.461  -0.131  -2.991
   41   2HD   PRO   5          2HD       PRO   5  12.218  -0.323  -3.130
   42    H    GLY   6           H        GLY   6  10.338  -4.848  -5.609
   43   1HA   GLY   6          1HA       GLY   6   8.349  -5.907  -5.967
   44   2HA   GLY   6          2HA       GLY   6   7.559  -4.552  -5.222
   45    H    LYS   7           H        LYS   7   6.268  -5.763  -7.190
   46    HA   LYS   7           HA       LYS   7   6.813  -4.780  -9.804
   47   1HB   LYS   7          1HB       LYS   7   5.512  -6.821  -9.213
   48   2HB   LYS   7          2HB       LYS   7   4.213  -5.800  -8.704
   49   1HG   LYS   7          1HG       LYS   7   3.775  -5.038 -10.856
   50   2HG   LYS   7          2HG       LYS   7   5.331  -5.607 -11.459
   51   1HD   LYS   7          1HD       LYS   7   3.973  -7.871 -10.390
   52   2HD   LYS   7          2HD       LYS   7   2.783  -6.957 -11.316
   53   1HE   LYS   7          1HE       LYS   7   5.183  -7.051 -12.862
   54   2HE   LYS   7          2HE       LYS   7   4.865  -8.666 -12.238
   55   1HZ   LYS   7          1HZ       LYS   7   2.915  -6.994 -13.727
   56   2HZ   LYS   7          2HZ       LYS   7   3.797  -8.287 -14.366
   57   3HZ   LYS   7          3HZ       LYS   7   2.649  -8.569 -13.159
   58    H    ASN   8           H        ASN   8   5.703  -3.139 -11.001
   59    HA   ASN   8           HA       ASN   8   4.600  -1.000  -9.270
   60   1HB   ASN   8          1HB       ASN   8   6.148  -0.891 -11.856
   61   2HB   ASN   8          2HB       ASN   8   5.332   0.509 -11.165
   62   2HD2  ASN   8          2HD2      ASN   8   7.841  -1.909 -10.563
   63   1HD2  ASN   8          1HD2      ASN   8   8.737  -0.922  -9.465
   64    H    ALA   9           H        ALA   9   3.591  -3.202 -11.632
   65    HA   ALA   9           HA       ALA   9   1.057  -1.855 -11.861
   66   1HB   ALA   9          1HB       ALA   9   2.709  -2.281 -14.343
   67   2HB   ALA   9          2HB       ALA   9   1.039  -1.706 -14.287
   68   3HB   ALA   9          3HB       ALA   9   2.333  -0.725 -13.605
   69    H    TRP  10           H        TRP  10  -0.456  -3.383 -11.743
   70    HA   TRP  10           HA       TRP  10   0.264  -6.132 -12.585
   71   1HB   TRP  10          1HB       TRP  10  -1.698  -5.143 -10.534
   72   2HB   TRP  10          2HB       TRP  10  -1.554  -6.820 -11.035
   73    HD1  TRP  10           HD1      TRP  10   0.316  -8.242  -9.923
   74    HE1  TRP  10           HE1      TRP  10   2.104  -7.771  -8.139
   75    HE3  TRP  10           HE3      TRP  10  -0.100  -3.169  -9.625
   76    HZ2  TRP  10           HZ2      TRP  10   3.189  -5.548  -6.787
   77    HZ3  TRP  10           HZ3      TRP  10   1.335  -1.937  -8.075
   78    HH2  TRP  10           HH2      TRP  10   2.950  -3.107  -6.670
   79   1HB   PRO  11          1HB       PRO  11  -1.812  -6.194 -17.687
   80   2HB   PRO  11          2HB       PRO  11  -1.400  -4.498 -17.435
   81   1HG   PRO  11          1HG       PRO  11   0.698  -5.422 -17.180
   82   2HG   PRO  11          2HG       PRO  11   0.052  -6.946 -16.543
   83   1HD   PRO  11          1HD       PRO  11   0.766  -5.992 -14.583
   84   2HD   PRO  11          2HD       PRO  11   0.477  -4.332 -15.147
   85    H    GLU  12           H        GLU  12  -1.637  -7.784 -15.022
   86    HA   GLU  12           HA       GLU  12  -3.823  -9.221 -16.061
   87   1HB   GLU  12          1HB       GLU  12  -1.683 -10.260 -15.603
   88   2HB   GLU  12          2HB       GLU  12  -2.977 -11.102 -14.764
   89   1HG   GLU  12          1HG       GLU  12  -2.142  -9.276 -12.870
   90   2HG   GLU  12          2HG       GLU  12  -1.709 -10.978 -12.964
   91    H    LEU  13           H        LEU  13  -3.815  -7.131 -13.407
   92    HA   LEU  13           HA       LEU  13  -5.729  -8.635 -11.848
   93   1HB   LEU  13          1HB       LEU  13  -4.429  -5.963 -11.580
   94   2HB   LEU  13          2HB       LEU  13  -5.813  -6.348 -10.592
   95    HG   LEU  13           HG       LEU  13  -3.123  -7.706 -10.583
   96   1HD1  LEU  13          1HD1      LEU  13  -4.627  -5.976  -8.662
   97   2HD1  LEU  13          2HD1      LEU  13  -3.352  -7.031  -8.117
   98   3HD1  LEU  13          3HD1      LEU  13  -3.016  -5.773  -9.263
   99   1HD2  LEU  13          1HD2      LEU  13  -5.743  -8.569  -9.413
  100   2HD2  LEU  13          2HD2      LEU  13  -4.550  -9.507 -10.311
  101   3HD2  LEU  13          3HD2      LEU  13  -4.217  -9.008  -8.684
  102    H    VAL  14           H        VAL  14  -5.769  -6.369 -14.426
  103    HA   VAL  14           HA       VAL  14  -8.193  -5.063 -13.998
  104    HB   VAL  14           HB       VAL  14  -7.097  -5.960 -16.678
  105   1HG1  VAL  14          1HG1      VAL  14  -9.062  -3.799 -15.902
  106   2HG1  VAL  14          2HG1      VAL  14  -8.316  -3.929 -17.496
  107   3HG1  VAL  14          3HG1      VAL  14  -9.364  -5.216 -16.907
  108   1HG2  VAL  14          1HG2      VAL  14  -5.494  -4.629 -15.197
  109   2HG2  VAL  14          2HG2      VAL  14  -5.867  -3.973 -16.777
  110   3HG2  VAL  14          3HG2      VAL  14  -6.634  -3.302 -15.346
  111    H    GLY  15           H        GLY  15 -10.116  -5.992 -13.584
  112   1HA   GLY  15          1HA       GLY  15 -12.004  -7.133 -14.563
  113   2HA   GLY  15          2HA       GLY  15 -10.919  -8.363 -15.182
  114    H    LYS  16           H        LYS  16  -9.601  -7.828 -12.293
  115    HA   LYS  16           HA       LYS  16 -11.159  -9.973 -11.052
  116   1HB   LYS  16          1HB       LYS  16  -8.682 -10.206 -11.351
  117   2HB   LYS  16          2HB       LYS  16  -8.464  -8.860 -10.243
  118   1HG   LYS  16          1HG       LYS  16  -9.620 -10.156  -8.497
  119   2HG   LYS  16          2HG       LYS  16  -8.140 -10.891  -9.060
  120   1HD   LYS  16          1HD       LYS  16 -10.531 -11.775 -10.546
  121   2HD   LYS  16          2HD       LYS  16 -10.577 -12.140  -8.829
  122   1HE   LYS  16          1HE       LYS  16  -7.982 -12.750 -10.022
  123   2HE   LYS  16          2HE       LYS  16  -9.040 -13.727  -9.005
  124   1HZ   LYS  16          1HZ       LYS  16  -9.369 -13.306 -11.930
  125   2HZ   LYS  16          2HZ       LYS  16  -8.732 -14.690 -11.194
  126   3HZ   LYS  16          3HZ       LYS  16 -10.352 -14.276 -10.949
  127    H    SER  17           H        SER  17 -11.641  -9.878  -8.770
  128    HA   SER  17           HA       SER  17 -13.003  -7.578  -8.014
  129   1HB   SER  17          1HB       SER  17 -13.428  -8.643  -5.968
  130   2HB   SER  17          2HB       SER  17 -13.172  -9.987  -7.080
  131    HG   SER  17           HG       SER  17 -11.918 -10.436  -5.334
  132    H    GLY  18           H        GLY  18 -12.554  -5.829  -6.705
  133   1HA   GLY  18          1HA       GLY  18 -10.005  -4.741  -6.660
  134   2HA   GLY  18          2HA       GLY  18 -11.311  -4.283  -5.603
  135    H    ASN  19           H        ASN  19 -11.480  -6.977  -4.387
  136    HA   ASN  19           HA       ASN  19  -9.548  -6.558  -2.327
  137   1HB   ASN  19          1HB       ASN  19 -11.950  -7.662  -2.252
  138   2HB   ASN  19          2HB       ASN  19 -11.066  -9.145  -2.595
  139   2HD2  ASN  19          2HD2      ASN  19 -10.688 -10.247  -0.789
  140   1HD2  ASN  19          1HD2      ASN  19 -10.307  -9.559   0.748
  141    H    MET  20           H        MET  20  -9.953  -8.978  -4.902
  142    HA   MET  20           HA       MET  20  -7.668 -10.509  -4.188
  143   1HB   MET  20          1HB       MET  20  -9.712 -10.771  -6.063
  144   2HB   MET  20          2HB       MET  20  -8.307 -10.448  -7.029
  145   1HG   MET  20          1HG       MET  20  -8.083 -12.656  -6.977
  146   2HG   MET  20          2HG       MET  20  -7.232 -12.310  -5.476
  147   1HE   MET  20          1HE       MET  20  -7.910 -13.020  -3.226
  148   2HE   MET  20          2HE       MET  20  -9.205 -11.834  -3.207
  149   3HE   MET  20          3HE       MET  20  -9.532 -13.500  -2.719
  150    H    ALA  21           H        ALA  21  -8.190  -7.744  -6.316
  151    HA   ALA  21           HA       ALA  21  -5.644  -7.667  -7.481
  152   1HB   ALA  21          1HB       ALA  21  -7.845  -5.704  -7.092
  153   2HB   ALA  21          2HB       ALA  21  -6.260  -5.098  -7.575
  154   3HB   ALA  21          3HB       ALA  21  -7.091  -6.281  -8.583
  155    H    ALA  22           H        ALA  22  -6.927  -5.746  -4.770
  156    HA   ALA  22           HA       ALA  22  -4.558  -4.526  -4.003
  157   1HB   ALA  22          1HB       ALA  22  -5.720  -4.723  -1.603
  158   2HB   ALA  22          2HB       ALA  22  -6.310  -3.652  -2.866
  159   3HB   ALA  22          3HB       ALA  22  -7.092  -5.207  -2.608
  160    H    ALA  23           H        ALA  23  -5.826  -7.719  -3.204
  161    HA   ALA  23           HA       ALA  23  -3.898  -8.407  -1.263
  162   1HB   ALA  23          1HB       ALA  23  -4.609 -10.696  -1.624
  163   2HB   ALA  23          2HB       ALA  23  -5.406 -10.241  -3.132
  164   3HB   ALA  23          3HB       ALA  23  -6.007  -9.623  -1.597
  165    H    THR  24           H        THR  24  -4.042  -8.937  -4.776
  166    HA   THR  24           HA       THR  24  -1.650 -10.381  -5.031
  167    HB   THR  24           HB       THR  24  -2.785  -8.468  -7.074
  168    HG1  THR  24           HG1      THR  24  -4.499  -9.678  -6.952
  169   1HG2  THR  24          1HG2      THR  24  -1.258 -11.037  -7.395
  170   2HG2  THR  24          2HG2      THR  24  -1.982 -10.096  -8.698
  171   3HG2  THR  24          3HG2      THR  24  -0.669  -9.411  -7.743
  172    H    VAL  25           H        VAL  25  -2.287  -6.897  -5.108
  173    HA   VAL  25           HA       VAL  25   0.349  -6.106  -5.786
  174    HB   VAL  25           HB       VAL  25  -1.755  -4.543  -4.266
  175   1HG1  VAL  25          1HG1      VAL  25   0.950  -3.879  -5.166
  176   2HG1  VAL  25          2HG1      VAL  25  -0.284  -2.744  -5.704
  177   3HG1  VAL  25          3HG1      VAL  25  -0.094  -3.090  -3.991
  178   1HG2  VAL  25          1HG2      VAL  25  -1.193  -4.704  -7.222
  179   2HG2  VAL  25          2HG2      VAL  25  -2.624  -5.277  -6.398
  180   3HG2  VAL  25          3HG2      VAL  25  -2.291  -3.559  -6.465
  181    H    GLU  26           H        GLU  26  -1.329  -6.246  -2.652
  182    HA   GLU  26           HA       GLU  26   0.934  -5.444  -1.129
  183   1HB   GLU  26          1HB       GLU  26  -0.341  -6.005   0.795
  184   2HB   GLU  26          2HB       GLU  26  -1.369  -7.101  -0.112
  185   1HG   GLU  26          1HG       GLU  26  -1.686  -4.631  -1.410
  186   2HG   GLU  26          2HG       GLU  26  -2.820  -5.476  -0.362
  187    H    ARG  27           H        ARG  27  -0.119  -8.568  -2.346
  188    HA   ARG  27           HA       ARG  27   1.690 -10.030  -0.610
  189   1HB   ARG  27          1HB       ARG  27  -0.438 -10.711  -2.527
  190   2HB   ARG  27          2HB       ARG  27   0.927 -11.781  -2.620
  191   1HG   ARG  27          1HG       ARG  27   0.194 -12.893  -0.891
  192   2HG   ARG  27          2HG       ARG  27   0.412 -11.480   0.135
  193   1HD   ARG  27          1HD       ARG  27  -1.784 -12.026   0.438
  194   2HD   ARG  27          2HD       ARG  27  -1.887 -10.734  -0.733
  195    HE   ARG  27           HE       ARG  27  -2.022 -12.596  -2.455
  196   1HH1  ARG  27          1HH1      ARG  27  -3.272 -12.960   0.825
  197   2HH1  ARG  27          2HH1      ARG  27  -4.431 -14.136   0.357
  198   1HH2  ARG  27          1HH2      ARG  27  -3.579 -14.144  -3.027
  199   2HH2  ARG  27          2HH2      ARG  27  -4.618 -14.816  -1.815
  200    H    GLU  28           H        GLU  28   1.497  -9.398  -4.120
  201    HA   GLU  28           HA       GLU  28   4.026 -10.593  -4.673
  202   1HB   GLU  28          1HB       GLU  28   2.235  -8.718  -6.209
  203   2HB   GLU  28          2HB       GLU  28   3.815  -9.159  -6.824
  204   1HG   GLU  28          1HG       GLU  28   3.170 -11.537  -6.707
  205   2HG   GLU  28          2HG       GLU  28   1.552 -11.043  -6.210
  206    H    ASN  29           H        ASN  29   3.003  -7.375  -3.713
  207    HA   ASN  29           HA       ASN  29   5.848  -6.570  -3.606
  208   1HB   ASN  29          1HB       ASN  29   4.654  -5.407  -5.418
  209   2HB   ASN  29          2HB       ASN  29   3.487  -4.783  -4.260
  210   2HD2  ASN  29          2HD2      ASN  29   5.220  -3.259  -5.990
  211   1HD2  ASN  29          1HD2      ASN  29   6.234  -2.331  -4.945
  212    H    ARG  30           H        ARG  30   5.695  -7.486  -1.455
  213    HA   ARG  30           HA       ARG  30   3.973  -6.471   0.534
  214   1HB   ARG  30          1HB       ARG  30   5.579  -8.554   0.482
  215   2HB   ARG  30          2HB       ARG  30   6.738  -7.444   1.192
  216   1HG   ARG  30          1HG       ARG  30   4.257  -7.190   2.608
  217   2HG   ARG  30          2HG       ARG  30   4.609  -8.902   2.409
  218   1HD   ARG  30          1HD       ARG  30   6.079  -8.819   4.027
  219   2HD   ARG  30          2HD       ARG  30   7.049  -7.626   3.172
  220    HE   ARG  30           HE       ARG  30   5.107  -6.108   4.267
  221   1HH1  ARG  30          1HH1      ARG  30   7.268  -8.542   5.628
  222   2HH1  ARG  30          2HH1      ARG  30   7.296  -7.777   7.170
  223   1HH2  ARG  30          1HH2      ARG  30   5.156  -5.159   6.330
  224   2HH2  ARG  30          2HH2      ARG  30   6.103  -5.886   7.586
  225    H    ASN  31           H        ASN  31   6.168  -4.672  -1.148
  226    HA   ASN  31           HA       ASN  31   7.110  -3.129   1.138
  227   1HB   ASN  31          1HB       ASN  31   8.700  -3.696  -0.639
  228   2HB   ASN  31          2HB       ASN  31   7.708  -2.847  -1.813
  229   2HD2  ASN  31          2HD2      ASN  31   8.080  -0.739  -2.129
  230   1HD2  ASN  31          1HD2      ASN  31   9.071   0.247  -1.116
  231    H    VAL  32           H        VAL  32   4.514  -3.141  -1.105
  232    HA   VAL  32           HA       VAL  32   3.866  -0.363  -0.348
  233    HB   VAL  32           HB       VAL  32   3.163   0.154  -2.549
  234   1HG1  VAL  32          1HG1      VAL  32   5.605   0.320  -2.080
  235   2HG1  VAL  32          2HG1      VAL  32   5.812  -1.293  -2.760
  236   3HG1  VAL  32          3HG1      VAL  32   5.280   0.027  -3.786
  237   1HG2  VAL  32          1HG2      VAL  32   3.395  -2.761  -3.033
  238   2HG2  VAL  32          2HG2      VAL  32   2.147  -1.622  -3.511
  239   3HG2  VAL  32          3HG2      VAL  32   3.670  -1.663  -4.387
  240    H    HIS  33           H        HIS  33   1.521   0.156  -0.814
  241    HA   HIS  33           HA       HIS  33  -0.167  -2.221  -0.420
  242   1HB   HIS  33          1HB       HIS  33  -1.053  -1.476   1.521
  243   2HB   HIS  33          2HB       HIS  33   0.424  -0.553   1.632
  244    HD1  HIS  33           HD1      HIS  33  -3.184  -0.200   1.589
  245    HD2  HIS  33           HD2      HIS  33   0.086   2.227   0.829
  246    HE1  HIS  33           HE1      HIS  33  -4.044   2.156   1.712
  247    HE2  HIS  33           HE2      HIS  33  -2.047   3.608   1.230
  248    H    ALA  34           H        ALA  34  -2.133  -2.247  -1.416
  249    HA   ALA  34           HA       ALA  34  -2.613  -0.052  -3.303
  250   1HB   ALA  34          1HB       ALA  34  -3.600  -2.885  -3.382
  251   2HB   ALA  34          2HB       ALA  34  -2.254  -2.238  -4.302
  252   3HB   ALA  34          3HB       ALA  34  -3.878  -1.654  -4.609
  253    H    ILE  35           H        ILE  35  -4.447   1.113  -3.265
  254    HA   ILE  35           HA       ILE  35  -6.384   0.533  -1.117
  255    HB   ILE  35           HB       ILE  35  -6.119   3.068  -2.715
  256   1HG1  ILE  35          1HG1      ILE  35  -4.979   2.443  -0.012
  257   2HG1  ILE  35          2HG1      ILE  35  -4.020   2.595  -1.472
  258   1HG2  ILE  35          1HG2      ILE  35  -8.294   2.690  -1.600
  259   2HG2  ILE  35          2HG2      ILE  35  -7.452   2.516  -0.060
  260   3HG2  ILE  35          3HG2      ILE  35  -7.430   4.053  -0.926
  261   1HD1  ILE  35          1HD1      ILE  35  -5.703   4.842  -0.378
  262   2HD1  ILE  35          2HD1      ILE  35  -4.029   4.562   0.055
  263   3HD1  ILE  35          3HD1      ILE  35  -4.449   4.901  -1.613
  264    H    VAL  36           H        VAL  36  -8.198  -0.460  -1.714
  265    HA   VAL  36           HA       VAL  36  -9.039  -0.482  -4.485
  266    HB   VAL  36           HB       VAL  36 -10.371  -1.718  -2.080
  267   1HG1  VAL  36          1HG1      VAL  36 -10.684  -2.254  -5.034
  268   2HG1  VAL  36          2HG1      VAL  36 -11.433  -3.182  -3.738
  269   3HG1  VAL  36          3HG1      VAL  36 -11.871  -1.499  -3.977
  270   1HG2  VAL  36          1HG2      VAL  36  -8.098  -2.549  -2.312
  271   2HG2  VAL  36          2HG2      VAL  36  -9.269  -3.786  -2.737
  272   3HG2  VAL  36          3HG2      VAL  36  -8.390  -2.930  -4.008
  273    H    LEU  37           H        LEU  37 -10.295   1.018  -5.331
  274    HA   LEU  37           HA       LEU  37 -12.510   2.143  -3.764
  275   1HB   LEU  37          1HB       LEU  37 -11.916   4.402  -4.664
  276   2HB   LEU  37          2HB       LEU  37 -10.897   3.787  -3.402
  277    HG   LEU  37           HG       LEU  37  -9.409   2.954  -5.451
  278   1HD1  LEU  37          1HD1      LEU  37 -11.394   4.561  -6.746
  279   2HD1  LEU  37          2HD1      LEU  37  -9.824   5.348  -6.893
  280   3HD1  LEU  37          3HD1      LEU  37 -10.034   3.683  -7.411
  281   1HD2  LEU  37          1HD2      LEU  37  -9.505   5.636  -4.128
  282   2HD2  LEU  37          2HD2      LEU  37  -8.408   4.279  -3.866
  283   3HD2  LEU  37          3HD2      LEU  37  -8.283   5.248  -5.331
  284    H    LYS  38           H        LYS  38 -14.151   3.127  -5.111
  285    HA   LYS  38           HA       LYS  38 -14.283   1.805  -7.698
  286   1HB   LYS  38          1HB       LYS  38 -16.194   2.701  -5.713
  287   2HB   LYS  38          2HB       LYS  38 -16.655   3.245  -7.308
  288   1HG   LYS  38          1HG       LYS  38 -17.375   1.268  -7.903
  289   2HG   LYS  38          2HG       LYS  38 -15.904   0.478  -7.434
  290   1HD   LYS  38          1HD       LYS  38 -16.852  -0.418  -5.665
  291   2HD   LYS  38          2HD       LYS  38 -17.297   1.166  -5.039
  292   1HE   LYS  38          1HE       LYS  38 -19.380   1.126  -6.103
  293   2HE   LYS  38          2HE       LYS  38 -18.895  -0.162  -7.171
  294   1HZ   LYS  38          1HZ       LYS  38 -19.295  -0.459  -4.262
  295   2HZ   LYS  38          2HZ       LYS  38 -20.382  -0.957  -5.460
  296   3HZ   LYS  38          3HZ       LYS  38 -18.867  -1.699  -5.338
  297    H    GLU  39           H        GLU  39 -15.131   2.867  -9.583
  298    HA   GLU  39           HA       GLU  39 -13.596   5.005 -10.409
  299   1HB   GLU  39          1HB       GLU  39 -15.743   3.436 -11.487
  300   2HB   GLU  39          2HB       GLU  39 -16.093   5.116 -11.841
  301   1HG   GLU  39          1HG       GLU  39 -13.308   4.410 -12.390
  302   2HG   GLU  39          2HG       GLU  39 -14.460   3.417 -13.264
  303    H    GLY  40           H        GLY  40 -13.535   7.041  -9.710
  304   1HA   GLY  40          1HA       GLY  40 -14.726   9.160  -9.703
  305   2HA   GLY  40          2HA       GLY  40 -16.092   8.355  -8.954
  306    H    SER  41           H        SER  41 -13.537   6.930  -7.509
  307    HA   SER  41           HA       SER  41 -13.911   8.288  -5.060
  308   1HB   SER  41          1HB       SER  41 -13.192   5.944  -5.184
  309   2HB   SER  41          2HB       SER  41 -11.672   6.457  -5.906
  310    HG   SER  41           HG       SER  41 -12.371   6.319  -3.294
  311    H    ALA  42           H        ALA  42 -11.746   8.946  -3.829
  312    HA   ALA  42           HA       ALA  42 -10.713  11.250  -5.313
  313   1HB   ALA  42          1HB       ALA  42  -9.857  11.985  -3.153
  314   2HB   ALA  42          2HB       ALA  42 -10.381  10.468  -2.413
  315   3HB   ALA  42          3HB       ALA  42 -11.573  11.596  -3.061
  316    H    MET  43           H        MET  43  -9.280  10.210  -6.762
  317    HA   MET  43           HA       MET  43  -6.956   8.911  -5.506
  318   1HB   MET  43          1HB       MET  43  -6.526   8.046  -7.835
  319   2HB   MET  43          2HB       MET  43  -7.868   7.346  -6.956
  320   1HG   MET  43          1HG       MET  43  -9.451   8.660  -8.197
  321   2HG   MET  43          2HG       MET  43  -8.155   9.499  -9.040
  322   1HE   MET  43          1HE       MET  43  -6.132   7.792  -9.989
  323   2HE   MET  43          2HE       MET  43  -6.433   6.243  -9.196
  324   3HE   MET  43          3HE       MET  43  -6.548   6.368 -10.949
  325    H    THR  44           H        THR  44  -5.487  10.437  -5.160
  326    HA   THR  44           HA       THR  44  -5.199  12.738  -6.800
  327    HB   THR  44           HB       THR  44  -3.307  13.292  -5.472
  328    HG1  THR  44           HG1      THR  44  -2.030  11.593  -5.294
  329   1HG2  THR  44          1HG2      THR  44  -5.506  13.308  -4.272
  330   2HG2  THR  44          2HG2      THR  44  -5.054  11.744  -3.585
  331   3HG2  THR  44          3HG2      THR  44  -4.076  13.165  -3.249
  332    H    LYS  45           H        LYS  45  -3.434  13.285  -8.158
  333    HA   LYS  45           HA       LYS  45  -2.662  11.102  -9.895
  334   1HB   LYS  45          1HB       LYS  45  -2.421  14.081  -9.929
  335   2HB   LYS  45          2HB       LYS  45  -1.390  13.147 -10.995
  336   1HG   LYS  45          1HG       LYS  45  -2.998  12.716 -12.422
  337   2HG   LYS  45          2HG       LYS  45  -4.138  12.237 -11.169
  338   1HD   LYS  45          1HD       LYS  45  -3.732  15.112 -11.095
  339   2HD   LYS  45          2HD       LYS  45  -4.106  14.594 -12.734
  340   1HE   LYS  45          1HE       LYS  45  -5.817  13.340 -10.694
  341   2HE   LYS  45          2HE       LYS  45  -5.918  15.094 -10.748
  342   1HZ   LYS  45          1HZ       LYS  45  -6.255  13.320 -13.106
  343   2HZ   LYS  45          2HZ       LYS  45  -7.518  14.024 -12.223
  344   3HZ   LYS  45          3HZ       LYS  45  -6.440  15.006 -13.075
  345    H    ASP  46           H        ASP  46  -1.191  12.915  -7.334
  346    HA   ASP  46           HA       ASP  46   1.465  12.828  -7.835
  347   1HB   ASP  46          1HB       ASP  46  -0.181  13.011  -5.495
  348   2HB   ASP  46          2HB       ASP  46   1.137  11.910  -5.126
  349    H    PHE  47           H        PHE  47   3.132  11.378  -7.789
  350    HA   PHE  47           HA       PHE  47   2.384   8.581  -8.083
  351   1HB   PHE  47          1HB       PHE  47   3.900   9.383  -9.709
  352   2HB   PHE  47          2HB       PHE  47   4.949  10.104  -8.496
  353    HD1  PHE  47           HD1      PHE  47   6.539   8.764  -7.267
  354    HD2  PHE  47           HD2      PHE  47   3.907   6.972 -10.097
  355    HE1  PHE  47           HE1      PHE  47   7.881   6.709  -7.215
  356    HE2  PHE  47           HE2      PHE  47   5.258   4.931 -10.056
  357    HZ   PHE  47           HZ       PHE  47   7.233   4.777  -8.596
  358    H    ARG  48           H        ARG  48   2.596   7.056  -6.581
  359    HA   ARG  48           HA       ARG  48   4.512   7.370  -4.382
  360   1HB   ARG  48          1HB       ARG  48   2.836   6.838  -2.695
  361   2HB   ARG  48          2HB       ARG  48   1.579   6.833  -3.922
  362   1HG   ARG  48          1HG       ARG  48   3.188   9.215  -3.035
  363   2HG   ARG  48          2HG       ARG  48   2.007   9.222  -4.345
  364   1HD   ARG  48          1HD       ARG  48   1.112  10.066  -2.186
  365   2HD   ARG  48          2HD       ARG  48   0.244   8.700  -2.862
  366    HE   ARG  48           HE       ARG  48   2.176   7.745  -1.057
  367   1HH1  ARG  48          1HH1      ARG  48  -0.855   9.516  -1.044
  368   2HH1  ARG  48          2HH1      ARG  48  -1.305   8.931   0.510
  369   1HH2  ARG  48          1HH2      ARG  48   1.558   6.992   0.988
  370   2HH2  ARG  48          2HH2      ARG  48   0.073   7.544   1.686
  371    H    CYS  49           H        CYS  49   5.662   5.568  -4.508
  372    HA   CYS  49           HA       CYS  49   4.900   3.218  -5.786
  373   1HB   CYS  49          1HB       CYS  49   6.856   2.186  -4.851
  374   2HB   CYS  49          2HB       CYS  49   6.931   3.396  -3.572
  375    H    ASP  50           H        ASP  50   4.691   4.146  -2.397
  376    HA   ASP  50           HA       ASP  50   3.821   1.563  -1.539
  377   1HB   ASP  50          1HB       ASP  50   5.054   2.964  -0.028
  378   2HB   ASP  50          2HB       ASP  50   3.466   2.601   0.636
  379    H    ARG  51           H        ARG  51   2.196   3.831  -3.338
  380    HA   ARG  51           HA       ARG  51  -0.365   2.920  -2.233
  381   1HB   ARG  51          1HB       ARG  51   0.192   5.332  -1.713
  382   2HB   ARG  51          2HB       ARG  51   0.064   5.640  -3.440
  383   1HG   ARG  51          1HG       ARG  51  -2.285   4.542  -3.213
  384   2HG   ARG  51          2HG       ARG  51  -2.061   4.852  -1.490
  385   1HD   ARG  51          1HD       ARG  51  -3.241   6.691  -2.390
  386   2HD   ARG  51          2HD       ARG  51  -1.603   7.226  -2.059
  387    HE   ARG  51           HE       ARG  51  -2.130   6.339  -4.788
  388   1HH1  ARG  51          1HH1      ARG  51  -1.982   9.053  -2.579
  389   2HH1  ARG  51          2HH1      ARG  51  -1.717  10.204  -3.820
  390   1HH2  ARG  51          1HH2      ARG  51  -1.850   7.906  -6.425
  391   2HH2  ARG  51          2HH2      ARG  51  -1.682   9.568  -6.025
  392    H    VAL  52           H        VAL  52  -1.071   1.496  -3.660
  393    HA   VAL  52           HA       VAL  52  -0.901   2.149  -6.540
  394    HB   VAL  52           HB       VAL  52  -1.526  -0.513  -5.262
  395   1HG1  VAL  52          1HG1      VAL  52  -1.730   0.480  -7.968
  396   2HG1  VAL  52          2HG1      VAL  52  -0.599  -0.867  -7.875
  397   3HG1  VAL  52          3HG1      VAL  52  -2.241  -1.054  -7.282
  398   1HG2  VAL  52          1HG2      VAL  52   1.064   0.596  -6.285
  399   2HG2  VAL  52          2HG2      VAL  52   0.716  -0.083  -4.704
  400   3HG2  VAL  52          3HG2      VAL  52   0.781  -1.122  -6.121
  401    H    TRP  53           H        TRP  53  -2.736   2.924  -7.420
  402    HA   TRP  53           HA       TRP  53  -5.187   2.874  -5.925
  403   1HB   TRP  53          1HB       TRP  53  -4.432   3.956  -8.631
  404   2HB   TRP  53          2HB       TRP  53  -6.104   3.965  -8.095
  405    HD1  TRP  53           HD1      TRP  53  -3.910   6.481  -8.627
  406    HE1  TRP  53           HE1      TRP  53  -3.948   8.353  -6.862
  407    HE3  TRP  53           HE3      TRP  53  -6.159   3.955  -4.828
  408    HZ2  TRP  53           HZ2      TRP  53  -4.768   8.680  -4.175
  409    HZ3  TRP  53           HZ3      TRP  53  -6.536   5.104  -2.701
  410    HH2  TRP  53           HH2      TRP  53  -5.863   7.420  -2.378
  411    H    VAL  54           H        VAL  54  -6.906   1.572  -6.127
  412    HA   VAL  54           HA       VAL  54  -6.914  -0.346  -8.390
  413    HB   VAL  54           HB       VAL  54  -7.552  -0.815  -5.485
  414   1HG1  VAL  54          1HG1      VAL  54  -8.201  -2.489  -7.882
  415   2HG1  VAL  54          2HG1      VAL  54  -8.065  -3.188  -6.273
  416   3HG1  VAL  54          3HG1      VAL  54  -9.294  -1.978  -6.607
  417   1HG2  VAL  54          1HG2      VAL  54  -5.172  -0.938  -6.256
  418   2HG2  VAL  54          2HG2      VAL  54  -5.811  -2.401  -5.515
  419   3HG2  VAL  54          3HG2      VAL  54  -5.653  -2.301  -7.260
  420    H    ILE  55           H        ILE  55  -8.297   0.985  -9.559
  421    HA   ILE  55           HA       ILE  55 -10.783   1.899  -8.462
  422    HB   ILE  55           HB       ILE  55  -9.979   1.872 -11.361
  423   1HG1  ILE  55          1HG1      ILE  55  -9.019   3.488  -9.092
  424   2HG1  ILE  55          2HG1      ILE  55  -9.659   4.464 -10.400
  425   1HG2  ILE  55          1HG2      ILE  55 -12.034   3.441  -9.818
  426   2HG2  ILE  55          2HG2      ILE  55 -11.542   3.787 -11.472
  427   3HG2  ILE  55          3HG2      ILE  55 -12.333   2.260 -11.097
  428   1HD1  ILE  55          1HD1      ILE  55  -7.613   2.326 -10.851
  429   2HD1  ILE  55          2HD1      ILE  55  -8.097   3.638 -11.925
  430   3HD1  ILE  55          3HD1      ILE  55  -7.210   3.985 -10.443
  431    H    VAL  56           H        VAL  56 -12.608   0.806  -8.355
  432    HA   VAL  56           HA       VAL  56 -13.004  -1.495 -10.128
  433    HB   VAL  56           HB       VAL  56 -14.375  -2.468  -8.266
  434   1HG1  VAL  56          1HG1      VAL  56 -11.470  -2.254  -8.408
  435   2HG1  VAL  56          2HG1      VAL  56 -12.040  -2.649  -6.795
  436   3HG1  VAL  56          3HG1      VAL  56 -12.492  -3.660  -8.151
  437   1HG2  VAL  56          1HG2      VAL  56 -14.147   0.009  -7.124
  438   2HG2  VAL  56          2HG2      VAL  56 -14.696  -1.424  -6.320
  439   3HG2  VAL  56          3HG2      VAL  56 -13.019  -0.923  -6.186
  440    H    ASN  57           H        ASN  57 -15.282  -2.076 -10.490
  441    HA   ASN  57           HA       ASN  57 -16.833   0.368 -10.968
  442   1HB   ASN  57          1HB       ASN  57 -16.486  -1.238 -12.802
  443   2HB   ASN  57          2HB       ASN  57 -18.180  -0.992 -12.452
  444   2HD2  ASN  57          2HD2      ASN  57 -17.677  -3.139 -13.870
  445   1HD2  ASN  57          1HD2      ASN  57 -17.746  -4.573 -12.912
  446    H    ASP  58           H        ASP  58 -19.393  -0.468 -10.979
  447    HA   ASP  58           HA       ASP  58 -20.210  -0.221  -8.369
  448   1HB   ASP  58          1HB       ASP  58 -21.535   0.091 -10.529
  449   2HB   ASP  58          2HB       ASP  58 -21.874  -1.636 -10.439
  450    H    HIS  59           H        HIS  59 -19.183  -3.090 -10.033
  451    HA   HIS  59           HA       HIS  59 -20.293  -4.821  -7.950
  452   1HB   HIS  59          1HB       HIS  59 -19.660  -5.120 -10.787
  453   2HB   HIS  59          2HB       HIS  59 -18.992  -6.428  -9.833
  454    HD1  HIS  59           HD1      HIS  59 -20.522  -8.264  -9.215
  455    HD2  HIS  59           HD2      HIS  59 -22.549  -4.831 -10.390
  456    HE1  HIS  59           HE1      HIS  59 -22.952  -8.911  -9.293
  457    HE2  HIS  59           HE2      HIS  59 -24.165  -6.801  -9.943
  458    H    GLY  60           H        GLY  60 -17.847  -3.000  -7.648
  459   1HA   GLY  60          1HA       GLY  60 -15.827  -3.132  -6.620
  460   2HA   GLY  60          2HA       GLY  60 -16.352  -4.689  -6.012
  461    H    VAL  61           H        VAL  61 -16.152  -4.157  -9.455
  462    HA   VAL  61           HA       VAL  61 -13.986  -6.124  -9.607
  463    HB   VAL  61           HB       VAL  61 -15.632  -4.940 -11.855
  464   1HG1  VAL  61          1HG1      VAL  61 -13.767  -7.307 -11.687
  465   2HG1  VAL  61          2HG1      VAL  61 -14.868  -7.006 -13.045
  466   3HG1  VAL  61          3HG1      VAL  61 -13.588  -5.843 -12.672
  467   1HG2  VAL  61          1HG2      VAL  61 -17.040  -6.120 -10.220
  468   2HG2  VAL  61          2HG2      VAL  61 -16.994  -6.931 -11.780
  469   3HG2  VAL  61          3HG2      VAL  61 -16.048  -7.564 -10.421
  470    H    VAL  62           H        VAL  62 -11.975  -5.631 -10.433
  471    HA   VAL  62           HA       VAL  62 -11.254  -2.856 -10.481
  472    HB   VAL  62           HB       VAL  62  -9.544  -5.233 -11.228
  473   1HG1  VAL  62          1HG1      VAL  62  -8.902  -2.344 -10.618
  474   2HG1  VAL  62          2HG1      VAL  62  -7.700  -3.638 -10.545
  475   3HG1  VAL  62          3HG1      VAL  62  -8.520  -3.286 -12.061
  476   1HG2  VAL  62          1HG2      VAL  62 -10.669  -4.780  -8.755
  477   2HG2  VAL  62          2HG2      VAL  62  -9.171  -5.646  -9.074
  478   3HG2  VAL  62          3HG2      VAL  62  -9.131  -3.960  -8.638
  479    H    THR  63           H        THR  63 -11.667  -1.587 -12.162
  480    HA   THR  63           HA       THR  63 -11.801  -2.720 -14.865
  481    HB   THR  63           HB       THR  63 -12.826  -0.658 -15.509
  482    HG1  THR  63           HG1      THR  63 -12.736   1.132 -14.328
  483   1HG2  THR  63          1HG2      THR  63 -13.897  -1.530 -12.833
  484   2HG2  THR  63          2HG2      THR  63 -14.734  -0.468 -13.964
  485   3HG2  THR  63          3HG2      THR  63 -14.375  -2.137 -14.425
  486    H    SER  64           H        SER  64  -9.887  -0.475 -12.925
  487    HA   SER  64           HA       SER  64  -8.233   0.152 -15.275
  488   1HB   SER  64          1HB       SER  64  -9.173   1.814 -13.371
  489   2HB   SER  64          2HB       SER  64  -7.620   1.389 -12.663
  490    HG   SER  64           HG       SER  64  -7.712   3.241 -14.172
  491    H    VAL  65           H        VAL  65  -6.002  -0.046 -15.229
  492    HA   VAL  65           HA       VAL  65  -5.018  -2.463 -14.145
  493    HB   VAL  65           HB       VAL  65  -3.345  -0.208 -15.225
  494   1HG1  VAL  65          1HG1      VAL  65  -2.823  -2.979 -14.421
  495   2HG1  VAL  65          2HG1      VAL  65  -2.229  -2.576 -16.035
  496   3HG1  VAL  65          3HG1      VAL  65  -1.728  -1.620 -14.647
  497   1HG2  VAL  65          1HG2      VAL  65  -5.145  -0.708 -16.812
  498   2HG2  VAL  65          2HG2      VAL  65  -3.580  -1.214 -17.411
  499   3HG2  VAL  65          3HG2      VAL  65  -4.690  -2.399 -16.771
  500   1HB   PRO  66          1HB       PRO  66  -3.276  -2.847  -8.914
  501   2HB   PRO  66          2HB       PRO  66  -4.943  -2.287  -8.998
  502   1HG   PRO  66          1HG       PRO  66  -3.561  -4.276 -10.715
  503   2HG   PRO  66          2HG       PRO  66  -5.195  -4.320 -10.035
  504   1HD   PRO  66          1HD       PRO  66  -4.719  -3.674 -12.602
  505   2HD   PRO  66          2HD       PRO  66  -6.031  -2.947 -11.671
  506    H    HIS  67           H        HIS  67  -2.349   0.686 -10.673
  507    HA   HIS  67           HA       HIS  67   0.262  -0.668 -10.585
  508   1HB   HIS  67          1HB       HIS  67   1.107   0.838 -12.303
  509   2HB   HIS  67          2HB       HIS  67  -0.285  -0.043 -12.916
  510    HD1  HIS  67           HD1      HIS  67   0.426   2.480 -14.353
  511    HD2  HIS  67           HD2      HIS  67  -2.137   2.445 -11.087
  512    HE1  HIS  67           HE1      HIS  67  -0.943   4.582 -14.531
  513    HE2  HIS  67           HE2      HIS  67  -2.535   4.488 -12.581
  514    H    ILE  68           H        ILE  68   1.953   0.479  -9.693
  515    HA   ILE  68           HA       ILE  68   1.497   1.937  -7.445
  516    HB   ILE  68           HB       ILE  68   3.819   1.369  -9.143
  517   1HG1  ILE  68          1HG1      ILE  68   3.508   1.702  -6.170
  518   2HG1  ILE  68          2HG1      ILE  68   3.245   0.208  -7.039
  519   1HG2  ILE  68          1HG2      ILE  68   3.820   3.943  -7.576
  520   2HG2  ILE  68          2HG2      ILE  68   5.287   3.095  -8.051
  521   3HG2  ILE  68          3HG2      ILE  68   4.189   3.649  -9.272
  522   1HD1  ILE  68          1HD1      ILE  68   5.883   1.659  -6.874
  523   2HD1  ILE  68          2HD1      ILE  68   5.402   0.240  -5.963
  524   3HD1  ILE  68          3HD1      ILE  68   5.554   0.146  -7.707
  525    H    THR  69           H        THR  69   0.439   3.761  -7.168
  526    HA   THR  69           HA       THR  69   1.222   6.161  -8.566
  527    HB   THR  69           HB       THR  69  -1.461   4.878  -9.095
  528    HG1  THR  69           HG1      THR  69   0.498   5.996 -10.839
  529   1HG2  THR  69          1HG2      THR  69  -0.690   7.730  -9.633
  530   2HG2  THR  69          2HG2      THR  69  -2.135   6.930 -10.243
  531   3HG2  THR  69          3HG2      THR  69  -1.932   7.204  -8.522

  No H/Q in entry =         531
  Start of MODEL    6
    1    H    SER   1           H        SER   1  17.894   8.094  -7.247
    2    HA   SER   1           HA       SER   1  16.107   9.463  -7.816
    3   1HB   SER   1          1HB       SER   1  15.127   9.772 -10.072
    4   2HB   SER   1          2HB       SER   1  16.219   8.564 -10.729
    5    HG   SER   1           HG       SER   1  17.971   9.870  -9.912
    6    H    ARG   2           H        ARG   2  15.043   6.403  -9.575
    7    HA   ARG   2           HA       ARG   2  12.653   6.376  -7.863
    8   1HB   ARG   2          1HB       ARG   2  12.818   7.442 -10.638
    9   2HB   ARG   2          2HB       ARG   2  11.440   6.414 -10.294
   10   1HG   ARG   2          1HG       ARG   2  10.389   7.969  -9.154
   11   2HG   ARG   2          2HG       ARG   2  11.809   8.382  -8.194
   12   1HD   ARG   2          1HD       ARG   2  12.653   9.710 -10.067
   13   2HD   ARG   2          2HD       ARG   2  11.199   9.347 -10.986
   14    HE   ARG   2           HE       ARG   2   9.970  10.454  -9.064
   15   1HH1  ARG   2          1HH1      ARG   2  13.213  11.432 -10.055
   16   2HH1  ARG   2          2HH1      ARG   2  13.015  13.032  -9.464
   17   1HH2  ARG   2          1HH2      ARG   2   9.758  12.586  -8.300
   18   2HH2  ARG   2          2HH2      ARG   2  11.076  13.698  -8.477
   19    H    ARG   3           H        ARG   3  13.744   4.298  -7.415
   20    HA   ARG   3           HA       ARG   3  12.727   2.248  -9.282
   21   1HB   ARG   3          1HB       ARG   3  14.714   0.980  -9.212
   22   2HB   ARG   3          2HB       ARG   3  15.429   1.976  -7.956
   23   1HG   ARG   3          1HG       ARG   3  14.798   3.481 -10.403
   24   2HG   ARG   3          2HG       ARG   3  15.891   2.144 -10.658
   25   1HD   ARG   3          1HD       ARG   3  16.666   4.583  -9.851
   26   2HD   ARG   3          2HD       ARG   3  16.452   3.830  -8.291
   27    HE   ARG   3           HE       ARG   3  18.100   2.228  -8.813
   28   1HH1  ARG   3          1HH1      ARG   3  17.789   4.703 -11.304
   29   2HH1  ARG   3          2HH1      ARG   3  19.337   4.370 -11.968
   30   1HH2  ARG   3          1HH2      ARG   3  20.144   1.815  -9.736
   31   2HH2  ARG   3          2HH2      ARG   3  20.674   2.741 -11.100
   32    H    CYS   4           H        CYS   4  11.023   2.102  -7.738
   33    HA   CYS   4           HA       CYS   4  11.673   1.232  -5.061
   34   1HB   CYS   4          1HB       CYS   4   9.192   1.114  -4.752
   35   2HB   CYS   4          2HB       CYS   4   9.813   2.687  -5.236
   36   1HB   PRO   5          1HB       PRO   5  12.027  -4.045  -3.859
   37   2HB   PRO   5          2HB       PRO   5  10.470  -3.511  -3.221
   38   1HG   PRO   5          1HG       PRO   5  11.822  -2.079  -2.040
   39   2HG   PRO   5          2HG       PRO   5  13.085  -2.089  -3.284
   40   1HD   PRO   5          1HD       PRO   5  10.561  -0.497  -3.170
   41   2HD   PRO   5          2HD       PRO   5  12.173  -0.038  -3.727
   42    H    GLY   6           H        GLY   6  10.143  -5.103  -5.384
   43   1HA   GLY   6          1HA       GLY   6   8.188  -6.135  -5.907
   44   2HA   GLY   6          2HA       GLY   6   7.401  -4.785  -5.157
   45    H    LYS   7           H        LYS   7   6.125  -5.997  -7.167
   46    HA   LYS   7           HA       LYS   7   6.693  -5.003  -9.761
   47   1HB   LYS   7          1HB       LYS   7   5.332  -6.996  -9.305
   48   2HB   LYS   7          2HB       LYS   7   4.085  -5.996  -8.632
   49   1HG   LYS   7          1HG       LYS   7   3.674  -4.956 -10.735
   50   2HG   LYS   7          2HG       LYS   7   5.055  -5.771 -11.466
   51   1HD   LYS   7          1HD       LYS   7   3.025  -7.517 -10.204
   52   2HD   LYS   7          2HD       LYS   7   2.477  -6.646 -11.613
   53   1HE   LYS   7          1HE       LYS   7   5.070  -8.155 -11.641
   54   2HE   LYS   7          2HE       LYS   7   3.530  -8.974 -11.890
   55   1HZ   LYS   7          1HZ       LYS   7   3.077  -7.491 -13.753
   56   2HZ   LYS   7          2HZ       LYS   7   4.565  -6.717 -13.519
   57   3HZ   LYS   7          3HZ       LYS   7   4.517  -8.345 -13.983
   58    H    ASN   8           H        ASN   8   5.612  -3.349 -10.958
   59    HA   ASN   8           HA       ASN   8   4.571  -1.171  -9.240
   60   1HB   ASN   8          1HB       ASN   8   6.388  -1.244 -11.594
   61   2HB   ASN   8          2HB       ASN   8   5.275   0.116 -11.502
   62   2HD2  ASN   8          2HD2      ASN   8   7.658  -1.678  -9.583
   63   1HD2  ASN   8          1HD2      ASN   8   8.228  -0.303  -8.739
   64    H    ALA   9           H        ALA   9   3.648  -3.315 -11.744
   65    HA   ALA   9           HA       ALA   9   1.091  -1.938 -11.938
   66   1HB   ALA   9          1HB       ALA   9   2.734  -2.603 -14.375
   67   2HB   ALA   9          2HB       ALA   9   1.076  -1.997 -14.374
   68   3HB   ALA   9          3HB       ALA   9   2.387  -0.984 -13.770
   69    H    TRP  10           H        TRP  10  -0.537  -3.360 -11.922
   70    HA   TRP  10           HA       TRP  10   0.111  -6.202 -12.460
   71   1HB   TRP  10          1HB       TRP  10  -1.774  -4.963 -10.464
   72   2HB   TRP  10          2HB       TRP  10  -1.764  -6.670 -10.868
   73    HD1  TRP  10           HD1      TRP  10   0.125  -8.176  -9.809
   74    HE1  TRP  10           HE1      TRP  10   1.931  -7.740  -8.028
   75    HE3  TRP  10           HE3      TRP  10  -0.191  -3.106  -9.536
   76    HZ2  TRP  10           HZ2      TRP  10   3.066  -5.527  -6.689
   77    HZ3  TRP  10           HZ3      TRP  10   1.269  -1.887  -8.002
   78    HH2  TRP  10           HH2      TRP  10   2.869  -3.076  -6.589
   79   1HB   PRO  11          1HB       PRO  11  -1.898  -6.176 -17.599
   80   2HB   PRO  11          2HB       PRO  11  -1.557  -4.466 -17.334
   81   1HG   PRO  11          1HG       PRO  11   0.579  -5.293 -17.084
   82   2HG   PRO  11          2HG       PRO  11   0.006  -6.857 -16.477
   83   1HD   PRO  11          1HD       PRO  11   0.671  -5.911 -14.494
   84   2HD   PRO  11          2HD       PRO  11   0.311  -4.256 -15.029
   85    H    GLU  12           H        GLU  12  -1.699  -7.768 -14.857
   86    HA   GLU  12           HA       GLU  12  -3.809  -9.293 -15.942
   87   1HB   GLU  12          1HB       GLU  12  -1.652 -10.263 -15.388
   88   2HB   GLU  12          2HB       GLU  12  -2.954 -11.119 -14.575
   89   1HG   GLU  12          1HG       GLU  12  -2.237  -9.230 -12.695
   90   2HG   GLU  12          2HG       GLU  12  -1.752 -10.920 -12.738
   91    H    LEU  13           H        LEU  13  -3.842  -7.199 -13.264
   92    HA   LEU  13           HA       LEU  13  -5.792  -8.670 -11.744
   93   1HB   LEU  13          1HB       LEU  13  -4.572  -5.941 -11.519
   94   2HB   LEU  13          2HB       LEU  13  -5.957  -6.373 -10.545
   95    HG   LEU  13           HG       LEU  13  -3.244  -7.685 -10.481
   96   1HD1  LEU  13          1HD1      LEU  13  -4.731  -5.937  -8.553
   97   2HD1  LEU  13          2HD1      LEU  13  -3.307  -6.847  -8.111
   98   3HD1  LEU  13          3HD1      LEU  13  -3.229  -5.600  -9.322
   99   1HD2  LEU  13          1HD2      LEU  13  -5.857  -8.448  -9.239
  100   2HD2  LEU  13          2HD2      LEU  13  -4.691  -9.447 -10.100
  101   3HD2  LEU  13          3HD2      LEU  13  -4.330  -8.873  -8.487
  102    H    VAL  14           H        VAL  14  -5.788  -6.423 -14.346
  103    HA   VAL  14           HA       VAL  14  -8.239  -5.156 -14.039
  104    HB   VAL  14           HB       VAL  14  -7.046  -6.106 -16.655
  105   1HG1  VAL  14          1HG1      VAL  14  -9.049  -3.943 -15.999
  106   2HG1  VAL  14          2HG1      VAL  14  -8.238  -4.099 -17.557
  107   3HG1  VAL  14          3HG1      VAL  14  -9.302  -5.378 -16.993
  108   1HG2  VAL  14          1HG2      VAL  14  -5.464  -4.760 -15.215
  109   2HG2  VAL  14          2HG2      VAL  14  -5.868  -4.055 -16.763
  110   3HG2  VAL  14          3HG2      VAL  14  -6.627  -3.449 -15.300
  111    H    GLY  15           H        GLY  15 -10.241  -5.997 -13.822
  112   1HA   GLY  15          1HA       GLY  15 -12.061  -7.201 -14.786
  113   2HA   GLY  15          2HA       GLY  15 -10.947  -8.414 -15.388
  114    H    LYS  16           H        LYS  16  -9.768  -7.869 -12.418
  115    HA   LYS  16           HA       LYS  16 -11.315 -10.085 -11.267
  116   1HB   LYS  16          1HB       LYS  16  -8.547  -9.130 -11.076
  117   2HB   LYS  16          2HB       LYS  16  -9.213  -9.553  -9.524
  118   1HG   LYS  16          1HG       LYS  16  -9.309 -11.369 -11.922
  119   2HG   LYS  16          2HG       LYS  16  -7.984 -11.350 -10.756
  120   1HD   LYS  16          1HD       LYS  16  -9.261 -12.199  -9.046
  121   2HD   LYS  16          2HD       LYS  16 -10.783 -11.632  -9.736
  122   1HE   LYS  16          1HE       LYS  16 -11.110 -13.525 -10.837
  123   2HE   LYS  16          2HE       LYS  16  -9.475 -13.546 -11.493
  124   1HZ   LYS  16          1HZ       LYS  16 -10.258 -14.478  -8.780
  125   2HZ   LYS  16          2HZ       LYS  16  -9.913 -15.468 -10.110
  126   3HZ   LYS  16          3HZ       LYS  16  -8.694 -14.516  -9.428
  127    H    SER  17           H        SER  17 -11.118  -9.802  -8.636
  128    HA   SER  17           HA       SER  17 -12.907  -7.580  -8.112
  129   1HB   SER  17          1HB       SER  17 -13.381  -8.614  -6.067
  130   2HB   SER  17          2HB       SER  17 -13.097  -9.973  -7.156
  131    HG   SER  17           HG       SER  17 -11.898 -10.393  -5.360
  132    H    GLY  18           H        GLY  18 -12.502  -5.819  -6.790
  133   1HA   GLY  18          1HA       GLY  18  -9.959  -4.722  -6.712
  134   2HA   GLY  18          2HA       GLY  18 -11.277  -4.257  -5.648
  135    H    ASN  19           H        ASN  19 -11.505  -6.912  -4.429
  136    HA   ASN  19           HA       ASN  19  -9.624  -6.549  -2.333
  137   1HB   ASN  19          1HB       ASN  19 -12.025  -7.875  -2.574
  138   2HB   ASN  19          2HB       ASN  19 -10.896  -9.223  -2.540
  139   2HD2  ASN  19          2HD2      ASN  19 -12.018  -6.371  -0.809
  140   1HD2  ASN  19          1HD2      ASN  19 -11.489  -6.905   0.747
  141    H    MET  20           H        MET  20  -9.924  -8.967  -4.928
  142    HA   MET  20           HA       MET  20  -7.607 -10.430  -4.218
  143   1HB   MET  20          1HB       MET  20  -9.552 -11.009  -5.880
  144   2HB   MET  20          2HB       MET  20  -8.567 -10.176  -7.066
  145   1HG   MET  20          1HG       MET  20  -7.753 -12.226  -7.407
  146   2HG   MET  20          2HG       MET  20  -6.678 -11.790  -6.084
  147   1HE   MET  20          1HE       MET  20  -6.968 -12.635  -3.621
  148   2HE   MET  20          2HE       MET  20  -7.309 -14.361  -3.502
  149   3HE   MET  20          3HE       MET  20  -6.107 -13.776  -4.652
  150    H    ALA  21           H        ALA  21  -8.176  -7.570  -6.166
  151    HA   ALA  21           HA       ALA  21  -5.667  -7.405  -7.390
  152   1HB   ALA  21          1HB       ALA  21  -7.843  -5.454  -6.810
  153   2HB   ALA  21          2HB       ALA  21  -7.237  -6.049  -8.352
  154   3HB   ALA  21          3HB       ALA  21  -6.301  -4.867  -7.446
  155    H    ALA  22           H        ALA  22  -6.900  -5.565  -4.606
  156    HA   ALA  22           HA       ALA  22  -4.507  -4.402  -3.858
  157   1HB   ALA  22          1HB       ALA  22  -5.512  -4.191  -1.583
  158   2HB   ALA  22          2HB       ALA  22  -6.562  -3.662  -2.893
  159   3HB   ALA  22          3HB       ALA  22  -6.829  -5.230  -2.135
  160    H    ALA  23           H        ALA  23  -5.821  -7.561  -3.002
  161    HA   ALA  23           HA       ALA  23  -3.881  -8.270  -1.088
  162   1HB   ALA  23          1HB       ALA  23  -5.992  -9.475  -1.381
  163   2HB   ALA  23          2HB       ALA  23  -4.607 -10.564  -1.457
  164   3HB   ALA  23          3HB       ALA  23  -5.435 -10.080  -2.940
  165    H    THR  24           H        THR  24  -4.027  -8.768  -4.603
  166    HA   THR  24           HA       THR  24  -1.661 -10.268  -4.848
  167    HB   THR  24           HB       THR  24  -2.945  -8.393  -6.839
  168    HG1  THR  24           HG1      THR  24  -4.435  -9.900  -6.562
  169   1HG2  THR  24          1HG2      THR  24  -1.008 -10.649  -7.288
  170   2HG2  THR  24          2HG2      THR  24  -1.905  -9.808  -8.549
  171   3HG2  THR  24          3HG2      THR  24  -0.714  -8.938  -7.590
  172    H    VAL  25           H        VAL  25  -2.240  -6.775  -4.938
  173    HA   VAL  25           HA       VAL  25   0.388  -6.007  -5.637
  174    HB   VAL  25           HB       VAL  25  -1.603  -4.432  -3.988
  175   1HG1  VAL  25          1HG1      VAL  25   1.076  -3.833  -4.789
  176   2HG1  VAL  25          2HG1      VAL  25  -0.029  -2.808  -5.685
  177   3HG1  VAL  25          3HG1      VAL  25  -0.086  -2.826  -3.934
  178   1HG2  VAL  25          1HG2      VAL  25  -1.243  -4.553  -6.979
  179   2HG2  VAL  25          2HG2      VAL  25  -2.619  -5.132  -6.073
  180   3HG2  VAL  25          3HG2      VAL  25  -2.284  -3.418  -6.127
  181    H    GLU  26           H        GLU  26  -1.206  -6.289  -2.474
  182    HA   GLU  26           HA       GLU  26   1.106  -5.526  -0.981
  183   1HB   GLU  26          1HB       GLU  26  -0.124  -6.082   0.948
  184   2HB   GLU  26          2HB       GLU  26  -1.156  -7.208   0.083
  185   1HG   GLU  26          1HG       GLU  26  -1.572  -4.746  -1.205
  186   2HG   GLU  26          2HG       GLU  26  -2.656  -5.623  -0.131
  187    H    ARG  27           H        ARG  27  -0.095  -8.606  -2.190
  188    HA   ARG  27           HA       ARG  27   1.707 -10.168  -0.570
  189   1HB   ARG  27          1HB       ARG  27  -0.390 -10.704  -2.570
  190   2HB   ARG  27          2HB       ARG  27   0.945 -11.824  -2.639
  191   1HG   ARG  27          1HG       ARG  27   0.578 -12.665  -0.571
  192   2HG   ARG  27          2HG       ARG  27  -0.237 -11.231   0.026
  193   1HD   ARG  27          1HD       ARG  27  -1.858 -12.987  -0.235
  194   2HD   ARG  27          2HD       ARG  27  -2.163 -11.725  -1.426
  195    HE   ARG  27           HE       ARG  27  -1.865 -13.287  -3.043
  196   1HH1  ARG  27          1HH1      ARG  27  -0.156 -14.399  -0.170
  197   2HH1  ARG  27          2HH1      ARG  27   0.365 -15.851  -0.918
  198   1HH2  ARG  27          1HH2      ARG  27  -1.201 -15.264  -3.979
  199   2HH2  ARG  27          2HH2      ARG  27  -0.241 -16.370  -3.053
  200    H    GLU  28           H        GLU  28   1.590  -9.307  -4.037
  201    HA   GLU  28           HA       GLU  28   4.122 -10.531  -4.587
  202   1HB   GLU  28          1HB       GLU  28   2.246  -8.758  -6.111
  203   2HB   GLU  28          2HB       GLU  28   3.892  -8.919  -6.686
  204   1HG   GLU  28          1HG       GLU  28   3.602 -11.370  -6.742
  205   2HG   GLU  28          2HG       GLU  28   1.913 -11.146  -6.289
  206    H    ASN  29           H        ASN  29   3.054  -7.262  -3.773
  207    HA   ASN  29           HA       ASN  29   5.898  -6.463  -3.573
  208   1HB   ASN  29          1HB       ASN  29   4.681  -5.278  -5.357
  209   2HB   ASN  29          2HB       ASN  29   3.517  -4.691  -4.178
  210   2HD2  ASN  29          2HD2      ASN  29   5.394  -3.238  -5.933
  211   1HD2  ASN  29          1HD2      ASN  29   6.337  -2.264  -4.865
  212    H    ARG  30           H        ARG  30   5.799  -7.384  -1.417
  213    HA   ARG  30           HA       ARG  30   4.063  -6.387   0.585
  214   1HB   ARG  30          1HB       ARG  30   5.513  -8.495   0.624
  215   2HB   ARG  30          2HB       ARG  30   6.849  -7.450   1.058
  216   1HG   ARG  30          1HG       ARG  30   4.929  -6.689   2.880
  217   2HG   ARG  30          2HG       ARG  30   6.262  -7.801   3.164
  218   1HD   ARG  30          1HD       ARG  30   3.933  -9.081   1.921
  219   2HD   ARG  30          2HD       ARG  30   4.942  -9.577   3.260
  220    HE   ARG  30           HE       ARG  30   3.635  -8.320   4.755
  221   1HH1  ARG  30          1HH1      ARG  30   2.308  -8.338   1.485
  222   2HH1  ARG  30          2HH1      ARG  30   0.744  -7.870   2.017
  223   1HH2  ARG  30          1HH2      ARG  30   1.539  -7.688   5.402
  224   2HH2  ARG  30          2HH2      ARG  30   0.297  -7.495   4.211
  225    H    ASN  31           H        ASN  31   6.308  -4.632  -1.117
  226    HA   ASN  31           HA       ASN  31   7.234  -3.052   1.148
  227   1HB   ASN  31          1HB       ASN  31   8.832  -3.682  -0.598
  228   2HB   ASN  31          2HB       ASN  31   7.864  -2.846  -1.802
  229   2HD2  ASN  31          2HD2      ASN  31   8.558  -0.874  -2.291
  230   1HD2  ASN  31          1HD2      ASN  31   9.447   0.161  -1.234
  231    H    VAL  32           H        VAL  32   4.601  -3.111  -0.986
  232    HA   VAL  32           HA       VAL  32   3.974  -0.318  -0.305
  233    HB   VAL  32           HB       VAL  32   3.329   0.233  -2.511
  234   1HG1  VAL  32          1HG1      VAL  32   5.776   0.326  -2.048
  235   2HG1  VAL  32          2HG1      VAL  32   5.932  -1.284  -2.724
  236   3HG1  VAL  32          3HG1      VAL  32   5.425   0.030  -3.744
  237   1HG2  VAL  32          1HG2      VAL  32   3.442  -2.690  -2.999
  238   2HG2  VAL  32          2HG2      VAL  32   2.266  -1.493  -3.503
  239   3HG2  VAL  32          3HG2      VAL  32   3.800  -1.611  -4.348
  240    H    HIS  33           H        HIS  33   1.618   0.178  -0.784
  241    HA   HIS  33           HA       HIS  33  -0.027  -2.239  -0.386
  242   1HB   HIS  33          1HB       HIS  33  -1.162  -1.346   1.424
  243   2HB   HIS  33          2HB       HIS  33   0.472  -0.804   1.719
  244    HD1  HIS  33           HD1      HIS  33  -2.844   0.393   1.837
  245    HD2  HIS  33           HD2      HIS  33   0.774   2.009   0.649
  246    HE1  HIS  33           HE1      HIS  33  -3.158   2.882   1.910
  247    HE2  HIS  33           HE2      HIS  33  -1.001   3.839   1.027
  248    H    ALA  34           H        ALA  34  -2.044  -2.292  -1.259
  249    HA   ALA  34           HA       ALA  34  -2.629  -0.170  -3.212
  250   1HB   ALA  34          1HB       ALA  34  -4.006  -2.002  -4.307
  251   2HB   ALA  34          2HB       ALA  34  -2.269  -2.170  -4.370
  252   3HB   ALA  34          3HB       ALA  34  -3.190  -3.105  -3.215
  253    H    ILE  35           H        ILE  35  -4.479   0.955  -3.038
  254    HA   ILE  35           HA       ILE  35  -6.361   0.173  -0.902
  255    HB   ILE  35           HB       ILE  35  -6.185   2.830  -2.303
  256   1HG1  ILE  35          1HG1      ILE  35  -4.887   1.946   0.286
  257   2HG1  ILE  35          2HG1      ILE  35  -4.047   2.384  -1.200
  258   1HG2  ILE  35          1HG2      ILE  35  -8.313   2.169  -1.084
  259   2HG2  ILE  35          2HG2      ILE  35  -7.355   2.180   0.393
  260   3HG2  ILE  35          3HG2      ILE  35  -7.552   3.651  -0.552
  261   1HD1  ILE  35          1HD1      ILE  35  -5.824   4.468  -0.072
  262   2HD1  ILE  35          2HD1      ILE  35  -4.399   4.048   0.838
  263   3HD1  ILE  35          3HD1      ILE  35  -4.241   4.573  -0.823
  264    H    VAL  36           H        VAL  36  -8.339  -0.541  -1.415
  265    HA   VAL  36           HA       VAL  36  -9.129  -0.681  -4.193
  266    HB   VAL  36           HB       VAL  36 -10.591  -1.650  -1.751
  267   1HG1  VAL  36          1HG1      VAL  36 -10.927  -2.273  -4.687
  268   2HG1  VAL  36          2HG1      VAL  36 -11.722  -3.144  -3.378
  269   3HG1  VAL  36          3HG1      VAL  36 -12.075  -1.443  -3.639
  270   1HG2  VAL  36          1HG2      VAL  36  -8.644  -3.066  -3.567
  271   2HG2  VAL  36          2HG2      VAL  36  -8.430  -2.706  -1.855
  272   3HG2  VAL  36          3HG2      VAL  36  -9.657  -3.862  -2.365
  273    H    LEU  37           H        LEU  37 -10.288   0.787  -5.195
  274    HA   LEU  37           HA       LEU  37 -12.417   2.211  -3.778
  275   1HB   LEU  37          1HB       LEU  37 -11.493   4.323  -5.037
  276   2HB   LEU  37          2HB       LEU  37 -10.952   3.877  -3.446
  277    HG   LEU  37           HG       LEU  37  -9.133   2.554  -5.117
  278   1HD1  LEU  37          1HD1      LEU  37  -9.756   5.259  -6.269
  279   2HD1  LEU  37          2HD1      LEU  37  -8.324   4.294  -6.635
  280   3HD1  LEU  37          3HD1      LEU  37  -9.925   3.699  -7.067
  281   1HD2  LEU  37          1HD2      LEU  37  -9.145   4.687  -3.172
  282   2HD2  LEU  37          2HD2      LEU  37  -7.937   3.464  -3.525
  283   3HD2  LEU  37          3HD2      LEU  37  -7.973   4.961  -4.434
  284    H    LYS  38           H        LYS  38 -13.944   3.229  -5.215
  285    HA   LYS  38           HA       LYS  38 -14.132   1.773  -7.730
  286   1HB   LYS  38          1HB       LYS  38 -16.010   3.175  -5.940
  287   2HB   LYS  38          2HB       LYS  38 -16.402   3.263  -7.646
  288   1HG   LYS  38          1HG       LYS  38 -16.897   1.071  -7.829
  289   2HG   LYS  38          2HG       LYS  38 -15.723   0.595  -6.620
  290   1HD   LYS  38          1HD       LYS  38 -17.519   0.211  -5.363
  291   2HD   LYS  38          2HD       LYS  38 -17.379   1.928  -5.002
  292   1HE   LYS  38          1HE       LYS  38 -18.888   1.695  -7.408
  293   2HE   LYS  38          2HE       LYS  38 -19.503   0.496  -6.266
  294   1HZ   LYS  38          1HZ       LYS  38 -19.176   3.386  -5.690
  295   2HZ   LYS  38          2HZ       LYS  38 -20.632   2.626  -6.089
  296   3HZ   LYS  38          3HZ       LYS  38 -19.839   2.226  -4.650
  297    H    GLU  39           H        GLU  39 -14.890   2.850  -9.681
  298    HA   GLU  39           HA       GLU  39 -13.148   4.795 -10.618
  299   1HB   GLU  39          1HB       GLU  39 -15.942   4.293 -11.635
  300   2HB   GLU  39          2HB       GLU  39 -14.620   5.032 -12.531
  301   1HG   GLU  39          1HG       GLU  39 -13.826   2.431 -11.549
  302   2HG   GLU  39          2HG       GLU  39 -15.355   2.326 -12.393
  303    H    GLY  40           H        GLY  40 -12.950   6.923 -10.325
  304   1HA   GLY  40          1HA       GLY  40 -13.781   9.114 -10.276
  305   2HA   GLY  40          2HA       GLY  40 -15.358   8.527  -9.786
  306    H    SER  41           H        SER  41 -13.212   6.876  -7.893
  307    HA   SER  41           HA       SER  41 -13.933   8.170  -5.542
  308   1HB   SER  41          1HB       SER  41 -13.179   6.015  -5.201
  309   2HB   SER  41          2HB       SER  41 -11.784   6.211  -6.262
  310    HG   SER  41           HG       SER  41 -11.502   6.208  -3.833
  311    H    ALA  42           H        ALA  42 -13.121   9.820  -4.390
  312    HA   ALA  42           HA       ALA  42 -11.455  11.748  -5.604
  313   1HB   ALA  42          1HB       ALA  42 -11.496  12.868  -3.420
  314   2HB   ALA  42          2HB       ALA  42 -13.099  12.324  -3.913
  315   3HB   ALA  42          3HB       ALA  42 -12.199  11.420  -2.697
  316    H    MET  43           H        MET  43  -9.581  10.465  -6.236
  317    HA   MET  43           HA       MET  43  -7.682  10.069  -4.006
  318   1HB   MET  43          1HB       MET  43  -7.992   8.481  -6.551
  319   2HB   MET  43          2HB       MET  43  -6.768   8.240  -5.348
  320   1HG   MET  43          1HG       MET  43  -9.700   7.967  -4.882
  321   2HG   MET  43          2HG       MET  43  -8.608   6.643  -5.190
  322   1HE   MET  43          1HE       MET  43 -10.505   8.457  -2.964
  323   2HE   MET  43          2HE       MET  43 -10.399   7.020  -1.965
  324   3HE   MET  43          3HE       MET  43  -9.734   8.545  -1.392
  325    H    THR  44           H        THR  44  -5.837  11.133  -4.167
  326    HA   THR  44           HA       THR  44  -5.401  13.107  -6.092
  327    HB   THR  44           HB       THR  44  -3.218  13.387  -5.145
  328    HG1  THR  44           HG1      THR  44  -2.146  11.627  -4.746
  329   1HG2  THR  44          1HG2      THR  44  -5.261  13.819  -3.647
  330   2HG2  THR  44          2HG2      THR  44  -4.766  12.345  -2.811
  331   3HG2  THR  44          3HG2      THR  44  -3.668  13.715  -2.899
  332    H    LYS  45           H        LYS  45  -3.844  13.283  -7.774
  333    HA   LYS  45           HA       LYS  45  -3.547  10.803  -9.294
  334   1HB   LYS  45          1HB       LYS  45  -3.336  13.728  -9.892
  335   2HB   LYS  45          2HB       LYS  45  -2.459  12.608 -10.919
  336   1HG   LYS  45          1HG       LYS  45  -4.361  12.666 -12.086
  337   2HG   LYS  45          2HG       LYS  45  -4.792  11.355 -10.986
  338   1HD   LYS  45          1HD       LYS  45  -5.567  13.558  -9.546
  339   2HD   LYS  45          2HD       LYS  45  -5.833  14.106 -11.203
  340   1HE   LYS  45          1HE       LYS  45  -7.040  11.819 -11.496
  341   2HE   LYS  45          2HE       LYS  45  -7.085  11.823  -9.732
  342   1HZ   LYS  45          1HZ       LYS  45  -8.185  13.963 -11.479
  343   2HZ   LYS  45          2HZ       LYS  45  -9.090  12.757 -10.714
  344   3HZ   LYS  45          3HZ       LYS  45  -8.273  13.913  -9.789
  345    H    ASP  46           H        ASP  46  -1.656  12.934  -7.346
  346    HA   ASP  46           HA       ASP  46   0.861  12.815  -8.197
  347   1HB   ASP  46          1HB       ASP  46  -0.349  13.277  -5.729
  348   2HB   ASP  46          2HB       ASP  46   0.753  11.958  -5.373
  349    H    PHE  47           H        PHE  47   2.697  11.450  -7.925
  350    HA   PHE  47           HA       PHE  47   2.000   8.620  -8.234
  351   1HB   PHE  47          1HB       PHE  47   3.393   9.565  -9.952
  352   2HB   PHE  47          2HB       PHE  47   4.547  10.154  -8.760
  353    HD1  PHE  47           HD1      PHE  47   6.056   8.618  -7.610
  354    HD2  PHE  47           HD2      PHE  47   3.328   7.242 -10.581
  355    HE1  PHE  47           HE1      PHE  47   7.265   6.482  -7.732
  356    HE2  PHE  47           HE2      PHE  47   4.545   5.121 -10.716
  357    HZ   PHE  47           HZ       PHE  47   6.503   4.726  -9.283
  358    H    ARG  48           H        ARG  48   2.490   7.078  -6.797
  359    HA   ARG  48           HA       ARG  48   4.495   7.535  -4.721
  360   1HB   ARG  48          1HB       ARG  48   1.549   7.313  -4.210
  361   2HB   ARG  48          2HB       ARG  48   2.661   6.616  -3.049
  362   1HG   ARG  48          1HG       ARG  48   3.482   8.620  -2.372
  363   2HG   ARG  48          2HG       ARG  48   3.125   9.431  -3.887
  364   1HD   ARG  48          1HD       ARG  48   0.665   9.021  -3.250
  365   2HD   ARG  48          2HD       ARG  48   1.555  10.330  -2.540
  366    HE   ARG  48           HE       ARG  48   1.197   7.720  -1.182
  367   1HH1  ARG  48          1HH1      ARG  48   1.048  11.244  -1.094
  368   2HH1  ARG  48          2HH1      ARG  48   0.692  11.285   0.585
  369   1HH2  ARG  48          1HH2      ARG  48   0.721   7.829   1.041
  370   2HH2  ARG  48          2HH2      ARG  48   0.502   9.370   1.801
  371    H    CYS  49           H        CYS  49   5.729   5.810  -4.982
  372    HA   CYS  49           HA       CYS  49   4.952   3.418  -6.146
  373   1HB   CYS  49          1HB       CYS  49   7.315   4.359  -4.653
  374   2HB   CYS  49          2HB       CYS  49   7.107   2.617  -4.715
  375    H    ASP  50           H        ASP  50   4.983   4.371  -2.786
  376    HA   ASP  50           HA       ASP  50   4.418   1.746  -1.814
  377   1HB   ASP  50          1HB       ASP  50   4.090   2.840   0.361
  378   2HB   ASP  50          2HB       ASP  50   5.624   3.238  -0.404
  379    H    ARG  51           H        ARG  51   2.493   3.785  -3.535
  380    HA   ARG  51           HA       ARG  51   0.089   2.731  -2.235
  381   1HB   ARG  51          1HB       ARG  51   0.552   5.198  -1.827
  382   2HB   ARG  51          2HB       ARG  51   0.259   5.440  -3.545
  383   1HG   ARG  51          1HG       ARG  51  -1.999   4.311  -3.144
  384   2HG   ARG  51          2HG       ARG  51  -1.648   4.491  -1.422
  385   1HD   ARG  51          1HD       ARG  51  -2.981   6.337  -2.171
  386   2HD   ARG  51          2HD       ARG  51  -1.378   6.895  -1.746
  387    HE   ARG  51           HE       ARG  51  -1.818   6.304  -4.571
  388   1HH1  ARG  51          1HH1      ARG  51  -1.794   8.777  -2.058
  389   2HH1  ARG  51          2HH1      ARG  51  -1.575  10.058  -3.185
  390   1HH2  ARG  51          1HH2      ARG  51  -1.544   8.061  -6.025
  391   2HH2  ARG  51          2HH2      ARG  51  -1.416   9.660  -5.410
  392    H    VAL  52           H        VAL  52  -1.255   1.683  -3.531
  393    HA   VAL  52           HA       VAL  52  -1.036   2.099  -6.457
  394    HB   VAL  52           HB       VAL  52  -1.541  -0.541  -5.100
  395   1HG1  VAL  52          1HG1      VAL  52  -2.153   0.308  -7.704
  396   2HG1  VAL  52          2HG1      VAL  52  -0.703  -0.674  -7.854
  397   3HG1  VAL  52          3HG1      VAL  52  -2.133  -1.332  -7.078
  398   1HG2  VAL  52          1HG2      VAL  52   0.969   0.623  -6.227
  399   2HG2  VAL  52          2HG2      VAL  52   0.705  -0.124  -4.664
  400   3HG2  VAL  52          3HG2      VAL  52   0.737  -1.103  -6.117
  401    H    TRP  53           H        TRP  53  -2.919   2.896  -7.214
  402    HA   TRP  53           HA       TRP  53  -5.314   2.713  -5.629
  403   1HB   TRP  53          1HB       TRP  53  -4.754   3.903  -8.340
  404   2HB   TRP  53          2HB       TRP  53  -6.374   3.870  -7.664
  405    HD1  TRP  53           HD1      TRP  53  -4.438   6.483  -8.367
  406    HE1  TRP  53           HE1      TRP  53  -4.258   8.293  -6.546
  407    HE3  TRP  53           HE3      TRP  53  -5.925   3.748  -4.329
  408    HZ2  TRP  53           HZ2      TRP  53  -4.634   8.508  -3.768
  409    HZ3  TRP  53           HZ3      TRP  53  -5.994   4.834  -2.156
  410    HH2  TRP  53           HH2      TRP  53  -5.352   7.152  -1.852
  411    H    VAL  54           H        VAL  54  -6.983   1.372  -5.827
  412    HA   VAL  54           HA       VAL  54  -6.917  -0.571  -8.069
  413    HB   VAL  54           HB       VAL  54  -7.804  -0.882  -5.217
  414   1HG1  VAL  54          1HG1      VAL  54  -8.409  -2.579  -7.595
  415   2HG1  VAL  54          2HG1      VAL  54  -8.293  -3.294  -5.990
  416   3HG1  VAL  54          3HG1      VAL  54  -9.488  -2.053  -6.308
  417   1HG2  VAL  54          1HG2      VAL  54  -5.409  -1.129  -5.636
  418   2HG2  VAL  54          2HG2      VAL  54  -6.158  -2.634  -5.105
  419   3HG2  VAL  54          3HG2      VAL  54  -5.773  -2.394  -6.810
  420    H    ILE  55           H        ILE  55  -8.129   0.908  -9.345
  421    HA   ILE  55           HA       ILE  55 -10.684   1.829  -8.423
  422    HB   ILE  55           HB       ILE  55  -9.698   1.909 -11.257
  423   1HG1  ILE  55          1HG1      ILE  55  -9.386   4.223  -9.371
  424   2HG1  ILE  55          2HG1      ILE  55  -8.193   2.949  -9.296
  425   1HG2  ILE  55          1HG2      ILE  55 -11.711   3.543  -9.710
  426   2HG2  ILE  55          2HG2      ILE  55 -11.162   3.922 -11.345
  427   3HG2  ILE  55          3HG2      ILE  55 -12.026   2.427 -11.032
  428   1HD1  ILE  55          1HD1      ILE  55  -8.889   4.423 -11.809
  429   2HD1  ILE  55          2HD1      ILE  55  -7.561   4.831 -10.724
  430   3HD1  ILE  55          3HD1      ILE  55  -7.568   3.281 -11.559
  431    H    VAL  56           H        VAL  56 -12.502   0.738  -8.456
  432    HA   VAL  56           HA       VAL  56 -12.849  -1.426 -10.408
  433    HB   VAL  56           HB       VAL  56 -14.092  -2.669  -8.723
  434   1HG1  VAL  56          1HG1      VAL  56 -11.248  -2.121  -8.552
  435   2HG1  VAL  56          2HG1      VAL  56 -11.910  -2.633  -7.009
  436   3HG1  VAL  56          3HG1      VAL  56 -12.115  -3.638  -8.430
  437   1HG2  VAL  56          1HG2      VAL  56 -13.408  -0.359  -6.931
  438   2HG2  VAL  56          2HG2      VAL  56 -14.991  -1.011  -7.332
  439   3HG2  VAL  56          3HG2      VAL  56 -13.898  -1.930  -6.316
  440    H    ASN  57           H        ASN  57 -15.145  -2.030 -10.731
  441    HA   ASN  57           HA       ASN  57 -16.704   0.393 -11.172
  442   1HB   ASN  57          1HB       ASN  57 -18.234  -1.082 -12.411
  443   2HB   ASN  57          2HB       ASN  57 -16.571  -1.278 -12.939
  444   2HD2  ASN  57          2HD2      ASN  57 -17.228  -3.311 -13.817
  445   1HD2  ASN  57          1HD2      ASN  57 -17.404  -4.680 -12.785
  446    H    ASP  58           H        ASP  58 -19.264  -0.214 -10.892
  447    HA   ASP  58           HA       ASP  58 -19.744   0.027  -8.177
  448   1HB   ASP  58          1HB       ASP  58 -21.231   0.562 -10.286
  449   2HB   ASP  58          2HB       ASP  58 -21.910  -1.024  -9.934
  450    H    HIS  59           H        HIS  59 -19.204  -2.796 -10.016
  451    HA   HIS  59           HA       HIS  59 -20.523  -4.552  -8.126
  452   1HB   HIS  59          1HB       HIS  59 -20.255  -4.788 -10.756
  453   2HB   HIS  59          2HB       HIS  59 -18.740  -5.553 -10.318
  454    HD1  HIS  59           HD1      HIS  59 -18.900  -7.794  -8.958
  455    HD2  HIS  59           HD2      HIS  59 -22.533  -6.273 -10.284
  456    HE1  HIS  59           HE1      HIS  59 -20.550  -9.674  -8.704
  457    HE2  HIS  59           HE2      HIS  59 -22.755  -8.707  -9.442
  458    H    GLY  60           H        GLY  60 -17.379  -3.196  -8.630
  459   1HA   GLY  60          1HA       GLY  60 -15.747  -3.309  -6.926
  460   2HA   GLY  60          2HA       GLY  60 -16.329  -4.894  -6.462
  461    H    VAL  61           H        VAL  61 -15.981  -4.206  -9.843
  462    HA   VAL  61           HA       VAL  61 -13.782  -6.120  -9.998
  463    HB   VAL  61           HB       VAL  61 -15.373  -4.912 -12.253
  464   1HG1  VAL  61          1HG1      VAL  61 -13.579  -7.319 -12.125
  465   2HG1  VAL  61          2HG1      VAL  61 -14.558  -6.854 -13.517
  466   3HG1  VAL  61          3HG1      VAL  61 -13.254  -5.808 -12.970
  467   1HG2  VAL  61          1HG2      VAL  61 -16.866  -6.122 -10.746
  468   2HG2  VAL  61          2HG2      VAL  61 -16.678  -6.982 -12.265
  469   3HG2  VAL  61          3HG2      VAL  61 -15.815  -7.529 -10.826
  470    H    VAL  62           H        VAL  62 -11.759  -5.519 -10.594
  471    HA   VAL  62           HA       VAL  62 -11.072  -2.766 -10.619
  472    HB   VAL  62           HB       VAL  62  -9.348  -5.091 -11.483
  473   1HG1  VAL  62          1HG1      VAL  62  -8.747  -2.557 -11.943
  474   2HG1  VAL  62          2HG1      VAL  62  -8.287  -2.588 -10.246
  475   3HG1  VAL  62          3HG1      VAL  62  -7.560  -3.708 -11.389
  476   1HG2  VAL  62          1HG2      VAL  62  -9.727  -3.862  -8.754
  477   2HG2  VAL  62          2HG2      VAL  62 -10.180  -5.493  -9.245
  478   3HG2  VAL  62          3HG2      VAL  62  -8.504  -5.027  -9.197
  479    H    THR  63           H        THR  63 -11.555  -1.463 -12.268
  480    HA   THR  63           HA       THR  63 -11.700  -2.522 -14.993
  481    HB   THR  63           HB       THR  63 -12.684  -0.388 -15.574
  482    HG1  THR  63           HG1      THR  63 -12.227   0.399 -12.868
  483   1HG2  THR  63          1HG2      THR  63 -13.826  -1.481 -13.012
  484   2HG2  THR  63          2HG2      THR  63 -14.631  -0.322 -14.066
  485   3HG2  THR  63          3HG2      THR  63 -14.255  -1.938 -14.662
  486    H    SER  64           H        SER  64  -9.670  -0.457 -13.011
  487    HA   SER  64           HA       SER  64  -8.042   0.212 -15.379
  488   1HB   SER  64          1HB       SER  64  -7.865   1.416 -12.613
  489   2HB   SER  64          2HB       SER  64  -7.113   2.001 -14.099
  490    HG   SER  64           HG       SER  64  -9.850   2.010 -13.383
  491    H    VAL  65           H        VAL  65  -5.842  -0.145 -15.379
  492    HA   VAL  65           HA       VAL  65  -4.952  -2.565 -14.244
  493    HB   VAL  65           HB       VAL  65  -3.257  -0.349 -15.377
  494   1HG1  VAL  65          1HG1      VAL  65  -2.645  -3.026 -14.366
  495   2HG1  VAL  65          2HG1      VAL  65  -2.064  -2.744 -16.011
  496   3HG1  VAL  65          3HG1      VAL  65  -1.597  -1.659 -14.712
  497   1HG2  VAL  65          1HG2      VAL  65  -5.131  -1.156 -16.890
  498   2HG2  VAL  65          2HG2      VAL  65  -3.499  -1.335 -17.501
  499   3HG2  VAL  65          3HG2      VAL  65  -4.342  -2.727 -16.857
  500   1HB   PRO  66          1HB       PRO  66  -3.089  -3.482  -9.629
  501   2HB   PRO  66          2HB       PRO  66  -4.236  -2.496  -8.733
  502   1HG   PRO  66          1HG       PRO  66  -5.028  -4.534 -10.213
  503   2HG   PRO  66          2HG       PRO  66  -5.993  -3.101 -10.043
  504   1HD   PRO  66          1HD       PRO  66  -5.860  -3.138 -12.349
  505   2HD   PRO  66          2HD       PRO  66  -4.322  -3.969 -12.346
  506    H    HIS  67           H        HIS  67  -2.369   0.555 -10.732
  507    HA   HIS  67           HA       HIS  67   0.288  -0.708 -10.702
  508   1HB   HIS  67          1HB       HIS  67  -0.219   0.071 -12.967
  509   2HB   HIS  67          2HB       HIS  67   1.073   1.027 -12.248
  510    HD1  HIS  67           HD1      HIS  67   0.000   2.534 -14.398
  511    HD2  HIS  67           HD2      HIS  67  -2.055   2.439 -10.793
  512    HE1  HIS  67           HE1      HIS  67  -1.499   4.554 -14.409
  513    HE2  HIS  67           HE2      HIS  67  -2.787   4.419 -12.250
  514    H    ILE  68           H        ILE  68   1.998   0.814 -10.107
  515    HA   ILE  68           HA       ILE  68   1.449   1.926  -7.584
  516    HB   ILE  68           HB       ILE  68   3.767   1.388  -9.242
  517   1HG1  ILE  68          1HG1      ILE  68   3.448   1.884  -6.294
  518   2HG1  ILE  68          2HG1      ILE  68   3.264   0.333  -7.086
  519   1HG2  ILE  68          1HG2      ILE  68   3.787   4.056  -7.844
  520   2HG2  ILE  68          2HG2      ILE  68   5.221   3.181  -8.323
  521   3HG2  ILE  68          3HG2      ILE  68   4.089   3.655  -9.531
  522   1HD1  ILE  68          1HD1      ILE  68   5.819   1.543  -7.660
  523   2HD1  ILE  68          2HD1      ILE  68   5.599   1.250  -5.972
  524   3HD1  ILE  68          3HD1      ILE  68   5.431  -0.048  -7.111
  525    H    THR  69           H        THR  69   0.186   3.638  -7.341
  526    HA   THR  69           HA       THR  69   0.900   6.142  -8.675
  527    HB   THR  69           HB       THR  69  -1.816   4.829  -8.891
  528    HG1  THR  69           HG1      THR  69   0.033   5.746 -10.862
  529   1HG2  THR  69          1HG2      THR  69  -1.046   7.671  -9.490
  530   2HG2  THR  69          2HG2      THR  69  -2.453   6.878 -10.186
  531   3HG2  THR  69          3HG2      THR  69  -2.340   7.098  -8.453

  No H/Q in entry =         531
  Start of MODEL    7
    1    H    SER   1           H        SER   1  18.901   7.528 -10.285
    2    HA   SER   1           HA       SER   1  17.938   4.953 -11.339
    3   1HB   SER   1          1HB       SER   1  18.796   5.767  -8.493
    4   2HB   SER   1          2HB       SER   1  18.347   4.126  -8.935
    5    HG   SER   1           HG       SER   1  20.415   5.643 -10.186
    6    H    ARG   2           H        ARG   2  15.956   4.068 -11.341
    7    HA   ARG   2           HA       ARG   2  13.723   5.126  -9.716
    8   1HB   ARG   2          1HB       ARG   2  14.337   5.595 -12.566
    9   2HB   ARG   2          2HB       ARG   2  12.684   5.096 -12.272
   10   1HG   ARG   2          1HG       ARG   2  12.114   6.970 -11.162
   11   2HG   ARG   2          2HG       ARG   2  13.737   7.249 -10.532
   12   1HD   ARG   2          1HD       ARG   2  13.869   8.843 -12.063
   13   2HD   ARG   2          2HD       ARG   2  14.150   7.555 -13.227
   14    HE   ARG   2           HE       ARG   2  11.399   7.837 -13.033
   15   1HH1  ARG   2          1HH1      ARG   2  14.127   9.845 -13.967
   16   2HH1  ARG   2          2HH1      ARG   2  13.197  10.774 -15.082
   17   1HH2  ARG   2          1HH2      ARG   2  10.190   9.096 -14.497
   18   2HH2  ARG   2          2HH2      ARG   2  10.976  10.345 -15.405
   19    H    ARG   3           H        ARG   3  14.191   2.846  -8.915
   20    HA   ARG   3           HA       ARG   3  12.230   1.101 -10.211
   21   1HB   ARG   3          1HB       ARG   3  14.856   0.674 -10.797
   22   2HB   ARG   3          2HB       ARG   3  14.713  -0.323  -9.364
   23   1HG   ARG   3          1HG       ARG   3  13.022  -0.500 -11.848
   24   2HG   ARG   3          2HG       ARG   3  14.317  -1.601 -11.373
   25   1HD   ARG   3          1HD       ARG   3  12.533  -1.491  -9.175
   26   2HD   ARG   3          2HD       ARG   3  11.550  -1.580 -10.629
   27    HE   ARG   3           HE       ARG   3  13.748  -3.483 -10.390
   28   1HH1  ARG   3          1HH1      ARG   3  10.303  -2.891  -9.952
   29   2HH1  ARG   3          2HH1      ARG   3   9.916  -4.568  -9.960
   30   1HH2  ARG   3          1HH2      ARG   3  13.189  -5.687 -10.393
   31   2HH2  ARG   3          2HH2      ARG   3  11.530  -6.154 -10.207
   32    H    CYS   4           H        CYS   4  10.926   1.518  -8.430
   33    HA   CYS   4           HA       CYS   4  11.815   1.165  -5.756
   34   1HB   CYS   4          1HB       CYS   4   9.042   1.221  -6.951
   35   2HB   CYS   4          2HB       CYS   4   9.342   1.141  -5.217
   36   1HB   PRO   5          1HB       PRO   5  10.805  -3.432  -2.712
   37   2HB   PRO   5          2HB       PRO   5  12.452  -2.995  -3.166
   38   1HG   PRO   5          1HG       PRO   5  10.205  -1.236  -2.362
   39   2HG   PRO   5          2HG       PRO   5  11.894  -1.145  -1.873
   40   1HD   PRO   5          1HD       PRO   5  10.834   0.482  -3.742
   41   2HD   PRO   5          2HD       PRO   5  12.509  -0.099  -3.844
   42    H    GLY   6           H        GLY   6  10.242  -4.625  -6.064
   43   1HA   GLY   6          1HA       GLY   6   8.216  -5.821  -5.916
   44   2HA   GLY   6          2HA       GLY   6   7.453  -4.448  -5.180
   45    H    LYS   7           H        LYS   7   6.278  -5.837  -7.250
   46    HA   LYS   7           HA       LYS   7   6.786  -4.843  -9.822
   47   1HB   LYS   7          1HB       LYS   7   5.439  -6.826  -9.302
   48   2HB   LYS   7          2HB       LYS   7   4.182  -5.809  -8.664
   49   1HG   LYS   7          1HG       LYS   7   3.745  -4.862 -10.796
   50   2HG   LYS   7          2HG       LYS   7   5.148  -5.662 -11.504
   51   1HD   LYS   7          1HD       LYS   7   2.943  -7.234 -10.220
   52   2HD   LYS   7          2HD       LYS   7   2.781  -6.681 -11.870
   53   1HE   LYS   7          1HE       LYS   7   4.405  -8.077 -12.631
   54   2HE   LYS   7          2HE       LYS   7   5.280  -8.103 -11.100
   55   1HZ   LYS   7          1HZ       LYS   7   3.540  -9.503 -10.171
   56   2HZ   LYS   7          2HZ       LYS   7   2.719  -9.508 -11.663
   57   3HZ   LYS   7          3HZ       LYS   7   4.232 -10.215 -11.548
   58    H    ASN   8           H        ASN   8   5.883  -3.150 -11.027
   59    HA   ASN   8           HA       ASN   8   4.859  -0.927  -9.383
   60   1HB   ASN   8          1HB       ASN   8   6.975  -0.869 -10.958
   61   2HB   ASN   8          2HB       ASN   8   5.783  -0.577 -12.216
   62   2HD2  ASN   8          2HD2      ASN   8   7.604   0.781  -9.687
   63   1HD2  ASN   8          1HD2      ASN   8   6.888   2.352  -9.727
   64    H    ALA   9           H        ALA   9   3.757  -3.145 -11.764
   65    HA   ALA   9           HA       ALA   9   1.204  -1.792 -11.841
   66   1HB   ALA   9          1HB       ALA   9   2.731  -2.299 -14.389
   67   2HB   ALA   9          2HB       ALA   9   1.074  -1.699 -14.272
   68   3HB   ALA   9          3HB       ALA   9   2.413  -0.718 -13.677
   69    H    TRP  10           H        TRP  10  -0.434  -3.218 -11.883
   70    HA   TRP  10           HA       TRP  10   0.256  -6.033 -12.516
   71   1HB   TRP  10          1HB       TRP  10  -1.708  -4.881 -10.554
   72   2HB   TRP  10          2HB       TRP  10  -1.655  -6.576 -11.009
   73    HD1  TRP  10           HD1      TRP  10   0.170  -8.083  -9.923
   74    HE1  TRP  10           HE1      TRP  10   1.920  -7.707  -8.078
   75    HE3  TRP  10           HE3      TRP  10  -0.092  -2.999  -9.537
   76    HZ2  TRP  10           HZ2      TRP  10   3.032  -5.546  -6.663
   77    HZ3  TRP  10           HZ3      TRP  10   1.343  -1.845  -7.921
   78    HH2  TRP  10           HH2      TRP  10   2.877  -3.102  -6.501
   79   1HB   PRO  11          1HB       PRO  11  -1.692  -6.336 -17.643
   80   2HB   PRO  11          2HB       PRO  11  -1.245  -4.639 -17.491
   81   1HG   PRO  11          1HG       PRO  11   0.135  -7.057 -16.428
   82   2HG   PRO  11          2HG       PRO  11   0.825  -5.578 -17.123
   83   1HD   PRO  11          1HD       PRO  11   0.823  -6.013 -14.492
   84   2HD   PRO  11          2HD       PRO  11   0.577  -4.385 -15.155
   85    H    GLU  12           H        GLU  12  -1.638  -7.800 -15.019
   86    HA   GLU  12           HA       GLU  12  -3.891  -9.156 -16.005
   87   1HB   GLU  12          1HB       GLU  12  -1.779 -10.264 -15.529
   88   2HB   GLU  12          2HB       GLU  12  -3.116 -11.050 -14.706
   89   1HG   GLU  12          1HG       GLU  12  -2.273  -9.297 -12.779
   90   2HG   GLU  12          2HG       GLU  12  -1.823 -10.990 -12.917
   91    H    LEU  13           H        LEU  13  -3.801  -7.023 -13.375
   92    HA   LEU  13           HA       LEU  13  -5.740  -8.453 -11.785
   93   1HB   LEU  13          1HB       LEU  13  -4.411  -5.789 -11.579
   94   2HB   LEU  13          2HB       LEU  13  -5.802  -6.134 -10.582
   95    HG   LEU  13           HG       LEU  13  -3.123  -7.513 -10.539
   96   1HD1  LEU  13          1HD1      LEU  13  -4.567  -5.619  -8.770
   97   2HD1  LEU  13          2HD1      LEU  13  -3.617  -6.881  -8.005
   98   3HD1  LEU  13          3HD1      LEU  13  -2.864  -5.760  -9.099
   99   1HD2  LEU  13          1HD2      LEU  13  -5.742  -8.372  -9.370
  100   2HD2  LEU  13          2HD2      LEU  13  -4.586  -9.300 -10.319
  101   3HD2  LEU  13          3HD2      LEU  13  -4.206  -8.874  -8.659
  102    H    VAL  14           H        VAL  14  -5.793  -6.275 -14.428
  103    HA   VAL  14           HA       VAL  14  -8.227  -4.967 -14.006
  104    HB   VAL  14           HB       VAL  14  -7.096  -5.892 -16.661
  105   1HG1  VAL  14          1HG1      VAL  14  -9.144  -3.783 -15.968
  106   2HG1  VAL  14          2HG1      VAL  14  -8.370  -3.939 -17.544
  107   3HG1  VAL  14          3HG1      VAL  14  -9.389  -5.238 -16.937
  108   1HG2  VAL  14          1HG2      VAL  14  -5.495  -4.532 -15.339
  109   2HG2  VAL  14          2HG2      VAL  14  -6.048  -3.706 -16.787
  110   3HG2  VAL  14          3HG2      VAL  14  -6.711  -3.278 -15.213
  111    H    GLY  15           H        GLY  15 -10.183  -5.852 -13.645
  112   1HA   GLY  15          1HA       GLY  15 -12.049  -7.044 -14.555
  113   2HA   GLY  15          2HA       GLY  15 -10.959  -8.256 -15.201
  114    H    LYS  16           H        LYS  16  -9.581  -7.792 -12.348
  115    HA   LYS  16           HA       LYS  16 -11.086  -9.965 -11.113
  116   1HB   LYS  16          1HB       LYS  16  -8.568 -10.033 -11.376
  117   2HB   LYS  16          2HB       LYS  16  -8.475  -8.734 -10.210
  118   1HG   LYS  16          1HG       LYS  16  -9.552 -10.160  -8.544
  119   2HG   LYS  16          2HG       LYS  16  -8.053 -10.834  -9.133
  120   1HD   LYS  16          1HD       LYS  16 -10.761 -11.650 -10.220
  121   2HD   LYS  16          2HD       LYS  16  -9.962 -12.451  -8.884
  122   1HE   LYS  16          1HE       LYS  16  -7.924 -12.504 -10.608
  123   2HE   LYS  16          2HE       LYS  16  -9.162 -13.754 -10.529
  124   1HZ   LYS  16          1HZ       LYS  16 -10.365 -12.266 -12.261
  125   2HZ   LYS  16          2HZ       LYS  16  -8.817 -11.633 -12.528
  126   3HZ   LYS  16          3HZ       LYS  16  -9.114 -13.278 -12.744
  127    H    SER  17           H        SER  17 -11.513  -9.886  -8.758
  128    HA   SER  17           HA       SER  17 -12.969  -7.588  -8.072
  129   1HB   SER  17          1HB       SER  17 -13.143 -10.023  -7.156
  130   2HB   SER  17          2HB       SER  17 -13.510  -8.672  -6.083
  131    HG   SER  17           HG       SER  17 -12.107 -10.154  -5.059
  132    H    GLY  18           H        GLY  18 -12.554  -5.849  -6.728
  133   1HA   GLY  18          1HA       GLY  18  -9.992  -4.786  -6.626
  134   2HA   GLY  18          2HA       GLY  18 -11.329  -4.310  -5.607
  135    H    ASN  19           H        ASN  19 -11.564  -6.995  -4.390
  136    HA   ASN  19           HA       ASN  19  -9.711  -6.595  -2.255
  137   1HB   ASN  19          1HB       ASN  19 -12.133  -8.013  -2.623
  138   2HB   ASN  19          2HB       ASN  19 -10.938  -9.237  -2.221
  139   2HD2  ASN  19          2HD2      ASN  19  -9.321  -8.164  -0.429
  140   1HD2  ASN  19          1HD2      ASN  19 -10.200  -7.627   0.955
  141    H    MET  20           H        MET  20 -10.071  -9.123  -4.741
  142    HA   MET  20           HA       MET  20  -7.797 -10.603  -3.955
  143   1HB   MET  20          1HB       MET  20  -9.623 -11.438  -5.449
  144   2HB   MET  20          2HB       MET  20  -9.000 -10.403  -6.711
  145   1HG   MET  20          1HG       MET  20  -6.818 -11.620  -6.556
  146   2HG   MET  20          2HG       MET  20  -8.179 -12.569  -7.138
  147   1HE   MET  20          1HE       MET  20  -5.176 -12.785  -5.289
  148   2HE   MET  20          2HE       MET  20  -5.403 -14.331  -4.469
  149   3HE   MET  20          3HE       MET  20  -5.662 -14.209  -6.210
  150    H    ALA  21           H        ALA  21  -8.269  -7.955  -6.254
  151    HA   ALA  21           HA       ALA  21  -5.698  -7.925  -7.352
  152   1HB   ALA  21          1HB       ALA  21  -7.829  -5.855  -7.022
  153   2HB   ALA  21          2HB       ALA  21  -6.265  -5.413  -7.692
  154   3HB   ALA  21          3HB       ALA  21  -7.255  -6.626  -8.503
  155    H    ALA  22           H        ALA  22  -7.044  -5.993  -4.693
  156    HA   ALA  22           HA       ALA  22  -4.747  -4.657  -3.953
  157   1HB   ALA  22          1HB       ALA  22  -6.907  -5.681  -2.113
  158   2HB   ALA  22          2HB       ALA  22  -6.951  -4.166  -3.012
  159   3HB   ALA  22          3HB       ALA  22  -5.755  -4.397  -1.738
  160    H    ALA  23           H        ALA  23  -5.872  -7.862  -2.929
  161    HA   ALA  23           HA       ALA  23  -3.824  -8.395  -1.079
  162   1HB   ALA  23          1HB       ALA  23  -5.867  -9.724  -1.242
  163   2HB   ALA  23          2HB       ALA  23  -4.430 -10.742  -1.335
  164   3HB   ALA  23          3HB       ALA  23  -5.342 -10.363  -2.798
  165    H    THR  24           H        THR  24  -4.052  -9.045  -4.563
  166    HA   THR  24           HA       THR  24  -1.637 -10.437  -4.838
  167    HB   THR  24           HB       THR  24  -2.703  -8.598  -6.982
  168    HG1  THR  24           HG1      THR  24  -3.843 -11.074  -6.155
  169   1HG2  THR  24          1HG2      THR  24  -1.550 -11.376  -7.063
  170   2HG2  THR  24          2HG2      THR  24  -2.160 -10.472  -8.449
  171   3HG2  THR  24          3HG2      THR  24  -0.743  -9.890  -7.572
  172    H    VAL  25           H        VAL  25  -2.344  -6.969  -5.013
  173    HA   VAL  25           HA       VAL  25   0.273  -6.163  -5.767
  174    HB   VAL  25           HB       VAL  25  -1.810  -4.552  -4.284
  175   1HG1  VAL  25          1HG1      VAL  25   0.858  -3.914  -5.155
  176   2HG1  VAL  25          2HG1      VAL  25  -0.314  -2.932  -6.028
  177   3HG1  VAL  25          3HG1      VAL  25  -0.303  -2.943  -4.278
  178   1HG2  VAL  25          1HG2      VAL  25  -1.424  -5.065  -7.229
  179   2HG2  VAL  25          2HG2      VAL  25  -2.856  -5.340  -6.252
  180   3HG2  VAL  25          3HG2      VAL  25  -2.355  -3.703  -6.603
  181    H    GLU  26           H        GLU  26  -1.366  -6.135  -2.595
  182    HA   GLU  26           HA       GLU  26   0.933  -5.239  -1.175
  183   1HB   GLU  26          1HB       GLU  26  -1.386  -6.802  -0.028
  184   2HB   GLU  26          2HB       GLU  26  -0.289  -5.714   0.818
  185   1HG   GLU  26          1HG       GLU  26  -1.299  -4.043  -1.062
  186   2HG   GLU  26          2HG       GLU  26  -2.653  -5.135  -0.832
  187    H    ARG  27           H        ARG  27  -0.070  -8.380  -2.300
  188    HA   ARG  27           HA       ARG  27   1.710  -9.796  -0.486
  189   1HB   ARG  27          1HB       ARG  27  -0.169 -10.618  -2.684
  190   2HB   ARG  27          2HB       ARG  27   1.047 -11.731  -2.104
  191   1HG   ARG  27          1HG       ARG  27  -0.054 -10.873   0.251
  192   2HG   ARG  27          2HG       ARG  27  -1.440 -10.842  -0.831
  193   1HD   ARG  27          1HD       ARG  27   0.202 -13.261  -1.102
  194   2HD   ARG  27          2HD       ARG  27  -0.467 -13.016   0.495
  195    HE   ARG  27           HE       ARG  27  -2.085 -13.073  -1.982
  196   1HH1  ARG  27          1HH1      ARG  27  -1.683 -13.883   1.424
  197   2HH1  ARG  27          2HH1      ARG  27  -3.210 -14.657   1.525
  198   1HH2  ARG  27          1HH2      ARG  27  -4.098 -14.122  -1.806
  199   2HH2  ARG  27          2HH2      ARG  27  -4.603 -14.761  -0.278
  200    H    GLU  28           H        GLU  28   1.503  -9.384  -4.038
  201    HA   GLU  28           HA       GLU  28   4.048 -10.524  -4.540
  202   1HB   GLU  28          1HB       GLU  28   2.141  -8.839  -6.116
  203   2HB   GLU  28          2HB       GLU  28   3.782  -8.974  -6.702
  204   1HG   GLU  28          1HG       GLU  28   3.620 -11.351  -6.854
  205   2HG   GLU  28          2HG       GLU  28   2.018 -11.333  -6.117
  206    H    ASN  29           H        ASN  29   2.994  -7.288  -3.689
  207    HA   ASN  29           HA       ASN  29   5.828  -6.443  -3.621
  208   1HB   ASN  29          1HB       ASN  29   4.618  -5.351  -5.445
  209   2HB   ASN  29          2HB       ASN  29   3.422  -4.741  -4.313
  210   2HD2  ASN  29          2HD2      ASN  29   5.042  -3.169  -6.041
  211   1HD2  ASN  29          1HD2      ASN  29   6.106  -2.226  -5.067
  212    H    ARG  30           H        ARG  30   5.800  -7.239  -1.450
  213    HA   ARG  30           HA       ARG  30   4.065  -6.299   0.557
  214   1HB   ARG  30          1HB       ARG  30   6.542  -7.835   0.396
  215   2HB   ARG  30          2HB       ARG  30   6.524  -6.807   1.815
  216   1HG   ARG  30          1HG       ARG  30   4.044  -8.355   1.298
  217   2HG   ARG  30          2HG       ARG  30   5.490  -9.274   1.718
  218   1HD   ARG  30          1HD       ARG  30   4.595  -6.900   3.337
  219   2HD   ARG  30          2HD       ARG  30   3.984  -8.530   3.619
  220    HE   ARG  30           HE       ARG  30   6.823  -8.534   3.570
  221   1HH1  ARG  30          1HH1      ARG  30   4.097  -7.608   5.585
  222   2HH1  ARG  30          2HH1      ARG  30   4.985  -7.783   7.052
  223   1HH2  ARG  30          1HH2      ARG  30   7.970  -8.772   5.526
  224   2HH2  ARG  30          2HH2      ARG  30   7.178  -8.434   7.030
  225    H    ASN  31           H        ASN  31   6.240  -4.447  -1.215
  226    HA   ASN  31           HA       ASN  31   6.841  -2.665   1.023
  227   1HB   ASN  31          1HB       ASN  31   8.673  -3.309  -0.479
  228   2HB   ASN  31          2HB       ASN  31   7.813  -2.592  -1.839
  229   2HD2  ASN  31          2HD2      ASN  31   7.835  -0.385  -2.106
  230   1HD2  ASN  31          1HD2      ASN  31   8.778   0.666  -1.112
  231    H    VAL  32           H        VAL  32   4.237  -3.063  -0.882
  232    HA   VAL  32           HA       VAL  32   3.648  -0.188  -0.845
  233    HB   VAL  32           HB       VAL  32   2.725  -0.177  -3.025
  234   1HG1  VAL  32          1HG1      VAL  32   5.171   0.091  -2.905
  235   2HG1  VAL  32          2HG1      VAL  32   5.356  -1.605  -3.155
  236   3HG1  VAL  32          3HG1      VAL  32   4.665  -0.635  -4.427
  237   1HG2  VAL  32          1HG2      VAL  32   3.036  -3.148  -2.906
  238   2HG2  VAL  32          2HG2      VAL  32   1.646  -2.184  -3.355
  239   3HG2  VAL  32          3HG2      VAL  32   3.001  -2.337  -4.464
  240    H    HIS  33           H        HIS  33   1.299   0.246  -1.148
  241    HA   HIS  33           HA       HIS  33  -0.344  -1.971  -0.109
  242   1HB   HIS  33          1HB       HIS  33  -1.157  -0.786   1.645
  243   2HB   HIS  33          2HB       HIS  33   0.417  -0.017   1.543
  244    HD1  HIS  33           HD1      HIS  33  -3.008   0.798   1.892
  245    HD2  HIS  33           HD2      HIS  33   0.172   2.500  -0.130
  246    HE1  HIS  33           HE1      HIS  33  -3.687   3.174   1.438
  247    HE2  HIS  33           HE2      HIS  33  -1.561   4.220   0.620
  248    H    ALA  34           H        ALA  34  -2.241  -2.262  -1.107
  249    HA   ALA  34           HA       ALA  34  -2.882  -0.488  -3.318
  250   1HB   ALA  34          1HB       ALA  34  -4.428  -2.408  -3.968
  251   2HB   ALA  34          2HB       ALA  34  -2.690  -2.658  -4.083
  252   3HB   ALA  34          3HB       ALA  34  -3.583  -3.332  -2.718
  253    H    ILE  35           H        ILE  35  -4.580   0.818  -3.282
  254    HA   ILE  35           HA       ILE  35  -6.500   0.575  -1.049
  255    HB   ILE  35           HB       ILE  35  -6.093   2.955  -2.811
  256   1HG1  ILE  35          1HG1      ILE  35  -4.693   2.147  -0.298
  257   2HG1  ILE  35          2HG1      ILE  35  -4.842   3.850  -0.720
  258   1HG2  ILE  35          1HG2      ILE  35  -7.466   2.536  -0.183
  259   2HG2  ILE  35          2HG2      ILE  35  -7.126   4.132  -0.845
  260   3HG2  ILE  35          3HG2      ILE  35  -8.185   3.030  -1.713
  261   1HD1  ILE  35          1HD1      ILE  35  -3.833   2.932  -3.028
  262   2HD1  ILE  35          2HD1      ILE  35  -2.886   3.459  -1.667
  263   3HD1  ILE  35          3HD1      ILE  35  -3.152   1.760  -1.902
  264    H    VAL  36           H        VAL  36  -8.235  -0.560  -1.683
  265    HA   VAL  36           HA       VAL  36  -9.111  -0.570  -4.416
  266    HB   VAL  36           HB       VAL  36  -9.246  -2.557  -2.957
  267   1HG1  VAL  36          1HG1      VAL  36 -10.036  -1.262  -0.920
  268   2HG1  VAL  36          2HG1      VAL  36 -11.637  -1.272  -1.654
  269   3HG1  VAL  36          3HG1      VAL  36 -10.844  -2.789  -1.246
  270   1HG2  VAL  36          1HG2      VAL  36 -10.573  -2.388  -4.991
  271   2HG2  VAL  36          2HG2      VAL  36 -11.423  -3.297  -3.744
  272   3HG2  VAL  36          3HG2      VAL  36 -11.884  -1.632  -4.090
  273    H    LEU  37           H        LEU  37 -10.375   0.844  -5.325
  274    HA   LEU  37           HA       LEU  37 -12.526   2.131  -3.819
  275   1HB   LEU  37          1HB       LEU  37 -11.716   4.300  -4.999
  276   2HB   LEU  37          2HB       LEU  37 -11.065   3.823  -3.465
  277    HG   LEU  37           HG       LEU  37  -9.186   2.697  -4.951
  278   1HD1  LEU  37          1HD1      LEU  37 -10.398   3.235  -7.076
  279   2HD1  LEU  37          2HD1      LEU  37 -10.071   4.943  -6.746
  280   3HD1  LEU  37          3HD1      LEU  37  -8.721   3.810  -6.995
  281   1HD2  LEU  37          1HD2      LEU  37  -9.523   5.475  -3.998
  282   2HD2  LEU  37          2HD2      LEU  37  -8.371   4.242  -3.530
  283   3HD2  LEU  37          3HD2      LEU  37  -8.147   5.133  -5.029
  284    H    LYS  38           H        LYS  38 -14.135   3.102  -5.204
  285    HA   LYS  38           HA       LYS  38 -14.303   1.683  -7.739
  286   1HB   LYS  38          1HB       LYS  38 -16.198   2.843  -5.842
  287   2HB   LYS  38          2HB       LYS  38 -16.628   3.164  -7.515
  288   1HG   LYS  38          1HG       LYS  38 -16.748   0.880  -8.036
  289   2HG   LYS  38          2HG       LYS  38 -15.995   0.421  -6.518
  290   1HD   LYS  38          1HD       LYS  38 -18.428   2.020  -6.181
  291   2HD   LYS  38          2HD       LYS  38 -18.681   0.486  -6.999
  292   1HE   LYS  38          1HE       LYS  38 -17.409  -0.621  -5.133
  293   2HE   LYS  38          2HE       LYS  38 -17.459   0.931  -4.294
  294   1HZ   LYS  38          1HZ       LYS  38 -19.875   0.843  -4.352
  295   2HZ   LYS  38          2HZ       LYS  38 -19.824  -0.649  -5.163
  296   3HZ   LYS  38          3HZ       LYS  38 -19.245  -0.534  -3.583
  297    H    GLU  39           H        GLU  39 -15.253   2.781  -9.628
  298    HA   GLU  39           HA       GLU  39 -13.588   4.718 -10.657
  299   1HB   GLU  39          1HB       GLU  39 -16.141   3.502 -11.417
  300   2HB   GLU  39          2HB       GLU  39 -16.000   5.146 -12.005
  301   1HG   GLU  39          1HG       GLU  39 -13.584   3.551 -12.470
  302   2HG   GLU  39          2HG       GLU  39 -15.030   2.883 -13.208
  303    H    GLY  40           H        GLY  40 -13.280   6.813 -10.266
  304   1HA   GLY  40          1HA       GLY  40 -13.974   9.032 -10.075
  305   2HA   GLY  40          2HA       GLY  40 -15.582   8.511  -9.611
  306    H    SER  41           H        SER  41 -13.291   6.753  -7.877
  307    HA   SER  41           HA       SER  41 -14.009   7.956  -5.420
  308   1HB   SER  41          1HB       SER  41 -13.343   5.616  -5.575
  309   2HB   SER  41          2HB       SER  41 -11.722   6.093  -6.079
  310    HG   SER  41           HG       SER  41 -11.298   6.174  -4.004
  311    H    ALA  42           H        ALA  42 -11.863   8.309  -3.881
  312    HA   ALA  42           HA       ALA  42 -10.718  10.792  -4.919
  313   1HB   ALA  42          1HB       ALA  42  -9.996  11.163  -2.623
  314   2HB   ALA  42          2HB       ALA  42 -11.711  10.765  -2.690
  315   3HB   ALA  42          3HB       ALA  42 -10.548   9.548  -2.172
  316    H    MET  43           H        MET  43  -9.228   9.940  -6.451
  317    HA   MET  43           HA       MET  43  -6.889   8.622  -5.220
  318   1HB   MET  43          1HB       MET  43  -6.464   7.770  -7.571
  319   2HB   MET  43          2HB       MET  43  -7.723   6.996  -6.641
  320   1HG   MET  43          1HG       MET  43  -9.426   7.919  -7.877
  321   2HG   MET  43          2HG       MET  43  -8.419   9.206  -8.529
  322   1HE   MET  43          1HE       MET  43  -6.236   8.637  -9.748
  323   2HE   MET  43          2HE       MET  43  -5.760   6.943  -9.648
  324   3HE   MET  43          3HE       MET  43  -6.299   7.613 -11.183
  325    H    THR  44           H        THR  44  -5.477  10.193  -4.907
  326    HA   THR  44           HA       THR  44  -5.303  12.531  -6.477
  327    HB   THR  44           HB       THR  44  -2.929  12.613  -5.355
  328    HG1  THR  44           HG1      THR  44  -2.949  11.226  -3.453
  329   1HG2  THR  44          1HG2      THR  44  -4.807  13.922  -4.537
  330   2HG2  THR  44          2HG2      THR  44  -5.385  12.535  -3.611
  331   3HG2  THR  44          3HG2      THR  44  -3.829  13.272  -3.226
  332    H    LYS  45           H        LYS  45  -3.716  13.167  -7.978
  333    HA   LYS  45           HA       LYS  45  -2.962  11.048  -9.800
  334   1HB   LYS  45          1HB       LYS  45  -2.925  14.034  -9.820
  335   2HB   LYS  45          2HB       LYS  45  -1.848  13.194 -10.928
  336   1HG   LYS  45          1HG       LYS  45  -3.657  12.074 -11.982
  337   2HG   LYS  45          2HG       LYS  45  -4.811  12.680 -10.793
  338   1HD   LYS  45          1HD       LYS  45  -3.215  14.748 -12.213
  339   2HD   LYS  45          2HD       LYS  45  -4.338  13.822 -13.207
  340   1HE   LYS  45          1HE       LYS  45  -6.167  14.386 -11.684
  341   2HE   LYS  45          2HE       LYS  45  -5.403  15.824 -12.363
  342   1HZ   LYS  45          1HZ       LYS  45  -4.102  16.006 -10.263
  343   2HZ   LYS  45          2HZ       LYS  45  -5.766  16.172 -10.056
  344   3HZ   LYS  45          3HZ       LYS  45  -5.041  14.717  -9.635
  345    H    ASP  46           H        ASP  46  -1.455  12.878  -7.282
  346    HA   ASP  46           HA       ASP  46   1.185  12.949  -7.915
  347   1HB   ASP  46          1HB       ASP  46   0.208  13.746  -5.782
  348   2HB   ASP  46          2HB       ASP  46   0.051  12.078  -5.239
  349    H    PHE  47           H        PHE  47   2.997  11.538  -7.481
  350    HA   PHE  47           HA       PHE  47   2.307   8.721  -7.976
  351   1HB   PHE  47          1HB       PHE  47   3.783   9.753  -9.592
  352   2HB   PHE  47          2HB       PHE  47   4.901  10.228  -8.317
  353    HD1  PHE  47           HD1      PHE  47   6.167   8.505  -7.070
  354    HD2  PHE  47           HD2      PHE  47   3.786   7.539 -10.470
  355    HE1  PHE  47           HE1      PHE  47   7.309   6.365  -7.263
  356    HE2  PHE  47           HE2      PHE  47   4.923   5.373 -10.650
  357    HZ   PHE  47           HZ       PHE  47   6.688   4.772  -9.039
  358    H    ARG  48           H        ARG  48   2.818   7.110  -6.613
  359    HA   ARG  48           HA       ARG  48   4.699   7.496  -4.426
  360   1HB   ARG  48          1HB       ARG  48   1.731   7.358  -4.052
  361   2HB   ARG  48          2HB       ARG  48   2.745   6.512  -2.888
  362   1HG   ARG  48          1HG       ARG  48   3.950   8.617  -2.444
  363   2HG   ARG  48          2HG       ARG  48   2.857   9.445  -3.549
  364   1HD   ARG  48          1HD       ARG  48   1.608   9.834  -1.770
  365   2HD   ARG  48          2HD       ARG  48   1.083   8.172  -1.906
  366    HE   ARG  48           HE       ARG  48   2.876   7.584  -0.311
  367   1HH1  ARG  48          1HH1      ARG  48   1.665  10.896  -0.352
  368   2HH1  ARG  48          2HH1      ARG  48   2.139  11.199   1.270
  369   1HH2  ARG  48          1HH2      ARG  48   3.482   8.028   1.832
  370   2HH2  ARG  48          2HH2      ARG  48   3.154   9.579   2.529
  371    H    CYS  49           H        CYS  49   5.934   5.763  -4.708
  372    HA   CYS  49           HA       CYS  49   5.198   3.407  -5.970
  373   1HB   CYS  49          1HB       CYS  49   7.456   4.119  -4.149
  374   2HB   CYS  49          2HB       CYS  49   7.277   2.458  -4.709
  375    H    ASP  50           H        ASP  50   5.143   4.197  -2.543
  376    HA   ASP  50           HA       ASP  50   4.430   1.508  -1.792
  377   1HB   ASP  50          1HB       ASP  50   5.689   2.879  -0.241
  378   2HB   ASP  50          2HB       ASP  50   4.144   2.427   0.469
  379    H    ARG  51           H        ARG  51   2.676   3.661  -3.478
  380    HA   ARG  51           HA       ARG  51   0.163   2.805  -2.240
  381   1HB   ARG  51          1HB       ARG  51   0.795   5.271  -1.950
  382   2HB   ARG  51          2HB       ARG  51   0.529   5.433  -3.681
  383   1HG   ARG  51          1HG       ARG  51  -1.802   4.480  -3.246
  384   2HG   ARG  51          2HG       ARG  51  -1.439   4.720  -1.535
  385   1HD   ARG  51          1HD       ARG  51  -2.598   6.642  -2.183
  386   2HD   ARG  51          2HD       ARG  51  -0.904   7.111  -2.100
  387    HE   ARG  51           HE       ARG  51  -1.839   6.285  -4.727
  388   1HH1  ARG  51          1HH1      ARG  51  -1.375   8.988  -2.518
  389   2HH1  ARG  51          2HH1      ARG  51  -1.340  10.147  -3.784
  390   1HH2  ARG  51          1HH2      ARG  51  -1.829   7.865  -6.364
  391   2HH2  ARG  51          2HH2      ARG  51  -1.635   9.528  -5.969
  392    H    VAL  52           H        VAL  52  -1.233   1.830  -3.545
  393    HA   VAL  52           HA       VAL  52  -0.946   2.160  -6.468
  394    HB   VAL  52           HB       VAL  52  -1.354  -0.508  -5.080
  395   1HG1  VAL  52          1HG1      VAL  52  -1.311   0.313  -7.976
  396   2HG1  VAL  52          2HG1      VAL  52  -1.011  -1.343  -7.461
  397   3HG1  VAL  52          3HG1      VAL  52  -2.550  -0.573  -7.099
  398   1HG2  VAL  52          1HG2      VAL  52   0.968   0.338  -4.908
  399   2HG2  VAL  52          2HG2      VAL  52   0.841  -1.104  -5.902
  400   3HG2  VAL  52          3HG2      VAL  52   1.016   0.466  -6.659
  401    H    TRP  53           H        TRP  53  -2.812   2.927  -7.212
  402    HA   TRP  53           HA       TRP  53  -5.235   2.734  -5.670
  403   1HB   TRP  53          1HB       TRP  53  -4.655   3.875  -8.404
  404   2HB   TRP  53          2HB       TRP  53  -6.250   3.924  -7.672
  405    HD1  TRP  53           HD1      TRP  53  -4.021   6.366  -8.440
  406    HE1  TRP  53           HE1      TRP  53  -3.844   8.233  -6.684
  407    HE3  TRP  53           HE3      TRP  53  -5.943   3.899  -4.446
  408    HZ2  TRP  53           HZ2      TRP  53  -4.369   8.578  -3.933
  409    HZ3  TRP  53           HZ3      TRP  53  -6.047   5.058  -2.283
  410    HH2  TRP  53           HH2      TRP  53  -5.284   7.336  -2.023
  411    H    VAL  54           H        VAL  54  -7.039   1.538  -6.056
  412    HA   VAL  54           HA       VAL  54  -6.925  -0.373  -8.318
  413    HB   VAL  54           HB       VAL  54  -7.693  -0.900  -5.455
  414   1HG1  VAL  54          1HG1      VAL  54  -8.122  -2.565  -7.916
  415   2HG1  VAL  54          2HG1      VAL  54  -8.088  -3.260  -6.299
  416   3HG1  VAL  54          3HG1      VAL  54  -9.321  -2.087  -6.716
  417   1HG2  VAL  54          1HG2      VAL  54  -5.285  -0.958  -5.940
  418   2HG2  VAL  54          2HG2      VAL  54  -5.930  -2.536  -5.488
  419   3HG2  VAL  54          3HG2      VAL  54  -5.599  -2.176  -7.172
  420    H    ILE  55           H        ILE  55  -8.302   0.994  -9.504
  421    HA   ILE  55           HA       ILE  55 -10.834   1.816  -8.433
  422    HB   ILE  55           HB       ILE  55 -10.044   1.858 -11.316
  423   1HG1  ILE  55          1HG1      ILE  55  -9.749   4.365  -9.804
  424   2HG1  ILE  55          2HG1      ILE  55  -8.618   3.136  -9.289
  425   1HG2  ILE  55          1HG2      ILE  55 -12.014   3.469  -9.718
  426   2HG2  ILE  55          2HG2      ILE  55 -11.608   3.773 -11.405
  427   3HG2  ILE  55          3HG2      ILE  55 -12.386   2.261 -10.946
  428   1HD1  ILE  55          1HD1      ILE  55  -8.965   3.900 -12.168
  429   2HD1  ILE  55          2HD1      ILE  55  -7.830   4.678 -11.075
  430   3HD1  ILE  55          3HD1      ILE  55  -7.660   2.975 -11.415
  431    H    VAL  56           H        VAL  56 -12.713   0.772  -8.496
  432    HA   VAL  56           HA       VAL  56 -12.999  -1.496 -10.330
  433    HB   VAL  56           HB       VAL  56 -14.300  -2.664  -8.622
  434   1HG1  VAL  56          1HG1      VAL  56 -11.444  -2.171  -8.464
  435   2HG1  VAL  56          2HG1      VAL  56 -12.117  -2.652  -6.916
  436   3HG1  VAL  56          3HG1      VAL  56 -12.340  -3.670  -8.321
  437   1HG2  VAL  56          1HG2      VAL  56 -13.629  -0.270  -6.944
  438   2HG2  VAL  56          2HG2      VAL  56 -15.172  -1.038  -7.272
  439   3HG2  VAL  56          3HG2      VAL  56 -14.026  -1.824  -6.220
  440    H    ASN  57           H        ASN  57 -15.269  -2.132 -10.701
  441    HA   ASN  57           HA       ASN  57 -16.834   0.259 -11.260
  442   1HB   ASN  57          1HB       ASN  57 -16.609  -1.486 -12.962
  443   2HB   ASN  57          2HB       ASN  57 -18.284  -1.251 -12.534
  444   2HD2  ASN  57          2HD2      ASN  57 -17.736  -3.500 -13.799
  445   1HD2  ASN  57          1HD2      ASN  57 -17.756  -4.849 -12.721
  446    H    ASP  58           H        ASP  58 -19.410  -0.500 -11.098
  447    HA   ASP  58           HA       ASP  58 -20.023  -0.131  -8.386
  448   1HB   ASP  58          1HB       ASP  58 -21.671  -0.875 -10.793
  449   2HB   ASP  58          2HB       ASP  58 -22.402  -0.725  -9.197
  450    H    HIS  59           H        HIS  59 -19.085  -2.995  -9.931
  451    HA   HIS  59           HA       HIS  59 -20.537  -4.665  -8.016
  452   1HB   HIS  59          1HB       HIS  59 -19.718  -4.993 -10.799
  453   2HB   HIS  59          2HB       HIS  59 -19.159  -6.333  -9.806
  454    HD1  HIS  59           HD1      HIS  59 -21.732  -5.830 -11.951
  455    HD2  HIS  59           HD2      HIS  59 -21.693  -6.883  -7.932
  456    HE1  HIS  59           HE1      HIS  59 -23.970  -6.888 -11.512
  457    HE2  HIS  59           HE2      HIS  59 -23.932  -7.502  -9.071
  458    H    GLY  60           H        GLY  60 -17.547  -3.174  -8.330
  459   1HA   GLY  60          1HA       GLY  60 -15.840  -3.380  -6.768
  460   2HA   GLY  60          2HA       GLY  60 -16.426  -4.971  -6.313
  461    H    VAL  61           H        VAL  61 -16.078  -4.257  -9.691
  462    HA   VAL  61           HA       VAL  61 -13.845  -6.155  -9.850
  463    HB   VAL  61           HB       VAL  61 -15.534  -5.023 -12.090
  464   1HG1  VAL  61          1HG1      VAL  61 -13.591  -7.314 -11.971
  465   2HG1  VAL  61          2HG1      VAL  61 -14.645  -6.972 -13.342
  466   3HG1  VAL  61          3HG1      VAL  61 -13.399  -5.817 -12.880
  467   1HG2  VAL  61          1HG2      VAL  61 -15.821  -7.620 -10.580
  468   2HG2  VAL  61          2HG2      VAL  61 -16.964  -6.275 -10.607
  469   3HG2  VAL  61          3HG2      VAL  61 -16.676  -7.213 -12.070
  470    H    VAL  62           H        VAL  62 -11.837  -5.506 -10.453
  471    HA   VAL  62           HA       VAL  62 -11.208  -2.757 -10.491
  472    HB   VAL  62           HB       VAL  62  -9.485  -5.066 -11.381
  473   1HG1  VAL  62          1HG1      VAL  62  -8.854  -2.165 -10.828
  474   2HG1  VAL  62          2HG1      VAL  62  -7.628  -3.436 -10.769
  475   3HG1  VAL  62          3HG1      VAL  62  -8.504  -3.136 -12.260
  476   1HG2  VAL  62          1HG2      VAL  62  -9.781  -3.686  -8.723
  477   2HG2  VAL  62          2HG2      VAL  62 -10.170  -5.348  -9.086
  478   3HG2  VAL  62          3HG2      VAL  62  -8.501  -4.826  -9.105
  479    H    THR  63           H        THR  63 -11.775  -1.418 -12.075
  480    HA   THR  63           HA       THR  63 -12.020  -2.372 -14.820
  481    HB   THR  63           HB       THR  63 -13.021  -0.246 -15.286
  482    HG1  THR  63           HG1      THR  63 -11.965   1.280 -14.213
  483   1HG2  THR  63          1HG2      THR  63 -14.474  -1.821 -14.112
  484   2HG2  THR  63          2HG2      THR  63 -13.976  -1.120 -12.574
  485   3HG2  THR  63          3HG2      THR  63 -14.872  -0.143 -13.737
  486    H    SER  64           H        SER  64  -9.964  -0.236 -12.895
  487    HA   SER  64           HA       SER  64  -8.352   0.316 -15.306
  488   1HB   SER  64          1HB       SER  64  -8.861   1.785 -12.793
  489   2HB   SER  64          2HB       SER  64  -7.277   1.987 -13.520
  490    HG   SER  64           HG       SER  64  -9.789   2.772 -14.450
  491    H    VAL  65           H        VAL  65  -6.080   0.255 -15.140
  492    HA   VAL  65           HA       VAL  65  -5.104  -2.130 -14.007
  493    HB   VAL  65           HB       VAL  65  -3.326   0.128 -14.894
  494   1HG1  VAL  65          1HG1      VAL  65  -3.081  -2.872 -14.875
  495   2HG1  VAL  65          2HG1      VAL  65  -1.942  -1.803 -15.692
  496   3HG1  VAL  65          3HG1      VAL  65  -2.144  -1.711 -13.945
  497   1HG2  VAL  65          1HG2      VAL  65  -4.989  -1.720 -16.592
  498   2HG2  VAL  65          2HG2      VAL  65  -4.841   0.037 -16.660
  499   3HG2  VAL  65          3HG2      VAL  65  -3.504  -0.970 -17.184
  500   1HB   PRO  66          1HB       PRO  66  -3.195  -2.685  -8.889
  501   2HB   PRO  66          2HB       PRO  66  -4.827  -2.040  -8.970
  502   1HG   PRO  66          1HG       PRO  66  -3.744  -4.298 -10.327
  503   2HG   PRO  66          2HG       PRO  66  -5.422  -3.768 -10.294
  504   1HD   PRO  66          1HD       PRO  66  -3.358  -3.412 -12.343
  505   2HD   PRO  66          2HD       PRO  66  -5.115  -3.234 -12.462
  506    H    HIS  67           H        HIS  67  -2.109   0.862 -10.694
  507    HA   HIS  67           HA       HIS  67   0.445  -0.599 -10.468
  508   1HB   HIS  67          1HB       HIS  67   1.347   1.065 -12.167
  509   2HB   HIS  67          2HB       HIS  67   0.225  -0.138 -12.782
  510    HD1  HIS  67           HD1      HIS  67  -2.407   0.853 -12.738
  511    HD2  HIS  67           HD2      HIS  67   0.736   3.498 -13.156
  512    HE1  HIS  67           HE1      HIS  67  -3.438   2.941 -13.648
  513    HE2  HIS  67           HE2      HIS  67  -1.484   4.478 -14.051
  514    H    ILE  68           H        ILE  68   2.180   0.561  -9.660
  515    HA   ILE  68           HA       ILE  68   1.812   2.044  -7.422
  516    HB   ILE  68           HB       ILE  68   4.038   1.469  -9.196
  517   1HG1  ILE  68          1HG1      ILE  68   3.808   1.790  -6.242
  518   2HG1  ILE  68          2HG1      ILE  68   3.599   0.294  -7.121
  519   1HG2  ILE  68          1HG2      ILE  68   4.107   4.073  -7.700
  520   2HG2  ILE  68          2HG2      ILE  68   5.564   3.187  -8.154
  521   3HG2  ILE  68          3HG2      ILE  68   4.479   3.719  -9.384
  522   1HD1  ILE  68          1HD1      ILE  68   5.913   0.387  -7.844
  523   2HD1  ILE  68          2HD1      ILE  68   6.173   1.828  -6.902
  524   3HD1  ILE  68          3HD1      ILE  68   5.763   0.337  -6.094
  525    H    THR  69           H        THR  69   0.510   3.731  -7.284
  526    HA   THR  69           HA       THR  69   1.257   6.192  -8.673
  527    HB   THR  69           HB       THR  69  -1.449   4.871  -8.915
  528    HG1  THR  69           HG1      THR  69  -0.991   4.781 -11.018
  529   1HG2  THR  69          1HG2      THR  69  -0.706   7.710  -9.574
  530   2HG2  THR  69          2HG2      THR  69  -2.134   6.882 -10.183
  531   3HG2  THR  69          3HG2      THR  69  -1.947   7.163  -8.454

  No H/Q in entry =         531
  Start of MODEL    8
    1    H    SER   1           H        SER   1  11.198  10.787 -11.162
    2    HA   SER   1           HA       SER   1  13.019   8.650 -10.355
    3   1HB   SER   1          1HB       SER   1  12.149  10.476  -8.856
    4   2HB   SER   1          2HB       SER   1  10.555   9.698  -8.841
    5    HG   SER   1           HG       SER   1  11.851   9.046  -7.069
    6    H    ARG   2           H        ARG   2  12.853   6.481 -10.563
    7    HA   ARG   2           HA       ARG   2  10.327   5.016 -10.809
    8   1HB   ARG   2          1HB       ARG   2  11.658   6.167 -13.059
    9   2HB   ARG   2          2HB       ARG   2  11.908   4.436 -13.160
   10   1HG   ARG   2          1HG       ARG   2   9.414   4.182 -12.845
   11   2HG   ARG   2          2HG       ARG   2   9.306   5.931 -13.069
   12   1HD   ARG   2          1HD       ARG   2  10.743   4.213 -15.077
   13   2HD   ARG   2          2HD       ARG   2   8.998   4.335 -15.083
   14    HE   ARG   2           HE       ARG   2   9.107   6.604 -15.621
   15   1HH1  ARG   2          1HH1      ARG   2  12.313   5.149 -15.462
   16   2HH1  ARG   2          2HH1      ARG   2  13.045   6.422 -16.354
   17   1HH2  ARG   2          1HH2      ARG   2  10.123   8.279 -16.787
   18   2HH2  ARG   2          2HH2      ARG   2  11.825   8.197 -17.101
   19    H    ARG   3           H        ARG   3  11.360   4.066  -8.906
   20    HA   ARG   3           HA       ARG   3  12.528   1.584  -9.542
   21   1HB   ARG   3          1HB       ARG   3  14.396   3.734  -9.295
   22   2HB   ARG   3          2HB       ARG   3  14.617   2.706  -7.900
   23   1HG   ARG   3          1HG       ARG   3  15.434   0.990  -9.068
   24   2HG   ARG   3          2HG       ARG   3  14.413   1.277 -10.474
   25   1HD   ARG   3          1HD       ARG   3  16.069   2.288 -11.513
   26   2HD   ARG   3          2HD       ARG   3  16.176   3.491 -10.233
   27    HE   ARG   3           HE       ARG   3  17.515   0.947  -9.739
   28   1HH1  ARG   3          1HH1      ARG   3  17.831   4.275 -10.844
   29   2HH1  ARG   3          2HH1      ARG   3  19.527   4.308 -10.573
   30   1HH2  ARG   3          1HH2      ARG   3  19.760   1.029  -9.400
   31   2HH2  ARG   3          2HH2      ARG   3  20.632   2.480  -9.769
   32    H    CYS   4           H        CYS   4  10.984   0.747  -8.204
   33    HA   CYS   4           HA       CYS   4  11.488   1.128  -5.344
   34   1HB   CYS   4          1HB       CYS   4   8.804   1.333  -6.700
   35   2HB   CYS   4          2HB       CYS   4   8.983   1.081  -4.964
   36   1HB   PRO   5          1HB       PRO   5   9.852  -2.915  -2.647
   37   2HB   PRO   5          2HB       PRO   5  11.366  -3.772  -2.856
   38   1HG   PRO   5          1HG       PRO   5  11.305  -1.413  -1.619
   39   2HG   PRO   5          2HG       PRO   5  12.632  -1.847  -2.696
   40   1HD   PRO   5          1HD       PRO   5  12.021   0.103  -3.721
   41   2HD   PRO   5          2HD       PRO   5  10.333  -0.007  -3.176
   42    H    GLY   6           H        GLY   6  10.167  -5.088  -5.326
   43   1HA   GLY   6          1HA       GLY   6   8.296  -6.223  -5.952
   44   2HA   GLY   6          2HA       GLY   6   7.340  -4.973  -5.214
   45    H    LYS   7           H        LYS   7   5.955  -5.541  -7.080
   46    HA   LYS   7           HA       LYS   7   6.835  -4.563  -9.685
   47   1HB   LYS   7          1HB       LYS   7   5.543  -6.660  -9.330
   48   2HB   LYS   7          2HB       LYS   7   4.195  -5.710  -8.852
   49   1HG   LYS   7          1HG       LYS   7   3.875  -4.794 -10.939
   50   2HG   LYS   7          2HG       LYS   7   5.471  -5.275 -11.511
   51   1HD   LYS   7          1HD       LYS   7   3.519  -7.384 -10.630
   52   2HD   LYS   7          2HD       LYS   7   3.285  -6.598 -12.186
   53   1HE   LYS   7          1HE       LYS   7   4.568  -8.579 -12.527
   54   2HE   LYS   7          2HE       LYS   7   5.615  -7.187 -12.801
   55   1HZ   LYS   7          1HZ       LYS   7   5.519  -8.616 -10.195
   56   2HZ   LYS   7          2HZ       LYS   7   6.560  -9.068 -11.445
   57   3HZ   LYS   7          3HZ       LYS   7   6.694  -7.531 -10.761
   58    H    ASN   8           H        ASN   8   5.637  -2.937 -10.872
   59    HA   ASN   8           HA       ASN   8   4.385  -0.921  -9.089
   60   1HB   ASN   8          1HB       ASN   8   5.168   0.712 -10.917
   61   2HB   ASN   8          2HB       ASN   8   6.375   0.030  -9.836
   62   2HD2  ASN   8          2HD2      ASN   8   8.190  -0.353 -10.900
   63   1HD2  ASN   8          1HD2      ASN   8   8.289  -1.035 -12.483
   64    H    ALA   9           H        ALA   9   3.550  -3.077 -11.458
   65    HA   ALA   9           HA       ALA   9   1.053  -1.734 -11.921
   66   1HB   ALA   9          1HB       ALA   9   2.864  -2.332 -14.252
   67   2HB   ALA   9          2HB       ALA   9   1.196  -1.757 -14.351
   68   3HB   ALA   9          3HB       ALA   9   2.446  -0.728 -13.652
   69    H    TRP  10           H        TRP  10  -0.537  -3.200 -12.019
   70    HA   TRP  10           HA       TRP  10   0.208  -6.011 -12.583
   71   1HB   TRP  10          1HB       TRP  10  -1.698  -4.853 -10.565
   72   2HB   TRP  10          2HB       TRP  10  -1.694  -6.547 -11.038
   73    HD1  TRP  10           HD1      TRP  10   0.202  -8.103 -10.068
   74    HE1  TRP  10           HE1      TRP  10   2.041  -7.739  -8.304
   75    HE3  TRP  10           HE3      TRP  10  -0.124  -3.042  -9.557
   76    HZ2  TRP  10           HZ2      TRP  10   3.195  -5.582  -6.885
   77    HZ3  TRP  10           HZ3      TRP  10   1.365  -1.891  -7.995
   78    HH2  TRP  10           HH2      TRP  10   2.981  -3.143  -6.659
   79   1HB   PRO  11          1HB       PRO  11  -1.805  -5.042 -17.813
   80   2HB   PRO  11          2HB       PRO  11  -1.291  -6.651 -17.298
   81   1HG   PRO  11          1HG       PRO  11   0.735  -5.554 -17.178
   82   2HG   PRO  11          2HG       PRO  11  -0.021  -3.998 -16.792
   83   1HD   PRO  11          1HD       PRO  11   0.654  -4.551 -14.701
   84   2HD   PRO  11          2HD       PRO  11   0.612  -6.292 -14.989
   85    H    GLU  12           H        GLU  12  -1.631  -7.795 -14.982
   86    HA   GLU  12           HA       GLU  12  -3.810  -9.274 -15.955
   87   1HB   GLU  12          1HB       GLU  12  -1.635 -10.246 -15.366
   88   2HB   GLU  12          2HB       GLU  12  -2.978 -11.092 -14.610
   89   1HG   GLU  12          1HG       GLU  12  -2.308  -9.249 -12.674
   90   2HG   GLU  12          2HG       GLU  12  -1.822 -10.937 -12.736
   91    H    LEU  13           H        LEU  13  -3.782  -7.090 -13.350
   92    HA   LEU  13           HA       LEU  13  -5.749  -8.505 -11.781
   93   1HB   LEU  13          1HB       LEU  13  -4.488  -5.796 -11.580
   94   2HB   LEU  13          2HB       LEU  13  -5.820  -6.256 -10.548
   95    HG   LEU  13           HG       LEU  13  -3.131  -7.619 -10.672
   96   1HD1  LEU  13          1HD1      LEU  13  -3.135  -5.403  -9.562
   97   2HD1  LEU  13          2HD1      LEU  13  -4.363  -5.955  -8.486
   98   3HD1  LEU  13          3HD1      LEU  13  -2.773  -6.707  -8.460
   99   1HD2  LEU  13          1HD2      LEU  13  -5.694  -8.297  -9.313
  100   2HD2  LEU  13          2HD2      LEU  13  -4.513  -9.335 -10.101
  101   3HD2  LEU  13          3HD2      LEU  13  -4.179  -8.665  -8.535
  102    H    VAL  14           H        VAL  14  -5.710  -6.250 -14.394
  103    HA   VAL  14           HA       VAL  14  -8.173  -4.975 -14.030
  104    HB   VAL  14           HB       VAL  14  -6.957  -5.799 -16.683
  105   1HG1  VAL  14          1HG1      VAL  14  -8.932  -3.638 -15.943
  106   2HG1  VAL  14          2HG1      VAL  14  -8.157  -3.789 -17.520
  107   3HG1  VAL  14          3HG1      VAL  14  -9.238  -5.053 -16.949
  108   1HG2  VAL  14          1HG2      VAL  14  -5.381  -4.526 -15.178
  109   2HG2  VAL  14          2HG2      VAL  14  -5.781  -3.741 -16.687
  110   3HG2  VAL  14          3HG2      VAL  14  -6.551  -3.211 -15.196
  111    H    GLY  15           H        GLY  15 -10.076  -5.982 -13.681
  112   1HA   GLY  15          1HA       GLY  15 -11.913  -7.139 -14.735
  113   2HA   GLY  15          2HA       GLY  15 -10.779  -8.296 -15.406
  114    H    LYS  16           H        LYS  16  -9.572  -7.808 -12.429
  115    HA   LYS  16           HA       LYS  16 -11.039 -10.111 -11.330
  116   1HB   LYS  16          1HB       LYS  16  -8.275  -9.160 -11.241
  117   2HB   LYS  16          2HB       LYS  16  -8.878  -9.557  -9.650
  118   1HG   LYS  16          1HG       LYS  16  -9.422 -11.531 -11.808
  119   2HG   LYS  16          2HG       LYS  16  -7.740 -11.294 -11.348
  120   1HD   LYS  16          1HD       LYS  16  -9.073 -11.455  -8.910
  121   2HD   LYS  16          2HD       LYS  16  -8.078 -12.687  -9.659
  122   1HE   LYS  16          1HE       LYS  16 -11.047 -12.361  -9.977
  123   2HE   LYS  16          2HE       LYS  16 -10.061 -13.571 -10.801
  124   1HZ   LYS  16          1HZ       LYS  16  -9.437 -14.459  -8.614
  125   2HZ   LYS  16          2HZ       LYS  16 -10.458 -13.332  -7.866
  126   3HZ   LYS  16          3HZ       LYS  16 -11.107 -14.521  -8.876
  127    H    SER  17           H        SER  17 -11.336 -10.102  -8.924
  128    HA   SER  17           HA       SER  17 -12.955  -7.907  -8.196
  129   1HB   SER  17          1HB       SER  17 -12.975 -10.350  -7.301
  130   2HB   SER  17          2HB       SER  17 -13.375  -9.033  -6.199
  131    HG   SER  17           HG       SER  17 -11.867 -10.520  -5.300
  132    H    GLY  18           H        GLY  18 -12.631  -6.173  -6.816
  133   1HA   GLY  18          1HA       GLY  18 -10.154  -4.923  -6.726
  134   2HA   GLY  18          2HA       GLY  18 -11.484  -4.581  -5.648
  135    H    ASN  19           H        ASN  19 -11.546  -7.268  -4.506
  136    HA   ASN  19           HA       ASN  19  -9.649  -6.863  -2.426
  137   1HB   ASN  19          1HB       ASN  19 -11.927  -8.036  -2.290
  138   2HB   ASN  19          2HB       ASN  19 -11.131  -9.453  -2.966
  139   2HD2  ASN  19          2HD2      ASN  19 -12.349  -8.774  -0.266
  140   1HD2  ASN  19          1HD2      ASN  19 -11.118  -9.232   0.854
  141    H    MET  20           H        MET  20  -9.862  -9.074  -5.183
  142    HA   MET  20           HA       MET  20  -7.540 -10.567  -4.549
  143   1HB   MET  20          1HB       MET  20  -9.527 -10.709  -6.490
  144   2HB   MET  20          2HB       MET  20  -8.111 -10.306  -7.426
  145   1HG   MET  20          1HG       MET  20  -8.441 -12.706  -7.297
  146   2HG   MET  20          2HG       MET  20  -8.434 -12.630  -5.547
  147   1HE   MET  20          1HE       MET  20  -6.462 -11.900  -8.755
  148   2HE   MET  20          2HE       MET  20  -5.876 -10.515  -7.853
  149   3HE   MET  20          3HE       MET  20  -4.792 -11.848  -8.241
  150    H    ALA  21           H        ALA  21  -8.111  -7.577  -6.311
  151    HA   ALA  21           HA       ALA  21  -5.549  -7.318  -7.446
  152   1HB   ALA  21          1HB       ALA  21  -7.780  -5.427  -6.857
  153   2HB   ALA  21          2HB       ALA  21  -7.085  -5.912  -8.403
  154   3HB   ALA  21          3HB       ALA  21  -6.210  -4.793  -7.369
  155    H    ALA  22           H        ALA  22  -6.930  -5.688  -4.601
  156    HA   ALA  22           HA       ALA  22  -4.639  -4.485  -3.653
  157   1HB   ALA  22          1HB       ALA  22  -5.793  -5.032  -1.306
  158   2HB   ALA  22          2HB       ALA  22  -6.434  -3.844  -2.430
  159   3HB   ALA  22          3HB       ALA  22  -7.135  -5.456  -2.371
  160    H    ALA  23           H        ALA  23  -5.829  -7.747  -2.863
  161    HA   ALA  23           HA       ALA  23  -3.748  -8.488  -1.145
  162   1HB   ALA  23          1HB       ALA  23  -5.821  -9.762  -1.372
  163   2HB   ALA  23          2HB       ALA  23  -4.410 -10.795  -1.590
  164   3HB   ALA  23          3HB       ALA  23  -5.344 -10.265  -2.992
  165    H    THR  24           H        THR  24  -4.045  -8.822  -4.667
  166    HA   THR  24           HA       THR  24  -1.664 -10.245  -5.107
  167    HB   THR  24           HB       THR  24  -3.070  -8.264  -6.902
  168    HG1  THR  24           HG1      THR  24  -3.281 -11.101  -6.698
  169   1HG2  THR  24          1HG2      THR  24  -1.096 -10.408  -7.627
  170   2HG2  THR  24          2HG2      THR  24  -2.045  -9.456  -8.760
  171   3HG2  THR  24          3HG2      THR  24  -0.836  -8.670  -7.754
  172    H    VAL  25           H        VAL  25  -2.301  -6.760  -4.968
  173    HA   VAL  25           HA       VAL  25   0.341  -5.967  -5.667
  174    HB   VAL  25           HB       VAL  25  -1.663  -4.367  -4.057
  175   1HG1  VAL  25          1HG1      VAL  25   0.987  -3.806  -5.010
  176   2HG1  VAL  25          2HG1      VAL  25  -0.159  -2.781  -5.849
  177   3HG1  VAL  25          3HG1      VAL  25  -0.121  -2.788  -4.099
  178   1HG2  VAL  25          1HG2      VAL  25  -2.190  -5.424  -6.542
  179   2HG2  VAL  25          2HG2      VAL  25  -2.890  -3.965  -5.869
  180   3HG2  VAL  25          3HG2      VAL  25  -1.508  -3.869  -6.949
  181    H    GLU  26           H        GLU  26  -1.323  -6.155  -2.524
  182    HA   GLU  26           HA       GLU  26   0.946  -5.383  -0.996
  183   1HB   GLU  26          1HB       GLU  26  -0.291  -6.005   0.921
  184   2HB   GLU  26          2HB       GLU  26  -1.291  -7.130   0.023
  185   1HG   GLU  26          1HG       GLU  26  -1.772  -4.687  -1.239
  186   2HG   GLU  26          2HG       GLU  26  -2.821  -5.560  -0.132
  187    H    ARG  27           H        ARG  27  -0.123  -8.455  -2.301
  188    HA   ARG  27           HA       ARG  27   1.694 -10.004  -0.666
  189   1HB   ARG  27          1HB       ARG  27  -0.517 -10.830  -1.567
  190   2HB   ARG  27          2HB       ARG  27   0.235 -10.919  -3.158
  191   1HG   ARG  27          1HG       ARG  27   1.948 -12.452  -2.110
  192   2HG   ARG  27          2HG       ARG  27   0.946 -12.439  -0.657
  193   1HD   ARG  27          1HD       ARG  27   0.062 -14.252  -1.605
  194   2HD   ARG  27          2HD       ARG  27  -0.948 -13.080  -2.447
  195    HE   ARG  27           HE       ARG  27   1.134 -13.300  -4.129
  196   1HH1  ARG  27          1HH1      ARG  27  -0.831 -15.753  -2.540
  197   2HH1  ARG  27          2HH1      ARG  27  -0.602 -16.898  -3.804
  198   1HH2  ARG  27          1HH2      ARG  27   1.408 -14.840  -5.781
  199   2HH2  ARG  27          2HH2      ARG  27   0.658 -16.395  -5.639
  200    H    GLU  28           H        GLU  28   1.457  -9.343  -4.183
  201    HA   GLU  28           HA       GLU  28   3.983 -10.451  -4.804
  202   1HB   GLU  28          1HB       GLU  28   2.156  -8.528  -6.221
  203   2HB   GLU  28          2HB       GLU  28   3.759  -8.827  -6.848
  204   1HG   GLU  28          1HG       GLU  28   2.908 -11.373  -6.506
  205   2HG   GLU  28          2HG       GLU  28   1.380 -10.554  -6.838
  206    H    ASN  29           H        ASN  29   3.001  -7.284  -3.657
  207    HA   ASN  29           HA       ASN  29   5.851  -6.500  -3.590
  208   1HB   ASN  29          1HB       ASN  29   4.575  -5.282  -5.328
  209   2HB   ASN  29          2HB       ASN  29   3.495  -4.663  -4.087
  210   2HD2  ASN  29          2HD2      ASN  29   5.354  -3.283  -5.936
  211   1HD2  ASN  29          1HD2      ASN  29   6.377  -2.346  -4.907
  212    H    ARG  30           H        ARG  30   5.792  -7.446  -1.465
  213    HA   ARG  30           HA       ARG  30   4.137  -6.483   0.620
  214   1HB   ARG  30          1HB       ARG  30   5.825  -7.486   2.134
  215   2HB   ARG  30          2HB       ARG  30   5.298  -8.564   0.849
  216   1HG   ARG  30          1HG       ARG  30   7.460  -7.621  -0.373
  217   2HG   ARG  30          2HG       ARG  30   7.932  -7.238   1.278
  218   1HD   ARG  30          1HD       ARG  30   8.153  -9.410   1.879
  219   2HD   ARG  30          2HD       ARG  30   6.882  -9.964   0.786
  220    HE   ARG  30           HE       ARG  30   9.278  -9.033  -0.541
  221   1HH1  ARG  30          1HH1      ARG  30   7.666 -11.803   0.913
  222   2HH1  ARG  30          2HH1      ARG  30   8.589 -12.943   0.010
  223   1HH2  ARG  30          1HH2      ARG  30  10.484 -10.568  -1.711
  224   2HH2  ARG  30          2HH2      ARG  30  10.189 -12.257  -1.469
  225    H    ASN  31           H        ASN  31   6.267  -4.662  -1.131
  226    HA   ASN  31           HA       ASN  31   7.264  -3.116   1.137
  227   1HB   ASN  31          1HB       ASN  31   8.843  -3.753  -0.638
  228   2HB   ASN  31          2HB       ASN  31   7.862  -2.895  -1.816
  229   2HD2  ASN  31          2HD2      ASN  31  10.038  -2.568   0.885
  230   1HD2  ASN  31          1HD2      ASN  31  10.353  -0.885   0.657
  231    H    VAL  32           H        VAL  32   4.544  -3.174  -0.831
  232    HA   VAL  32           HA       VAL  32   3.916  -0.408  -0.124
  233    HB   VAL  32           HB       VAL  32   3.250   0.185  -2.368
  234   1HG1  VAL  32          1HG1      VAL  32   5.621   0.572  -1.663
  235   2HG1  VAL  32          2HG1      VAL  32   6.049  -0.951  -2.430
  236   3HG1  VAL  32          3HG1      VAL  32   5.448   0.357  -3.394
  237   1HG2  VAL  32          1HG2      VAL  32   3.747  -2.657  -2.933
  238   2HG2  VAL  32          2HG2      VAL  32   2.540  -1.562  -3.562
  239   3HG2  VAL  32          3HG2      VAL  32   4.170  -1.506  -4.205
  240    H    HIS  33           H        HIS  33   1.580   0.108  -0.630
  241    HA   HIS  33           HA       HIS  33  -0.070  -2.343  -0.598
  242   1HB   HIS  33          1HB       HIS  33  -1.603  -0.929   1.004
  243   2HB   HIS  33          2HB       HIS  33  -0.235  -1.831   1.635
  244    HD1  HIS  33           HD1      HIS  33   0.746  -0.511   3.449
  245    HD2  HIS  33           HD2      HIS  33  -0.472   1.890   0.294
  246    HE1  HIS  33           HE1      HIS  33   1.412   1.828   4.089
  247    HE2  HIS  33           HE2      HIS  33   0.819   3.237   2.088
  248    H    ALA  34           H        ALA  34  -2.208  -2.151  -1.355
  249    HA   ALA  34           HA       ALA  34  -2.564   0.133  -3.190
  250   1HB   ALA  34          1HB       ALA  34  -3.861  -2.552  -3.508
  251   2HB   ALA  34          2HB       ALA  34  -2.267  -2.197  -4.143
  252   3HB   ALA  34          3HB       ALA  34  -3.650  -1.276  -4.702
  253    H    ILE  35           H        ILE  35  -4.588   1.098  -3.395
  254    HA   ILE  35           HA       ILE  35  -6.461   0.533  -1.170
  255    HB   ILE  35           HB       ILE  35  -6.158   3.120  -2.679
  256   1HG1  ILE  35          1HG1      ILE  35  -5.363   3.472   0.004
  257   2HG1  ILE  35          2HG1      ILE  35  -4.555   2.001  -0.513
  258   1HG2  ILE  35          1HG2      ILE  35  -7.714   2.359  -0.214
  259   2HG2  ILE  35          2HG2      ILE  35  -7.472   4.018  -0.759
  260   3HG2  ILE  35          3HG2      ILE  35  -8.357   2.883  -1.769
  261   1HD1  ILE  35          1HD1      ILE  35  -3.945   3.504  -2.608
  262   2HD1  ILE  35          2HD1      ILE  35  -4.209   4.790  -1.426
  263   3HD1  ILE  35          3HD1      ILE  35  -3.027   3.524  -1.103
  264    H    VAL  36           H        VAL  36  -8.211  -0.521  -1.837
  265    HA   VAL  36           HA       VAL  36  -9.061  -0.428  -4.595
  266    HB   VAL  36           HB       VAL  36 -10.283  -1.857  -2.249
  267   1HG1  VAL  36          1HG1      VAL  36 -10.768  -2.166  -5.207
  268   2HG1  VAL  36          2HG1      VAL  36 -11.421  -3.206  -3.957
  269   3HG1  VAL  36          3HG1      VAL  36 -11.906  -1.522  -4.039
  270   1HG2  VAL  36          1HG2      VAL  36  -7.901  -2.480  -2.937
  271   2HG2  VAL  36          2HG2      VAL  36  -9.096  -3.761  -2.872
  272   3HG2  VAL  36          3HG2      VAL  36  -8.617  -3.094  -4.407
  273    H    LEU  37           H        LEU  37 -10.188   1.199  -5.320
  274    HA   LEU  37           HA       LEU  37 -12.503   2.155  -3.760
  275   1HB   LEU  37          1HB       LEU  37 -11.879   4.441  -4.822
  276   2HB   LEU  37          2HB       LEU  37 -11.129   3.921  -3.342
  277    HG   LEU  37           HG       LEU  37  -9.254   2.991  -4.988
  278   1HD1  LEU  37          1HD1      LEU  37 -10.563   3.623  -7.017
  279   2HD1  LEU  37          2HD1      LEU  37 -10.351   5.305  -6.564
  280   3HD1  LEU  37          3HD1      LEU  37  -8.953   4.306  -6.935
  281   1HD2  LEU  37          1HD2      LEU  37  -9.684   5.635  -3.746
  282   2HD2  LEU  37          2HD2      LEU  37  -8.422   4.433  -3.508
  283   3HD2  LEU  37          3HD2      LEU  37  -8.376   5.494  -4.914
  284    H    LYS  38           H        LYS  38 -14.193   3.049  -5.093
  285    HA   LYS  38           HA       LYS  38 -14.279   1.720  -7.667
  286   1HB   LYS  38          1HB       LYS  38 -16.283   3.080  -5.920
  287   2HB   LYS  38          2HB       LYS  38 -16.647   2.919  -7.626
  288   1HG   LYS  38          1HG       LYS  38 -16.157   0.463  -7.369
  289   2HG   LYS  38          2HG       LYS  38 -17.640   1.068  -6.673
  290   1HD   LYS  38          1HD       LYS  38 -15.116   0.817  -5.032
  291   2HD   LYS  38          2HD       LYS  38 -16.199  -0.543  -5.275
  292   1HE   LYS  38          1HE       LYS  38 -17.062   2.116  -4.146
  293   2HE   LYS  38          2HE       LYS  38 -16.629   0.708  -3.183
  294   1HZ   LYS  38          1HZ       LYS  38 -18.418  -0.517  -4.408
  295   2HZ   LYS  38          2HZ       LYS  38 -18.961   0.718  -3.391
  296   3HZ   LYS  38          3HZ       LYS  38 -18.908   0.968  -5.057
  297    H    GLU  39           H        GLU  39 -14.945   2.765  -9.622
  298    HA   GLU  39           HA       GLU  39 -13.384   4.938 -10.346
  299   1HB   GLU  39          1HB       GLU  39 -15.032   3.192 -11.678
  300   2HB   GLU  39          2HB       GLU  39 -15.921   4.692 -11.851
  301   1HG   GLU  39          1HG       GLU  39 -14.547   5.436 -13.402
  302   2HG   GLU  39          2HG       GLU  39 -13.114   5.114 -12.430
  303    H    GLY  40           H        GLY  40 -13.432   6.950  -9.607
  304   1HA   GLY  40          1HA       GLY  40 -14.710   9.040  -9.784
  305   2HA   GLY  40          2HA       GLY  40 -16.086   8.195  -9.098
  306    H    SER  41           H        SER  41 -13.662   6.862  -7.439
  307    HA   SER  41           HA       SER  41 -14.187   8.321  -5.075
  308   1HB   SER  41          1HB       SER  41 -13.528   5.952  -5.051
  309   2HB   SER  41          2HB       SER  41 -11.947   6.385  -5.700
  310    HG   SER  41           HG       SER  41 -13.025   6.953  -3.153
  311    H    ALA  42           H        ALA  42 -11.933   8.815  -3.752
  312    HA   ALA  42           HA       ALA  42 -10.841  11.136  -5.158
  313   1HB   ALA  42          1HB       ALA  42 -10.014  11.824  -3.019
  314   2HB   ALA  42          2HB       ALA  42 -10.407  10.260  -2.300
  315   3HB   ALA  42          3HB       ALA  42 -11.697  11.332  -2.845
  316    H    MET  43           H        MET  43  -9.330  10.394  -6.588
  317    HA   MET  43           HA       MET  43  -7.051   8.920  -5.454
  318   1HB   MET  43          1HB       MET  43  -6.725   7.997  -7.784
  319   2HB   MET  43          2HB       MET  43  -8.058   7.359  -6.847
  320   1HG   MET  43          1HG       MET  43  -9.106   9.551  -8.314
  321   2HG   MET  43          2HG       MET  43  -9.469   7.841  -8.451
  322   1HE   MET  43          1HE       MET  43  -8.060   6.219  -9.657
  323   2HE   MET  43          2HE       MET  43  -7.272   6.550 -11.200
  324   3HE   MET  43          3HE       MET  43  -6.387   6.777  -9.693
  325    H    THR  44           H        THR  44  -5.581  10.474  -5.168
  326    HA   THR  44           HA       THR  44  -5.322  12.729  -6.853
  327    HB   THR  44           HB       THR  44  -2.886  12.619  -5.681
  328    HG1  THR  44           HG1      THR  44  -3.415  10.497  -4.829
  329   1HG2  THR  44          1HG2      THR  44  -4.531  14.363  -5.266
  330   2HG2  THR  44          2HG2      THR  44  -5.402  13.280  -4.178
  331   3HG2  THR  44          3HG2      THR  44  -3.767  13.804  -3.778
  332    H    LYS  45           H        LYS  45  -3.429  13.260  -8.166
  333    HA   LYS  45           HA       LYS  45  -2.782  11.010  -9.917
  334   1HB   LYS  45          1HB       LYS  45  -2.690  13.980 -10.112
  335   2HB   LYS  45          2HB       LYS  45  -1.537  13.072 -11.082
  336   1HG   LYS  45          1HG       LYS  45  -3.865  11.731 -11.620
  337   2HG   LYS  45          2HG       LYS  45  -4.438  13.376 -11.355
  338   1HD   LYS  45          1HD       LYS  45  -3.945  13.650 -13.518
  339   2HD   LYS  45          2HD       LYS  45  -2.297  13.890 -12.944
  340   1HE   LYS  45          1HE       LYS  45  -3.404  11.191 -13.737
  341   2HE   LYS  45          2HE       LYS  45  -2.593  12.278 -14.859
  342   1HZ   LYS  45          1HZ       LYS  45  -0.618  12.204 -13.456
  343   2HZ   LYS  45          2HZ       LYS  45  -1.396  11.143 -12.387
  344   3HZ   LYS  45          3HZ       LYS  45  -1.061  10.653 -13.970
  345    H    ASP  46           H        ASP  46  -1.300  12.907  -7.436
  346    HA   ASP  46           HA       ASP  46   1.359  12.846  -7.987
  347   1HB   ASP  46          1HB       ASP  46  -0.064  12.322  -5.374
  348   2HB   ASP  46          2HB       ASP  46   1.685  12.529  -5.475
  349    H    PHE  47           H        PHE  47   3.027  11.399  -7.921
  350    HA   PHE  47           HA       PHE  47   2.285   8.603  -8.162
  351   1HB   PHE  47          1HB       PHE  47   3.839   9.442  -9.766
  352   2HB   PHE  47          2HB       PHE  47   4.891  10.081  -8.508
  353    HD1  PHE  47           HD1      PHE  47   3.835   7.090 -10.306
  354    HD2  PHE  47           HD2      PHE  47   6.310   8.606  -7.188
  355    HE1  PHE  47           HE1      PHE  47   5.075   4.981 -10.262
  356    HE2  PHE  47           HE2      PHE  47   7.543   6.499  -7.141
  357    HZ   PHE  47           HZ       PHE  47   6.915   4.660  -8.672
  358    H    ARG  48           H        ARG  48   2.549   7.059  -6.670
  359    HA   ARG  48           HA       ARG  48   4.396   7.440  -4.424
  360   1HB   ARG  48          1HB       ARG  48   1.413   7.174  -4.173
  361   2HB   ARG  48          2HB       ARG  48   2.471   6.598  -2.901
  362   1HG   ARG  48          1HG       ARG  48   3.412   8.855  -2.691
  363   2HG   ARG  48          2HG       ARG  48   2.304   9.416  -3.945
  364   1HD   ARG  48          1HD       ARG  48   0.423   8.653  -2.514
  365   2HD   ARG  48          2HD       ARG  48   1.356   9.974  -1.855
  366    HE   ARG  48           HE       ARG  48   1.842   7.173  -1.031
  367   1HH1  ARG  48          1HH1      ARG  48   0.945  10.464  -0.155
  368   2HH1  ARG  48          2HH1      ARG  48   1.068  10.150   1.529
  369   1HH2  ARG  48          1HH2      ARG  48   1.993   6.804   1.202
  370   2HH2  ARG  48          2HH2      ARG  48   1.658   8.092   2.310
  371    H    CYS  49           H        CYS  49   5.622   5.679  -4.573
  372    HA   CYS  49           HA       CYS  49   4.919   3.286  -5.815
  373   1HB   CYS  49          1HB       CYS  49   7.032   3.877  -3.767
  374   2HB   CYS  49          2HB       CYS  49   6.896   2.318  -4.572
  375    H    ASP  50           H        ASP  50   4.683   4.253  -2.441
  376    HA   ASP  50           HA       ASP  50   3.863   1.658  -1.558
  377   1HB   ASP  50          1HB       ASP  50   3.403   2.756   0.598
  378   2HB   ASP  50          2HB       ASP  50   5.037   3.009  -0.004
  379    H    ARG  51           H        ARG  51   2.257   4.036  -3.262
  380    HA   ARG  51           HA       ARG  51  -0.328   3.134  -2.207
  381   1HB   ARG  51          1HB       ARG  51   0.328   5.579  -1.877
  382   2HB   ARG  51          2HB       ARG  51   0.155   5.741  -3.616
  383   1HG   ARG  51          1HG       ARG  51  -2.209   4.801  -3.299
  384   2HG   ARG  51          2HG       ARG  51  -1.916   5.115  -1.584
  385   1HD   ARG  51          1HD       ARG  51  -1.377   7.456  -2.161
  386   2HD   ARG  51          2HD       ARG  51  -3.058   6.995  -2.422
  387    HE   ARG  51           HE       ARG  51  -2.119   6.594  -4.857
  388   1HH1  ARG  51          1HH1      ARG  51  -1.541   9.307  -2.684
  389   2HH1  ARG  51          2HH1      ARG  51  -1.287  10.413  -3.974
  390   1HH2  ARG  51          1HH2      ARG  51  -1.838   8.113  -6.529
  391   2HH2  ARG  51          2HH2      ARG  51  -1.446   9.746  -6.148
  392    H    VAL  52           H        VAL  52  -1.030   1.612  -3.554
  393    HA   VAL  52           HA       VAL  52  -0.829   2.089  -6.466
  394    HB   VAL  52           HB       VAL  52  -1.413  -0.485  -5.011
  395   1HG1  VAL  52          1HG1      VAL  52  -1.135   0.196  -7.910
  396   2HG1  VAL  52          2HG1      VAL  52  -0.921  -1.444  -7.326
  397   3HG1  VAL  52          3HG1      VAL  52  -2.459  -0.622  -7.106
  398   1HG2  VAL  52          1HG2      VAL  52   1.119   0.693  -6.016
  399   2HG2  VAL  52          2HG2      VAL  52   0.801  -0.225  -4.557
  400   3HG2  VAL  52          3HG2      VAL  52   0.904  -1.042  -6.107
  401    H    TRP  53           H        TRP  53  -2.650   2.851  -7.379
  402    HA   TRP  53           HA       TRP  53  -5.109   2.863  -5.902
  403   1HB   TRP  53          1HB       TRP  53  -4.305   3.861  -8.616
  404   2HB   TRP  53          2HB       TRP  53  -5.996   3.844  -8.154
  405    HD1  TRP  53           HD1      TRP  53  -3.950   6.418  -8.733
  406    HE1  TRP  53           HE1      TRP  53  -4.069   8.349  -7.035
  407    HE3  TRP  53           HE3      TRP  53  -6.055   3.937  -4.814
  408    HZ2  TRP  53           HZ2      TRP  53  -4.904   8.746  -4.376
  409    HZ3  TRP  53           HZ3      TRP  53  -6.479   5.154  -2.736
  410    HH2  TRP  53           HH2      TRP  53  -5.922   7.513  -2.518
  411    H    VAL  54           H        VAL  54  -6.905   1.657  -6.149
  412    HA   VAL  54           HA       VAL  54  -6.901  -0.361  -8.317
  413    HB   VAL  54           HB       VAL  54  -7.531  -0.747  -5.403
  414   1HG1  VAL  54          1HG1      VAL  54  -8.435  -2.293  -7.780
  415   2HG1  VAL  54          2HG1      VAL  54  -8.003  -3.183  -6.329
  416   3HG1  VAL  54          3HG1      VAL  54  -9.261  -1.970  -6.267
  417   1HG2  VAL  54          1HG2      VAL  54  -5.176  -0.956  -6.125
  418   2HG2  VAL  54          2HG2      VAL  54  -5.855  -2.431  -5.441
  419   3HG2  VAL  54          3HG2      VAL  54  -5.673  -2.273  -7.185
  420    H    ILE  55           H        ILE  55  -8.230   1.077  -9.487
  421    HA   ILE  55           HA       ILE  55 -10.747   1.948  -8.416
  422    HB   ILE  55           HB       ILE  55  -9.879   1.974 -11.287
  423   1HG1  ILE  55          1HG1      ILE  55  -9.708   4.471  -9.704
  424   2HG1  ILE  55          2HG1      ILE  55  -8.538   3.253  -9.240
  425   1HG2  ILE  55          1HG2      ILE  55 -11.988   3.493  -9.772
  426   2HG2  ILE  55          2HG2      ILE  55 -11.461   3.906 -11.403
  427   3HG2  ILE  55          3HG2      ILE  55 -12.224   2.351 -11.096
  428   1HD1  ILE  55          1HD1      ILE  55  -8.258   3.222 -11.921
  429   2HD1  ILE  55          2HD1      ILE  55  -8.695   4.885 -11.641
  430   3HD1  ILE  55          3HD1      ILE  55  -7.309   4.185 -10.824
  431    H    VAL  56           H        VAL  56 -12.531   0.767  -8.312
  432    HA   VAL  56           HA       VAL  56 -12.858  -1.459 -10.195
  433    HB   VAL  56           HB       VAL  56 -14.168  -2.589  -8.442
  434   1HG1  VAL  56          1HG1      VAL  56 -11.289  -2.140  -8.368
  435   2HG1  VAL  56          2HG1      VAL  56 -11.949  -2.666  -6.827
  436   3HG1  VAL  56          3HG1      VAL  56 -12.206  -3.635  -8.248
  437   1HG2  VAL  56          1HG2      VAL  56 -13.227  -0.324  -6.703
  438   2HG2  VAL  56          2HG2      VAL  56 -14.862  -0.765  -7.125
  439   3HG2  VAL  56          3HG2      VAL  56 -13.933  -1.813  -6.099
  440    H    ASN  57           H        ASN  57 -15.100  -2.070 -10.638
  441    HA   ASN  57           HA       ASN  57 -16.655   0.302 -11.211
  442   1HB   ASN  57          1HB       ASN  57 -16.470  -1.518 -12.844
  443   2HB   ASN  57          2HB       ASN  57 -18.135  -1.213 -12.427
  444   2HD2  ASN  57          2HD2      ASN  57 -17.492  -3.548 -13.617
  445   1HD2  ASN  57          1HD2      ASN  57 -17.628  -4.839 -12.478
  446    H    ASP  58           H        ASP  58 -19.236  -0.403 -11.014
  447    HA   ASP  58           HA       ASP  58 -19.856   0.140  -8.347
  448   1HB   ASP  58          1HB       ASP  58 -21.237   0.186 -10.720
  449   2HB   ASP  58          2HB       ASP  58 -21.995  -1.185  -9.920
  450    H    HIS  59           H        HIS  59 -19.201  -2.884  -9.883
  451    HA   HIS  59           HA       HIS  59 -20.513  -4.405  -7.777
  452   1HB   HIS  59          1HB       HIS  59 -19.810  -4.887 -10.532
  453   2HB   HIS  59          2HB       HIS  59 -19.070  -6.126  -9.526
  454    HD1  HIS  59           HD1      HIS  59 -21.328  -6.413  -7.418
  455    HD2  HIS  59           HD2      HIS  59 -21.911  -6.302 -11.531
  456    HE1  HIS  59           HE1      HIS  59 -23.528  -7.562  -7.815
  457    HE2  HIS  59           HE2      HIS  59 -23.895  -7.421 -10.304
  458    H    GLY  60           H        GLY  60 -17.503  -2.977  -8.228
  459   1HA   GLY  60          1HA       GLY  60 -15.781  -3.075  -6.680
  460   2HA   GLY  60          2HA       GLY  60 -16.380  -4.614  -6.088
  461    H    VAL  61           H        VAL  61 -16.027  -4.073  -9.510
  462    HA   VAL  61           HA       VAL  61 -13.912  -6.101  -9.598
  463    HB   VAL  61           HB       VAL  61 -15.502  -4.931 -11.877
  464   1HG1  VAL  61          1HG1      VAL  61 -13.704  -7.327 -11.710
  465   2HG1  VAL  61          2HG1      VAL  61 -14.730  -6.931 -13.089
  466   3HG1  VAL  61          3HG1      VAL  61 -13.421  -5.850 -12.629
  467   1HG2  VAL  61          1HG2      VAL  61 -15.961  -7.433 -10.266
  468   2HG2  VAL  61          2HG2      VAL  61 -17.041  -6.050 -10.426
  469   3HG2  VAL  61          3HG2      VAL  61 -16.745  -7.095 -11.811
  470    H    VAL  62           H        VAL  62 -11.876  -5.633 -10.262
  471    HA   VAL  62           HA       VAL  62 -11.024  -2.921 -10.356
  472    HB   VAL  62           HB       VAL  62  -9.476  -5.369 -11.230
  473   1HG1  VAL  62          1HG1      VAL  62  -8.580  -2.601 -10.405
  474   2HG1  VAL  62          2HG1      VAL  62  -7.526  -3.987 -10.666
  475   3HG1  VAL  62          3HG1      VAL  62  -8.445  -3.339 -12.001
  476   1HG2  VAL  62          1HG2      VAL  62 -10.512  -5.019  -8.741
  477   2HG2  VAL  62          2HG2      VAL  62  -9.030  -5.870  -9.102
  478   3HG2  VAL  62          3HG2      VAL  62  -8.971  -4.196  -8.573
  479    H    THR  63           H        THR  63 -11.680  -1.658 -11.985
  480    HA   THR  63           HA       THR  63 -11.841  -2.689 -14.710
  481    HB   THR  63           HB       THR  63 -12.865  -0.588 -15.257
  482    HG1  THR  63           HG1      THR  63 -11.837   0.969 -14.178
  483   1HG2  THR  63          1HG2      THR  63 -14.302  -2.192 -14.044
  484   2HG2  THR  63          2HG2      THR  63 -13.895  -1.356 -12.543
  485   3HG2  THR  63          3HG2      THR  63 -14.768  -0.506 -13.816
  486    H    SER  64           H        SER  64  -9.849  -0.493 -12.788
  487    HA   SER  64           HA       SER  64  -8.255   0.164 -15.172
  488   1HB   SER  64          1HB       SER  64  -9.131   1.792 -13.234
  489   2HB   SER  64          2HB       SER  64  -7.577   1.342 -12.527
  490    HG   SER  64           HG       SER  64  -6.553   2.173 -14.303
  491    H    VAL  65           H        VAL  65  -5.965   0.074 -15.073
  492    HA   VAL  65           HA       VAL  65  -4.983  -2.419 -14.096
  493    HB   VAL  65           HB       VAL  65  -3.244  -0.179 -15.091
  494   1HG1  VAL  65          1HG1      VAL  65  -2.940  -3.056 -14.596
  495   2HG1  VAL  65          2HG1      VAL  65  -2.308  -2.516 -16.154
  496   3HG1  VAL  65          3HG1      VAL  65  -1.749  -1.768 -14.665
  497   1HG2  VAL  65          1HG2      VAL  65  -5.233  -1.771 -16.610
  498   2HG2  VAL  65          2HG2      VAL  65  -4.667  -0.133 -16.835
  499   3HG2  VAL  65          3HG2      VAL  65  -3.673  -1.479 -17.363
  500   1HB   PRO  66          1HB       PRO  66  -4.129  -2.433  -8.610
  501   2HB   PRO  66          2HB       PRO  66  -2.990  -3.378  -9.558
  502   1HG   PRO  66          1HG       PRO  66  -4.964  -4.452 -10.090
  503   2HG   PRO  66          2HG       PRO  66  -5.915  -3.011  -9.910
  504   1HD   PRO  66          1HD       PRO  66  -5.813  -3.083 -12.210
  505   2HD   PRO  66          2HD       PRO  66  -4.237  -3.851 -12.225
  506    H    HIS  67           H        HIS  67  -2.326   0.685 -10.449
  507    HA   HIS  67           HA       HIS  67   0.322  -0.570 -10.539
  508   1HB   HIS  67          1HB       HIS  67   1.064   1.003 -12.264
  509   2HB   HIS  67          2HB       HIS  67  -0.265   0.013 -12.846
  510    HD1  HIS  67           HD1      HIS  67   0.189   2.515 -14.360
  511    HD2  HIS  67           HD2      HIS  67  -2.221   2.424 -10.982
  512    HE1  HIS  67           HE1      HIS  67  -1.332   4.509 -14.548
  513    HE2  HIS  67           HE2      HIS  67  -2.819   4.385 -12.519
  514    H    ILE  68           H        ILE  68   1.920   0.484  -9.549
  515    HA   ILE  68           HA       ILE  68   1.553   1.980  -7.343
  516    HB   ILE  68           HB       ILE  68   3.800   1.388  -9.134
  517   1HG1  ILE  68          1HG1      ILE  68   3.668   1.720  -6.152
  518   2HG1  ILE  68          2HG1      ILE  68   3.273   0.244  -6.989
  519   1HG2  ILE  68          1HG2      ILE  68   3.873   3.974  -7.597
  520   2HG2  ILE  68          2HG2      ILE  68   5.321   3.091  -8.057
  521   3HG2  ILE  68          3HG2      ILE  68   4.223   3.632  -9.289
  522   1HD1  ILE  68          1HD1      ILE  68   5.610   0.288  -7.928
  523   2HD1  ILE  68          2HD1      ILE  68   5.955   1.558  -6.768
  524   3HD1  ILE  68          3HD1      ILE  68   5.456  -0.030  -6.210
  525    H    THR  69           H        THR  69   0.353   3.770  -7.163
  526    HA   THR  69           HA       THR  69   1.189   6.184  -8.535
  527    HB   THR  69           HB       THR  69  -1.517   4.936  -9.053
  528    HG1  THR  69           HG1      THR  69  -0.172   4.291 -10.612
  529   1HG2  THR  69          1HG2      THR  69  -0.604   7.737  -9.663
  530   2HG2  THR  69          2HG2      THR  69  -2.005   6.961 -10.385
  531   3HG2  THR  69          3HG2      THR  69  -1.965   7.264  -8.657

  No H/Q in entry =         531
  Start of MODEL    9
    1    H    SER   1           H        SER   1  16.069   6.337  -9.757
    2    HA   SER   1           HA       SER   1  14.711   8.015 -10.628
    3   1HB   SER   1          1HB       SER   1  14.211   8.236 -12.963
    4   2HB   SER   1          2HB       SER   1  15.833   7.586 -12.769
    5    HG   SER   1           HG       SER   1  14.790   5.447 -13.026
    6    H    ARG   2           H        ARG   2  12.927   5.058 -11.611
    7    HA   ARG   2           HA       ARG   2  10.639   5.810 -10.005
    8   1HB   ARG   2          1HB       ARG   2   9.051   5.697 -11.920
    9   2HB   ARG   2          2HB       ARG   2  10.112   7.096 -11.951
   10   1HG   ARG   2          1HG       ARG   2  10.791   6.592 -13.976
   11   2HG   ARG   2          2HG       ARG   2  11.416   5.042 -13.433
   12   1HD   ARG   2          1HD       ARG   2   9.199   4.037 -13.757
   13   2HD   ARG   2          2HD       ARG   2   9.833   4.719 -15.234
   14    HE   ARG   2           HE       ARG   2   7.470   5.519 -13.842
   15   1HH1  ARG   2          1HH1      ARG   2  10.045   6.704 -15.925
   16   2HH1  ARG   2          2HH1      ARG   2   9.092   7.994 -16.542
   17   1HH2  ARG   2          1HH2      ARG   2   6.229   7.238 -14.698
   18   2HH2  ARG   2          2HH2      ARG   2   6.939   8.305 -15.866
   19    H    ARG   3           H        ARG   3  11.934   3.754  -9.317
   20    HA   ARG   3           HA       ARG   3  10.246   1.508 -10.043
   21   1HB   ARG   3          1HB       ARG   3  12.190   1.580 -11.697
   22   2HB   ARG   3          2HB       ARG   3  13.236   1.170 -10.353
   23   1HG   ARG   3          1HG       ARG   3  12.784  -0.968 -10.641
   24   2HG   ARG   3          2HG       ARG   3  11.081  -0.679 -10.287
   25   1HD   ARG   3          1HD       ARG   3  11.358  -1.776 -12.449
   26   2HD   ARG   3          2HD       ARG   3  10.672  -0.167 -12.631
   27    HE   ARG   3           HE       ARG   3  12.514   0.476 -13.803
   28   1HH1  ARG   3          1HH1      ARG   3  13.267  -2.506 -12.102
   29   2HH1  ARG   3          2HH1      ARG   3  14.787  -2.695 -12.887
   30   1HH2  ARG   3          1HH2      ARG   3  14.538   0.195 -14.829
   31   2HH2  ARG   3          2HH2      ARG   3  15.517  -1.177 -14.427
   32    H    CYS   4           H        CYS   4   9.582   1.408  -7.935
   33    HA   CYS   4           HA       CYS   4  11.626   1.111  -5.850
   34   1HB   CYS   4          1HB       CYS   4   9.819   1.459  -4.264
   35   2HB   CYS   4          2HB       CYS   4   8.643   1.378  -5.563
   36   1HB   PRO   5          1HB       PRO   5  10.212  -2.567  -2.519
   37   2HB   PRO   5          2HB       PRO   5  11.541  -3.654  -2.884
   38   1HG   PRO   5          1HG       PRO   5  11.985  -1.235  -1.858
   39   2HG   PRO   5          2HG       PRO   5  13.064  -1.914  -3.091
   40   1HD   PRO   5          1HD       PRO   5  11.054   0.243  -3.324
   41   2HD   PRO   5          2HD       PRO   5  12.543  -0.002  -4.240
   42    H    GLY   6           H        GLY   6  10.104  -4.729  -5.865
   43   1HA   GLY   6          1HA       GLY   6   8.145  -5.934  -5.968
   44   2HA   GLY   6          2HA       GLY   6   7.315  -4.689  -5.079
   45    H    LYS   7           H        LYS   7   6.359  -6.029  -7.389
   46    HA   LYS   7           HA       LYS   7   6.700  -4.787  -9.815
   47   1HB   LYS   7          1HB       LYS   7   5.371  -6.809  -9.391
   48   2HB   LYS   7          2HB       LYS   7   4.114  -5.835  -8.694
   49   1HG   LYS   7          1HG       LYS   7   3.624  -4.796 -10.732
   50   2HG   LYS   7          2HG       LYS   7   5.066  -5.440 -11.506
   51   1HD   LYS   7          1HD       LYS   7   3.225  -7.456 -10.346
   52   2HD   LYS   7          2HD       LYS   7   2.571  -6.549 -11.694
   53   1HE   LYS   7          1HE       LYS   7   5.323  -7.550 -12.070
   54   2HE   LYS   7          2HE       LYS   7   4.063  -8.772 -11.929
   55   1HZ   LYS   7          1HZ       LYS   7   3.974  -6.495 -13.839
   56   2HZ   LYS   7          2HZ       LYS   7   4.481  -8.043 -14.229
   57   3HZ   LYS   7          3HZ       LYS   7   2.880  -7.815 -13.735
   58    H    ASN   8           H        ASN   8   5.743  -3.053 -10.913
   59    HA   ASN   8           HA       ASN   8   4.687  -0.934  -9.148
   60   1HB   ASN   8          1HB       ASN   8   6.365  -0.982 -11.607
   61   2HB   ASN   8          2HB       ASN   8   5.274   0.392 -11.414
   62   2HD2  ASN   8          2HD2      ASN   8   5.699   1.929  -9.881
   63   1HD2  ASN   8          1HD2      ASN   8   7.145   1.937  -8.944
   64    H    ALA   9           H        ALA   9   3.687  -3.039 -11.666
   65    HA   ALA   9           HA       ALA   9   1.103  -1.701 -11.742
   66   1HB   ALA   9          1HB       ALA   9   2.661  -2.355 -14.231
   67   2HB   ALA   9          2HB       ALA   9   0.998  -1.755 -14.174
   68   3HB   ALA   9          3HB       ALA   9   2.319  -0.733 -13.625
   69    H    TRP  10           H        TRP  10  -0.615  -3.067 -12.308
   70    HA   TRP  10           HA       TRP  10   0.067  -5.922 -12.632
   71   1HB   TRP  10          1HB       TRP  10  -1.795  -4.688 -10.598
   72   2HB   TRP  10          2HB       TRP  10  -1.825  -6.382 -11.046
   73    HD1  TRP  10           HD1      TRP  10   0.039  -7.972 -10.078
   74    HE1  TRP  10           HE1      TRP  10   1.840  -7.648  -8.268
   75    HE3  TRP  10           HE3      TRP  10  -0.187  -2.900  -9.602
   76    HZ2  TRP  10           HZ2      TRP  10   3.008  -5.508  -6.826
   77    HZ3  TRP  10           HZ3      TRP  10   1.296  -1.779  -7.999
   78    HH2  TRP  10           HH2      TRP  10   2.855  -3.062  -6.626
   79   1HB   PRO  11          1HB       PRO  11  -2.016  -5.913 -17.734
   80   2HB   PRO  11          2HB       PRO  11  -1.694  -4.198 -17.477
   81   1HG   PRO  11          1HG       PRO  11  -0.082  -6.565 -16.648
   82   2HG   PRO  11          2HG       PRO  11   0.459  -4.996 -17.263
   83   1HD   PRO  11          1HD       PRO  11   0.600  -5.607 -14.667
   84   2HD   PRO  11          2HD       PRO  11   0.210  -3.958 -15.203
   85    H    GLU  12           H        GLU  12  -1.745  -7.468 -14.954
   86    HA   GLU  12           HA       GLU  12  -3.817  -9.067 -15.996
   87   1HB   GLU  12          1HB       GLU  12  -2.929 -10.826 -14.487
   88   2HB   GLU  12          2HB       GLU  12  -1.703 -10.045 -15.484
   89   1HG   GLU  12          1HG       GLU  12  -2.042  -8.743 -12.890
   90   2HG   GLU  12          2HG       GLU  12  -1.589 -10.442 -12.773
   91    H    LEU  13           H        LEU  13  -3.850  -6.967 -13.302
   92    HA   LEU  13           HA       LEU  13  -5.795  -8.468 -11.803
   93   1HB   LEU  13          1HB       LEU  13  -4.586  -5.734 -11.504
   94   2HB   LEU  13          2HB       LEU  13  -5.939  -6.226 -10.514
   95    HG   LEU  13           HG       LEU  13  -3.190  -7.467 -10.577
   96   1HD1  LEU  13          1HD1      LEU  13  -4.704  -5.900  -8.520
   97   2HD1  LEU  13          2HD1      LEU  13  -3.249  -6.806  -8.156
   98   3HD1  LEU  13          3HD1      LEU  13  -3.226  -5.466  -9.281
   99   1HD2  LEU  13          1HD2      LEU  13  -5.759  -8.452  -9.419
  100   2HD2  LEU  13          2HD2      LEU  13  -4.490  -9.324 -10.275
  101   3HD2  LEU  13          3HD2      LEU  13  -4.233  -8.814  -8.617
  102    H    VAL  14           H        VAL  14  -5.804  -6.263 -14.402
  103    HA   VAL  14           HA       VAL  14  -8.304  -5.021 -14.034
  104    HB   VAL  14           HB       VAL  14  -7.027  -5.758 -16.682
  105   1HG1  VAL  14          1HG1      VAL  14  -9.117  -3.731 -15.891
  106   2HG1  VAL  14          2HG1      VAL  14  -8.233  -3.661 -17.416
  107   3HG1  VAL  14          3HG1      VAL  14  -9.256  -5.048 -17.054
  108   1HG2  VAL  14          1HG2      VAL  14  -5.639  -4.381 -14.885
  109   2HG2  VAL  14          2HG2      VAL  14  -5.687  -3.943 -16.577
  110   3HG2  VAL  14          3HG2      VAL  14  -6.686  -3.077 -15.417
  111    H    GLY  15           H        GLY  15 -10.184  -6.097 -13.740
  112   1HA   GLY  15          1HA       GLY  15 -11.965  -7.282 -14.851
  113   2HA   GLY  15          2HA       GLY  15 -10.785  -8.374 -15.551
  114    H    LYS  16           H        LYS  16  -9.737  -7.864 -12.470
  115    HA   LYS  16           HA       LYS  16 -11.096 -10.305 -11.513
  116   1HB   LYS  16          1HB       LYS  16  -8.461  -9.011 -10.870
  117   2HB   LYS  16          2HB       LYS  16  -9.167 -10.196  -9.791
  118   1HG   LYS  16          1HG       LYS  16  -9.276 -11.370 -12.338
  119   2HG   LYS  16          2HG       LYS  16  -7.718 -10.547 -12.264
  120   1HD   LYS  16          1HD       LYS  16  -7.711 -11.739  -9.835
  121   2HD   LYS  16          2HD       LYS  16  -8.755 -12.857 -10.717
  122   1HE   LYS  16          1HE       LYS  16  -6.444 -13.568 -10.826
  123   2HE   LYS  16          2HE       LYS  16  -5.972 -11.997 -11.501
  124   1HZ   LYS  16          1HZ       LYS  16  -7.940 -13.781 -12.835
  125   2HZ   LYS  16          2HZ       LYS  16  -7.090 -12.473 -13.490
  126   3HZ   LYS  16          3HZ       LYS  16  -6.270 -13.894 -13.113
  127    H    SER  17           H        SER  17 -11.125 -10.304  -8.963
  128    HA   SER  17           HA       SER  17 -12.984  -8.250  -8.236
  129   1HB   SER  17          1HB       SER  17 -13.324  -9.447  -6.264
  130   2HB   SER  17          2HB       SER  17 -12.854 -10.712  -7.393
  131    HG   SER  17           HG       SER  17 -11.767 -10.728  -5.298
  132    H    GLY  18           H        GLY  18 -12.676  -6.415  -7.044
  133   1HA   GLY  18          1HA       GLY  18 -10.249  -5.128  -6.903
  134   2HA   GLY  18          2HA       GLY  18 -11.600  -4.795  -5.838
  135    H    ASN  19           H        ASN  19 -11.581  -7.484  -4.667
  136    HA   ASN  19           HA       ASN  19  -9.718  -6.972  -2.568
  137   1HB   ASN  19          1HB       ASN  19 -11.768  -9.052  -3.189
  138   2HB   ASN  19          2HB       ASN  19 -10.488  -9.524  -2.080
  139   2HD2  ASN  19          2HD2      ASN  19 -10.024  -7.802  -0.347
  140   1HD2  ASN  19          1HD2      ASN  19 -11.434  -7.154   0.414
  141    H    MET  20           H        MET  20  -9.896  -9.398  -5.162
  142    HA   MET  20           HA       MET  20  -7.508 -10.741  -4.467
  143   1HB   MET  20          1HB       MET  20  -9.439 -11.335  -6.184
  144   2HB   MET  20          2HB       MET  20  -8.405 -10.523  -7.333
  145   1HG   MET  20          1HG       MET  20  -7.665 -12.639  -7.583
  146   2HG   MET  20          2HG       MET  20  -6.558 -12.116  -6.323
  147   1HE   MET  20          1HE       MET  20  -5.946 -13.951  -4.770
  148   2HE   MET  20          2HE       MET  20  -6.831 -12.806  -3.762
  149   3HE   MET  20          3HE       MET  20  -7.107 -14.535  -3.576
  150    H    ALA  21           H        ALA  21  -8.196  -7.838  -6.291
  151    HA   ALA  21           HA       ALA  21  -5.675  -7.554  -7.524
  152   1HB   ALA  21          1HB       ALA  21  -7.960  -5.720  -6.976
  153   2HB   ALA  21          2HB       ALA  21  -7.310  -6.286  -8.510
  154   3HB   ALA  21          3HB       ALA  21  -6.443  -5.060  -7.582
  155    H    ALA  22           H        ALA  22  -7.045  -5.736  -4.789
  156    HA   ALA  22           HA       ALA  22  -4.719  -4.460  -3.990
  157   1HB   ALA  22          1HB       ALA  22  -5.931  -4.778  -1.592
  158   2HB   ALA  22          2HB       ALA  22  -6.428  -3.621  -2.812
  159   3HB   ALA  22          3HB       ALA  22  -7.276  -5.157  -2.677
  160    H    ALA  23           H        ALA  23  -5.883  -7.690  -3.176
  161    HA   ALA  23           HA       ALA  23  -3.914  -8.303  -1.236
  162   1HB   ALA  23          1HB       ALA  23  -5.957  -9.591  -1.433
  163   2HB   ALA  23          2HB       ALA  23  -4.560 -10.648  -1.619
  164   3HB   ALA  23          3HB       ALA  23  -5.484 -10.147  -3.038
  165    H    THR  24           H        THR  24  -4.068  -8.861  -4.742
  166    HA   THR  24           HA       THR  24  -1.678 -10.312  -4.992
  167    HB   THR  24           HB       THR  24  -2.991  -8.449  -6.973
  168    HG1  THR  24           HG1      THR  24  -3.257 -11.258  -6.563
  169   1HG2  THR  24          1HG2      THR  24  -0.943 -10.606  -7.397
  170   2HG2  THR  24          2HG2      THR  24  -1.915  -9.880  -8.684
  171   3HG2  THR  24          3HG2      THR  24  -0.786  -8.889  -7.778
  172    H    VAL  25           H        VAL  25  -2.301  -6.832  -5.082
  173    HA   VAL  25           HA       VAL  25   0.335  -6.043  -5.766
  174    HB   VAL  25           HB       VAL  25  -1.625  -4.413  -4.129
  175   1HG1  VAL  25          1HG1      VAL  25   0.997  -3.876  -5.054
  176   2HG1  VAL  25          2HG1      VAL  25  -0.102  -2.932  -6.041
  177   3HG1  VAL  25          3HG1      VAL  25  -0.157  -2.777  -4.312
  178   1HG2  VAL  25          1HG2      VAL  25  -1.689  -5.221  -6.983
  179   2HG2  VAL  25          2HG2      VAL  25  -2.984  -4.780  -5.877
  180   3HG2  VAL  25          3HG2      VAL  25  -2.029  -3.527  -6.639
  181    H    GLU  26           H        GLU  26  -1.301  -6.138  -2.585
  182    HA   GLU  26           HA       GLU  26   1.018  -5.388  -1.122
  183   1HB   GLU  26          1HB       GLU  26  -0.202  -5.931   0.829
  184   2HB   GLU  26          2HB       GLU  26  -1.294  -7.010  -0.039
  185   1HG   GLU  26          1HG       GLU  26  -1.424  -4.365  -1.200
  186   2HG   GLU  26          2HG       GLU  26  -2.683  -5.372  -0.482
  187    H    ARG  27           H        ARG  27  -0.168  -8.477  -2.288
  188    HA   ARG  27           HA       ARG  27   1.567 -10.049  -0.613
  189   1HB   ARG  27          1HB       ARG  27  -0.634 -10.774  -1.714
  190   2HB   ARG  27          2HB       ARG  27   0.308 -10.993  -3.191
  191   1HG   ARG  27          1HG       ARG  27   1.710 -12.306  -1.121
  192   2HG   ARG  27          2HG       ARG  27   0.005 -12.701  -0.908
  193   1HD   ARG  27          1HD       ARG  27  -0.055 -13.286  -3.364
  194   2HD   ARG  27          2HD       ARG  27   0.863 -14.367  -2.322
  195    HE   ARG  27           HE       ARG  27   1.861 -12.820  -4.490
  196   1HH1  ARG  27          1HH1      ARG  27   2.748 -14.066  -1.319
  197   2HH1  ARG  27          2HH1      ARG  27   4.429 -14.052  -1.671
  198   1HH2  ARG  27          1HH2      ARG  27   4.106 -12.841  -4.927
  199   2HH2  ARG  27          2HH2      ARG  27   5.209 -13.382  -3.704
  200    H    GLU  28           H        GLU  28   1.546  -9.288  -4.102
  201    HA   GLU  28           HA       GLU  28   4.090 -10.464  -4.600
  202   1HB   GLU  28          1HB       GLU  28   2.559  -8.375  -6.172
  203   2HB   GLU  28          2HB       GLU  28   3.984  -9.238  -6.754
  204   1HG   GLU  28          1HG       GLU  28   2.602 -11.370  -6.280
  205   2HG   GLU  28          2HG       GLU  28   1.225 -10.284  -6.252
  206    H    ASN  29           H        ASN  29   3.034  -7.153  -3.889
  207    HA   ASN  29           HA       ASN  29   5.882  -6.372  -3.638
  208   1HB   ASN  29          1HB       ASN  29   4.686  -5.177  -5.414
  209   2HB   ASN  29          2HB       ASN  29   3.480  -4.636  -4.256
  210   2HD2  ASN  29          2HD2      ASN  29   5.125  -2.971  -5.885
  211   1HD2  ASN  29          1HD2      ASN  29   6.185  -2.091  -4.855
  212    H    ARG  30           H        ARG  30   5.860  -7.245  -1.483
  213    HA   ARG  30           HA       ARG  30   4.109  -6.318   0.540
  214   1HB   ARG  30          1HB       ARG  30   5.632  -8.359   0.584
  215   2HB   ARG  30          2HB       ARG  30   6.956  -7.265   0.966
  216   1HG   ARG  30          1HG       ARG  30   5.718  -6.541   2.989
  217   2HG   ARG  30          2HG       ARG  30   4.449  -7.694   2.590
  218   1HD   ARG  30          1HD       ARG  30   6.581  -9.347   2.536
  219   2HD   ARG  30          2HD       ARG  30   7.179  -8.127   3.650
  220    HE   ARG  30           HE       ARG  30   5.725  -8.875   5.234
  221   1HH1  ARG  30          1HH1      ARG  30   4.728 -10.155   2.110
  222   2HH1  ARG  30          2HH1      ARG  30   3.547 -11.197   2.791
  223   1HH2  ARG  30          1HH2      ARG  30   4.142 -10.272   6.109
  224   2HH2  ARG  30          2HH2      ARG  30   3.200 -11.271   5.052
  225    H    ASN  31           H        ASN  31   6.417  -4.559  -1.173
  226    HA   ASN  31           HA       ASN  31   7.175  -2.867   1.076
  227   1HB   ASN  31          1HB       ASN  31   8.891  -3.493  -0.547
  228   2HB   ASN  31          2HB       ASN  31   7.950  -2.767  -1.844
  229   2HD2  ASN  31          2HD2      ASN  31   9.917  -2.147   0.973
  230   1HD2  ASN  31          1HD2      ASN  31  10.162  -0.467   0.651
  231    H    VAL  32           H        VAL  32   4.510  -3.097  -0.891
  232    HA   VAL  32           HA       VAL  32   3.927  -0.247  -0.537
  233    HB   VAL  32           HB       VAL  32   3.094   0.030  -2.723
  234   1HG1  VAL  32          1HG1      VAL  32   5.737  -1.418  -2.841
  235   2HG1  VAL  32          2HG1      VAL  32   5.074  -0.437  -4.134
  236   3HG1  VAL  32          3HG1      VAL  32   5.500   0.272  -2.586
  237   1HG2  VAL  32          1HG2      VAL  32   3.275  -2.943  -2.907
  238   2HG2  VAL  32          2HG2      VAL  32   1.967  -1.864  -3.328
  239   3HG2  VAL  32          3HG2      VAL  32   3.356  -1.983  -4.382
  240    H    HIS  33           H        HIS  33   1.556   0.173  -1.047
  241    HA   HIS  33           HA       HIS  33  -0.114  -2.113  -0.298
  242   1HB   HIS  33          1HB       HIS  33  -0.717  -1.278   1.702
  243   2HB   HIS  33          2HB       HIS  33   0.631  -0.180   1.547
  244    HD1  HIS  33           HD1      HIS  33  -2.989  -0.269   1.874
  245    HD2  HIS  33           HD2      HIS  33  -0.151   2.437   0.526
  246    HE1  HIS  33           HE1      HIS  33  -4.131   1.965   1.877
  247    HE2  HIS  33           HE2      HIS  33  -2.379   3.595   1.084
  248    H    ALA  34           H        ALA  34  -2.092  -2.184  -1.243
  249    HA   ALA  34           HA       ALA  34  -2.639  -0.075  -3.217
  250   1HB   ALA  34          1HB       ALA  34  -3.622  -2.910  -3.095
  251   2HB   ALA  34          2HB       ALA  34  -3.998  -1.747  -4.372
  252   3HB   ALA  34          3HB       ALA  34  -2.339  -2.296  -4.132
  253    H    ILE  35           H        ILE  35  -4.419   1.139  -3.159
  254    HA   ILE  35           HA       ILE  35  -6.331   0.668  -0.963
  255    HB   ILE  35           HB       ILE  35  -6.001   3.164  -2.633
  256   1HG1  ILE  35          1HG1      ILE  35  -4.949   2.591   0.130
  257   2HG1  ILE  35          2HG1      ILE  35  -3.945   2.634  -1.310
  258   1HG2  ILE  35          1HG2      ILE  35  -8.205   2.871  -1.560
  259   2HG2  ILE  35          2HG2      ILE  35  -7.408   2.690   0.001
  260   3HG2  ILE  35          3HG2      ILE  35  -7.320   4.217  -0.881
  261   1HD1  ILE  35          1HD1      ILE  35  -5.523   4.955  -0.217
  262   2HD1  ILE  35          2HD1      ILE  35  -3.802   4.685  -0.008
  263   3HD1  ILE  35          3HD1      ILE  35  -4.450   4.970  -1.610
  264    H    VAL  36           H        VAL  36  -8.226  -0.237  -1.488
  265    HA   VAL  36           HA       VAL  36  -9.051  -0.348  -4.272
  266    HB   VAL  36           HB       VAL  36 -10.323  -1.547  -1.818
  267   1HG1  VAL  36          1HG1      VAL  36 -10.898  -1.922  -4.753
  268   2HG1  VAL  36          2HG1      VAL  36 -11.486  -3.001  -3.501
  269   3HG1  VAL  36          3HG1      VAL  36 -11.995  -1.327  -3.506
  270   1HG2  VAL  36          1HG2      VAL  36  -8.479  -2.746  -3.880
  271   2HG2  VAL  36          2HG2      VAL  36  -8.133  -2.472  -2.181
  272   3HG2  VAL  36          3HG2      VAL  36  -9.343  -3.659  -2.650
  273    H    LEU  37           H        LEU  37 -10.207   1.198  -5.134
  274    HA   LEU  37           HA       LEU  37 -12.433   2.382  -3.622
  275   1HB   LEU  37          1HB       LEU  37 -11.709   4.551  -4.909
  276   2HB   LEU  37          2HB       LEU  37 -11.102   4.166  -3.328
  277    HG   LEU  37           HG       LEU  37  -9.222   2.980  -5.012
  278   1HD1  LEU  37          1HD1      LEU  37 -10.277   4.066  -6.945
  279   2HD1  LEU  37          2HD1      LEU  37  -9.959   5.635  -6.198
  280   3HD1  LEU  37          3HD1      LEU  37  -8.618   4.588  -6.661
  281   1HD2  LEU  37          1HD2      LEU  37  -9.316   5.008  -3.034
  282   2HD2  LEU  37          2HD2      LEU  37  -7.958   4.084  -3.624
  283   3HD2  LEU  37          3HD2      LEU  37  -8.389   5.618  -4.398
  284    H    LYS  38           H        LYS  38 -14.061   3.303  -4.994
  285    HA   LYS  38           HA       LYS  38 -14.267   1.820  -7.495
  286   1HB   LYS  38          1HB       LYS  38 -16.613   2.584  -7.508
  287   2HB   LYS  38          2HB       LYS  38 -16.158   1.704  -6.068
  288   1HG   LYS  38          1HG       LYS  38 -15.667   4.428  -5.474
  289   2HG   LYS  38          2HG       LYS  38 -16.874   3.348  -4.796
  290   1HD   LYS  38          1HD       LYS  38 -17.338   5.643  -6.235
  291   2HD   LYS  38          2HD       LYS  38 -17.599   4.403  -7.455
  292   1HE   LYS  38          1HE       LYS  38 -18.895   4.467  -4.725
  293   2HE   LYS  38          2HE       LYS  38 -19.650   5.029  -6.212
  294   1HZ   LYS  38          1HZ       LYS  38 -19.409   2.752  -7.099
  295   2HZ   LYS  38          2HZ       LYS  38 -18.766   2.250  -5.624
  296   3HZ   LYS  38          3HZ       LYS  38 -20.377   2.814  -5.723
  297    H    GLU  39           H        GLU  39 -14.793   2.731  -9.492
  298    HA   GLU  39           HA       GLU  39 -13.310   4.856 -10.371
  299   1HB   GLU  39          1HB       GLU  39 -14.749   3.100 -11.667
  300   2HB   GLU  39          2HB       GLU  39 -16.000   4.336 -11.613
  301   1HG   GLU  39          1HG       GLU  39 -14.109   5.867 -12.589
  302   2HG   GLU  39          2HG       GLU  39 -13.365   4.328 -13.029
  303    H    GLY  40           H        GLY  40 -13.276   6.901  -9.752
  304   1HA   GLY  40          1HA       GLY  40 -14.417   9.033  -9.950
  305   2HA   GLY  40          2HA       GLY  40 -15.872   8.283  -9.312
  306    H    SER  41           H        SER  41 -13.380   6.969  -7.579
  307    HA   SER  41           HA       SER  41 -14.026   8.498  -5.252
  308   1HB   SER  41          1HB       SER  41 -13.472   6.095  -5.156
  309   2HB   SER  41          2HB       SER  41 -11.834   6.461  -5.686
  310    HG   SER  41           HG       SER  41 -12.229   6.244  -3.333
  311    H    ALA  42           H        ALA  42 -11.560   8.719  -3.933
  312    HA   ALA  42           HA       ALA  42 -10.510  11.114  -5.207
  313   1HB   ALA  42          1HB       ALA  42  -9.312  11.395  -3.057
  314   2HB   ALA  42          2HB       ALA  42 -11.060  11.257  -2.876
  315   3HB   ALA  42          3HB       ALA  42 -10.020   9.882  -2.498
  316    H    MET  43           H        MET  43  -9.156  10.529  -6.837
  317    HA   MET  43           HA       MET  43  -6.903   8.774  -6.123
  318   1HB   MET  43          1HB       MET  43  -7.037   8.701  -8.878
  319   2HB   MET  43          2HB       MET  43  -7.544   7.445  -7.753
  320   1HG   MET  43          1HG       MET  43  -9.823   8.527  -7.724
  321   2HG   MET  43          2HG       MET  43  -9.255   9.544  -9.054
  322   1HE   MET  43          1HE       MET  43  -7.695   8.118 -10.909
  323   2HE   MET  43          2HE       MET  43  -7.331   6.604 -10.079
  324   3HE   MET  43          3HE       MET  43  -8.263   6.585 -11.576
  325    H    THR  44           H        THR  44  -5.445  10.277  -5.559
  326    HA   THR  44           HA       THR  44  -5.006  12.676  -7.002
  327    HB   THR  44           HB       THR  44  -2.676  12.352  -5.641
  328    HG1  THR  44           HG1      THR  44  -4.461  10.982  -3.942
  329   1HG2  THR  44          1HG2      THR  44  -5.311  13.111  -4.409
  330   2HG2  THR  44          2HG2      THR  44  -3.726  13.405  -3.697
  331   3HG2  THR  44          3HG2      THR  44  -4.161  14.184  -5.214
  332    H    LYS  45           H        LYS  45  -3.100  13.245  -8.201
  333    HA   LYS  45           HA       LYS  45  -2.306  11.101 -10.009
  334   1HB   LYS  45          1HB       LYS  45  -2.191  14.082 -10.020
  335   2HB   LYS  45          2HB       LYS  45  -1.029  13.217 -11.015
  336   1HG   LYS  45          1HG       LYS  45  -2.775  12.129 -12.229
  337   2HG   LYS  45          2HG       LYS  45  -4.011  12.825 -11.174
  338   1HD   LYS  45          1HD       LYS  45  -3.719  14.965 -12.025
  339   2HD   LYS  45          2HD       LYS  45  -2.116  14.619 -12.670
  340   1HE   LYS  45          1HE       LYS  45  -4.351  13.011 -13.794
  341   2HE   LYS  45          2HE       LYS  45  -4.364  14.733 -14.154
  342   1HZ   LYS  45          1HZ       LYS  45  -2.033  14.489 -14.936
  343   2HZ   LYS  45          2HZ       LYS  45  -2.174  12.822 -14.739
  344   3HZ   LYS  45          3HZ       LYS  45  -3.167  13.618 -15.853
  345    H    ASP  46           H        ASP  46  -0.985  12.920  -7.378
  346    HA   ASP  46           HA       ASP  46   1.701  12.899  -7.785
  347   1HB   ASP  46          1HB       ASP  46   0.134  13.400  -5.623
  348   2HB   ASP  46          2HB       ASP  46   0.882  11.907  -5.086
  349    H    PHE  47           H        PHE  47   3.393  11.478  -7.650
  350    HA   PHE  47           HA       PHE  47   2.700   8.663  -7.993
  351   1HB   PHE  47          1HB       PHE  47   4.210   9.457  -9.601
  352   2HB   PHE  47          2HB       PHE  47   5.198  10.284  -8.410
  353    HD1  PHE  47           HD1      PHE  47   4.140   6.888  -9.531
  354    HD2  PHE  47           HD2      PHE  47   7.092   9.230  -7.537
  355    HE1  PHE  47           HE1      PHE  47   5.644   4.952  -9.454
  356    HE2  PHE  47           HE2      PHE  47   8.575   7.275  -7.435
  357    HZ   PHE  47           HZ       PHE  47   7.846   5.132  -8.413
  358    H    ARG  48           H        ARG  48   2.852   7.181  -6.456
  359    HA   ARG  48           HA       ARG  48   4.796   7.461  -4.280
  360   1HB   ARG  48          1HB       ARG  48   3.208   7.122  -2.548
  361   2HB   ARG  48          2HB       ARG  48   1.896   6.869  -3.685
  362   1HG   ARG  48          1HG       ARG  48   3.219   9.487  -3.881
  363   2HG   ARG  48          2HG       ARG  48   1.521   9.052  -3.980
  364   1HD   ARG  48          1HD       ARG  48   3.220   9.293  -1.500
  365   2HD   ARG  48          2HD       ARG  48   1.972  10.414  -2.046
  366    HE   ARG  48           HE       ARG  48   0.965   7.752  -1.674
  367   1HH1  ARG  48          1HH1      ARG  48   1.780  10.729   0.006
  368   2HH1  ARG  48          2HH1      ARG  48   0.697  10.411   1.304
  369   1HH2  ARG  48          1HH2      ARG  48  -0.447   7.356   0.058
  370   2HH2  ARG  48          2HH2      ARG  48  -0.561   8.505   1.349
  371    H    CYS  49           H        CYS  49   5.921   5.638  -4.477
  372    HA   CYS  49           HA       CYS  49   5.043   3.303  -5.713
  373   1HB   CYS  49          1HB       CYS  49   7.260   3.647  -3.725
  374   2HB   CYS  49          2HB       CYS  49   7.027   2.228  -4.725
  375    H    ASP  50           H        ASP  50   4.861   4.297  -2.365
  376    HA   ASP  50           HA       ASP  50   4.118   1.678  -1.429
  377   1HB   ASP  50          1HB       ASP  50   5.284   3.240   0.038
  378   2HB   ASP  50          2HB       ASP  50   3.720   2.802   0.714
  379    H    ARG  51           H        ARG  51   2.439   3.962  -3.210
  380    HA   ARG  51           HA       ARG  51  -0.128   3.042  -2.110
  381   1HB   ARG  51          1HB       ARG  51   0.352   5.473  -1.785
  382   2HB   ARG  51          2HB       ARG  51   0.420   5.657  -3.527
  383   1HG   ARG  51          1HG       ARG  51  -1.933   4.825  -3.647
  384   2HG   ARG  51          2HG       ARG  51  -1.957   4.829  -1.880
  385   1HD   ARG  51          1HD       ARG  51  -1.290   7.263  -2.019
  386   2HD   ARG  51          2HD       ARG  51  -2.937   6.854  -2.513
  387    HE   ARG  51           HE       ARG  51  -1.651   6.778  -4.856
  388   1HH1  ARG  51          1HH1      ARG  51  -1.674   9.195  -2.301
  389   2HH1  ARG  51          2HH1      ARG  51  -1.419  10.500  -3.394
  390   1HH2  ARG  51          1HH2      ARG  51  -1.326   8.544  -6.271
  391   2HH2  ARG  51          2HH2      ARG  51  -1.208  10.141  -5.629
  392    H    VAL  52           H        VAL  52  -1.287   1.851  -3.412
  393    HA   VAL  52           HA       VAL  52  -0.907   2.118  -6.352
  394    HB   VAL  52           HB       VAL  52  -1.470  -0.433  -4.832
  395   1HG1  VAL  52          1HG1      VAL  52  -1.209   0.123  -7.772
  396   2HG1  VAL  52          2HG1      VAL  52  -1.147  -1.492  -7.076
  397   3HG1  VAL  52          3HG1      VAL  52  -2.607  -0.528  -6.925
  398   1HG2  VAL  52          1HG2      VAL  52   1.016   0.750  -5.927
  399   2HG2  VAL  52          2HG2      VAL  52   0.753  -0.209  -4.479
  400   3HG2  VAL  52          3HG2      VAL  52   0.805  -0.987  -6.051
  401    H    TRP  53           H        TRP  53  -2.703   2.862  -7.285
  402    HA   TRP  53           HA       TRP  53  -5.186   2.935  -5.847
  403   1HB   TRP  53          1HB       TRP  53  -4.318   3.866  -8.567
  404   2HB   TRP  53          2HB       TRP  53  -6.016   3.893  -8.128
  405    HD1  TRP  53           HD1      TRP  53  -3.945   6.421  -8.756
  406    HE1  TRP  53           HE1      TRP  53  -4.024   8.394  -7.102
  407    HE3  TRP  53           HE3      TRP  53  -6.052   4.046  -4.761
  408    HZ2  TRP  53           HZ2      TRP  53  -4.860   8.854  -4.437
  409    HZ3  TRP  53           HZ3      TRP  53  -6.444   5.313  -2.702
  410    HH2  TRP  53           HH2      TRP  53  -5.878   7.675  -2.549
  411    H    VAL  54           H        VAL  54  -6.910   1.623  -5.988
  412    HA   VAL  54           HA       VAL  54  -6.943  -0.370  -8.184
  413    HB   VAL  54           HB       VAL  54  -7.438  -0.733  -5.240
  414   1HG1  VAL  54          1HG1      VAL  54  -8.720  -2.254  -7.486
  415   2HG1  VAL  54          2HG1      VAL  54  -8.336  -3.050  -5.966
  416   3HG1  VAL  54          3HG1      VAL  54  -9.422  -1.684  -5.979
  417   1HG2  VAL  54          1HG2      VAL  54  -5.227  -1.239  -6.136
  418   2HG2  VAL  54          2HG2      VAL  54  -6.040  -2.687  -5.545
  419   3HG2  VAL  54          3HG2      VAL  54  -5.948  -2.366  -7.284
  420    H    ILE  55           H        ILE  55  -8.342   0.810  -9.460
  421    HA   ILE  55           HA       ILE  55 -10.826   1.806  -8.372
  422    HB   ILE  55           HB       ILE  55  -9.985   1.735 -11.252
  423   1HG1  ILE  55          1HG1      ILE  55  -9.058   3.394  -8.997
  424   2HG1  ILE  55          2HG1      ILE  55  -9.682   4.345 -10.338
  425   1HG2  ILE  55          1HG2      ILE  55 -12.047   3.323  -9.763
  426   2HG2  ILE  55          2HG2      ILE  55 -11.573   3.644 -11.431
  427   3HG2  ILE  55          3HG2      ILE  55 -12.338   2.114 -11.017
  428   1HD1  ILE  55          1HD1      ILE  55  -7.662   2.190 -10.798
  429   2HD1  ILE  55          2HD1      ILE  55  -8.083   3.578 -11.802
  430   3HD1  ILE  55          3HD1      ILE  55  -7.212   3.805 -10.290
  431    H    VAL  56           H        VAL  56 -12.680   0.719  -8.295
  432    HA   VAL  56           HA       VAL  56 -13.041  -1.578 -10.085
  433    HB   VAL  56           HB       VAL  56 -14.247  -2.747  -8.323
  434   1HG1  VAL  56          1HG1      VAL  56 -11.513  -1.828  -7.439
  435   2HG1  VAL  56          2HG1      VAL  56 -12.364  -3.233  -6.832
  436   3HG1  VAL  56          3HG1      VAL  56 -11.873  -3.173  -8.521
  437   1HG2  VAL  56          1HG2      VAL  56 -13.542  -0.360  -6.621
  438   2HG2  VAL  56          2HG2      VAL  56 -15.160  -0.904  -7.073
  439   3HG2  VAL  56          3HG2      VAL  56 -14.180  -1.877  -5.994
  440    H    ASN  57           H        ASN  57 -15.326  -2.229 -10.347
  441    HA   ASN  57           HA       ASN  57 -16.939   0.160 -10.863
  442   1HB   ASN  57          1HB       ASN  57 -18.376  -1.366 -12.155
  443   2HB   ASN  57          2HB       ASN  57 -16.697  -1.472 -12.652
  444   2HD2  ASN  57          2HD2      ASN  57 -17.168  -3.523 -13.569
  445   1HD2  ASN  57          1HD2      ASN  57 -17.327  -4.917 -12.564
  446    H    ASP  58           H        ASP  58 -19.448  -0.502 -10.667
  447    HA   ASP  58           HA       ASP  58 -20.068  -0.316  -7.955
  448   1HB   ASP  58          1HB       ASP  58 -22.349  -0.454  -8.595
  449   2HB   ASP  58          2HB       ASP  58 -21.971  -1.373 -10.060
  450    H    HIS  59           H        HIS  59 -19.396  -3.120  -9.868
  451    HA   HIS  59           HA       HIS  59 -20.710  -4.949  -8.035
  452   1HB   HIS  59          1HB       HIS  59 -18.986  -5.447 -10.479
  453   2HB   HIS  59          2HB       HIS  59 -19.811  -6.689  -9.551
  454    HD1  HIS  59           HD1      HIS  59 -20.460  -3.884 -11.950
  455    HD2  HIS  59           HD2      HIS  59 -22.541  -6.922 -10.026
  456    HE1  HIS  59           HE1      HIS  59 -22.712  -3.964 -13.065
  457    HE2  HIS  59           HE2      HIS  59 -23.910  -5.889 -11.961
  458    H    GLY  60           H        GLY  60 -17.561  -3.534  -8.490
  459   1HA   GLY  60          1HA       GLY  60 -15.981  -3.586  -6.736
  460   2HA   GLY  60          2HA       GLY  60 -16.543  -5.181  -6.275
  461    H    VAL  61           H        VAL  61 -16.064  -4.460  -9.646
  462    HA   VAL  61           HA       VAL  61 -13.812  -6.338  -9.705
  463    HB   VAL  61           HB       VAL  61 -15.394  -5.235 -12.024
  464   1HG1  VAL  61          1HG1      VAL  61 -13.454  -7.515 -11.807
  465   2HG1  VAL  61          2HG1      VAL  61 -14.451  -7.182 -13.218
  466   3HG1  VAL  61          3HG1      VAL  61 -13.238  -6.016 -12.708
  467   1HG2  VAL  61          1HG2      VAL  61 -15.749  -7.831 -10.539
  468   2HG2  VAL  61          2HG2      VAL  61 -16.892  -6.486 -10.584
  469   3HG2  VAL  61          3HG2      VAL  61 -16.558  -7.409 -12.048
  470    H    VAL  62           H        VAL  62 -11.830  -5.777 -10.639
  471    HA   VAL  62           HA       VAL  62 -11.161  -2.989 -10.488
  472    HB   VAL  62           HB       VAL  62  -9.457  -5.273 -11.504
  473   1HG1  VAL  62          1HG1      VAL  62  -8.665  -3.046 -12.188
  474   2HG1  VAL  62          2HG1      VAL  62  -8.668  -2.527 -10.508
  475   3HG1  VAL  62          3HG1      VAL  62  -7.589  -3.817 -11.046
  476   1HG2  VAL  62          1HG2      VAL  62 -10.428  -4.812  -8.897
  477   2HG2  VAL  62          2HG2      VAL  62  -9.191  -5.941  -9.418
  478   3HG2  VAL  62          3HG2      VAL  62  -8.744  -4.325  -8.886
  479    H    THR  63           H        THR  63 -11.730  -1.615 -12.054
  480    HA   THR  63           HA       THR  63 -11.954  -2.546 -14.824
  481    HB   THR  63           HB       THR  63 -13.017  -0.427 -15.263
  482    HG1  THR  63           HG1      THR  63 -12.046   1.080 -14.067
  483   1HG2  THR  63          1HG2      THR  63 -14.346  -2.224 -14.071
  484   2HG2  THR  63          2HG2      THR  63 -14.105  -1.275 -12.604
  485   3HG2  THR  63          3HG2      THR  63 -14.961  -0.574 -13.974
  486    H    SER  64           H        SER  64  -9.979  -0.419 -12.819
  487    HA   SER  64           HA       SER  64  -8.413   0.358 -15.190
  488   1HB   SER  64          1HB       SER  64  -9.327   1.904 -13.135
  489   2HB   SER  64          2HB       SER  64  -7.701   1.513 -12.591
  490    HG   SER  64           HG       SER  64  -6.862   2.475 -14.364
  491    H    VAL  65           H        VAL  65  -6.200   0.086 -15.265
  492    HA   VAL  65           HA       VAL  65  -5.193  -2.318 -14.159
  493    HB   VAL  65           HB       VAL  65  -3.648  -0.098 -15.468
  494   1HG1  VAL  65          1HG1      VAL  65  -2.921  -2.782 -14.490
  495   2HG1  VAL  65          2HG1      VAL  65  -2.333  -2.375 -16.110
  496   3HG1  VAL  65          3HG1      VAL  65  -1.944  -1.350 -14.735
  497   1HG2  VAL  65          1HG2      VAL  65  -5.692  -1.519 -16.638
  498   2HG2  VAL  65          2HG2      VAL  65  -4.343  -0.766 -17.466
  499   3HG2  VAL  65          3HG2      VAL  65  -4.280  -2.471 -17.064
  500   1HB   PRO  66          1HB       PRO  66  -4.309  -2.070  -8.729
  501   2HB   PRO  66          2HB       PRO  66  -3.110  -3.074  -9.541
  502   1HG   PRO  66          1HG       PRO  66  -4.968  -4.240 -10.146
  503   2HG   PRO  66          2HG       PRO  66  -6.028  -2.859 -10.011
  504   1HD   PRO  66          1HD       PRO  66  -5.892  -2.954 -12.300
  505   2HD   PRO  66          2HD       PRO  66  -4.296  -3.692 -12.282
  506    H    HIS  67           H        HIS  67  -2.260   0.802 -10.245
  507    HA   HIS  67           HA       HIS  67   0.310  -0.538 -10.359
  508   1HB   HIS  67          1HB       HIS  67   1.192   0.836 -12.170
  509   2HB   HIS  67          2HB       HIS  67  -0.203  -0.064 -12.733
  510    HD1  HIS  67           HD1      HIS  67   0.632   2.401 -14.273
  511    HD2  HIS  67           HD2      HIS  67  -2.113   2.500 -11.160
  512    HE1  HIS  67           HE1      HIS  67  -0.730   4.487 -14.627
  513    HE2  HIS  67           HE2      HIS  67  -2.308   4.571 -12.667
  514    H    ILE  68           H        ILE  68   1.922   0.556  -9.364
  515    HA   ILE  68           HA       ILE  68   1.481   2.182  -7.266
  516    HB   ILE  68           HB       ILE  68   3.819   1.621  -8.988
  517   1HG1  ILE  68          1HG1      ILE  68   3.510   1.809  -5.989
  518   2HG1  ILE  68          2HG1      ILE  68   3.185   0.370  -6.927
  519   1HG2  ILE  68          1HG2      ILE  68   3.829   4.056  -7.204
  520   2HG2  ILE  68          2HG2      ILE  68   5.269   3.299  -7.883
  521   3HG2  ILE  68          3HG2      ILE  68   4.078   3.993  -8.943
  522   1HD1  ILE  68          1HD1      ILE  68   5.881   1.709  -6.829
  523   2HD1  ILE  68          2HD1      ILE  68   5.391   0.342  -5.856
  524   3HD1  ILE  68          3HD1      ILE  68   5.459   0.186  -7.590
  525    H    THR  69           H        THR  69   0.717   4.153  -6.959
  526    HA   THR  69           HA       THR  69   1.479   6.419  -8.494
  527    HB   THR  69           HB       THR  69  -1.127   5.080  -9.159
  528    HG1  THR  69           HG1      THR  69   0.872   6.420 -10.695
  529   1HG2  THR  69          1HG2      THR  69  -0.619   8.035  -9.260
  530   2HG2  THR  69          2HG2      THR  69  -1.744   7.233 -10.341
  531   3HG2  THR  69          3HG2      THR  69  -2.009   7.180  -8.616

  No H/Q in entry =         531
  Start of MODEL   10
    1    H    SER   1           H        SER   1   7.733   7.067 -10.023
    2    HA   SER   1           HA       SER   1   9.112   5.186 -10.301
    3   1HB   SER   1          1HB       SER   1   8.518   5.427 -12.712
    4   2HB   SER   1          2HB       SER   1  10.023   6.309 -12.984
    5    HG   SER   1           HG       SER   1  10.292   4.092 -13.386
    6    H    ARG   2           H        ARG   2  10.752   4.911  -8.867
    7    HA   ARG   2           HA       ARG   2  13.410   5.920  -9.340
    8   1HB   ARG   2          1HB       ARG   2  12.272   7.856  -8.239
    9   2HB   ARG   2          2HB       ARG   2  11.950   6.836  -6.845
   10   1HG   ARG   2          1HG       ARG   2  14.400   6.515  -6.578
   11   2HG   ARG   2          2HG       ARG   2  13.851   8.169  -6.367
   12   1HD   ARG   2          1HD       ARG   2  15.665   7.026  -8.343
   13   2HD   ARG   2          2HD       ARG   2  14.422   8.037  -9.079
   14    HE   ARG   2           HE       ARG   2  15.482   9.435  -6.901
   15   1HH1  ARG   2          1HH1      ARG   2  16.522   8.244 -10.038
   16   2HH1  ARG   2          2HH1      ARG   2  17.690   9.497 -10.242
   17   1HH2  ARG   2          1HH2      ARG   2  17.028  11.072  -7.194
   18   2HH2  ARG   2          2HH2      ARG   2  17.985  11.100  -8.638
   19    H    ARG   3           H        ARG   3  13.574   3.554  -9.417
   20    HA   ARG   3           HA       ARG   3  13.971   1.494  -8.534
   21   1HB   ARG   3          1HB       ARG   3  15.561   1.455  -6.740
   22   2HB   ARG   3          2HB       ARG   3  15.089   3.061  -6.201
   23   1HG   ARG   3          1HG       ARG   3  17.070   2.282  -8.113
   24   2HG   ARG   3          2HG       ARG   3  15.896   3.313  -8.919
   25   1HD   ARG   3          1HD       ARG   3  16.173   4.976  -7.149
   26   2HD   ARG   3          2HD       ARG   3  17.669   4.649  -8.011
   27    HE   ARG   3           HE       ARG   3  18.262   3.155  -6.095
   28   1HH1  ARG   3          1HH1      ARG   3  16.113   5.907  -5.623
   29   2HH1  ARG   3          2HH1      ARG   3  16.498   6.057  -3.962
   30   1HH2  ARG   3          1HH2      ARG   3  18.753   3.396  -3.885
   31   2HH2  ARG   3          2HH2      ARG   3  17.991   4.653  -2.967
   32    H    CYS   4           H        CYS   4  11.736   0.959  -8.226
   33    HA   CYS   4           HA       CYS   4  10.848   1.138  -5.436
   34   1HB   CYS   4          1HB       CYS   4   9.504   2.203  -7.378
   35   2HB   CYS   4          2HB       CYS   4   8.985   0.557  -7.691
   36   1HB   PRO   5          1HB       PRO   5  11.342  -3.703  -3.065
   37   2HB   PRO   5          2HB       PRO   5   9.663  -3.174  -2.919
   38   1HG   PRO   5          1HG       PRO   5  10.690  -1.410  -1.842
   39   2HG   PRO   5          2HG       PRO   5  12.178  -1.587  -2.764
   40   1HD   PRO   5          1HD       PRO   5  11.304   0.243  -3.825
   41   2HD   PRO   5          2HD       PRO   5   9.619  -0.248  -3.544
   42    H    GLY   6           H        GLY   6  10.132  -5.224  -5.415
   43   1HA   GLY   6          1HA       GLY   6   8.398  -6.419  -6.306
   44   2HA   GLY   6          2HA       GLY   6   7.361  -5.346  -5.393
   45    H    LYS   7           H        LYS   7   6.278  -6.230  -7.599
   46    HA   LYS   7           HA       LYS   7   6.858  -4.917 -10.004
   47   1HB   LYS   7          1HB       LYS   7   5.431  -6.894  -9.781
   48   2HB   LYS   7          2HB       LYS   7   4.200  -5.928  -9.028
   49   1HG   LYS   7          1HG       LYS   7   3.782  -4.711 -10.983
   50   2HG   LYS   7          2HG       LYS   7   5.236  -5.320 -11.775
   51   1HD   LYS   7          1HD       LYS   7   3.013  -7.165 -10.883
   52   2HD   LYS   7          2HD       LYS   7   2.950  -6.326 -12.425
   53   1HE   LYS   7          1HE       LYS   7   5.073  -7.317 -13.086
   54   2HE   LYS   7          2HE       LYS   7   5.163  -8.157 -11.538
   55   1HZ   LYS   7          1HZ       LYS   7   3.058  -8.549 -13.599
   56   2HZ   LYS   7          2HZ       LYS   7   4.342  -9.601 -13.279
   57   3HZ   LYS   7          3HZ       LYS   7   3.142  -9.356 -12.112
   58    H    ASN   8           H        ASN   8   5.765  -3.158 -11.069
   59    HA   ASN   8           HA       ASN   8   4.928  -1.073  -9.185
   60   1HB   ASN   8          1HB       ASN   8   6.825  -1.102 -11.281
   61   2HB   ASN   8          2HB       ASN   8   5.542  -0.007 -11.763
   62   2HD2  ASN   8          2HD2      ASN   8   8.450   0.064 -10.514
   63   1HD2  ASN   8          1HD2      ASN   8   8.290   1.407  -9.445
   64    H    ALA   9           H        ALA   9   3.798  -2.931 -11.847
   65    HA   ALA   9           HA       ALA   9   1.254  -1.577 -11.712
   66   1HB   ALA   9          1HB       ALA   9   2.775  -1.913 -14.275
   67   2HB   ALA   9          2HB       ALA   9   1.097  -1.381 -14.170
   68   3HB   ALA   9          3HB       ALA   9   2.387  -0.383 -13.498
   69    H    TRP  10           H        TRP  10  -0.377  -3.008 -11.648
   70    HA   TRP  10           HA       TRP  10   0.271  -5.764 -12.522
   71   1HB   TRP  10          1HB       TRP  10  -1.648  -4.734 -10.453
   72   2HB   TRP  10          2HB       TRP  10  -1.595  -6.400 -11.006
   73    HD1  TRP  10           HD1      TRP  10   0.198  -7.966  -9.958
   74    HE1  TRP  10           HE1      TRP  10   2.053  -7.643  -8.208
   75    HE3  TRP  10           HE3      TRP  10   0.090  -2.886  -9.555
   76    HZ2  TRP  10           HZ2      TRP  10   3.298  -5.517  -6.835
   77    HZ3  TRP  10           HZ3      TRP  10   1.624  -1.773  -8.006
   78    HH2  TRP  10           HH2      TRP  10   3.197  -3.067  -6.663
   79   1HB   PRO  11          1HB       PRO  11  -1.783  -5.679 -17.654
   80   2HB   PRO  11          2HB       PRO  11  -1.367  -4.000 -17.310
   81   1HG   PRO  11          1HG       PRO  11   0.731  -4.946 -17.113
   82   2HG   PRO  11          2HG       PRO  11   0.082  -6.496 -16.548
   83   1HD   PRO  11          1HD       PRO  11   0.784  -5.653 -14.537
   84   2HD   PRO  11          2HD       PRO  11   0.541  -3.963 -15.033
   85    H    GLU  12           H        GLU  12  -1.516  -7.377 -15.017
   86    HA   GLU  12           HA       GLU  12  -3.654  -8.856 -16.099
   87   1HB   GLU  12          1HB       GLU  12  -1.462  -9.819 -15.640
   88   2HB   GLU  12          2HB       GLU  12  -2.749 -10.743 -14.880
   89   1HG   GLU  12          1HG       GLU  12  -2.041  -8.987 -12.875
   90   2HG   GLU  12          2HG       GLU  12  -1.528 -10.660 -13.044
   91    H    LEU  13           H        LEU  13  -3.648  -6.874 -13.337
   92    HA   LEU  13           HA       LEU  13  -5.512  -8.455 -11.822
   93   1HB   LEU  13          1HB       LEU  13  -4.334  -5.716 -11.531
   94   2HB   LEU  13          2HB       LEU  13  -5.728  -6.163 -10.574
   95    HG   LEU  13           HG       LEU  13  -2.990  -7.415 -10.500
   96   1HD1  LEU  13          1HD1      LEU  13  -4.608  -5.779  -8.594
   97   2HD1  LEU  13          2HD1      LEU  13  -3.271  -6.757  -8.058
   98   3HD1  LEU  13          3HD1      LEU  13  -3.028  -5.465  -9.193
   99   1HD2  LEU  13          1HD2      LEU  13  -5.613  -8.435  -9.528
  100   2HD2  LEU  13          2HD2      LEU  13  -4.241  -9.296 -10.220
  101   3HD2  LEU  13          3HD2      LEU  13  -4.176  -8.724  -8.579
  102    H    VAL  14           H        VAL  14  -5.649  -6.092 -14.326
  103    HA   VAL  14           HA       VAL  14  -8.153  -4.964 -13.911
  104    HB   VAL  14           HB       VAL  14  -6.968  -5.710 -16.595
  105   1HG1  VAL  14          1HG1      VAL  14  -9.002  -3.629 -15.788
  106   2HG1  VAL  14          2HG1      VAL  14  -8.256  -3.741 -17.382
  107   3HG1  VAL  14          3HG1      VAL  14  -9.279  -5.048 -16.797
  108   1HG2  VAL  14          1HG2      VAL  14  -5.804  -4.066 -14.657
  109   2HG2  VAL  14          2HG2      VAL  14  -5.442  -4.118 -16.373
  110   3HG2  VAL  14          3HG2      VAL  14  -6.602  -2.954 -15.757
  111    H    GLY  15           H        GLY  15 -10.019  -6.025 -13.547
  112   1HA   GLY  15          1HA       GLY  15 -11.824  -7.231 -14.627
  113   2HA   GLY  15          2HA       GLY  15 -10.654  -8.379 -15.249
  114    H    LYS  16           H        LYS  16  -9.527  -7.785 -12.247
  115    HA   LYS  16           HA       LYS  16 -11.020 -10.069 -11.126
  116   1HB   LYS  16          1HB       LYS  16  -8.222  -9.162 -11.007
  117   2HB   LYS  16          2HB       LYS  16  -8.868  -9.633  -9.448
  118   1HG   LYS  16          1HG       LYS  16  -9.126 -11.390 -11.877
  119   2HG   LYS  16          2HG       LYS  16  -7.689 -11.396 -10.853
  120   1HD   LYS  16          1HD       LYS  16  -8.873 -12.161  -8.982
  121   2HD   LYS  16          2HD       LYS  16 -10.439 -11.774  -9.687
  122   1HE   LYS  16          1HE       LYS  16 -10.105 -14.153  -9.744
  123   2HE   LYS  16          2HE       LYS  16 -10.069 -13.523 -11.390
  124   1HZ   LYS  16          1HZ       LYS  16  -7.659 -14.159  -9.761
  125   2HZ   LYS  16          2HZ       LYS  16  -8.319 -15.161 -10.951
  126   3HZ   LYS  16          3HZ       LYS  16  -7.674 -13.659 -11.378
  127    H    SER  17           H        SER  17 -11.477 -10.029  -8.808
  128    HA   SER  17           HA       SER  17 -12.981  -7.796  -8.079
  129   1HB   SER  17          1HB       SER  17 -13.403  -8.879  -6.054
  130   2HB   SER  17          2HB       SER  17 -13.009 -10.221  -7.128
  131    HG   SER  17           HG       SER  17 -11.884 -10.395  -5.163
  132    H    GLY  18           H        GLY  18 -12.574  -5.938  -6.958
  133   1HA   GLY  18          1HA       GLY  18 -10.109  -4.747  -6.861
  134   2HA   GLY  18          2HA       GLY  18 -11.415  -4.348  -5.774
  135    H    ASN  19           H        ASN  19 -11.451  -7.020  -4.559
  136    HA   ASN  19           HA       ASN  19  -9.506  -6.544  -2.532
  137   1HB   ASN  19          1HB       ASN  19 -11.881  -8.023  -2.740
  138   2HB   ASN  19          2HB       ASN  19 -10.642  -9.249  -2.518
  139   2HD2  ASN  19          2HD2      ASN  19 -11.546  -6.047  -1.234
  140   1HD2  ASN  19          1HD2      ASN  19 -11.252  -6.465   0.416
  141    H    MET  20           H        MET  20  -9.842  -8.944  -5.126
  142    HA   MET  20           HA       MET  20  -7.501 -10.401  -4.466
  143   1HB   MET  20          1HB       MET  20  -9.560 -10.660  -6.335
  144   2HB   MET  20          2HB       MET  20  -8.165 -10.354  -7.332
  145   1HG   MET  20          1HG       MET  20  -7.875 -12.551  -7.217
  146   2HG   MET  20          2HG       MET  20  -7.132 -12.214  -5.663
  147   1HE   MET  20          1HE       MET  20  -8.638 -12.022  -3.448
  148   2HE   MET  20          2HE       MET  20 -10.088 -11.322  -4.168
  149   3HE   MET  20          3HE       MET  20 -10.196 -12.823  -3.249
  150    H    ALA  21           H        ALA  21  -8.106  -7.508  -6.347
  151    HA   ALA  21           HA       ALA  21  -5.598  -7.380  -7.613
  152   1HB   ALA  21          1HB       ALA  21  -7.840  -5.492  -7.172
  153   2HB   ALA  21          2HB       ALA  21  -7.092  -6.031  -8.673
  154   3HB   ALA  21          3HB       ALA  21  -6.290  -4.822  -7.678
  155    H    ALA  22           H        ALA  22  -6.875  -5.493  -4.881
  156    HA   ALA  22           HA       ALA  22  -4.501  -4.255  -4.155
  157   1HB   ALA  22          1HB       ALA  22  -5.645  -4.359  -1.759
  158   2HB   ALA  22          2HB       ALA  22  -6.264  -3.354  -3.061
  159   3HB   ALA  22          3HB       ALA  22  -7.022  -4.908  -2.720
  160    H    ALA  23           H        ALA  23  -5.767  -7.423  -3.245
  161    HA   ALA  23           HA       ALA  23  -3.808  -8.054  -1.311
  162   1HB   ALA  23          1HB       ALA  23  -5.399  -9.920  -3.073
  163   2HB   ALA  23          2HB       ALA  23  -4.539 -10.362  -1.595
  164   3HB   ALA  23          3HB       ALA  23  -5.920  -9.268  -1.519
  165    H    THR  24           H        THR  24  -4.003  -8.695  -4.807
  166    HA   THR  24           HA       THR  24  -1.655 -10.210  -5.034
  167    HB   THR  24           HB       THR  24  -2.889  -8.345  -7.052
  168    HG1  THR  24           HG1      THR  24  -3.307 -11.119  -6.573
  169   1HG2  THR  24          1HG2      THR  24  -0.934 -10.595  -7.404
  170   2HG2  THR  24          2HG2      THR  24  -1.899  -9.918  -8.715
  171   3HG2  THR  24          3HG2      THR  24  -0.735  -8.903  -7.868
  172    H    VAL  25           H        VAL  25  -2.182  -6.706  -5.132
  173    HA   VAL  25           HA       VAL  25   0.473  -6.011  -5.839
  174    HB   VAL  25           HB       VAL  25  -1.547  -4.373  -4.291
  175   1HG1  VAL  25          1HG1      VAL  25   1.191  -3.826  -5.028
  176   2HG1  VAL  25          2HG1      VAL  25   0.106  -2.729  -5.858
  177   3HG1  VAL  25          3HG1      VAL  25   0.053  -2.854  -4.109
  178   1HG2  VAL  25          1HG2      VAL  25  -1.019  -4.570  -7.245
  179   2HG2  VAL  25          2HG2      VAL  25  -2.469  -5.053  -6.408
  180   3HG2  VAL  25          3HG2      VAL  25  -2.045  -3.360  -6.499
  181    H    GLU  26           H        GLU  26  -1.149  -5.885  -2.642
  182    HA   GLU  26           HA       GLU  26   1.218  -5.300  -1.215
  183   1HB   GLU  26          1HB       GLU  26  -1.396  -6.535  -0.354
  184   2HB   GLU  26          2HB       GLU  26  -0.119  -6.110   0.780
  185   1HG   GLU  26          1HG       GLU  26  -0.491  -3.908   0.633
  186   2HG   GLU  26          2HG       GLU  26  -0.952  -3.959  -1.068
  187    H    ARG  27           H        ARG  27  -0.036  -8.302  -2.461
  188    HA   ARG  27           HA       ARG  27   1.565  -9.957  -0.716
  189   1HB   ARG  27          1HB       ARG  27  -0.646 -10.590  -1.809
  190   2HB   ARG  27          2HB       ARG  27   0.249 -10.829  -3.302
  191   1HG   ARG  27          1HG       ARG  27   1.550 -12.569  -2.285
  192   2HG   ARG  27          2HG       ARG  27   0.859 -12.226  -0.696
  193   1HD   ARG  27          1HD       ARG  27  -0.741 -13.125  -3.089
  194   2HD   ARG  27          2HD       ARG  27  -0.106 -14.207  -1.868
  195    HE   ARG  27           HE       ARG  27  -2.125 -12.090  -1.412
  196   1HH1  ARG  27          1HH1      ARG  27  -0.688 -15.172  -0.481
  197   2HH1  ARG  27          2HH1      ARG  27  -1.873 -15.472   0.724
  198   1HH2  ARG  27          1HH2      ARG  27  -3.667 -12.527   0.205
  199   2HH2  ARG  27          2HH2      ARG  27  -3.555 -13.992   1.123
  200    H    GLU  28           H        GLU  28   1.583  -9.331  -4.244
  201    HA   GLU  28           HA       GLU  28   4.093 -10.568  -4.691
  202   1HB   GLU  28          1HB       GLU  28   2.598  -8.480  -6.286
  203   2HB   GLU  28          2HB       GLU  28   4.058  -9.285  -6.855
  204   1HG   GLU  28          1HG       GLU  28   2.838 -11.464  -6.588
  205   2HG   GLU  28          2HG       GLU  28   1.377 -10.529  -6.279
  206    H    ASN  29           H        ASN  29   3.135  -7.266  -3.914
  207    HA   ASN  29           HA       ASN  29   5.989  -6.551  -3.601
  208   1HB   ASN  29          1HB       ASN  29   4.954  -5.356  -5.468
  209   2HB   ASN  29          2HB       ASN  29   3.675  -4.771  -4.409
  210   2HD2  ASN  29          2HD2      ASN  29   5.459  -3.172  -5.956
  211   1HD2  ASN  29          1HD2      ASN  29   6.403  -2.242  -4.850
  212    H    ARG  30           H        ARG  30   5.734  -7.443  -1.451
  213    HA   ARG  30           HA       ARG  30   3.919  -6.418   0.449
  214   1HB   ARG  30          1HB       ARG  30   5.326  -8.530   0.571
  215   2HB   ARG  30          2HB       ARG  30   6.663  -7.503   1.068
  216   1HG   ARG  30          1HG       ARG  30   5.694  -6.985   3.098
  217   2HG   ARG  30          2HG       ARG  30   4.064  -7.360   2.547
  218   1HD   ARG  30          1HD       ARG  30   4.225  -9.507   3.098
  219   2HD   ARG  30          2HD       ARG  30   5.848  -9.680   2.431
  220    HE   ARG  30           HE       ARG  30   5.173  -9.381   5.145
  221   1HH1  ARG  30          1HH1      ARG  30   7.558  -8.269   2.811
  222   2HH1  ARG  30          2HH1      ARG  30   8.759  -8.004   4.002
  223   1HH2  ARG  30          1HH2      ARG  30   6.814  -9.052   6.702
  224   2HH2  ARG  30          2HH2      ARG  30   8.364  -8.463   6.201
  225    H    ASN  31           H        ASN  31   6.283  -4.670  -1.106
  226    HA   ASN  31           HA       ASN  31   7.058  -3.113   1.227
  227   1HB   ASN  31          1HB       ASN  31   8.753  -3.708  -0.451
  228   2HB   ASN  31          2HB       ASN  31   7.855  -2.822  -1.676
  229   2HD2  ASN  31          2HD2      ASN  31   7.624  -0.508  -1.411
  230   1HD2  ASN  31          1HD2      ASN  31   8.820   0.356  -0.519
  231    H    VAL  32           H        VAL  32   4.573  -3.126  -1.097
  232    HA   VAL  32           HA       VAL  32   4.037  -0.271  -0.579
  233    HB   VAL  32           HB       VAL  32   3.020  -0.076  -2.733
  234   1HG1  VAL  32          1HG1      VAL  32   5.706  -1.433  -2.961
  235   2HG1  VAL  32          2HG1      VAL  32   4.971  -0.427  -4.190
  236   3HG1  VAL  32          3HG1      VAL  32   5.434   0.262  -2.644
  237   1HG2  VAL  32          1HG2      VAL  32   3.374  -3.037  -2.858
  238   2HG2  VAL  32          2HG2      VAL  32   1.968  -2.062  -3.219
  239   3HG2  VAL  32          3HG2      VAL  32   3.317  -2.109  -4.346
  240    H    HIS  33           H        HIS  33   1.675   0.249  -0.955
  241    HA   HIS  33           HA       HIS  33  -0.070  -1.906   0.022
  242   1HB   HIS  33          1HB       HIS  33  -0.304  -0.872   1.979
  243   2HB   HIS  33          2HB       HIS  33   0.725   0.455   1.463
  244    HD1  HIS  33           HD1      HIS  33  -2.847  -0.518   1.904
  245    HD2  HIS  33           HD2      HIS  33  -0.643   2.768   0.646
  246    HE1  HIS  33           HE1      HIS  33  -4.475   1.397   1.816
  247    HE2  HIS  33           HE2      HIS  33  -3.061   3.396   1.246
  248    H    ALA  34           H        ALA  34  -1.988  -2.065  -1.018
  249    HA   ALA  34           HA       ALA  34  -2.553  -0.045  -3.075
  250   1HB   ALA  34          1HB       ALA  34  -3.491  -2.892  -2.908
  251   2HB   ALA  34          2HB       ALA  34  -3.799  -1.764  -4.231
  252   3HB   ALA  34          3HB       ALA  34  -2.154  -2.304  -3.890
  253    H    ILE  35           H        ILE  35  -4.403   1.077  -3.103
  254    HA   ILE  35           HA       ILE  35  -6.307   0.607  -0.898
  255    HB   ILE  35           HB       ILE  35  -6.062   3.075  -2.624
  256   1HG1  ILE  35          1HG1      ILE  35  -5.030   2.765   0.180
  257   2HG1  ILE  35          2HG1      ILE  35  -3.981   2.504  -1.206
  258   1HG2  ILE  35          1HG2      ILE  35  -7.448   2.557   0.009
  259   2HG2  ILE  35          2HG2      ILE  35  -7.347   4.115  -0.805
  260   3HG2  ILE  35          3HG2      ILE  35  -8.232   2.795  -1.552
  261   1HD1  ILE  35          1HD1      ILE  35  -5.441   5.044  -0.542
  262   2HD1  ILE  35          2HD1      ILE  35  -3.733   4.729  -0.282
  263   3HD1  ILE  35          3HD1      ILE  35  -4.377   4.786  -1.918
  264    H    VAL  36           H        VAL  36  -8.220  -0.271  -1.385
  265    HA   VAL  36           HA       VAL  36  -9.021  -0.490  -4.183
  266    HB   VAL  36           HB       VAL  36 -10.257  -1.705  -1.719
  267   1HG1  VAL  36          1HG1      VAL  36 -10.787  -2.117  -4.657
  268   2HG1  VAL  36          2HG1      VAL  36 -11.302  -3.250  -3.416
  269   3HG1  VAL  36          3HG1      VAL  36 -11.916  -1.603  -3.414
  270   1HG2  VAL  36          1HG2      VAL  36  -8.341  -2.866  -3.741
  271   2HG2  VAL  36          2HG2      VAL  36  -8.019  -2.540  -2.040
  272   3HG2  VAL  36          3HG2      VAL  36  -9.176  -3.788  -2.491
  273    H    LEU  37           H        LEU  37 -10.399   0.842  -5.095
  274    HA   LEU  37           HA       LEU  37 -12.629   1.956  -3.581
  275   1HB   LEU  37          1HB       LEU  37 -11.981   4.225  -4.691
  276   2HB   LEU  37          2HB       LEU  37 -11.355   3.761  -3.143
  277    HG   LEU  37           HG       LEU  37  -9.359   2.793  -4.694
  278   1HD1  LEU  37          1HD1      LEU  37 -10.564   3.603  -6.749
  279   2HD1  LEU  37          2HD1      LEU  37 -10.227   5.244  -6.199
  280   3HD1  LEU  37          3HD1      LEU  37  -8.901   4.146  -6.553
  281   1HD2  LEU  37          1HD2      LEU  37  -9.800   5.176  -3.106
  282   2HD2  LEU  37          2HD2      LEU  37  -8.381   4.155  -3.277
  283   3HD2  LEU  37          3HD2      LEU  37  -8.664   5.465  -4.417
  284    H    LYS  38           H        LYS  38 -14.235   2.966  -4.983
  285    HA   LYS  38           HA       LYS  38 -14.331   1.596  -7.549
  286   1HB   LYS  38          1HB       LYS  38 -16.647   2.232  -7.634
  287   2HB   LYS  38          2HB       LYS  38 -16.433   3.335  -6.277
  288   1HG   LYS  38          1HG       LYS  38 -16.300   0.334  -6.226
  289   2HG   LYS  38          2HG       LYS  38 -15.858   1.356  -4.861
  290   1HD   LYS  38          1HD       LYS  38 -18.216   2.381  -5.171
  291   2HD   LYS  38          2HD       LYS  38 -18.542   0.946  -6.148
  292   1HE   LYS  38          1HE       LYS  38 -17.365   0.643  -3.404
  293   2HE   LYS  38          2HE       LYS  38 -19.083   0.978  -3.596
  294   1HZ   LYS  38          1HZ       LYS  38 -19.297  -0.983  -4.979
  295   2HZ   LYS  38          2HZ       LYS  38 -17.642  -1.309  -4.828
  296   3HZ   LYS  38          3HZ       LYS  38 -18.647  -1.388  -3.471
  297    H    GLU  39           H        GLU  39 -15.022   2.693  -9.491
  298    HA   GLU  39           HA       GLU  39 -13.398   4.757 -10.297
  299   1HB   GLU  39          1HB       GLU  39 -15.402   3.213 -11.462
  300   2HB   GLU  39          2HB       GLU  39 -15.993   4.853 -11.652
  301   1HG   GLU  39          1HG       GLU  39 -14.166   5.495 -12.944
  302   2HG   GLU  39          2HG       GLU  39 -13.201   4.110 -12.450
  303    H    GLY  40           H        GLY  40 -13.239   6.850  -9.823
  304   1HA   GLY  40          1HA       GLY  40 -14.228   9.017  -9.769
  305   2HA   GLY  40          2HA       GLY  40 -15.712   8.332  -9.141
  306    H    SER  41           H        SER  41 -13.485   6.713  -7.428
  307    HA   SER  41           HA       SER  41 -13.919   8.242  -5.072
  308   1HB   SER  41          1HB       SER  41 -13.605   5.791  -5.068
  309   2HB   SER  41          2HB       SER  41 -11.935   6.024  -5.565
  310    HG   SER  41           HG       SER  41 -13.158   6.685  -3.113
  311    H    ALA  42           H        ALA  42 -11.504   8.199  -3.725
  312    HA   ALA  42           HA       ALA  42 -10.298  10.604  -4.655
  313   1HB   ALA  42          1HB       ALA  42  -8.830  10.369  -2.729
  314   2HB   ALA  42          2HB       ALA  42  -9.400   8.718  -2.476
  315   3HB   ALA  42          3HB       ALA  42 -10.509  10.075  -2.283
  316    H    MET  43           H        MET  43  -9.373  10.279  -6.665
  317    HA   MET  43           HA       MET  43  -7.061   8.458  -6.707
  318   1HB   MET  43          1HB       MET  43  -9.225   8.099  -8.233
  319   2HB   MET  43          2HB       MET  43  -8.360   9.212  -9.274
  320   1HG   MET  43          1HG       MET  43  -6.437   7.387  -8.532
  321   2HG   MET  43          2HG       MET  43  -7.876   6.401  -8.662
  322   1HE   MET  43          1HE       MET  43  -5.106   8.268 -10.216
  323   2HE   MET  43          2HE       MET  43  -5.422   8.324 -11.950
  324   3HE   MET  43          3HE       MET  43  -6.222   9.466 -10.872
  325    H    THR  44           H        THR  44  -5.464   9.806  -6.253
  326    HA   THR  44           HA       THR  44  -5.255  12.372  -7.619
  327    HB   THR  44           HB       THR  44  -3.026  12.323  -6.149
  328    HG1  THR  44           HG1      THR  44  -3.643  10.067  -5.523
  329   1HG2  THR  44          1HG2      THR  44  -4.830  13.912  -5.802
  330   2HG2  THR  44          2HG2      THR  44  -5.737  12.693  -4.906
  331   3HG2  THR  44          3HG2      THR  44  -4.201  13.290  -4.277
  332    H    LYS  45           H        LYS  45  -3.447  12.958  -8.855
  333    HA   LYS  45           HA       LYS  45  -2.430  10.800 -10.498
  334   1HB   LYS  45          1HB       LYS  45  -2.284  13.793 -10.553
  335   2HB   LYS  45          2HB       LYS  45  -1.155  12.864 -11.522
  336   1HG   LYS  45          1HG       LYS  45  -2.653  12.695 -13.110
  337   2HG   LYS  45          2HG       LYS  45  -3.677  11.731 -12.044
  338   1HD   LYS  45          1HD       LYS  45  -4.569  13.927 -11.133
  339   2HD   LYS  45          2HD       LYS  45  -3.707  14.720 -12.456
  340   1HE   LYS  45          1HE       LYS  45  -4.974  13.226 -14.039
  341   2HE   LYS  45          2HE       LYS  45  -5.934  12.702 -12.653
  342   1HZ   LYS  45          1HZ       LYS  45  -6.631  14.995 -12.318
  343   2HZ   LYS  45          2HZ       LYS  45  -5.703  15.497 -13.644
  344   3HZ   LYS  45          3HZ       LYS  45  -7.024  14.469 -13.877
  345    H    ASP  46           H        ASP  46  -1.289  12.752  -7.857
  346    HA   ASP  46           HA       ASP  46   1.415  12.724  -8.114
  347   1HB   ASP  46          1HB       ASP  46  -0.162  13.501  -6.142
  348   2HB   ASP  46          2HB       ASP  46   0.260  11.942  -5.442
  349    H    PHE  47           H        PHE  47   3.100  11.318  -7.737
  350    HA   PHE  47           HA       PHE  47   2.434   8.492  -7.980
  351   1HB   PHE  47          1HB       PHE  47   4.084   9.224  -9.486
  352   2HB   PHE  47          2HB       PHE  47   4.978  10.079  -8.236
  353    HD1  PHE  47           HD1      PHE  47   6.536   8.941  -6.824
  354    HD2  PHE  47           HD2      PHE  47   4.171   6.765  -9.622
  355    HE1  PHE  47           HE1      PHE  47   7.916   6.943  -6.430
  356    HE2  PHE  47           HE2      PHE  47   5.608   4.802  -9.299
  357    HZ   PHE  47           HZ       PHE  47   7.485   4.894  -7.737
  358    H    ARG  48           H        ARG  48   2.557   7.030  -6.401
  359    HA   ARG  48           HA       ARG  48   4.237   7.507  -4.043
  360   1HB   ARG  48          1HB       ARG  48   1.259   7.057  -3.965
  361   2HB   ARG  48          2HB       ARG  48   2.298   6.787  -2.578
  362   1HG   ARG  48          1HG       ARG  48   3.034   9.228  -2.922
  363   2HG   ARG  48          2HG       ARG  48   1.632   9.355  -3.987
  364   1HD   ARG  48          1HD       ARG  48   0.218   8.566  -2.100
  365   2HD   ARG  48          2HD       ARG  48   1.004  10.112  -1.839
  366    HE   ARG  48           HE       ARG  48   2.292   7.693  -0.779
  367   1HH1  ARG  48          1HH1      ARG  48   0.443  10.616  -0.114
  368   2HH1  ARG  48          2HH1      ARG  48   0.812  10.580   1.564
  369   1HH2  ARG  48          1HH2      ARG  48   2.744   7.679   1.442
  370   2HH2  ARG  48          2HH2      ARG  48   2.102   8.928   2.457
  371    H    CYS  49           H        CYS  49   5.514   5.792  -4.134
  372    HA   CYS  49           HA       CYS  49   4.992   3.369  -5.372
  373   1HB   CYS  49          1HB       CYS  49   7.030   4.412  -3.526
  374   2HB   CYS  49          2HB       CYS  49   6.836   2.671  -3.449
  375    H    ASP  50           H        ASP  50   4.564   4.216  -1.962
  376    HA   ASP  50           HA       ASP  50   3.705   1.556  -1.270
  377   1HB   ASP  50          1HB       ASP  50   4.864   2.949   0.362
  378   2HB   ASP  50          2HB       ASP  50   3.267   2.501   0.950
  379    H    ARG  51           H        ARG  51   2.141   3.799  -3.072
  380    HA   ARG  51           HA       ARG  51  -0.473   2.980  -2.029
  381   1HB   ARG  51          1HB       ARG  51   0.050   5.370  -1.583
  382   2HB   ARG  51          2HB       ARG  51   0.171   5.609  -3.315
  383   1HG   ARG  51          1HG       ARG  51  -2.224   4.738  -3.463
  384   2HG   ARG  51          2HG       ARG  51  -2.224   4.898  -1.715
  385   1HD   ARG  51          1HD       ARG  51  -1.433   7.305  -2.145
  386   2HD   ARG  51          2HD       ARG  51  -3.128   6.904  -2.380
  387    HE   ARG  51           HE       ARG  51  -2.181   6.529  -4.849
  388   1HH1  ARG  51          1HH1      ARG  51  -1.740   9.202  -2.599
  389   2HH1  ARG  51          2HH1      ARG  51  -1.556  10.360  -3.855
  390   1HH2  ARG  51          1HH2      ARG  51  -1.977   8.110  -6.479
  391   2HH2  ARG  51          2HH2      ARG  51  -1.642   9.747  -6.049
  392    H    VAL  52           H        VAL  52  -1.409   1.658  -3.413
  393    HA   VAL  52           HA       VAL  52  -1.027   2.123  -6.312
  394    HB   VAL  52           HB       VAL  52  -1.652  -0.495  -4.949
  395   1HG1  VAL  52          1HG1      VAL  52  -1.251   0.262  -7.820
  396   2HG1  VAL  52          2HG1      VAL  52  -1.134  -1.398  -7.253
  397   3HG1  VAL  52          3HG1      VAL  52  -2.647  -0.513  -7.091
  398   1HG2  VAL  52          1HG2      VAL  52   0.854   0.830  -5.382
  399   2HG2  VAL  52          2HG2      VAL  52   0.516  -0.700  -4.590
  400   3HG2  VAL  52          3HG2      VAL  52   0.790  -0.656  -6.326
  401    H    TRP  53           H        TRP  53  -2.808   2.809  -7.319
  402    HA   TRP  53           HA       TRP  53  -5.306   2.899  -5.916
  403   1HB   TRP  53          1HB       TRP  53  -4.393   3.808  -8.626
  404   2HB   TRP  53          2HB       TRP  53  -6.100   3.832  -8.223
  405    HD1  TRP  53           HD1      TRP  53  -4.011   6.356  -8.807
  406    HE1  TRP  53           HE1      TRP  53  -4.141   8.336  -7.168
  407    HE3  TRP  53           HE3      TRP  53  -6.219   3.997  -4.854
  408    HZ2  TRP  53           HZ2      TRP  53  -5.042   8.811  -4.526
  409    HZ3  TRP  53           HZ3      TRP  53  -6.655   5.274  -2.812
  410    HH2  TRP  53           HH2      TRP  53  -6.093   7.640  -2.656
  411    H    VAL  54           H        VAL  54  -6.907   1.479  -5.946
  412    HA   VAL  54           HA       VAL  54  -6.978  -0.511  -8.145
  413    HB   VAL  54           HB       VAL  54  -7.532  -0.814  -5.205
  414   1HG1  VAL  54          1HG1      VAL  54  -8.582  -2.450  -7.470
  415   2HG1  VAL  54          2HG1      VAL  54  -8.217  -3.208  -5.924
  416   3HG1  VAL  54          3HG1      VAL  54  -9.395  -1.921  -6.007
  417   1HG2  VAL  54          1HG2      VAL  54  -5.225  -1.165  -6.089
  418   2HG2  VAL  54          2HG2      VAL  54  -5.936  -2.557  -5.277
  419   3HG2  VAL  54          3HG2      VAL  54  -5.872  -2.508  -7.034
  420    H    ILE  55           H        ILE  55  -8.343   0.862  -9.358
  421    HA   ILE  55           HA       ILE  55 -10.857   1.727  -8.254
  422    HB   ILE  55           HB       ILE  55 -10.017   1.836 -11.133
  423   1HG1  ILE  55          1HG1      ILE  55  -9.075   3.355  -8.790
  424   2HG1  ILE  55          2HG1      ILE  55  -9.733   4.387 -10.050
  425   1HG2  ILE  55          1HG2      ILE  55 -12.125   3.254  -9.541
  426   2HG2  ILE  55          2HG2      ILE  55 -11.599   3.776 -11.140
  427   3HG2  ILE  55          3HG2      ILE  55 -12.344   2.193 -10.934
  428   1HD1  ILE  55          1HD1      ILE  55  -7.644   2.308 -10.609
  429   2HD1  ILE  55          2HD1      ILE  55  -8.182   3.640 -11.630
  430   3HD1  ILE  55          3HD1      ILE  55  -7.287   3.970 -10.154
  431    H    VAL  56           H        VAL  56 -12.728   0.667  -8.318
  432    HA   VAL  56           HA       VAL  56 -13.016  -1.573 -10.193
  433    HB   VAL  56           HB       VAL  56 -14.299  -2.774  -8.520
  434   1HG1  VAL  56          1HG1      VAL  56 -11.506  -2.328  -8.412
  435   2HG1  VAL  56          2HG1      VAL  56 -12.083  -2.460  -6.756
  436   3HG1  VAL  56          3HG1      VAL  56 -12.411  -3.743  -7.911
  437   1HG2  VAL  56          1HG2      VAL  56 -13.705  -0.423  -6.749
  438   2HG2  VAL  56          2HG2      VAL  56 -15.277  -1.038  -7.251
  439   3HG2  VAL  56          3HG2      VAL  56 -14.284  -1.975  -6.149
  440    H    ASN  57           H        ASN  57 -15.287  -2.185 -10.610
  441    HA   ASN  57           HA       ASN  57 -16.818   0.217 -11.187
  442   1HB   ASN  57          1HB       ASN  57 -16.592  -1.555 -12.872
  443   2HB   ASN  57          2HB       ASN  57 -18.269  -1.253 -12.476
  444   2HD2  ASN  57          2HD2      ASN  57 -17.412  -3.584 -13.720
  445   1HD2  ASN  57          1HD2      ASN  57 -17.647  -4.899 -12.626
  446    H    ASP  58           H        ASP  58 -19.355  -0.262 -11.016
  447    HA   ASP  58           HA       ASP  58 -20.048   0.104  -8.360
  448   1HB   ASP  58          1HB       ASP  58 -21.656  -0.773 -10.758
  449   2HB   ASP  58          2HB       ASP  58 -22.413  -0.512  -9.188
  450    H    HIS  59           H        HIS  59 -19.458  -2.889 -10.023
  451    HA   HIS  59           HA       HIS  59 -20.868  -4.461  -8.036
  452   1HB   HIS  59          1HB       HIS  59 -20.259  -4.856 -10.716
  453   2HB   HIS  59          2HB       HIS  59 -19.128  -5.927  -9.899
  454    HD1  HIS  59           HD1      HIS  59 -20.077  -8.015  -8.814
  455    HD2  HIS  59           HD2      HIS  59 -23.000  -5.468 -10.306
  456    HE1  HIS  59           HE1      HIS  59 -22.225  -9.320  -8.706
  457    HE2  HIS  59           HE2      HIS  59 -23.994  -7.726  -9.529
  458    H    GLY  60           H        GLY  60 -17.632  -3.337  -8.661
  459   1HA   GLY  60          1HA       GLY  60 -16.095  -3.321  -6.830
  460   2HA   GLY  60          2HA       GLY  60 -16.702  -4.878  -6.313
  461    H    VAL  61           H        VAL  61 -16.167  -4.296  -9.708
  462    HA   VAL  61           HA       VAL  61 -13.953  -6.225  -9.658
  463    HB   VAL  61           HB       VAL  61 -15.524  -5.208 -12.036
  464   1HG1  VAL  61          1HG1      VAL  61 -13.602  -7.505 -11.709
  465   2HG1  VAL  61          2HG1      VAL  61 -14.572  -7.197 -13.148
  466   3HG1  VAL  61          3HG1      VAL  61 -13.344  -6.040 -12.654
  467   1HG2  VAL  61          1HG2      VAL  61 -15.882  -7.747 -10.448
  468   2HG2  VAL  61          2HG2      VAL  61 -17.016  -6.398 -10.533
  469   3HG2  VAL  61          3HG2      VAL  61 -16.693  -7.368 -11.967
  470    H    VAL  62           H        VAL  62 -11.932  -5.696 -10.460
  471    HA   VAL  62           HA       VAL  62 -11.243  -2.935 -10.449
  472    HB   VAL  62           HB       VAL  62  -9.544  -5.248 -11.387
  473   1HG1  VAL  62          1HG1      VAL  62  -8.791  -2.469 -10.456
  474   2HG1  VAL  62          2HG1      VAL  62  -7.676  -3.774 -10.848
  475   3HG1  VAL  62          3HG1      VAL  62  -8.682  -3.086 -12.105
  476   1HG2  VAL  62          1HG2      VAL  62 -10.598  -4.976  -8.875
  477   2HG2  VAL  62          2HG2      VAL  62  -9.100  -5.787  -9.274
  478   3HG2  VAL  62          3HG2      VAL  62  -9.068  -4.125  -8.716
  479    H    THR  63           H        THR  63 -11.712  -1.571 -12.052
  480    HA   THR  63           HA       THR  63 -11.891  -2.560 -14.812
  481    HB   THR  63           HB       THR  63 -12.953  -0.451 -15.316
  482    HG1  THR  63           HG1      THR  63 -12.045   1.071 -14.090
  483   1HG2  THR  63          1HG2      THR  63 -14.410  -2.145 -14.341
  484   2HG2  THR  63          2HG2      THR  63 -14.061  -1.516 -12.731
  485   3HG2  THR  63          3HG2      THR  63 -14.913  -0.512 -13.905
  486    H    SER  64           H        SER  64  -9.973  -0.400 -12.789
  487    HA   SER  64           HA       SER  64  -8.364   0.358 -15.141
  488   1HB   SER  64          1HB       SER  64  -9.170   2.236 -13.842
  489   2HB   SER  64          2HB       SER  64  -8.502   1.526 -12.384
  490    HG   SER  64           HG       SER  64  -7.228   3.217 -13.581
  491    H    VAL  65           H        VAL  65  -6.130   0.236 -15.080
  492    HA   VAL  65           HA       VAL  65  -5.059  -2.146 -14.039
  493    HB   VAL  65           HB       VAL  65  -3.369   0.187 -14.899
  494   1HG1  VAL  65          1HG1      VAL  65  -2.926  -2.648 -14.360
  495   2HG1  VAL  65          2HG1      VAL  65  -2.323  -2.145 -15.942
  496   3HG1  VAL  65          3HG1      VAL  65  -1.791  -1.313 -14.487
  497   1HG2  VAL  65          1HG2      VAL  65  -4.994  -1.679 -16.616
  498   2HG2  VAL  65          2HG2      VAL  65  -4.948   0.083 -16.634
  499   3HG2  VAL  65          3HG2      VAL  65  -3.568  -0.831 -17.215
  500   1HB   PRO  66          1HB       PRO  66  -4.794  -2.021  -8.684
  501   2HB   PRO  66          2HB       PRO  66  -3.350  -2.948  -9.044
  502   1HG   PRO  66          1HG       PRO  66  -4.733  -4.317 -10.141
  503   2HG   PRO  66          2HG       PRO  66  -6.036  -3.167 -10.149
  504   1HD   PRO  66          1HD       PRO  66  -3.883  -3.586 -12.138
  505   2HD   PRO  66          2HD       PRO  66  -5.559  -3.090 -12.379
  506    H    HIS  67           H        HIS  67  -2.296   0.778 -10.853
  507    HA   HIS  67           HA       HIS  67   0.248  -0.653 -10.412
  508   1HB   HIS  67          1HB       HIS  67   1.250   0.866 -12.135
  509   2HB   HIS  67          2HB       HIS  67   0.023  -0.229 -12.757
  510    HD1  HIS  67           HD1      HIS  67  -2.467   0.926 -12.903
  511    HD2  HIS  67           HD2      HIS  67   0.844   3.376 -13.071
  512    HE1  HIS  67           HE1      HIS  67  -3.310   3.078 -13.860
  513    HE2  HIS  67           HE2      HIS  67  -1.290   4.581 -13.891
  514    H    ILE  68           H        ILE  68   1.826   0.394  -9.309
  515    HA   ILE  68           HA       ILE  68   1.297   1.981  -7.217
  516    HB   ILE  68           HB       ILE  68   3.696   1.453  -8.835
  517   1HG1  ILE  68          1HG1      ILE  68   4.101   1.671  -5.982
  518   2HG1  ILE  68          2HG1      ILE  68   2.666   0.752  -6.302
  519   1HG2  ILE  68          1HG2      ILE  68   3.634   3.905  -7.084
  520   2HG2  ILE  68          2HG2      ILE  68   5.110   3.099  -7.610
  521   3HG2  ILE  68          3HG2      ILE  68   4.030   3.786  -8.799
  522   1HD1  ILE  68          1HD1      ILE  68   5.380   0.168  -7.405
  523   2HD1  ILE  68          2HD1      ILE  68   4.593  -0.662  -6.080
  524   3HD1  ILE  68          3HD1      ILE  68   3.908  -0.760  -7.686
  525    H    THR  69           H        THR  69   0.338   3.869  -6.980
  526    HA   THR  69           HA       THR  69   1.173   6.205  -8.449
  527    HB   THR  69           HB       THR  69  -1.508   4.923  -8.990
  528    HG1  THR  69           HG1      THR  69  -0.800   4.857 -11.012
  529   1HG2  THR  69          1HG2      THR  69  -0.728   7.769  -9.569
  530   2HG2  THR  69          2HG2      THR  69  -2.117   6.938 -10.253
  531   3HG2  THR  69          3HG2      THR  69  -2.037   7.241  -8.530

  No H/Q in entry =         531
  Start of MODEL   11
    1    H    SER   1           H        SER   1   7.882   7.526 -10.328
    2    HA   SER   1           HA       SER   1   9.002   5.704  -9.349
    3   1HB   SER   1          1HB       SER   1  10.169   3.933 -10.615
    4   2HB   SER   1          2HB       SER   1   9.974   4.859 -12.103
    5    HG   SER   1           HG       SER   1   7.709   4.790 -11.763
    6    H    ARG   2           H        ARG   2  10.587   5.930  -7.918
    7    HA   ARG   2           HA       ARG   2  13.303   6.554  -8.913
    8   1HB   ARG   2          1HB       ARG   2  11.859   7.783  -6.730
    9   2HB   ARG   2          2HB       ARG   2  13.257   6.947  -6.102
   10   1HG   ARG   2          1HG       ARG   2  14.597   8.186  -7.891
   11   2HG   ARG   2          2HG       ARG   2  13.145   9.166  -8.117
   12   1HD   ARG   2          1HD       ARG   2  14.766  10.195  -6.572
   13   2HD   ARG   2          2HD       ARG   2  13.209   9.867  -5.811
   14    HE   ARG   2           HE       ARG   2  14.992   7.699  -5.382
   15   1HH1  ARG   2          1HH1      ARG   2  14.434  11.012  -4.359
   16   2HH1  ARG   2          2HH1      ARG   2  15.167  10.767  -2.817
   17   1HH2  ARG   2          1HH2      ARG   2  15.933   7.398  -3.344
   18   2HH2  ARG   2          2HH2      ARG   2  16.018   8.726  -2.234
   19    H    ARG   3           H        ARG   3  12.687   4.121  -9.336
   20    HA   ARG   3           HA       ARG   3  13.088   1.949  -8.893
   21   1HB   ARG   3          1HB       ARG   3  15.345   3.445  -8.054
   22   2HB   ARG   3          2HB       ARG   3  15.114   2.224  -6.825
   23   1HG   ARG   3          1HG       ARG   3  14.994   0.526  -8.698
   24   2HG   ARG   3          2HG       ARG   3  16.557   1.268  -8.363
   25   1HD   ARG   3          1HD       ARG   3  14.657   2.084 -10.563
   26   2HD   ARG   3          2HD       ARG   3  16.195   2.862 -10.193
   27    HE   ARG   3           HE       ARG   3  17.272   1.201 -11.300
   28   1HH1  ARG   3          1HH1      ARG   3  14.041   0.057 -10.503
   29   2HH1  ARG   3          2HH1      ARG   3  14.234  -1.414 -11.369
   30   1HH2  ARG   3          1HH2      ARG   3  17.487  -0.760 -12.454
   31   2HH2  ARG   3          2HH2      ARG   3  16.169  -1.885 -12.484
   32    H    CYS   4           H        CYS   4  11.015   1.663  -7.910
   33    HA   CYS   4           HA       CYS   4  11.039   1.566  -4.979
   34   1HB   CYS   4          1HB       CYS   4   8.863   1.954  -4.927
   35   2HB   CYS   4          2HB       CYS   4   8.487   1.049  -6.387
   36   1HB   PRO   5          1HB       PRO   5   9.875  -2.854  -2.594
   37   2HB   PRO   5          2HB       PRO   5  11.502  -3.438  -2.899
   38   1HG   PRO   5          1HG       PRO   5  11.089  -1.204  -1.492
   39   2HG   PRO   5          2HG       PRO   5  12.453  -1.370  -2.584
   40   1HD   PRO   5          1HD       PRO   5  11.546   0.548  -3.435
   41   2HD   PRO   5          2HD       PRO   5   9.885   0.103  -2.992
   42    H    GLY   6           H        GLY   6  10.223  -4.767  -5.316
   43   1HA   GLY   6          1HA       GLY   6   8.437  -6.018  -5.951
   44   2HA   GLY   6          2HA       GLY   6   7.420  -4.896  -5.109
   45    H    LYS   7           H        LYS   7   6.424  -6.040  -7.290
   46    HA   LYS   7           HA       LYS   7   6.928  -4.900  -9.777
   47   1HB   LYS   7          1HB       LYS   7   5.528  -6.867  -9.321
   48   2HB   LYS   7          2HB       LYS   7   4.288  -5.851  -8.722
   49   1HG   LYS   7          1HG       LYS   7   3.871  -4.875 -10.796
   50   2HG   LYS   7          2HG       LYS   7   5.342  -5.544 -11.502
   51   1HD   LYS   7          1HD       LYS   7   3.219  -7.373 -10.414
   52   2HD   LYS   7          2HD       LYS   7   3.007  -6.637 -11.989
   53   1HE   LYS   7          1HE       LYS   7   4.003  -8.756 -12.321
   54   2HE   LYS   7          2HE       LYS   7   5.246  -7.546 -12.632
   55   1HZ   LYS   7          1HZ       LYS   7   4.987  -8.793  -9.955
   56   2HZ   LYS   7          2HZ       LYS   7   5.817  -9.569 -11.202
   57   3HZ   LYS   7          3HZ       LYS   7   6.337  -8.056 -10.674
   58    H    ASN   8           H        ASN   8   5.916  -3.208 -10.965
   59    HA   ASN   8           HA       ASN   8   4.986  -1.008  -9.237
   60   1HB   ASN   8          1HB       ASN   8   7.046  -0.767 -10.693
   61   2HB   ASN   8          2HB       ASN   8   5.966  -0.790 -12.083
   62   2HD2  ASN   8          2HD2      ASN   8   7.084   1.012  -9.338
   63   1HD2  ASN   8          1HD2      ASN   8   6.359   2.502  -9.803
   64    H    ALA   9           H        ALA   9   3.808  -3.139 -11.655
   65    HA   ALA   9           HA       ALA   9   1.254  -1.813 -11.604
   66   1HB   ALA   9          1HB       ALA   9   2.750  -2.201 -14.184
   67   2HB   ALA   9          2HB       ALA   9   1.069  -1.682 -14.059
   68   3HB   ALA   9          3HB       ALA   9   2.363  -0.653 -13.443
   69    H    TRP  10           H        TRP  10  -0.439  -3.217 -11.837
   70    HA   TRP  10           HA       TRP  10   0.299  -5.999 -12.559
   71   1HB   TRP  10          1HB       TRP  10  -1.623  -5.020 -10.477
   72   2HB   TRP  10          2HB       TRP  10  -1.508  -6.689 -11.002
   73    HD1  TRP  10           HD1      TRP  10   0.324  -8.157  -9.904
   74    HE1  TRP  10           HE1      TRP  10   2.146  -7.731  -8.143
   75    HE3  TRP  10           HE3      TRP  10   0.034  -3.078  -9.621
   76    HZ2  TRP  10           HZ2      TRP  10   3.293  -5.535  -6.803
   77    HZ3  TRP  10           HZ3      TRP  10   1.511  -1.881  -8.081
   78    HH2  TRP  10           HH2      TRP  10   3.110  -3.087  -6.684
   79   1HB   PRO  11          1HB       PRO  11  -1.811  -5.927 -17.615
   80   2HB   PRO  11          2HB       PRO  11  -1.467  -4.219 -17.350
   81   1HG   PRO  11          1HG       PRO  11   0.111  -6.611 -16.531
   82   2HG   PRO  11          2HG       PRO  11   0.674  -5.040 -17.131
   83   1HD   PRO  11          1HD       PRO  11   0.812  -5.673 -14.546
   84   2HD   PRO  11          2HD       PRO  11   0.424  -4.020 -15.062
   85    H    GLU  12           H        GLU  12  -1.576  -7.562 -15.026
   86    HA   GLU  12           HA       GLU  12  -3.734  -9.020 -16.074
   87   1HB   GLU  12          1HB       GLU  12  -2.868 -10.893 -14.684
   88   2HB   GLU  12          2HB       GLU  12  -1.659 -10.109 -15.689
   89   1HG   GLU  12          1HG       GLU  12  -1.857  -8.938 -13.009
   90   2HG   GLU  12          2HG       GLU  12  -1.458 -10.653 -13.009
   91    H    LEU  13           H        LEU  13  -3.723  -7.024 -13.323
   92    HA   LEU  13           HA       LEU  13  -5.598  -8.592 -11.805
   93   1HB   LEU  13          1HB       LEU  13  -4.430  -5.850 -11.512
   94   2HB   LEU  13          2HB       LEU  13  -5.788  -6.327 -10.527
   95    HG   LEU  13           HG       LEU  13  -3.049  -7.577 -10.555
   96   1HD1  LEU  13          1HD1      LEU  13  -4.535  -5.801  -8.688
   97   2HD1  LEU  13          2HD1      LEU  13  -3.381  -6.934  -8.045
   98   3HD1  LEU  13          3HD1      LEU  13  -2.882  -5.739  -9.183
   99   1HD2  LEU  13          1HD2      LEU  13  -5.645  -8.615  -9.594
  100   2HD2  LEU  13          2HD2      LEU  13  -4.205  -9.462 -10.147
  101   3HD2  LEU  13          3HD2      LEU  13  -4.275  -8.809  -8.539
  102    H    VAL  14           H        VAL  14  -5.736  -6.235 -14.317
  103    HA   VAL  14           HA       VAL  14  -8.259  -5.126 -13.874
  104    HB   VAL  14           HB       VAL  14  -7.007  -5.768 -16.558
  105   1HG1  VAL  14          1HG1      VAL  14  -9.166  -3.815 -15.758
  106   2HG1  VAL  14          2HG1      VAL  14  -8.365  -3.829 -17.329
  107   3HG1  VAL  14          3HG1      VAL  14  -9.333  -5.207 -16.826
  108   1HG2  VAL  14          1HG2      VAL  14  -5.529  -4.430 -15.049
  109   2HG2  VAL  14          2HG2      VAL  14  -6.044  -3.582 -16.490
  110   3HG2  VAL  14          3HG2      VAL  14  -6.810  -3.231 -14.943
  111    H    GLY  15           H        GLY  15 -10.079  -6.265 -13.506
  112   1HA   GLY  15          1HA       GLY  15 -11.857  -7.461 -14.691
  113   2HA   GLY  15          2HA       GLY  15 -10.653  -8.601 -15.259
  114    H    LYS  16           H        LYS  16  -9.706  -7.907 -12.188
  115    HA   LYS  16           HA       LYS  16 -11.163 -10.243 -11.123
  116   1HB   LYS  16          1HB       LYS  16  -8.473  -9.030 -10.564
  117   2HB   LYS  16          2HB       LYS  16  -9.234 -10.046  -9.363
  118   1HG   LYS  16          1HG       LYS  16  -8.829 -10.960 -12.190
  119   2HG   LYS  16          2HG       LYS  16  -7.587 -11.126 -10.952
  120   1HD   LYS  16          1HD       LYS  16  -8.714 -12.759  -9.834
  121   2HD   LYS  16          2HD       LYS  16 -10.296 -12.105 -10.223
  122   1HE   LYS  16          1HE       LYS  16 -10.086 -12.955 -12.495
  123   2HE   LYS  16          2HE       LYS  16  -8.483 -13.593 -12.119
  124   1HZ   LYS  16          1HZ       LYS  16 -11.027 -14.432 -10.831
  125   2HZ   LYS  16          2HZ       LYS  16 -10.165 -15.307 -11.995
  126   3HZ   LYS  16          3HZ       LYS  16  -9.489 -15.044 -10.468
  127    H    SER  17           H        SER  17 -11.171 -10.064  -8.551
  128    HA   SER  17           HA       SER  17 -12.981  -7.897  -7.992
  129   1HB   SER  17          1HB       SER  17 -13.016 -10.312  -7.037
  130   2HB   SER  17          2HB       SER  17 -13.420  -8.973  -5.964
  131    HG   SER  17           HG       SER  17 -11.897 -10.521  -5.090
  132    H    GLY  18           H        GLY  18 -12.676  -6.124  -6.646
  133   1HA   GLY  18          1HA       GLY  18 -10.256  -4.818  -6.583
  134   2HA   GLY  18          2HA       GLY  18 -11.541  -4.536  -5.440
  135    H    ASN  19           H        ASN  19 -11.473  -7.207  -4.315
  136    HA   ASN  19           HA       ASN  19  -9.398  -6.780  -2.392
  137   1HB   ASN  19          1HB       ASN  19 -11.816  -8.139  -2.410
  138   2HB   ASN  19          2HB       ASN  19 -10.651  -9.456  -2.405
  139   2HD2  ASN  19          2HD2      ASN  19 -12.554  -8.253  -0.362
  140   1HD2  ASN  19          1HD2      ASN  19 -11.555  -8.040   1.029
  141    H    MET  20           H        MET  20  -9.887  -8.921  -5.139
  142    HA   MET  20           HA       MET  20  -7.634 -10.577  -4.669
  143   1HB   MET  20          1HB       MET  20  -9.686 -10.888  -6.256
  144   2HB   MET  20          2HB       MET  20  -8.725 -10.010  -7.423
  145   1HG   MET  20          1HG       MET  20  -7.504 -12.339  -6.001
  146   2HG   MET  20          2HG       MET  20  -8.736 -12.648  -7.219
  147   1HE   MET  20          1HE       MET  20  -5.263 -12.565  -6.539
  148   2HE   MET  20          2HE       MET  20  -5.731 -13.835  -7.669
  149   3HE   MET  20          3HE       MET  20  -4.546 -12.619  -8.150
  150    H    ALA  21           H        ALA  21  -8.173  -7.588  -6.474
  151    HA   ALA  21           HA       ALA  21  -5.639  -7.448  -7.669
  152   1HB   ALA  21          1HB       ALA  21  -7.769  -5.445  -7.112
  153   2HB   ALA  21          2HB       ALA  21  -7.231  -6.096  -8.660
  154   3HB   ALA  21          3HB       ALA  21  -6.228  -4.934  -7.795
  155    H    ALA  22           H        ALA  22  -6.928  -5.658  -4.879
  156    HA   ALA  22           HA       ALA  22  -4.552  -4.457  -4.079
  157   1HB   ALA  22          1HB       ALA  22  -6.792  -5.422  -2.297
  158   2HB   ALA  22          2HB       ALA  22  -6.741  -3.879  -3.149
  159   3HB   ALA  22          3HB       ALA  22  -5.572  -4.217  -1.874
  160    H    ALA  23           H        ALA  23  -5.843  -7.654  -3.262
  161    HA   ALA  23           HA       ALA  23  -3.894  -8.385  -1.375
  162   1HB   ALA  23          1HB       ALA  23  -5.504 -10.117  -3.249
  163   2HB   ALA  23          2HB       ALA  23  -5.954  -9.623  -1.617
  164   3HB   ALA  23          3HB       ALA  23  -4.585 -10.705  -1.861
  165    H    THR  24           H        THR  24  -4.020  -8.865  -4.902
  166    HA   THR  24           HA       THR  24  -1.642 -10.351  -5.122
  167    HB   THR  24           HB       THR  24  -2.829  -8.471  -7.158
  168    HG1  THR  24           HG1      THR  24  -4.404  -9.913  -6.729
  169   1HG2  THR  24          1HG2      THR  24  -0.978 -10.814  -7.471
  170   2HG2  THR  24          2HG2      THR  24  -1.859 -10.056  -8.797
  171   3HG2  THR  24          3HG2      THR  24  -0.663  -9.130  -7.893
  172    H    VAL  25           H        VAL  25  -2.233  -6.856  -5.184
  173    HA   VAL  25           HA       VAL  25   0.428  -6.118  -5.850
  174    HB   VAL  25           HB       VAL  25  -1.625  -4.482  -4.337
  175   1HG1  VAL  25          1HG1      VAL  25   1.098  -3.935  -5.154
  176   2HG1  VAL  25          2HG1      VAL  25  -0.025  -2.823  -5.926
  177   3HG1  VAL  25          3HG1      VAL  25  -0.006  -2.984  -4.178
  178   1HG2  VAL  25          1HG2      VAL  25  -1.126  -4.707  -7.301
  179   2HG2  VAL  25          2HG2      VAL  25  -2.549  -5.238  -6.449
  180   3HG2  VAL  25          3HG2      VAL  25  -2.187  -3.530  -6.541
  181    H    GLU  26           H        GLU  26  -1.285  -6.085  -2.706
  182    HA   GLU  26           HA       GLU  26   1.025  -5.411  -1.207
  183   1HB   GLU  26          1HB       GLU  26  -1.586  -6.698  -0.418
  184   2HB   GLU  26          2HB       GLU  26  -0.362  -6.201   0.748
  185   1HG   GLU  26          1HG       GLU  26  -0.853  -4.044   0.573
  186   2HG   GLU  26          2HG       GLU  26  -1.097  -4.112  -1.169
  187    H    ARG  27           H        ARG  27  -0.109  -8.452  -2.472
  188    HA   ARG  27           HA       ARG  27   1.511 -10.027  -0.653
  189   1HB   ARG  27          1HB       ARG  27  -0.679 -10.784  -1.670
  190   2HB   ARG  27          2HB       ARG  27   0.172 -10.970  -3.200
  191   1HG   ARG  27          1HG       ARG  27   1.758 -12.361  -1.402
  192   2HG   ARG  27          2HG       ARG  27   0.124 -12.640  -0.797
  193   1HD   ARG  27          1HD       ARG  27   1.021 -13.095  -3.638
  194   2HD   ARG  27          2HD       ARG  27   0.892 -14.353  -2.418
  195    HE   ARG  27           HE       ARG  27  -1.253 -13.080  -3.876
  196   1HH1  ARG  27          1HH1      ARG  27  -0.423 -14.927  -0.999
  197   2HH1  ARG  27          2HH1      ARG  27  -2.021 -15.529  -0.796
  198   1HH2  ARG  27          1HH2      ARG  27  -3.368 -13.893  -3.569
  199   2HH2  ARG  27          2HH2      ARG  27  -3.694 -14.950  -2.236
  200    H    GLU  28           H        GLU  28   1.527  -9.336  -4.160
  201    HA   GLU  28           HA       GLU  28   4.039 -10.599  -4.623
  202   1HB   GLU  28          1HB       GLU  28   2.534  -8.529  -6.226
  203   2HB   GLU  28          2HB       GLU  28   3.979  -9.360  -6.794
  204   1HG   GLU  28          1HG       GLU  28   2.605 -11.518  -6.282
  205   2HG   GLU  28          2HG       GLU  28   1.223 -10.435  -6.358
  206    H    ASN  29           H        ASN  29   3.065  -7.293  -3.852
  207    HA   ASN  29           HA       ASN  29   5.924  -6.561  -3.624
  208   1HB   ASN  29          1HB       ASN  29   4.784  -5.355  -5.418
  209   2HB   ASN  29          2HB       ASN  29   3.567  -4.778  -4.285
  210   2HD2  ASN  29          2HD2      ASN  29   5.375  -3.232  -5.946
  211   1HD2  ASN  29          1HD2      ASN  29   6.321  -2.280  -4.859
  212    H    ARG  30           H        ARG  30   5.822  -7.455  -1.481
  213    HA   ARG  30           HA       ARG  30   4.077  -6.508   0.519
  214   1HB   ARG  30          1HB       ARG  30   5.910  -8.490   0.381
  215   2HB   ARG  30          2HB       ARG  30   6.832  -7.329   1.315
  216   1HG   ARG  30          1HG       ARG  30   5.718  -7.792   3.157
  217   2HG   ARG  30          2HG       ARG  30   4.153  -7.545   2.386
  218   1HD   ARG  30          1HD       ARG  30   3.902  -9.742   1.871
  219   2HD   ARG  30          2HD       ARG  30   5.617 -10.060   1.756
  220    HE   ARG  30           HE       ARG  30   5.740  -9.997   4.185
  221   1HH1  ARG  30          1HH1      ARG  30   2.567 -10.537   2.740
  222   2HH1  ARG  30          2HH1      ARG  30   1.952 -11.313   4.142
  223   1HH2  ARG  30          1HH2      ARG  30   4.878 -11.032   6.019
  224   2HH2  ARG  30          2HH2      ARG  30   3.241 -11.598   5.997
  225    H    ASN  31           H        ASN  31   6.344  -4.700  -1.139
  226    HA   ASN  31           HA       ASN  31   7.168  -3.098   1.147
  227   1HB   ASN  31          1HB       ASN  31   8.805  -3.674  -0.598
  228   2HB   ASN  31          2HB       ASN  31   7.833  -2.821  -1.787
  229   2HD2  ASN  31          2HD2      ASN  31   9.997  -2.506   0.910
  230   1HD2  ASN  31          1HD2      ASN  31  10.245  -0.805   0.750
  231    H    VAL  32           H        VAL  32   4.635  -3.178  -1.147
  232    HA   VAL  32           HA       VAL  32   3.822  -0.467  -0.347
  233    HB   VAL  32           HB       VAL  32   3.283   0.190  -2.551
  234   1HG1  VAL  32          1HG1      VAL  32   5.663   0.466  -1.936
  235   2HG1  VAL  32          2HG1      VAL  32   6.012  -1.113  -2.626
  236   3HG1  VAL  32          3HG1      VAL  32   5.488   0.190  -3.664
  237   1HG2  VAL  32          1HG2      VAL  32   3.648  -2.663  -3.224
  238   2HG2  VAL  32          2HG2      VAL  32   2.432  -1.520  -3.738
  239   3HG2  VAL  32          3HG2      VAL  32   4.023  -1.474  -4.471
  240    H    HIS  33           H        HIS  33   1.495  -0.051  -0.877
  241    HA   HIS  33           HA       HIS  33  -0.054  -2.533  -1.044
  242   1HB   HIS  33          1HB       HIS  33  -1.502  -1.932   0.759
  243   2HB   HIS  33          2HB       HIS  33   0.151  -1.849   1.349
  244    HD1  HIS  33           HD1      HIS  33  -1.644  -0.373   3.060
  245    HD2  HIS  33           HD2      HIS  33  -0.195   1.365  -0.398
  246    HE1  HIS  33           HE1      HIS  33  -1.846   2.107   3.410
  247    HE2  HIS  33           HE2      HIS  33  -0.845   3.136   1.339
  248    H    ALA  34           H        ALA  34  -2.378  -2.180  -1.536
  249    HA   ALA  34           HA       ALA  34  -2.621   0.136  -3.343
  250   1HB   ALA  34          1HB       ALA  34  -4.152  -2.387  -3.766
  251   2HB   ALA  34          2HB       ALA  34  -3.672  -1.144  -4.913
  252   3HB   ALA  34          3HB       ALA  34  -2.474  -2.261  -4.287
  253    H    ILE  35           H        ILE  35  -4.442   1.343  -3.353
  254    HA   ILE  35           HA       ILE  35  -6.318   0.880  -1.132
  255    HB   ILE  35           HB       ILE  35  -6.045   3.334  -2.831
  256   1HG1  ILE  35          1HG1      ILE  35  -4.789   2.743  -0.152
  257   2HG1  ILE  35          2HG1      ILE  35  -3.928   2.916  -1.679
  258   1HG2  ILE  35          1HG2      ILE  35  -8.196   3.047  -1.636
  259   2HG2  ILE  35          2HG2      ILE  35  -7.304   2.923  -0.126
  260   3HG2  ILE  35          3HG2      ILE  35  -7.295   4.423  -1.043
  261   1HD1  ILE  35          1HD1      ILE  35  -5.486   5.102  -0.315
  262   2HD1  ILE  35          2HD1      ILE  35  -3.744   4.895  -0.291
  263   3HD1  ILE  35          3HD1      ILE  35  -4.562   5.234  -1.801
  264    H    VAL  36           H        VAL  36  -8.074  -0.242  -1.696
  265    HA   VAL  36           HA       VAL  36  -9.016  -0.291  -4.415
  266    HB   VAL  36           HB       VAL  36  -9.010  -2.273  -2.841
  267   1HG1  VAL  36          1HG1      VAL  36 -10.089  -0.919  -0.956
  268   2HG1  VAL  36          2HG1      VAL  36 -11.616  -1.165  -1.809
  269   3HG1  VAL  36          3HG1      VAL  36 -10.688  -2.548  -1.242
  270   1HG2  VAL  36          1HG2      VAL  36 -11.224  -1.429  -4.639
  271   2HG2  VAL  36          2HG2      VAL  36 -10.116  -2.793  -4.734
  272   3HG2  VAL  36          3HG2      VAL  36 -11.485  -2.859  -3.644
  273    H    LEU  37           H        LEU  37 -10.489   0.943  -5.296
  274    HA   LEU  37           HA       LEU  37 -12.713   1.999  -3.778
  275   1HB   LEU  37          1HB       LEU  37 -12.155   4.336  -4.730
  276   2HB   LEU  37          2HB       LEU  37 -11.451   3.804  -3.235
  277    HG   LEU  37           HG       LEU  37  -9.462   3.033  -4.866
  278   1HD1  LEU  37          1HD1      LEU  37 -10.697   3.792  -6.882
  279   2HD1  LEU  37          2HD1      LEU  37 -10.576   5.441  -6.287
  280   3HD1  LEU  37          3HD1      LEU  37  -9.123   4.538  -6.660
  281   1HD2  LEU  37          1HD2      LEU  37 -10.059   5.521  -3.391
  282   2HD2  LEU  37          2HD2      LEU  37  -8.724   4.383  -3.247
  283   3HD2  LEU  37          3HD2      LEU  37  -8.721   5.583  -4.530
  284    H    LYS  38           H        LYS  38 -14.278   3.083  -5.195
  285    HA   LYS  38           HA       LYS  38 -14.318   1.758  -7.782
  286   1HB   LYS  38          1HB       LYS  38 -16.642   2.409  -7.906
  287   2HB   LYS  38          2HB       LYS  38 -16.474   3.406  -6.470
  288   1HG   LYS  38          1HG       LYS  38 -15.883   0.482  -6.360
  289   2HG   LYS  38          2HG       LYS  38 -17.529   1.045  -6.318
  290   1HD   LYS  38          1HD       LYS  38 -16.069   2.626  -4.457
  291   2HD   LYS  38          2HD       LYS  38 -17.349   1.460  -4.165
  292   1HE   LYS  38          1HE       LYS  38 -14.481   0.624  -4.515
  293   2HE   LYS  38          2HE       LYS  38 -15.167   1.069  -2.956
  294   1HZ   LYS  38          1HZ       LYS  38 -16.804  -0.686  -3.203
  295   2HZ   LYS  38          2HZ       LYS  38 -16.162  -1.111  -4.713
  296   3HZ   LYS  38          3HZ       LYS  38 -15.238  -1.313  -3.311
  297    H    GLU  39           H        GLU  39 -14.834   2.831  -9.736
  298    HA   GLU  39           HA       GLU  39 -13.271   4.981 -10.407
  299   1HB   GLU  39          1HB       GLU  39 -14.469   3.421 -11.956
  300   2HB   GLU  39          2HB       GLU  39 -15.936   4.347 -11.684
  301   1HG   GLU  39          1HG       GLU  39 -15.314   6.013 -13.029
  302   2HG   GLU  39          2HG       GLU  39 -13.633   5.984 -12.495
  303    H    GLY  40           H        GLY  40 -13.231   7.006  -9.693
  304   1HA   GLY  40          1HA       GLY  40 -14.365   9.151  -9.789
  305   2HA   GLY  40          2HA       GLY  40 -15.821   8.378  -9.191
  306    H    SER  41           H        SER  41 -13.500   6.885  -7.476
  307    HA   SER  41           HA       SER  41 -14.065   8.358  -5.103
  308   1HB   SER  41          1HB       SER  41 -13.646   5.920  -5.130
  309   2HB   SER  41          2HB       SER  41 -11.987   6.238  -5.584
  310    HG   SER  41           HG       SER  41 -12.587   5.936  -3.230
  311    H    ALA  42           H        ALA  42 -11.583   8.323  -3.768
  312    HA   ALA  42           HA       ALA  42 -10.480  10.807  -4.712
  313   1HB   ALA  42          1HB       ALA  42  -9.108  10.709  -2.707
  314   2HB   ALA  42          2HB       ALA  42  -9.639   9.052  -2.405
  315   3HB   ALA  42          3HB       ALA  42 -10.799  10.378  -2.334
  316    H    MET  43           H        MET  43  -9.382  10.503  -6.608
  317    HA   MET  43           HA       MET  43  -7.084   8.659  -6.512
  318   1HB   MET  43          1HB       MET  43  -8.949   8.097  -8.116
  319   2HB   MET  43          2HB       MET  43  -8.512   9.537  -9.018
  320   1HG   MET  43          1HG       MET  43  -6.368   7.609  -8.363
  321   2HG   MET  43          2HG       MET  43  -7.551   7.100  -9.531
  322   1HE   MET  43          1HE       MET  43  -8.153   8.276 -11.603
  323   2HE   MET  43          2HE       MET  43  -8.170   9.984 -11.164
  324   3HE   MET  43          3HE       MET  43  -7.143   9.424 -12.483
  325    H    THR  44           H        THR  44  -5.553  10.053  -5.831
  326    HA   THR  44           HA       THR  44  -5.235  12.640  -7.069
  327    HB   THR  44           HB       THR  44  -2.933  12.171  -5.575
  328    HG1  THR  44           HG1      THR  44  -3.674  10.263  -4.744
  329   1HG2  THR  44          1HG2      THR  44  -5.534  13.272  -4.550
  330   2HG2  THR  44          2HG2      THR  44  -3.937  13.506  -3.837
  331   3HG2  THR  44          3HG2      THR  44  -4.300  14.176  -5.427
  332    H    LYS  45           H        LYS  45  -3.324  13.297  -8.168
  333    HA   LYS  45           HA       LYS  45  -2.359  11.248  -9.997
  334   1HB   LYS  45          1HB       LYS  45  -2.229  14.239  -9.861
  335   2HB   LYS  45          2HB       LYS  45  -1.076  13.377 -10.874
  336   1HG   LYS  45          1HG       LYS  45  -3.216  12.205 -11.828
  337   2HG   LYS  45          2HG       LYS  45  -4.039  13.602 -11.133
  338   1HD   LYS  45          1HD       LYS  45  -3.592  14.586 -13.089
  339   2HD   LYS  45          2HD       LYS  45  -1.978  14.836 -12.427
  340   1HE   LYS  45          1HE       LYS  45  -1.288  12.678 -13.458
  341   2HE   LYS  45          2HE       LYS  45  -2.886  12.568 -14.197
  342   1HZ   LYS  45          1HZ       LYS  45  -2.444  14.634 -15.373
  343   2HZ   LYS  45          2HZ       LYS  45  -0.911  14.742 -14.658
  344   3HZ   LYS  45          3HZ       LYS  45  -1.262  13.478 -15.725
  345    H    ASP  46           H        ASP  46  -1.214  13.060  -7.252
  346    HA   ASP  46           HA       ASP  46   1.479  13.041  -7.468
  347   1HB   ASP  46          1HB       ASP  46  -0.351  13.330  -5.369
  348   2HB   ASP  46          2HB       ASP  46   0.683  12.019  -4.826
  349    H    PHE  47           H        PHE  47   3.097  11.590  -7.584
  350    HA   PHE  47           HA       PHE  47   2.422   8.795  -7.861
  351   1HB   PHE  47          1HB       PHE  47   3.998   9.780  -9.390
  352   2HB   PHE  47          2HB       PHE  47   5.043  10.277  -8.064
  353    HD1  PHE  47           HD1      PHE  47   6.607   8.773  -7.105
  354    HD2  PHE  47           HD2      PHE  47   3.737   7.362  -9.922
  355    HE1  PHE  47           HE1      PHE  47   7.816   6.663  -7.278
  356    HE2  PHE  47           HE2      PHE  47   4.950   5.244 -10.091
  357    HZ   PHE  47           HZ       PHE  47   6.979   4.862  -8.746
  358    H    ARG  48           H        ARG  48   2.786   7.172  -6.483
  359    HA   ARG  48           HA       ARG  48   4.587   7.446  -4.213
  360   1HB   ARG  48          1HB       ARG  48   3.034   7.144  -2.520
  361   2HB   ARG  48          2HB       ARG  48   1.751   6.655  -3.608
  362   1HG   ARG  48          1HG       ARG  48   2.858   9.441  -3.432
  363   2HG   ARG  48          2HG       ARG  48   1.494   8.905  -4.418
  364   1HD   ARG  48          1HD       ARG  48   0.781  10.030  -2.379
  365   2HD   ARG  48          2HD       ARG  48   0.239   8.370  -2.453
  366    HE   ARG  48           HE       ARG  48   2.056   7.783  -0.912
  367   1HH1  ARG  48          1HH1      ARG  48   0.927  11.120  -0.976
  368   2HH1  ARG  48          2HH1      ARG  48   1.461  11.429   0.626
  369   1HH2  ARG  48          1HH2      ARG  48   2.759   8.244   1.192
  370   2HH2  ARG  48          2HH2      ARG  48   2.493   9.820   1.859
  371    H    CYS  49           H        CYS  49   5.746   5.651  -4.493
  372    HA   CYS  49           HA       CYS  49   4.884   3.350  -5.832
  373   1HB   CYS  49          1HB       CYS  49   6.890   2.335  -5.223
  374   2HB   CYS  49          2HB       CYS  49   7.080   3.318  -3.789
  375    H    ASP  50           H        ASP  50   4.688   4.269  -2.478
  376    HA   ASP  50           HA       ASP  50   4.013   1.649  -1.538
  377   1HB   ASP  50          1HB       ASP  50   3.534   2.729   0.594
  378   2HB   ASP  50          2HB       ASP  50   5.114   3.166  -0.047
  379    H    ARG  51           H        ARG  51   2.260   3.969  -3.248
  380    HA   ARG  51           HA       ARG  51  -0.262   2.861  -2.216
  381   1HB   ARG  51          1HB       ARG  51   0.083   5.248  -1.645
  382   2HB   ARG  51          2HB       ARG  51   0.180   5.612  -3.360
  383   1HG   ARG  51          1HG       ARG  51  -2.168   4.533  -3.512
  384   2HG   ARG  51          2HG       ARG  51  -2.166   4.712  -1.764
  385   1HD   ARG  51          1HD       ARG  51  -3.205   6.650  -2.505
  386   2HD   ARG  51          2HD       ARG  51  -1.548   7.152  -2.202
  387    HE   ARG  51           HE       ARG  51  -2.188   6.327  -4.929
  388   1HH1  ARG  51          1HH1      ARG  51  -1.841   9.018  -2.683
  389   2HH1  ARG  51          2HH1      ARG  51  -1.611  10.168  -3.940
  390   1HH2  ARG  51          1HH2      ARG  51  -1.909   7.892  -6.560
  391   2HH2  ARG  51          2HH2      ARG  51  -1.634   9.539  -6.133
  392    H    VAL  52           H        VAL  52  -1.258   1.631  -3.625
  393    HA   VAL  52           HA       VAL  52  -0.924   2.181  -6.516
  394    HB   VAL  52           HB       VAL  52  -1.538  -0.457  -5.184
  395   1HG1  VAL  52          1HG1      VAL  52  -1.419   0.407  -8.038
  396   2HG1  VAL  52          2HG1      VAL  52  -1.037  -1.255  -7.603
  397   3HG1  VAL  52          3HG1      VAL  52  -2.616  -0.579  -7.223
  398   1HG2  VAL  52          1HG2      VAL  52   0.948   0.815  -5.545
  399   2HG2  VAL  52          2HG2      VAL  52   0.628  -0.840  -5.052
  400   3HG2  VAL  52          3HG2      VAL  52   0.856  -0.455  -6.749
  401    H    TRP  53           H        TRP  53  -2.722   2.935  -7.472
  402    HA   TRP  53           HA       TRP  53  -5.194   2.994  -6.020
  403   1HB   TRP  53          1HB       TRP  53  -4.306   4.009  -8.698
  404   2HB   TRP  53          2HB       TRP  53  -6.018   3.987  -8.315
  405    HD1  TRP  53           HD1      TRP  53  -3.959   6.572  -8.775
  406    HE1  TRP  53           HE1      TRP  53  -4.146   8.482  -7.057
  407    HE3  TRP  53           HE3      TRP  53  -6.199   4.024  -4.953
  408    HZ2  TRP  53           HZ2      TRP  53  -5.087   8.825  -4.412
  409    HZ3  TRP  53           HZ3      TRP  53  -6.699   5.236  -2.887
  410    HH2  TRP  53           HH2      TRP  53  -6.150   7.577  -2.610
  411    H    VAL  54           H        VAL  54  -6.889   1.669  -6.139
  412    HA   VAL  54           HA       VAL  54  -6.944  -0.299  -8.359
  413    HB   VAL  54           HB       VAL  54  -7.590  -0.645  -5.440
  414   1HG1  VAL  54          1HG1      VAL  54  -8.365  -2.363  -7.773
  415   2HG1  VAL  54          2HG1      VAL  54  -8.183  -3.038  -6.156
  416   3HG1  VAL  54          3HG1      VAL  54  -9.381  -1.788  -6.460
  417   1HG2  VAL  54          1HG2      VAL  54  -5.226  -0.891  -6.297
  418   2HG2  VAL  54          2HG2      VAL  54  -5.895  -2.250  -5.401
  419   3HG2  VAL  54          3HG2      VAL  54  -5.797  -2.318  -7.155
  420    H    ILE  55           H        ILE  55  -8.338   0.855  -9.648
  421    HA   ILE  55           HA       ILE  55 -10.829   1.873  -8.576
  422    HB   ILE  55           HB       ILE  55 -10.142   1.723 -11.471
  423   1HG1  ILE  55          1HG1      ILE  55  -8.251   2.808 -10.184
  424   2HG1  ILE  55          2HG1      ILE  55  -9.047   3.844 -11.347
  425   1HG2  ILE  55          1HG2      ILE  55 -11.988   3.415  -9.845
  426   2HG2  ILE  55          2HG2      ILE  55 -11.534   3.825 -11.500
  427   3HG2  ILE  55          3HG2      ILE  55 -12.375   2.315 -11.161
  428   1HD1  ILE  55          1HD1      ILE  55 -10.335   4.111  -8.805
  429   2HD1  ILE  55          2HD1      ILE  55  -8.603   4.355  -8.658
  430   3HD1  ILE  55          3HD1      ILE  55  -9.540   5.313  -9.797
  431    H    VAL  56           H        VAL  56 -12.723   0.851  -8.589
  432    HA   VAL  56           HA       VAL  56 -13.054  -1.505 -10.300
  433    HB   VAL  56           HB       VAL  56 -14.248  -2.643  -8.532
  434   1HG1  VAL  56          1HG1      VAL  56 -11.433  -2.054  -8.420
  435   2HG1  VAL  56          2HG1      VAL  56 -12.063  -2.337  -6.806
  436   3HG1  VAL  56          3HG1      VAL  56 -12.287  -3.537  -8.064
  437   1HG2  VAL  56          1HG2      VAL  56 -13.713  -0.170  -6.947
  438   2HG2  VAL  56          2HG2      VAL  56 -15.243  -0.969  -7.285
  439   3HG2  VAL  56          3HG2      VAL  56 -14.096  -1.708  -6.182
  440    H    ASN  57           H        ASN  57 -15.347  -2.140 -10.576
  441    HA   ASN  57           HA       ASN  57 -16.904   0.253 -11.178
  442   1HB   ASN  57          1HB       ASN  57 -16.711  -1.573 -12.824
  443   2HB   ASN  57          2HB       ASN  57 -18.368  -1.240 -12.410
  444   2HD2  ASN  57          2HD2      ASN  57 -18.095  -3.532 -13.567
  445   1HD2  ASN  57          1HD2      ASN  57 -18.109  -4.846 -12.447
  446    H    ASP  58           H        ASP  58 -19.489  -0.575 -10.950
  447    HA   ASP  58           HA       ASP  58 -20.061  -0.063  -8.250
  448   1HB   ASP  58          1HB       ASP  58 -21.680  -0.932 -10.628
  449   2HB   ASP  58          2HB       ASP  58 -22.430  -0.919  -9.035
  450    H    HIS  59           H        HIS  59 -19.313  -3.032  -9.829
  451    HA   HIS  59           HA       HIS  59 -20.549  -4.626  -7.722
  452   1HB   HIS  59          1HB       HIS  59 -19.838  -5.064 -10.511
  453   2HB   HIS  59          2HB       HIS  59 -19.182  -6.332  -9.488
  454    HD1  HIS  59           HD1      HIS  59 -20.936  -7.682  -8.025
  455    HD2  HIS  59           HD2      HIS  59 -22.535  -5.233 -10.975
  456    HE1  HIS  59           HE1      HIS  59 -23.309  -8.455  -8.324
  457    HE2  HIS  59           HE2      HIS  59 -24.229  -7.018 -10.180
  458    H    GLY  60           H        GLY  60 -17.756  -2.954  -7.903
  459   1HA   GLY  60          1HA       GLY  60 -15.913  -3.090  -6.562
  460   2HA   GLY  60          2HA       GLY  60 -16.491  -4.618  -5.934
  461    H    VAL  61           H        VAL  61 -16.180  -4.138  -9.376
  462    HA   VAL  61           HA       VAL  61 -14.051  -6.161  -9.435
  463    HB   VAL  61           HB       VAL  61 -15.664  -5.056 -11.747
  464   1HG1  VAL  61          1HG1      VAL  61 -13.941  -7.519 -11.450
  465   2HG1  VAL  61          2HG1      VAL  61 -14.931  -7.133 -12.858
  466   3HG1  VAL  61          3HG1      VAL  61 -13.580  -6.094 -12.424
  467   1HG2  VAL  61          1HG2      VAL  61 -16.168  -7.518 -10.073
  468   2HG2  VAL  61          2HG2      VAL  61 -17.181  -6.078 -10.164
  469   3HG2  VAL  61          3HG2      VAL  61 -17.003  -7.113 -11.574
  470    H    VAL  62           H        VAL  62 -12.008  -5.653 -10.052
  471    HA   VAL  62           HA       VAL  62 -11.225  -2.948 -10.299
  472    HB   VAL  62           HB       VAL  62  -9.624  -5.393 -11.049
  473   1HG1  VAL  62          1HG1      VAL  62  -8.832  -2.528 -10.508
  474   2HG1  VAL  62          2HG1      VAL  62  -7.686  -3.870 -10.526
  475   3HG1  VAL  62          3HG1      VAL  62  -8.585  -3.468 -11.981
  476   1HG2  VAL  62          1HG2      VAL  62 -10.603  -4.665  -8.530
  477   2HG2  VAL  62          2HG2      VAL  62  -9.363  -5.839  -8.901
  478   3HG2  VAL  62          3HG2      VAL  62  -8.919  -4.182  -8.526
  479    H    THR  63           H        THR  63 -11.860  -1.750 -11.980
  480    HA   THR  63           HA       THR  63 -11.943  -2.914 -14.669
  481    HB   THR  63           HB       THR  63 -13.110  -0.906 -15.314
  482    HG1  THR  63           HG1      THR  63 -13.201   0.847 -14.082
  483   1HG2  THR  63          1HG2      THR  63 -14.376  -2.699 -14.053
  484   2HG2  THR  63          2HG2      THR  63 -14.265  -1.635 -12.649
  485   3HG2  THR  63          3HG2      THR  63 -15.092  -1.089 -14.105
  486    H    SER  64           H        SER  64 -10.103  -0.631 -12.737
  487    HA   SER  64           HA       SER  64  -8.549   0.135 -15.122
  488   1HB   SER  64          1HB       SER  64  -8.389   1.386 -12.379
  489   2HB   SER  64          2HB       SER  64  -7.791   2.018 -13.908
  490    HG   SER  64           HG       SER  64  -9.719   3.032 -13.452
  491    H    VAL  65           H        VAL  65  -6.302   0.054 -15.097
  492    HA   VAL  65           HA       VAL  65  -5.199  -2.281 -13.951
  493    HB   VAL  65           HB       VAL  65  -3.565   0.015 -15.013
  494   1HG1  VAL  65          1HG1      VAL  65  -3.101  -2.850 -14.414
  495   2HG1  VAL  65          2HG1      VAL  65  -2.330  -2.216 -15.869
  496   3HG1  VAL  65          3HG1      VAL  65  -2.025  -1.469 -14.307
  497   1HG2  VAL  65          1HG2      VAL  65  -5.523  -1.602 -16.440
  498   2HG2  VAL  65          2HG2      VAL  65  -4.654  -0.163 -16.925
  499   3HG2  VAL  65          3HG2      VAL  65  -3.917  -1.743 -17.128
  500   1HB   PRO  66          1HB       PRO  66  -3.501  -2.512  -8.666
  501   2HB   PRO  66          2HB       PRO  66  -5.159  -2.089  -9.102
  502   1HG   PRO  66          1HG       PRO  66  -3.346  -4.074 -10.374
  503   2HG   PRO  66          2HG       PRO  66  -5.072  -4.200 -10.018
  504   1HD   PRO  66          1HD       PRO  66  -4.001  -3.549 -12.490
  505   2HD   PRO  66          2HD       PRO  66  -5.651  -3.189 -11.971
  506    H    HIS  67           H        HIS  67  -2.192   0.786 -10.639
  507    HA   HIS  67           HA       HIS  67   0.314  -0.734 -10.351
  508   1HB   HIS  67          1HB       HIS  67   1.278   0.756 -12.168
  509   2HB   HIS  67          2HB       HIS  67   0.073  -0.409 -12.696
  510    HD1  HIS  67           HD1      HIS  67  -2.496   0.737 -12.642
  511    HD2  HIS  67           HD2      HIS  67   0.783   3.119 -13.392
  512    HE1  HIS  67           HE1      HIS  67  -3.432   2.799 -13.695
  513    HE2  HIS  67           HE2      HIS  67  -1.404   4.171 -14.282
  514    H    ILE  68           H        ILE  68   1.997   0.352  -9.418
  515    HA   ILE  68           HA       ILE  68   1.676   1.981  -7.330
  516    HB   ILE  68           HB       ILE  68   3.909   1.420  -9.151
  517   1HG1  ILE  68          1HG1      ILE  68   3.752   1.698  -6.168
  518   2HG1  ILE  68          2HG1      ILE  68   3.460   0.220  -7.043
  519   1HG2  ILE  68          1HG2      ILE  68   3.907   3.999  -7.603
  520   2HG2  ILE  68          2HG2      ILE  68   5.392   3.171  -8.037
  521   3HG2  ILE  68          3HG2      ILE  68   4.308   3.678  -9.286
  522   1HD1  ILE  68          1HD1      ILE  68   6.083   1.690  -7.001
  523   2HD1  ILE  68          2HD1      ILE  68   5.684   0.255  -6.076
  524   3HD1  ILE  68          3HD1      ILE  68   5.741   0.186  -7.827
  525    H    THR  69           H        THR  69   0.733   3.882  -7.033
  526    HA   THR  69           HA       THR  69   1.478   6.229  -8.469
  527    HB   THR  69           HB       THR  69  -1.139   4.899  -9.149
  528    HG1  THR  69           HG1      THR  69  -0.391   5.042 -11.155
  529   1HG2  THR  69          1HG2      THR  69  -0.530   7.837  -9.329
  530   2HG2  THR  69          2HG2      THR  69  -1.734   7.033 -10.331
  531   3HG2  THR  69          3HG2      THR  69  -1.915   7.059  -8.590

  No H/Q in entry =         531
  Start of MODEL   12
    1    H    SER   1           H        SER   1  12.970   9.528 -10.529
    2    HA   SER   1           HA       SER   1  13.513   7.562  -8.302
    3   1HB   SER   1          1HB       SER   1  11.541   8.514  -7.248
    4   2HB   SER   1          2HB       SER   1  12.593   9.803  -7.809
    5    HG   SER   1           HG       SER   1  10.293   8.810  -9.206
    6    H    ARG   2           H        ARG   2  13.444   5.446  -9.479
    7    HA   ARG   2           HA       ARG   2  10.750   4.388  -9.768
    8   1HB   ARG   2          1HB       ARG   2  12.063   5.399 -12.029
    9   2HB   ARG   2          2HB       ARG   2  12.308   3.671 -12.151
   10   1HG   ARG   2          1HG       ARG   2   9.694   3.646 -11.631
   11   2HG   ARG   2          2HG       ARG   2   9.818   5.281 -12.283
   12   1HD   ARG   2          1HD       ARG   2   9.592   4.303 -14.275
   13   2HD   ARG   2          2HD       ARG   2  11.278   3.886 -14.107
   14    HE   ARG   2           HE       ARG   2  10.703   1.699 -13.461
   15   1HH1  ARG   2          1HH1      ARG   2   7.889   3.611 -14.383
   16   2HH1  ARG   2          2HH1      ARG   2   6.907   2.225 -14.639
   17   1HH2  ARG   2          1HH2      ARG   2   9.355  -0.109 -13.790
   18   2HH2  ARG   2          2HH2      ARG   2   7.718   0.123 -14.306
   19    H    ARG   3           H        ARG   3  12.003   3.496  -7.815
   20    HA   ARG   3           HA       ARG   3  13.076   0.870  -8.617
   21   1HB   ARG   3          1HB       ARG   3  14.725   1.162  -6.635
   22   2HB   ARG   3          2HB       ARG   3  15.093   1.921  -8.178
   23   1HG   ARG   3          1HG       ARG   3  14.153   4.051  -7.284
   24   2HG   ARG   3          2HG       ARG   3  13.980   3.255  -5.727
   25   1HD   ARG   3          1HD       ARG   3  16.012   4.453  -5.644
   26   2HD   ARG   3          2HD       ARG   3  16.440   2.753  -5.808
   27    HE   ARG   3           HE       ARG   3  17.446   3.253  -7.785
   28   1HH1  ARG   3          1HH1      ARG   3  15.128   5.813  -7.082
   29   2HH1  ARG   3          2HH1      ARG   3  15.613   6.753  -8.431
   30   1HH2  ARG   3          1HH2      ARG   3  18.052   4.543  -9.570
   31   2HH2  ARG   3          2HH2      ARG   3  17.255   6.055  -9.845
   32    H    CYS   4           H        CYS   4  11.153  -0.091  -7.983
   33    HA   CYS   4           HA       CYS   4  10.544   0.115  -5.122
   34   1HB   CYS   4          1HB       CYS   4   8.867   0.552  -7.311
   35   2HB   CYS   4          2HB       CYS   4   8.366  -1.001  -6.671
   36   1HB   PRO   5          1HB       PRO   5  10.299  -4.262  -2.362
   37   2HB   PRO   5          2HB       PRO   5  12.016  -4.452  -2.706
   38   1HG   PRO   5          1HG       PRO   5  11.035  -2.306  -1.452
   39   2HG   PRO   5          2HG       PRO   5  12.441  -2.223  -2.497
   40   1HD   PRO   5          1HD       PRO   5   9.632  -1.412  -3.112
   41   2HD   PRO   5          2HD       PRO   5  11.159  -0.624  -3.521
   42    H    GLY   6           H        GLY   6   9.872  -4.080  -6.702
   43   1HA   GLY   6          1HA       GLY   6   8.512  -6.347  -6.760
   44   2HA   GLY   6          2HA       GLY   6   7.416  -5.364  -5.812
   45    H    LYS   7           H        LYS   7   6.286  -6.220  -7.971
   46    HA   LYS   7           HA       LYS   7   6.774  -4.870 -10.384
   47   1HB   LYS   7          1HB       LYS   7   5.411  -6.906 -10.120
   48   2HB   LYS   7          2HB       LYS   7   4.145  -5.960  -9.398
   49   1HG   LYS   7          1HG       LYS   7   3.671  -4.828 -11.367
   50   2HG   LYS   7          2HG       LYS   7   5.200  -5.288 -12.112
   51   1HD   LYS   7          1HD       LYS   7   3.897  -7.717 -11.513
   52   2HD   LYS   7          2HD       LYS   7   2.627  -6.638 -12.092
   53   1HE   LYS   7          1HE       LYS   7   3.508  -7.822 -13.956
   54   2HE   LYS   7          2HE       LYS   7   4.034  -6.146 -14.087
   55   1HZ   LYS   7          1HZ       LYS   7   5.695  -8.390 -13.048
   56   2HZ   LYS   7          2HZ       LYS   7   5.808  -7.711 -14.593
   57   3HZ   LYS   7          3HZ       LYS   7   6.197  -6.788 -13.233
   58    H    ASN   8           H        ASN   8   5.535  -3.164 -11.416
   59    HA   ASN   8           HA       ASN   8   4.613  -1.132  -9.497
   60   1HB   ASN   8          1HB       ASN   8   5.915  -0.779 -12.186
   61   2HB   ASN   8          2HB       ASN   8   5.335   0.534 -11.163
   62   2HD2  ASN   8          2HD2      ASN   8   7.657  -2.109 -11.371
   63   1HD2  ASN   8          1HD2      ASN   8   8.790  -1.417 -10.266
   64    H    ALA   9           H        ALA   9   3.617  -3.040 -12.141
   65    HA   ALA   9           HA       ALA   9   1.042  -1.665 -12.149
   66   1HB   ALA   9          1HB       ALA   9   2.582  -2.257 -14.675
   67   2HB   ALA   9          2HB       ALA   9   0.939  -1.622 -14.572
   68   3HB   ALA   9          3HB       ALA   9   2.296  -0.650 -14.003
   69    H    TRP  10           H        TRP  10  -0.501  -3.157 -11.889
   70    HA   TRP  10           HA       TRP  10   0.163  -5.952 -12.598
   71   1HB   TRP  10          1HB       TRP  10  -1.660  -4.783 -10.516
   72   2HB   TRP  10          2HB       TRP  10  -1.685  -6.474 -10.986
   73    HD1  TRP  10           HD1      TRP  10   0.215  -8.044 -10.074
   74    HE1  TRP  10           HE1      TRP  10   2.141  -7.694  -8.400
   75    HE3  TRP  10           HE3      TRP  10   0.019  -2.970  -9.646
   76    HZ2  TRP  10           HZ2      TRP  10   3.402  -5.534  -7.081
   77    HZ3  TRP  10           HZ3      TRP  10   1.599  -1.821  -8.164
   78    HH2  TRP  10           HH2      TRP  10   3.258  -3.086  -6.897
   79   1HB   PRO  11          1HB       PRO  11  -1.973  -6.211 -17.680
   80   2HB   PRO  11          2HB       PRO  11  -1.566  -4.513 -17.425
   81   1HG   PRO  11          1HG       PRO  11   0.539  -5.449 -17.217
   82   2HG   PRO  11          2HG       PRO  11  -0.099  -6.957 -16.537
   83   1HD   PRO  11          1HD       PRO  11   0.647  -5.961 -14.603
   84   2HD   PRO  11          2HD       PRO  11   0.355  -4.318 -15.219
   85    H    GLU  12           H        GLU  12  -1.628  -7.727 -14.875
   86    HA   GLU  12           HA       GLU  12  -3.728  -9.341 -15.844
   87   1HB   GLU  12          1HB       GLU  12  -2.784 -11.094 -14.406
   88   2HB   GLU  12          2HB       GLU  12  -1.560 -10.270 -15.360
   89   1HG   GLU  12          1HG       GLU  12  -1.975  -9.076 -12.706
   90   2HG   GLU  12          2HG       GLU  12  -1.460 -10.757 -12.672
   91    H    LEU  13           H        LEU  13  -3.669  -7.195 -13.187
   92    HA   LEU  13           HA       LEU  13  -5.574  -8.650 -11.596
   93   1HB   LEU  13          1HB       LEU  13  -4.364  -5.905 -11.409
   94   2HB   LEU  13          2HB       LEU  13  -5.688  -6.383 -10.372
   95    HG   LEU  13           HG       LEU  13  -2.949  -7.642 -10.463
   96   1HD1  LEU  13          1HD1      LEU  13  -3.160  -5.437  -9.310
   97   2HD1  LEU  13          2HD1      LEU  13  -4.308  -6.163  -8.236
   98   3HD1  LEU  13          3HD1      LEU  13  -2.680  -6.753  -8.276
   99   1HD2  LEU  13          1HD2      LEU  13  -5.507  -8.670  -9.490
  100   2HD2  LEU  13          2HD2      LEU  13  -3.975  -9.488  -9.783
  101   3HD2  LEU  13          3HD2      LEU  13  -4.254  -8.640  -8.290
  102    H    VAL  14           H        VAL  14  -5.637  -6.437 -14.217
  103    HA   VAL  14           HA       VAL  14  -8.062  -5.141 -13.850
  104    HB   VAL  14           HB       VAL  14  -6.979  -6.142 -16.498
  105   1HG1  VAL  14          1HG1      VAL  14  -8.873  -3.892 -15.810
  106   2HG1  VAL  14          2HG1      VAL  14  -8.178  -4.173 -17.409
  107   3HG1  VAL  14          3HG1      VAL  14  -9.254  -5.368 -16.696
  108   1HG2  VAL  14          1HG2      VAL  14  -5.359  -4.767 -15.037
  109   2HG2  VAL  14          2HG2      VAL  14  -5.676  -4.196 -16.660
  110   3HG2  VAL  14          3HG2      VAL  14  -6.476  -3.441 -15.288
  111    H    GLY  15           H        GLY  15 -10.007  -6.022 -13.446
  112   1HA   GLY  15          1HA       GLY  15 -11.882  -7.220 -14.358
  113   2HA   GLY  15          2HA       GLY  15 -10.792  -8.462 -14.943
  114    H    LYS  16           H        LYS  16  -9.421  -7.915 -12.113
  115    HA   LYS  16           HA       LYS  16 -10.951 -10.037 -10.791
  116   1HB   LYS  16          1HB       LYS  16  -8.234  -8.826 -10.323
  117   2HB   LYS  16          2HB       LYS  16  -8.970  -9.908  -9.162
  118   1HG   LYS  16          1HG       LYS  16  -8.844 -10.833 -11.990
  119   2HG   LYS  16          2HG       LYS  16  -7.328 -10.709 -11.105
  120   1HD   LYS  16          1HD       LYS  16  -7.730 -12.587 -10.011
  121   2HD   LYS  16          2HD       LYS  16  -9.270 -11.983  -9.404
  122   1HE   LYS  16          1HE       LYS  16 -10.390 -12.720 -11.410
  123   2HE   LYS  16          2HE       LYS  16  -8.859 -13.232 -12.121
  124   1HZ   LYS  16          1HZ       LYS  16 -10.092 -14.382  -9.669
  125   2HZ   LYS  16          2HZ       LYS  16 -10.073 -15.101 -11.202
  126   3HZ   LYS  16          3HZ       LYS  16  -8.625 -14.869 -10.363
  127    H    SER  17           H        SER  17 -11.415  -9.863  -8.482
  128    HA   SER  17           HA       SER  17 -12.890  -7.547  -7.882
  129   1HB   SER  17          1HB       SER  17 -13.396  -8.547  -5.830
  130   2HB   SER  17          2HB       SER  17 -13.075  -9.931  -6.875
  131    HG   SER  17           HG       SER  17 -12.027  -9.901  -4.735
  132    H    GLY  18           H        GLY  18 -12.476  -5.736  -6.644
  133   1HA   GLY  18          1HA       GLY  18  -9.981  -4.601  -6.578
  134   2HA   GLY  18          2HA       GLY  18 -11.264  -4.175  -5.470
  135    H    ASN  19           H        ASN  19 -11.371  -6.838  -4.258
  136    HA   ASN  19           HA       ASN  19  -9.368  -6.446  -2.261
  137   1HB   ASN  19          1HB       ASN  19 -11.580  -8.404  -2.756
  138   2HB   ASN  19          2HB       ASN  19 -10.300  -8.893  -1.654
  139   2HD2  ASN  19          2HD2      ASN  19 -12.981  -6.750  -2.157
  140   1HD2  ASN  19          1HD2      ASN  19 -13.028  -6.139  -0.541
  141    H    MET  20           H        MET  20  -9.869  -8.826  -4.842
  142    HA   MET  20           HA       MET  20  -7.593 -10.396  -4.259
  143   1HB   MET  20          1HB       MET  20  -9.682 -10.485  -6.110
  144   2HB   MET  20          2HB       MET  20  -8.275 -10.270  -7.118
  145   1HG   MET  20          1HG       MET  20  -8.523 -12.397  -4.999
  146   2HG   MET  20          2HG       MET  20  -8.993 -12.617  -6.680
  147   1HE   MET  20          1HE       MET  20  -6.631 -13.360  -4.244
  148   2HE   MET  20          2HE       MET  20  -5.009 -13.371  -4.939
  149   3HE   MET  20          3HE       MET  20  -5.714 -11.860  -4.365
  150    H    ALA  21           H        ALA  21  -8.097  -7.531  -6.258
  151    HA   ALA  21           HA       ALA  21  -5.579  -7.470  -7.465
  152   1HB   ALA  21          1HB       ALA  21  -7.531  -5.282  -6.860
  153   2HB   ALA  21          2HB       ALA  21  -6.072  -5.032  -7.822
  154   3HB   ALA  21          3HB       ALA  21  -7.316  -6.151  -8.379
  155    H    ALA  22           H        ALA  22  -6.781  -5.570  -4.716
  156    HA   ALA  22           HA       ALA  22  -4.405  -4.395  -3.985
  157   1HB   ALA  22          1HB       ALA  22  -6.602  -5.303  -2.134
  158   2HB   ALA  22          2HB       ALA  22  -6.567  -3.779  -3.021
  159   3HB   ALA  22          3HB       ALA  22  -5.377  -4.089  -1.757
  160    H    ALA  23           H        ALA  23  -5.626  -7.590  -3.148
  161    HA   ALA  23           HA       ALA  23  -3.644  -8.256  -1.250
  162   1HB   ALA  23          1HB       ALA  23  -5.211 -10.085  -3.074
  163   2HB   ALA  23          2HB       ALA  23  -4.340 -10.565  -1.614
  164   3HB   ALA  23          3HB       ALA  23  -5.736  -9.498  -1.497
  165    H    THR  24           H        THR  24  -3.853  -8.797  -4.759
  166    HA   THR  24           HA       THR  24  -1.475 -10.259  -5.048
  167    HB   THR  24           HB       THR  24  -2.630  -8.362  -7.088
  168    HG1  THR  24           HG1      THR  24  -3.447 -11.023  -6.469
  169   1HG2  THR  24          1HG2      THR  24  -1.147 -10.959  -7.399
  170   2HG2  THR  24          2HG2      THR  24  -1.877 -10.023  -8.701
  171   3HG2  THR  24          3HG2      THR  24  -0.526  -9.351  -7.785
  172    H    VAL  25           H        VAL  25  -2.067  -6.763  -5.100
  173    HA   VAL  25           HA       VAL  25   0.576  -6.048  -5.869
  174    HB   VAL  25           HB       VAL  25  -1.375  -4.350  -4.293
  175   1HG1  VAL  25          1HG1      VAL  25   1.286  -3.877  -5.326
  176   2HG1  VAL  25          2HG1      VAL  25   0.117  -2.799  -6.080
  177   3HG1  VAL  25          3HG1      VAL  25   0.257  -2.855  -4.335
  178   1HG2  VAL  25          1HG2      VAL  25  -1.112  -4.752  -7.270
  179   2HG2  VAL  25          2HG2      VAL  25  -2.492  -5.144  -6.271
  180   3HG2  VAL  25          3HG2      VAL  25  -2.057  -3.470  -6.518
  181    H    GLU  26           H        GLU  26  -1.031  -6.097  -2.679
  182    HA   GLU  26           HA       GLU  26   1.306  -5.327  -1.240
  183   1HB   GLU  26          1HB       GLU  26   0.093  -5.798   0.731
  184   2HB   GLU  26          2HB       GLU  26  -0.978  -6.925  -0.088
  185   1HG   GLU  26          1HG       GLU  26  -1.243  -4.377  -1.377
  186   2HG   GLU  26          2HG       GLU  26  -2.427  -5.351  -0.512
  187    H    ARG  27           H        ARG  27   0.130  -8.394  -2.427
  188    HA   ARG  27           HA       ARG  27   1.882  -9.967  -0.739
  189   1HB   ARG  27          1HB       ARG  27  -0.007 -10.567  -3.001
  190   2HB   ARG  27          2HB       ARG  27   1.153 -11.772  -2.485
  191   1HG   ARG  27          1HG       ARG  27   0.095 -11.079  -0.086
  192   2HG   ARG  27          2HG       ARG  27  -1.287 -10.814  -1.141
  193   1HD   ARG  27          1HD       ARG  27   0.324 -13.332  -1.268
  194   2HD   ARG  27          2HD       ARG  27  -0.958 -13.121  -0.088
  195    HE   ARG  27           HE       ARG  27  -2.380 -12.566  -2.170
  196   1HH1  ARG  27          1HH1      ARG  27   0.142 -15.025  -2.006
  197   2HH1  ARG  27          2HH1      ARG  27  -0.580 -15.990  -3.230
  198   1HH2  ARG  27          1HH2      ARG  27  -3.305 -13.883  -3.774
  199   2HH2  ARG  27          2HH2      ARG  27  -2.521 -15.352  -4.245
  200    H    GLU  28           H        GLU  28   1.690  -9.338  -4.251
  201    HA   GLU  28           HA       GLU  28   4.196 -10.521  -4.848
  202   1HB   GLU  28          1HB       GLU  28   2.420  -8.573  -6.313
  203   2HB   GLU  28          2HB       GLU  28   3.988  -9.018  -6.952
  204   1HG   GLU  28          1HG       GLU  28   3.067 -11.473  -6.551
  205   2HG   GLU  28          2HG       GLU  28   1.517 -10.640  -6.699
  206    H    ASN  29           H        ASN  29   3.226  -7.241  -3.972
  207    HA   ASN  29           HA       ASN  29   6.089  -6.515  -3.790
  208   1HB   ASN  29          1HB       ASN  29   4.976  -5.391  -5.683
  209   2HB   ASN  29          2HB       ASN  29   3.800  -4.691  -4.575
  210   2HD2  ASN  29          2HD2      ASN  29   5.636  -3.303  -6.321
  211   1HD2  ASN  29          1HD2      ASN  29   6.660  -2.359  -5.299
  212    H    ARG  30           H        ARG  30   5.916  -7.282  -1.599
  213    HA   ARG  30           HA       ARG  30   4.151  -6.220   0.318
  214   1HB   ARG  30          1HB       ARG  30   6.852  -7.520   0.462
  215   2HB   ARG  30          2HB       ARG  30   6.111  -6.867   1.910
  216   1HG   ARG  30          1HG       ARG  30   4.066  -8.372   0.920
  217   2HG   ARG  30          2HG       ARG  30   5.466  -9.275   0.350
  218   1HD   ARG  30          1HD       ARG  30   4.756 -10.104   2.506
  219   2HD   ARG  30          2HD       ARG  30   6.333  -9.359   2.623
  220    HE   ARG  30           HE       ARG  30   5.425  -7.534   3.781
  221   1HH1  ARG  30          1HH1      ARG  30   3.004  -9.998   3.106
  222   2HH1  ARG  30          2HH1      ARG  30   1.895  -9.370   4.260
  223   1HH2  ARG  30          1HH2      ARG  30   3.943  -6.759   5.330
  224   2HH2  ARG  30          2HH2      ARG  30   2.428  -7.570   5.547
  225    H    ASN  31           H        ASN  31   6.503  -4.514  -1.391
  226    HA   ASN  31           HA       ASN  31   7.220  -2.766   0.809
  227   1HB   ASN  31          1HB       ASN  31   8.849  -3.397  -0.950
  228   2HB   ASN  31          2HB       ASN  31   7.891  -2.516  -2.130
  229   2HD2  ASN  31          2HD2      ASN  31   7.873  -0.264  -2.093
  230   1HD2  ASN  31          1HD2      ASN  31   9.017   0.634  -1.160
  231    H    VAL  32           H        VAL  32   4.511  -3.043  -1.099
  232    HA   VAL  32           HA       VAL  32   3.867  -0.221  -0.670
  233    HB   VAL  32           HB       VAL  32   2.976   0.067  -2.862
  234   1HG1  VAL  32          1HG1      VAL  32   5.395   0.460  -2.629
  235   2HG1  VAL  32          2HG1      VAL  32   5.703  -1.217  -3.064
  236   3HG1  VAL  32          3HG1      VAL  32   5.005  -0.136  -4.245
  237   1HG2  VAL  32          1HG2      VAL  32   3.543  -2.854  -3.220
  238   2HG2  VAL  32          2HG2      VAL  32   2.024  -1.997  -3.431
  239   3HG2  VAL  32          3HG2      VAL  32   3.324  -1.786  -4.601
  240    H    HIS  33           H        HIS  33   1.475   0.170  -1.108
  241    HA   HIS  33           HA       HIS  33  -0.119  -2.190  -0.465
  242   1HB   HIS  33          1HB       HIS  33  -0.851  -1.449   1.546
  243   2HB   HIS  33          2HB       HIS  33   0.589  -0.466   1.521
  244    HD1  HIS  33           HD1      HIS  33  -3.095  -0.273   1.454
  245    HD2  HIS  33           HD2      HIS  33   0.143   2.279   1.028
  246    HE1  HIS  33           HE1      HIS  33  -4.008   2.043   1.740
  247    HE2  HIS  33           HE2      HIS  33  -2.045   3.575   1.415
  248    H    ALA  34           H        ALA  34  -2.161  -2.244  -1.291
  249    HA   ALA  34           HA       ALA  34  -2.786  -0.105  -3.202
  250   1HB   ALA  34          1HB       ALA  34  -3.562  -2.983  -3.100
  251   2HB   ALA  34          2HB       ALA  34  -4.267  -1.845  -4.249
  252   3HB   ALA  34          3HB       ALA  34  -2.531  -2.191  -4.285
  253    H    ILE  35           H        ILE  35  -4.720   0.927  -3.222
  254    HA   ILE  35           HA       ILE  35  -6.549   0.375  -0.959
  255    HB   ILE  35           HB       ILE  35  -6.123   3.000  -2.391
  256   1HG1  ILE  35          1HG1      ILE  35  -5.360   2.829   0.444
  257   2HG1  ILE  35          2HG1      ILE  35  -4.390   1.799  -0.590
  258   1HG2  ILE  35          1HG2      ILE  35  -7.732   2.244   0.046
  259   2HG2  ILE  35          2HG2      ILE  35  -7.408   3.904  -0.453
  260   3HG2  ILE  35          3HG2      ILE  35  -8.344   2.841  -1.496
  261   1HD1  ILE  35          1HD1      ILE  35  -3.944   3.777  -2.027
  262   2HD1  ILE  35          2HD1      ILE  35  -4.738   4.757  -0.796
  263   3HD1  ILE  35          3HD1      ILE  35  -3.282   3.858  -0.402
  264    H    VAL  36           H        VAL  36  -8.503  -0.346  -1.515
  265    HA   VAL  36           HA       VAL  36  -9.302  -0.407  -4.281
  266    HB   VAL  36           HB       VAL  36 -10.811  -1.296  -1.828
  267   1HG1  VAL  36          1HG1      VAL  36 -11.264  -1.816  -4.766
  268   2HG1  VAL  36          2HG1      VAL  36 -12.064  -2.700  -3.469
  269   3HG1  VAL  36          3HG1      VAL  36 -12.343  -0.974  -3.652
  270   1HG2  VAL  36          1HG2      VAL  36  -9.060  -2.848  -3.732
  271   2HG2  VAL  36          2HG2      VAL  36  -8.701  -2.481  -2.045
  272   3HG2  VAL  36          3HG2      VAL  36 -10.045  -3.548  -2.445
  273    H    LEU  37           H        LEU  37 -10.430   1.052  -5.298
  274    HA   LEU  37           HA       LEU  37 -12.387   2.724  -3.877
  275   1HB   LEU  37          1HB       LEU  37 -11.446   4.623  -5.397
  276   2HB   LEU  37          2HB       LEU  37 -10.706   4.265  -3.862
  277    HG   LEU  37           HG       LEU  37  -9.135   2.708  -5.354
  278   1HD1  LEU  37          1HD1      LEU  37 -10.705   3.911  -7.354
  279   2HD1  LEU  37          2HD1      LEU  37  -9.126   4.697  -7.416
  280   3HD1  LEU  37          3HD1      LEU  37  -9.239   2.977  -7.490
  281   1HD2  LEU  37          1HD2      LEU  37  -8.925   5.679  -5.011
  282   2HD2  LEU  37          2HD2      LEU  37  -8.228   4.394  -4.018
  283   3HD2  LEU  37          3HD2      LEU  37  -7.658   4.660  -5.673
  284    H    LYS  38           H        LYS  38 -14.064   3.498  -5.236
  285    HA   LYS  38           HA       LYS  38 -14.405   1.874  -7.643
  286   1HB   LYS  38          1HB       LYS  38 -16.281   3.681  -6.147
  287   2HB   LYS  38          2HB       LYS  38 -16.723   2.837  -7.613
  288   1HG   LYS  38          1HG       LYS  38 -15.864   0.733  -6.242
  289   2HG   LYS  38          2HG       LYS  38 -17.516   1.313  -6.171
  290   1HD   LYS  38          1HD       LYS  38 -15.345   2.121  -4.225
  291   2HD   LYS  38          2HD       LYS  38 -16.495   0.823  -3.948
  292   1HE   LYS  38          1HE       LYS  38 -16.893   3.319  -3.116
  293   2HE   LYS  38          2HE       LYS  38 -17.641   3.470  -4.695
  294   1HZ   LYS  38          1HZ       LYS  38 -19.031   1.547  -4.156
  295   2HZ   LYS  38          2HZ       LYS  38 -18.341   1.476  -2.611
  296   3HZ   LYS  38          3HZ       LYS  38 -19.253   2.824  -3.068
  297    H    GLU  39           H        GLU  39 -15.106   2.755  -9.653
  298    HA   GLU  39           HA       GLU  39 -13.546   4.763 -10.708
  299   1HB   GLU  39          1HB       GLU  39 -16.140   3.535 -11.527
  300   2HB   GLU  39          2HB       GLU  39 -15.570   4.943 -12.416
  301   1HG   GLU  39          1HG       GLU  39 -13.651   3.842 -13.182
  302   2HG   GLU  39          2HG       GLU  39 -13.837   2.552 -12.007
  303    H    GLY  40           H        GLY  40 -13.386   6.848 -10.228
  304   1HA   GLY  40          1HA       GLY  40 -14.363   9.023 -10.372
  305   2HA   GLY  40          2HA       GLY  40 -15.886   8.379  -9.790
  306    H    SER  41           H        SER  41 -13.453   6.958  -8.004
  307    HA   SER  41           HA       SER  41 -14.154   8.339  -5.639
  308   1HB   SER  41          1HB       SER  41 -13.385   6.061  -5.493
  309   2HB   SER  41          2HB       SER  41 -11.866   6.475  -6.288
  310    HG   SER  41           HG       SER  41 -12.717   7.036  -3.672
  311    H    ALA  42           H        ALA  42 -12.169   9.091  -4.188
  312    HA   ALA  42           HA       ALA  42 -11.012  11.383  -5.604
  313   1HB   ALA  42          1HB       ALA  42 -10.445  12.212  -3.406
  314   2HB   ALA  42          2HB       ALA  42 -10.960  10.693  -2.661
  315   3HB   ALA  42          3HB       ALA  42 -12.146  11.738  -3.450
  316    H    MET  43           H        MET  43  -9.372  10.479  -6.819
  317    HA   MET  43           HA       MET  43  -7.244   9.064  -5.323
  318   1HB   MET  43          1HB       MET  43  -6.572   8.399  -7.771
  319   2HB   MET  43          2HB       MET  43  -7.833   7.538  -6.900
  320   1HG   MET  43          1HG       MET  43  -9.498   9.015  -8.080
  321   2HG   MET  43          2HG       MET  43  -8.156   9.619  -9.044
  322   1HE   MET  43          1HE       MET  43 -10.995   7.444  -8.906
  323   2HE   MET  43          2HE       MET  43 -10.580   5.908  -9.637
  324   3HE   MET  43          3HE       MET  43 -10.070   6.271  -7.996
  325    H    THR  44           H        THR  44  -5.811  10.556  -4.727
  326    HA   THR  44           HA       THR  44  -5.285  12.942  -6.061
  327    HB   THR  44           HB       THR  44  -2.866  12.381  -4.869
  328    HG1  THR  44           HG1      THR  44  -3.509  10.373  -4.155
  329   1HG2  THR  44          1HG2      THR  44  -5.383  13.400  -3.583
  330   2HG2  THR  44          2HG2      THR  44  -3.789  13.427  -2.818
  331   3HG2  THR  44          3HG2      THR  44  -4.069  14.335  -4.308
  332    H    LYS  45           H        LYS  45  -3.540  13.585  -7.388
  333    HA   LYS  45           HA       LYS  45  -2.874  11.576  -9.385
  334   1HB   LYS  45          1HB       LYS  45  -2.636  14.554  -9.171
  335   2HB   LYS  45          2HB       LYS  45  -1.679  13.701 -10.373
  336   1HG   LYS  45          1HG       LYS  45  -3.390  13.381 -11.723
  337   2HG   LYS  45          2HG       LYS  45  -4.464  12.854 -10.425
  338   1HD   LYS  45          1HD       LYS  45  -4.998  15.105  -9.840
  339   2HD   LYS  45          2HD       LYS  45  -3.765  15.748 -10.928
  340   1HE   LYS  45          1HE       LYS  45  -5.522  14.056 -12.439
  341   2HE   LYS  45          2HE       LYS  45  -6.489  15.165 -11.470
  342   1HZ   LYS  45          1HZ       LYS  45  -5.231  17.015 -12.388
  343   2HZ   LYS  45          2HZ       LYS  45  -4.301  15.949 -13.320
  344   3HZ   LYS  45          3HZ       LYS  45  -5.962  16.108 -13.612
  345    H    ASP  46           H        ASP  46  -1.327  13.248  -6.758
  346    HA   ASP  46           HA       ASP  46   1.316  13.152  -7.385
  347   1HB   ASP  46          1HB       ASP  46  -0.192  13.463  -5.022
  348   2HB   ASP  46          2HB       ASP  46   0.925  12.159  -4.658
  349    H    PHE  47           H        PHE  47   2.979  11.673  -7.346
  350    HA   PHE  47           HA       PHE  47   2.164   8.902  -7.739
  351   1HB   PHE  47          1HB       PHE  47   3.701   9.850  -9.333
  352   2HB   PHE  47          2HB       PHE  47   4.812  10.317  -8.052
  353    HD1  PHE  47           HD1      PHE  47   6.326   8.740  -7.078
  354    HD2  PHE  47           HD2      PHE  47   3.421   7.474  -9.928
  355    HE1  PHE  47           HE1      PHE  47   7.461   6.570  -7.271
  356    HE2  PHE  47           HE2      PHE  47   4.554   5.317 -10.125
  357    HZ   PHE  47           HZ       PHE  47   6.575   4.848  -8.790
  358    H    ARG  48           H        ARG  48   2.531   7.244  -6.377
  359    HA   ARG  48           HA       ARG  48   4.425   7.518  -4.161
  360   1HB   ARG  48          1HB       ARG  48   1.471   7.072  -3.783
  361   2HB   ARG  48          2HB       ARG  48   2.658   6.699  -2.542
  362   1HG   ARG  48          1HG       ARG  48   3.336   9.068  -2.537
  363   2HG   ARG  48          2HG       ARG  48   2.081   9.411  -3.727
  364   1HD   ARG  48          1HD       ARG  48   0.391   8.645  -2.181
  365   2HD   ARG  48          2HD       ARG  48   1.319   9.964  -1.483
  366    HE   ARG  48           HE       ARG  48   2.598   7.779  -0.546
  367   1HH1  ARG  48          1HH1      ARG  48  -0.788   8.734  -0.530
  368   2HH1  ARG  48          2HH1      ARG  48  -1.128   7.876   0.922
  369   1HH2  ARG  48          1HH2      ARG  48   2.115   6.665   1.374
  370   2HH2  ARG  48          2HH2      ARG  48   0.504   6.704   2.011
  371    H    CYS  49           H        CYS  49   5.627   5.753  -4.345
  372    HA   CYS  49           HA       CYS  49   4.926   3.453  -5.745
  373   1HB   CYS  49          1HB       CYS  49   7.225   4.412  -4.487
  374   2HB   CYS  49          2HB       CYS  49   6.888   2.906  -3.655
  375    H    ASP  50           H        ASP  50   4.727   4.149  -2.299
  376    HA   ASP  50           HA       ASP  50   3.828   1.518  -1.629
  377   1HB   ASP  50          1HB       ASP  50   5.117   2.868  -0.057
  378   2HB   ASP  50          2HB       ASP  50   3.565   2.381   0.620
  379    H    ARG  51           H        ARG  51   2.232   3.867  -3.283
  380    HA   ARG  51           HA       ARG  51  -0.339   3.069  -2.112
  381   1HB   ARG  51          1HB       ARG  51   0.418   5.492  -1.728
  382   2HB   ARG  51          2HB       ARG  51   0.135   5.718  -3.448
  383   1HG   ARG  51          1HG       ARG  51  -2.217   4.724  -2.929
  384   2HG   ARG  51          2HG       ARG  51  -1.810   5.151  -1.264
  385   1HD   ARG  51          1HD       ARG  51  -1.310   7.444  -2.083
  386   2HD   ARG  51          2HD       ARG  51  -2.993   6.984  -2.154
  387    HE   ARG  51           HE       ARG  51  -2.286   6.379  -4.619
  388   1HH1  ARG  51          1HH1      ARG  51  -1.453   9.246  -2.743
  389   2HH1  ARG  51          2HH1      ARG  51  -1.236  10.216  -4.145
  390   1HH2  ARG  51          1HH2      ARG  51  -2.096   7.742  -6.427
  391   2HH2  ARG  51          2HH2      ARG  51  -1.666   9.395  -6.228
  392    H    VAL  52           H        VAL  52  -1.347   1.775  -3.462
  393    HA   VAL  52           HA       VAL  52  -1.178   2.341  -6.367
  394    HB   VAL  52           HB       VAL  52  -1.673  -0.330  -5.029
  395   1HG1  VAL  52          1HG1      VAL  52  -1.777   0.612  -7.846
  396   2HG1  VAL  52          2HG1      VAL  52  -1.123  -0.994  -7.548
  397   3HG1  VAL  52          3HG1      VAL  52  -2.743  -0.584  -7.013
  398   1HG2  VAL  52          1HG2      VAL  52   0.792   1.033  -5.522
  399   2HG2  VAL  52          2HG2      VAL  52   0.511  -0.589  -4.902
  400   3HG2  VAL  52          3HG2      VAL  52   0.682  -0.332  -6.630
  401    H    TRP  53           H        TRP  53  -3.028   3.124  -7.166
  402    HA   TRP  53           HA       TRP  53  -5.479   2.997  -5.652
  403   1HB   TRP  53          1HB       TRP  53  -4.804   4.108  -8.375
  404   2HB   TRP  53          2HB       TRP  53  -6.437   4.151  -7.736
  405    HD1  TRP  53           HD1      TRP  53  -4.338   6.651  -8.478
  406    HE1  TRP  53           HE1      TRP  53  -4.164   8.538  -6.738
  407    HE3  TRP  53           HE3      TRP  53  -6.085   4.150  -4.391
  408    HZ2  TRP  53           HZ2      TRP  53  -4.683   8.883  -3.983
  409    HZ3  TRP  53           HZ3      TRP  53  -6.241   5.329  -2.258
  410    HH2  TRP  53           HH2      TRP  53  -5.532   7.655  -2.046
  411    H    VAL  54           H        VAL  54  -7.175   1.646  -5.919
  412    HA   VAL  54           HA       VAL  54  -7.050  -0.260  -8.192
  413    HB   VAL  54           HB       VAL  54  -7.803  -0.714  -5.311
  414   1HG1  VAL  54          1HG1      VAL  54  -8.578  -2.263  -7.730
  415   2HG1  VAL  54          2HG1      VAL  54  -8.296  -3.115  -6.214
  416   3HG1  VAL  54          3HG1      VAL  54  -9.536  -1.875  -6.307
  417   1HG2  VAL  54          1HG2      VAL  54  -5.437  -0.950  -5.870
  418   2HG2  VAL  54          2HG2      VAL  54  -6.163  -2.497  -5.432
  419   3HG2  VAL  54          3HG2      VAL  54  -5.860  -2.115  -7.127
  420    H    ILE  55           H        ILE  55  -8.384   1.055  -9.461
  421    HA   ILE  55           HA       ILE  55 -10.945   1.925  -8.497
  422    HB   ILE  55           HB       ILE  55 -10.002   1.894 -11.347
  423   1HG1  ILE  55          1HG1      ILE  55  -9.833   4.374  -9.755
  424   2HG1  ILE  55          2HG1      ILE  55  -8.658   3.178  -9.348
  425   1HG2  ILE  55          1HG2      ILE  55 -12.380   2.267 -11.064
  426   2HG2  ILE  55          2HG2      ILE  55 -12.070   3.562  -9.914
  427   3HG2  ILE  55          3HG2      ILE  55 -11.594   3.734 -11.610
  428   1HD1  ILE  55          1HD1      ILE  55  -9.057   4.142 -12.136
  429   2HD1  ILE  55          2HD1      ILE  55  -7.906   4.825 -10.990
  430   3HD1  ILE  55          3HD1      ILE  55  -7.754   3.142 -11.488
  431    H    VAL  56           H        VAL  56 -12.741   0.772  -8.425
  432    HA   VAL  56           HA       VAL  56 -13.034  -1.499 -10.262
  433    HB   VAL  56           HB       VAL  56 -14.249  -2.694  -8.552
  434   1HG1  VAL  56          1HG1      VAL  56 -11.556  -1.697  -7.659
  435   2HG1  VAL  56          2HG1      VAL  56 -12.426  -3.002  -6.861
  436   3HG1  VAL  56          3HG1      VAL  56 -11.948  -3.170  -8.525
  437   1HG2  VAL  56          1HG2      VAL  56 -13.814  -0.252  -6.866
  438   2HG2  VAL  56          2HG2      VAL  56 -15.342  -1.000  -7.337
  439   3HG2  VAL  56          3HG2      VAL  56 -14.280  -1.817  -6.206
  440    H    ASN  57           H        ASN  57 -15.296  -2.157 -10.634
  441    HA   ASN  57           HA       ASN  57 -16.904   0.230 -11.159
  442   1HB   ASN  57          1HB       ASN  57 -18.250  -1.221 -12.573
  443   2HB   ASN  57          2HB       ASN  57 -16.549  -1.436 -12.935
  444   2HD2  ASN  57          2HD2      ASN  57 -17.844  -3.385 -13.892
  445   1HD2  ASN  57          1HD2      ASN  57 -17.824  -4.793 -12.890
  446    H    ASP  58           H        ASP  58 -19.458  -0.734 -11.106
  447    HA   ASP  58           HA       ASP  58 -20.163  -0.441  -8.412
  448   1HB   ASP  58          1HB       ASP  58 -22.453  -1.053  -9.163
  449   2HB   ASP  58          2HB       ASP  58 -21.693   0.164 -10.182
  450    H    HIS  59           H        HIS  59 -19.149  -3.250 -10.129
  451    HA   HIS  59           HA       HIS  59 -20.365  -5.063  -8.192
  452   1HB   HIS  59          1HB       HIS  59 -19.141  -5.361 -10.905
  453   2HB   HIS  59          2HB       HIS  59 -19.099  -6.746  -9.823
  454    HD1  HIS  59           HD1      HIS  59 -21.243  -5.042 -12.191
  455    HD2  HIS  59           HD2      HIS  59 -21.754  -7.578  -8.941
  456    HE1  HIS  59           HE1      HIS  59 -23.601  -5.899 -12.372
  457    HE2  HIS  59           HE2      HIS  59 -23.909  -7.383 -10.359
  458    H    GLY  60           H        GLY  60 -17.767  -3.180  -7.990
  459   1HA   GLY  60          1HA       GLY  60 -15.920  -3.297  -6.668
  460   2HA   GLY  60          2HA       GLY  60 -16.452  -4.876  -6.125
  461    H    VAL  61           H        VAL  61 -16.066  -4.318  -9.533
  462    HA   VAL  61           HA       VAL  61 -13.783  -6.169  -9.558
  463    HB   VAL  61           HB       VAL  61 -15.497  -5.199 -11.863
  464   1HG1  VAL  61          1HG1      VAL  61 -13.440  -7.395 -11.640
  465   2HG1  VAL  61          2HG1      VAL  61 -14.521  -7.174 -13.019
  466   3HG1  VAL  61          3HG1      VAL  61 -13.337  -5.934 -12.623
  467   1HG2  VAL  61          1HG2      VAL  61 -15.661  -7.760 -10.271
  468   2HG2  VAL  61          2HG2      VAL  61 -16.855  -6.463 -10.296
  469   3HG2  VAL  61          3HG2      VAL  61 -16.563  -7.414 -11.748
  470    H    VAL  62           H        VAL  62 -11.789  -5.556 -10.334
  471    HA   VAL  62           HA       VAL  62 -11.265  -2.745 -10.498
  472    HB   VAL  62           HB       VAL  62  -9.406  -5.058 -11.058
  473   1HG1  VAL  62          1HG1      VAL  62  -8.895  -2.101 -10.698
  474   2HG1  VAL  62          2HG1      VAL  62  -7.660  -3.338 -10.565
  475   3HG1  VAL  62          3HG1      VAL  62  -8.500  -3.127 -12.077
  476   1HG2  VAL  62          1HG2      VAL  62  -9.927  -3.461  -8.573
  477   2HG2  VAL  62          2HG2      VAL  62 -10.181  -5.175  -8.776
  478   3HG2  VAL  62          3HG2      VAL  62  -8.562  -4.515  -8.776
  479    H    THR  63           H        THR  63 -11.578  -1.539 -12.251
  480    HA   THR  63           HA       THR  63 -11.666  -2.809 -14.900
  481    HB   THR  63           HB       THR  63 -12.690  -0.742 -15.656
  482    HG1  THR  63           HG1      THR  63 -12.400   0.220 -12.989
  483   1HG2  THR  63          1HG2      THR  63 -14.005  -2.512 -14.194
  484   2HG2  THR  63          2HG2      THR  63 -14.101  -1.144 -13.082
  485   3HG2  THR  63          3HG2      THR  63 -14.732  -0.998 -14.721
  486    H    SER  64           H        SER  64  -9.742  -0.569 -13.007
  487    HA   SER  64           HA       SER  64  -8.108   0.061 -15.379
  488   1HB   SER  64          1HB       SER  64  -7.183   1.867 -14.082
  489   2HB   SER  64          2HB       SER  64  -8.017   1.311 -12.628
  490    HG   SER  64           HG       SER  64  -9.977   1.833 -13.571
  491    H    VAL  65           H        VAL  65  -5.904  -0.229 -15.378
  492    HA   VAL  65           HA       VAL  65  -4.927  -2.582 -14.176
  493    HB   VAL  65           HB       VAL  65  -3.269  -0.363 -15.347
  494   1HG1  VAL  65          1HG1      VAL  65  -2.721  -3.083 -14.409
  495   2HG1  VAL  65          2HG1      VAL  65  -2.045  -2.722 -15.999
  496   3HG1  VAL  65          3HG1      VAL  65  -1.658  -1.709 -14.618
  497   1HG2  VAL  65          1HG2      VAL  65  -5.236  -2.032 -16.636
  498   2HG2  VAL  65          2HG2      VAL  65  -4.240  -0.746 -17.287
  499   3HG2  VAL  65          3HG2      VAL  65  -3.631  -2.390 -17.261
  500   1HB   PRO  66          1HB       PRO  66  -4.320  -2.290  -8.694
  501   2HB   PRO  66          2HB       PRO  66  -3.094  -3.283  -9.474
  502   1HG   PRO  66          1HG       PRO  66  -4.942  -4.452 -10.118
  503   2HG   PRO  66          2HG       PRO  66  -5.986  -3.063 -10.019
  504   1HD   PRO  66          1HD       PRO  66  -4.228  -3.911 -12.249
  505   2HD   PRO  66          2HD       PRO  66  -5.802  -3.147 -12.306
  506    H    HIS  67           H        HIS  67  -2.377   0.698 -10.740
  507    HA   HIS  67           HA       HIS  67   0.286  -0.563 -10.667
  508   1HB   HIS  67          1HB       HIS  67  -0.217   0.208 -12.939
  509   2HB   HIS  67          2HB       HIS  67   1.088   1.147 -12.228
  510    HD1  HIS  67           HD1      HIS  67   0.116   2.699 -14.351
  511    HD2  HIS  67           HD2      HIS  67  -2.071   2.595 -10.826
  512    HE1  HIS  67           HE1      HIS  67  -1.375   4.723 -14.411
  513    HE2  HIS  67           HE2      HIS  67  -2.739   4.585 -12.298
  514    H    ILE  68           H        ILE  68   1.977   0.713  -9.853
  515    HA   ILE  68           HA       ILE  68   1.467   1.932  -7.416
  516    HB   ILE  68           HB       ILE  68   3.778   1.489  -9.178
  517   1HG1  ILE  68          1HG1      ILE  68   4.104   1.704  -6.258
  518   2HG1  ILE  68          2HG1      ILE  68   2.917   0.536  -6.772
  519   1HG2  ILE  68          1HG2      ILE  68   3.761   3.984  -7.504
  520   2HG2  ILE  68          2HG2      ILE  68   5.242   3.117  -7.903
  521   3HG2  ILE  68          3HG2      ILE  68   4.229   3.715  -9.181
  522   1HD1  ILE  68          1HD1      ILE  68   5.462   0.401  -8.204
  523   2HD1  ILE  68          2HD1      ILE  68   5.527   0.032  -6.492
  524   3HD1  ILE  68          3HD1      ILE  68   4.444  -0.870  -7.528
  525    H    THR  69           H        THR  69   0.438   3.773  -7.023
  526    HA   THR  69           HA       THR  69   1.236   6.240  -8.283
  527    HB   THR  69           HB       THR  69  -1.450   5.006  -8.902
  528    HG1  THR  69           HG1      THR  69  -0.088   4.567 -10.520
  529   1HG2  THR  69          1HG2      THR  69  -0.679   7.906  -9.003
  530   2HG2  THR  69          2HG2      THR  69  -1.865   7.217 -10.116
  531   3HG2  THR  69          3HG2      THR  69  -2.135   7.135  -8.388

  No H/Q in entry =         531
  Start of MODEL   13
    1    H    SER   1           H        SER   1  14.033   9.395  -5.133
    2    HA   SER   1           HA       SER   1  14.942   9.903  -7.278
    3   1HB   SER   1          1HB       SER   1  16.935   9.989  -5.846
    4   2HB   SER   1          2HB       SER   1  17.278   8.282  -6.147
    5    HG   SER   1           HG       SER   1  17.502   8.771  -8.366
    6    H    ARG   2           H        ARG   2  13.109   8.341  -8.023
    7    HA   ARG   2           HA       ARG   2  12.173   6.860  -9.454
    8   1HB   ARG   2          1HB       ARG   2  14.687   7.706 -10.836
    9   2HB   ARG   2          2HB       ARG   2  13.866   6.310 -11.481
   10   1HG   ARG   2          1HG       ARG   2  11.851   8.233 -11.077
   11   2HG   ARG   2          2HG       ARG   2  13.242   9.107 -11.711
   12   1HD   ARG   2          1HD       ARG   2  12.667   8.442 -13.722
   13   2HD   ARG   2          2HD       ARG   2  13.095   6.794 -13.303
   14    HE   ARG   2           HE       ARG   2  10.452   7.946 -13.548
   15   1HH1  ARG   2          1HH1      ARG   2  12.319   5.271 -12.229
   16   2HH1  ARG   2          2HH1      ARG   2  10.961   4.231 -12.131
   17   1HH2  ARG   2          1HH2      ARG   2   8.668   6.535 -13.406
   18   2HH2  ARG   2          2HH2      ARG   2   8.892   4.925 -12.808
   19    H    ARG   3           H        ARG   3  12.275   5.285  -7.746
   20    HA   ARG   3           HA       ARG   3  13.462   2.840  -8.610
   21   1HB   ARG   3          1HB       ARG   3  14.942   4.466  -6.735
   22   2HB   ARG   3          2HB       ARG   3  14.453   2.981  -5.951
   23   1HG   ARG   3          1HG       ARG   3  15.509   2.452  -8.601
   24   2HG   ARG   3          2HG       ARG   3  16.608   3.471  -7.681
   25   1HD   ARG   3          1HD       ARG   3  15.622   1.328  -5.998
   26   2HD   ARG   3          2HD       ARG   3  16.263   0.698  -7.504
   27    HE   ARG   3           HE       ARG   3  18.356   1.249  -6.838
   28   1HH1  ARG   3          1HH1      ARG   3  16.078   3.003  -4.817
   29   2HH1  ARG   3          2HH1      ARG   3  17.292   3.619  -3.788
   30   1HH2  ARG   3          1HH2      ARG   3  19.953   2.066  -5.422
   31   2HH2  ARG   3          2HH2      ARG   3  19.486   3.082  -4.099
   32    H    CYS   4           H        CYS   4  11.626   1.711  -8.422
   33    HA   CYS   4           HA       CYS   4  10.249   1.799  -5.829
   34   1HB   CYS   4          1HB       CYS   4   9.233   2.124  -8.525
   35   2HB   CYS   4          2HB       CYS   4   8.364   0.878  -7.642
   36   1HB   PRO   5          1HB       PRO   5  11.696  -2.845  -3.588
   37   2HB   PRO   5          2HB       PRO   5   9.972  -2.676  -3.257
   38   1HG   PRO   5          1HG       PRO   5  10.646  -0.727  -2.262
   39   2HG   PRO   5          2HG       PRO   5  12.120  -0.640  -3.218
   40   1HD   PRO   5          1HD       PRO   5  10.927   1.015  -4.253
   41   2HD   PRO   5          2HD       PRO   5   9.363   0.247  -3.914
   42    H    GLY   6           H        GLY   6  10.271  -4.595  -5.699
   43   1HA   GLY   6          1HA       GLY   6   8.548  -5.963  -6.295
   44   2HA   GLY   6          2HA       GLY   6   7.510  -4.869  -5.439
   45    H    LYS   7           H        LYS   7   6.380  -6.051  -7.489
   46    HA   LYS   7           HA       LYS   7   6.757  -4.977 -10.041
   47   1HB   LYS   7          1HB       LYS   7   5.415  -6.984  -9.460
   48   2HB   LYS   7          2HB       LYS   7   4.169  -5.946  -8.847
   49   1HG   LYS   7          1HG       LYS   7   3.707  -5.043 -10.979
   50   2HG   LYS   7          2HG       LYS   7   5.163  -5.767 -11.664
   51   1HD   LYS   7          1HD       LYS   7   3.435  -7.788 -10.456
   52   2HD   LYS   7          2HD       LYS   7   2.571  -6.824 -11.652
   53   1HE   LYS   7          1HE       LYS   7   4.314  -7.291 -13.302
   54   2HE   LYS   7          2HE       LYS   7   5.189  -8.250 -12.106
   55   1HZ   LYS   7          1HZ       LYS   7   3.244  -9.739 -11.992
   56   2HZ   LYS   7          2HZ       LYS   7   2.500  -8.838 -13.222
   57   3HZ   LYS   7          3HZ       LYS   7   3.931  -9.679 -13.538
   58    H    ASN   8           H        ASN   8   5.859  -3.228 -11.143
   59    HA   ASN   8           HA       ASN   8   4.917  -1.055  -9.411
   60   1HB   ASN   8          1HB       ASN   8   6.459  -1.224 -11.925
   61   2HB   ASN   8          2HB       ASN   8   5.374   0.154 -11.786
   62   2HD2  ASN   8          2HD2      ASN   8   6.100   1.886 -10.742
   63   1HD2  ASN   8          1HD2      ASN   8   7.485   1.911  -9.726
   64    H    ALA   9           H        ALA   9   3.807  -3.039 -12.049
   65    HA   ALA   9           HA       ALA   9   1.202  -1.727 -11.855
   66   1HB   ALA   9          1HB       ALA   9   2.601  -2.243 -14.466
   67   2HB   ALA   9          2HB       ALA   9   0.952  -1.640 -14.271
   68   3HB   ALA   9          3HB       ALA   9   2.319  -0.659 -13.744
   69    H    TRP  10           H        TRP  10  -0.417  -3.149 -11.751
   70    HA   TRP  10           HA       TRP  10   0.223  -5.962 -12.407
   71   1HB   TRP  10          1HB       TRP  10  -1.631  -4.773 -10.359
   72   2HB   TRP  10          2HB       TRP  10  -1.639  -6.456 -10.824
   73    HD1  TRP  10           HD1      TRP  10   0.264  -8.021  -9.898
   74    HE1  TRP  10           HE1      TRP  10   2.112  -7.673  -8.144
   75    HE3  TRP  10           HE3      TRP  10  -0.027  -2.966  -9.373
   76    HZ2  TRP  10           HZ2      TRP  10   3.277  -5.531  -6.737
   77    HZ3  TRP  10           HZ3      TRP  10   1.475  -1.830  -7.816
   78    HH2  TRP  10           HH2      TRP  10   3.100  -3.089  -6.501
   79   1HB   PRO  11          1HB       PRO  11  -1.844  -6.122 -17.532
   80   2HB   PRO  11          2HB       PRO  11  -1.431  -4.430 -17.256
   81   1HG   PRO  11          1HG       PRO  11   0.666  -5.365 -17.024
   82   2HG   PRO  11          2HG       PRO  11   0.020  -6.889 -16.386
   83   1HD   PRO  11          1HD       PRO  11   0.729  -5.944 -14.417
   84   2HD   PRO  11          2HD       PRO  11   0.471  -4.285 -15.000
   85    H    GLU  12           H        GLU  12  -1.562  -7.687 -14.760
   86    HA   GLU  12           HA       GLU  12  -3.664  -9.253 -15.788
   87   1HB   GLU  12          1HB       GLU  12  -1.445 -10.127 -15.187
   88   2HB   GLU  12          2HB       GLU  12  -2.760 -11.050 -14.474
   89   1HG   GLU  12          1HG       GLU  12  -2.217  -9.232 -12.484
   90   2HG   GLU  12          2HG       GLU  12  -1.636 -10.888 -12.580
   91    H    LEU  13           H        LEU  13  -3.669  -7.119 -13.125
   92    HA   LEU  13           HA       LEU  13  -5.632  -8.581 -11.605
   93   1HB   LEU  13          1HB       LEU  13  -4.411  -5.849 -11.329
   94   2HB   LEU  13          2HB       LEU  13  -5.711  -6.392 -10.291
   95    HG   LEU  13           HG       LEU  13  -2.961  -7.609 -10.494
   96   1HD1  LEU  13          1HD1      LEU  13  -3.443  -5.391  -9.207
   97   2HD1  LEU  13          2HD1      LEU  13  -4.134  -6.460  -8.005
   98   3HD1  LEU  13          3HD1      LEU  13  -2.451  -6.654  -8.489
   99   1HD2  LEU  13          1HD2      LEU  13  -5.439  -8.792  -9.638
  100   2HD2  LEU  13          2HD2      LEU  13  -3.825  -9.484  -9.723
  101   3HD2  LEU  13          3HD2      LEU  13  -4.361  -8.626  -8.307
  102    H    VAL  14           H        VAL  14  -5.601  -6.298 -14.172
  103    HA   VAL  14           HA       VAL  14  -8.038  -4.999 -13.805
  104    HB   VAL  14           HB       VAL  14  -6.858  -5.867 -16.457
  105   1HG1  VAL  14          1HG1      VAL  14  -8.886  -3.767 -15.694
  106   2HG1  VAL  14          2HG1      VAL  14  -8.034  -3.764 -17.248
  107   3HG1  VAL  14          3HG1      VAL  14  -9.080  -5.123 -16.818
  108   1HG2  VAL  14          1HG2      VAL  14  -5.312  -4.538 -14.892
  109   2HG2  VAL  14          2HG2      VAL  14  -5.599  -3.906 -16.499
  110   3HG2  VAL  14          3HG2      VAL  14  -6.444  -3.209 -15.120
  111    H    GLY  15           H        GLY  15  -9.991  -5.910 -13.492
  112   1HA   GLY  15          1HA       GLY  15 -11.839  -7.049 -14.540
  113   2HA   GLY  15          2HA       GLY  15 -10.732  -8.268 -15.143
  114    H    LYS  16           H        LYS  16  -9.512  -7.807 -12.202
  115    HA   LYS  16           HA       LYS  16 -11.140  -9.965 -11.048
  116   1HB   LYS  16          1HB       LYS  16  -8.321  -9.251 -11.005
  117   2HB   LYS  16          2HB       LYS  16  -8.929  -9.455  -9.374
  118   1HG   LYS  16          1HG       LYS  16  -9.405 -11.493 -11.536
  119   2HG   LYS  16          2HG       LYS  16  -7.940 -11.465 -10.566
  120   1HD   LYS  16          1HD       LYS  16  -8.947 -12.520  -8.917
  121   2HD   LYS  16          2HD       LYS  16 -10.146 -11.254  -8.760
  122   1HE   LYS  16          1HE       LYS  16 -10.819 -12.857 -11.035
  123   2HE   LYS  16          2HE       LYS  16 -10.414 -13.929  -9.700
  124   1HZ   LYS  16          1HZ       LYS  16 -12.371 -11.698  -9.530
  125   2HZ   LYS  16          2HZ       LYS  16 -12.766 -13.326  -9.782
  126   3HZ   LYS  16          3HZ       LYS  16 -12.034 -12.850  -8.326
  127    H    SER  17           H        SER  17 -11.607  -9.883  -8.725
  128    HA   SER  17           HA       SER  17 -13.034  -7.590  -8.026
  129   1HB   SER  17          1HB       SER  17 -13.523  -8.651  -6.000
  130   2HB   SER  17          2HB       SER  17 -13.212 -10.005  -7.086
  131    HG   SER  17           HG       SER  17 -12.081 -10.320  -5.172
  132    H    GLY  18           H        GLY  18 -12.614  -5.843  -6.692
  133   1HA   GLY  18          1HA       GLY  18 -10.092  -4.729  -6.611
  134   2HA   GLY  18          2HA       GLY  18 -11.388  -4.309  -5.521
  135    H    ASN  19           H        ASN  19 -11.536  -6.994  -4.356
  136    HA   ASN  19           HA       ASN  19  -9.576  -6.637  -2.320
  137   1HB   ASN  19          1HB       ASN  19 -11.980  -8.127  -2.638
  138   2HB   ASN  19          2HB       ASN  19 -10.725  -9.301  -2.265
  139   2HD2  ASN  19          2HD2      ASN  19  -9.494  -9.004  -0.312
  140   1HD2  ASN  19          1HD2      ASN  19 -10.207  -8.154   1.011
  141    H    MET  20           H        MET  20  -9.985  -9.034  -4.924
  142    HA   MET  20           HA       MET  20  -7.681 -10.540  -4.283
  143   1HB   MET  20          1HB       MET  20  -9.635 -11.104  -5.878
  144   2HB   MET  20          2HB       MET  20  -8.744 -10.211  -7.099
  145   1HG   MET  20          1HG       MET  20  -7.353 -12.368  -5.549
  146   2HG   MET  20          2HG       MET  20  -8.502 -12.812  -6.805
  147   1HE   MET  20          1HE       MET  20  -5.140 -12.639  -6.024
  148   2HE   MET  20          2HE       MET  20  -5.452 -13.835  -7.282
  149   3HE   MET  20          3HE       MET  20  -4.313 -12.524  -7.579
  150    H    ALA  21           H        ALA  21  -8.202  -7.633  -6.190
  151    HA   ALA  21           HA       ALA  21  -5.689  -7.540  -7.425
  152   1HB   ALA  21          1HB       ALA  21  -7.685  -5.408  -6.790
  153   2HB   ALA  21          2HB       ALA  21  -6.195  -5.083  -7.684
  154   3HB   ALA  21          3HB       ALA  21  -7.384  -6.211  -8.329
  155    H    ALA  22           H        ALA  22  -6.888  -5.654  -4.644
  156    HA   ALA  22           HA       ALA  22  -4.481  -4.502  -3.909
  157   1HB   ALA  22          1HB       ALA  22  -5.525  -4.644  -1.500
  158   2HB   ALA  22          2HB       ALA  22  -6.269  -3.655  -2.746
  159   3HB   ALA  22          3HB       ALA  22  -6.937  -5.243  -2.376
  160    H    ALA  23           H        ALA  23  -5.805  -7.656  -3.047
  161    HA   ALA  23           HA       ALA  23  -3.832  -8.459  -1.228
  162   1HB   ALA  23          1HB       ALA  23  -5.953  -9.646  -1.562
  163   2HB   ALA  23          2HB       ALA  23  -4.570 -10.731  -1.701
  164   3HB   ALA  23          3HB       ALA  23  -5.408 -10.177  -3.153
  165    H    THR  24           H        THR  24  -4.049  -8.911  -4.755
  166    HA   THR  24           HA       THR  24  -1.650 -10.333  -5.068
  167    HB   THR  24           HB       THR  24  -2.829  -8.407  -7.076
  168    HG1  THR  24           HG1      THR  24  -3.663 -10.980  -6.286
  169   1HG2  THR  24          1HG2      THR  24  -1.217 -10.926  -7.395
  170   2HG2  THR  24          2HG2      THR  24  -2.041 -10.091  -8.712
  171   3HG2  THR  24          3HG2      THR  24  -0.743  -9.281  -7.834
  172    H    VAL  25           H        VAL  25  -2.300  -6.845  -5.065
  173    HA   VAL  25           HA       VAL  25   0.326  -6.057  -5.796
  174    HB   VAL  25           HB       VAL  25  -1.720  -4.508  -4.193
  175   1HG1  VAL  25          1HG1      VAL  25   0.986  -3.864  -4.963
  176   2HG1  VAL  25          2HG1      VAL  25  -0.146  -2.773  -5.742
  177   3HG1  VAL  25          3HG1      VAL  25  -0.160  -2.951  -3.994
  178   1HG2  VAL  25          1HG2      VAL  25  -2.588  -5.253  -6.370
  179   2HG2  VAL  25          2HG2      VAL  25  -2.379  -3.513  -6.310
  180   3HG2  VAL  25          3HG2      VAL  25  -1.215  -4.517  -7.160
  181    H    GLU  26           H        GLU  26  -1.269  -6.045  -2.597
  182    HA   GLU  26           HA       GLU  26   1.094  -5.413  -1.180
  183   1HB   GLU  26          1HB       GLU  26  -1.486  -6.707  -0.301
  184   2HB   GLU  26          2HB       GLU  26  -0.217  -6.215   0.818
  185   1HG   GLU  26          1HG       GLU  26  -0.713  -4.053   0.678
  186   2HG   GLU  26          2HG       GLU  26  -1.066  -4.105  -1.050
  187    H    ARG  27           H        ARG  27  -0.062  -8.430  -2.472
  188    HA   ARG  27           HA       ARG  27   1.630 -10.016  -0.721
  189   1HB   ARG  27          1HB       ARG  27  -0.670 -10.644  -1.888
  190   2HB   ARG  27          2HB       ARG  27   0.376 -11.165  -3.188
  191   1HG   ARG  27          1HG       ARG  27   0.471 -13.092  -2.095
  192   2HG   ARG  27          2HG       ARG  27   1.572 -12.288  -0.979
  193   1HD   ARG  27          1HD       ARG  27   0.004 -13.203   0.413
  194   2HD   ARG  27          2HD       ARG  27  -0.580 -11.548   0.264
  195    HE   ARG  27           HE       ARG  27  -1.989 -12.699  -1.662
  196   1HH1  ARG  27          1HH1      ARG  27  -1.373 -13.829   1.617
  197   2HH1  ARG  27          2HH1      ARG  27  -2.843 -14.717   1.693
  198   1HH2  ARG  27          1HH2      ARG  27  -3.933 -13.871  -1.512
  199   2HH2  ARG  27          2HH2      ARG  27  -4.285 -14.768  -0.072
  200    H    GLU  28           H        GLU  28   1.471  -9.407  -4.254
  201    HA   GLU  28           HA       GLU  28   3.970 -10.653  -4.786
  202   1HB   GLU  28          1HB       GLU  28   2.137  -8.859  -6.327
  203   2HB   GLU  28          2HB       GLU  28   3.780  -9.029  -6.901
  204   1HG   GLU  28          1HG       GLU  28   3.396 -11.538  -6.820
  205   2HG   GLU  28          2HG       GLU  28   1.687 -11.156  -6.612
  206    H    ASN  29           H        ASN  29   3.044  -7.385  -3.889
  207    HA   ASN  29           HA       ASN  29   5.913  -6.689  -3.711
  208   1HB   ASN  29          1HB       ASN  29   4.913  -5.527  -5.601
  209   2HB   ASN  29          2HB       ASN  29   3.626  -4.897  -4.573
  210   2HD2  ASN  29          2HD2      ASN  29   5.412  -3.350  -6.154
  211   1HD2  ASN  29          1HD2      ASN  29   6.344  -2.382  -5.069
  212    H    ARG  30           H        ARG  30   5.620  -7.539  -1.547
  213    HA   ARG  30           HA       ARG  30   3.866  -6.415   0.340
  214   1HB   ARG  30          1HB       ARG  30   6.018  -8.310   0.322
  215   2HB   ARG  30          2HB       ARG  30   6.293  -7.196   1.646
  216   1HG   ARG  30          1HG       ARG  30   4.586  -7.962   2.849
  217   2HG   ARG  30          2HG       ARG  30   3.525  -8.180   1.467
  218   1HD   ARG  30          1HD       ARG  30   4.797 -10.184   0.849
  219   2HD   ARG  30          2HD       ARG  30   5.770 -10.000   2.302
  220    HE   ARG  30           HE       ARG  30   3.533 -10.160   3.522
  221   1HH1  ARG  30          1HH1      ARG  30   4.242 -11.884   0.528
  222   2HH1  ARG  30          2HH1      ARG  30   3.130 -13.146   0.877
  223   1HH2  ARG  30          1HH2      ARG  30   2.065 -11.851   3.934
  224   2HH2  ARG  30          2HH2      ARG  30   1.881 -13.129   2.780
  225    H    ASN  31           H        ASN  31   6.265  -4.769  -1.283
  226    HA   ASN  31           HA       ASN  31   7.068  -3.134   0.978
  227   1HB   ASN  31          1HB       ASN  31   8.736  -3.753  -0.699
  228   2HB   ASN  31          2HB       ASN  31   7.799  -2.954  -1.951
  229   2HD2  ASN  31          2HD2      ASN  31   7.706  -0.688  -2.003
  230   1HD2  ASN  31          1HD2      ASN  31   8.838   0.271  -1.118
  231    H    VAL  32           H        VAL  32   4.371  -3.246  -0.959
  232    HA   VAL  32           HA       VAL  32   3.822  -0.412  -0.466
  233    HB   VAL  32           HB       VAL  32   2.940  -0.053  -2.668
  234   1HG1  VAL  32          1HG1      VAL  32   5.348   0.331  -2.382
  235   2HG1  VAL  32          2HG1      VAL  32   5.671  -1.335  -2.870
  236   3HG1  VAL  32          3HG1      VAL  32   4.983  -0.209  -4.016
  237   1HG2  VAL  32          1HG2      VAL  32   3.444  -2.970  -3.052
  238   2HG2  VAL  32          2HG2      VAL  32   1.988  -2.046  -3.356
  239   3HG2  VAL  32          3HG2      VAL  32   3.367  -1.891  -4.438
  240    H    HIS  33           H        HIS  33   1.458   0.075  -0.894
  241    HA   HIS  33           HA       HIS  33  -0.240  -2.242  -0.317
  242   1HB   HIS  33          1HB       HIS  33  -0.928  -1.494   1.672
  243   2HB   HIS  33          2HB       HIS  33   0.475  -0.442   1.641
  244    HD1  HIS  33           HD1      HIS  33  -3.222  -0.433   1.481
  245    HD2  HIS  33           HD2      HIS  33  -0.103   2.278   1.120
  246    HE1  HIS  33           HE1      HIS  33  -4.281   1.838   1.620
  247    HE2  HIS  33           HE2      HIS  33  -2.369   3.465   1.417
  248    H    ALA  34           H        ALA  34  -2.291  -2.208  -1.188
  249    HA   ALA  34           HA       ALA  34  -2.732  -0.038  -3.129
  250   1HB   ALA  34          1HB       ALA  34  -4.127  -2.672  -3.242
  251   2HB   ALA  34          2HB       ALA  34  -2.477  -2.497  -3.837
  252   3HB   ALA  34          3HB       ALA  34  -3.768  -1.528  -4.531
  253    H    ILE  35           H        ILE  35  -4.538   1.147  -3.146
  254    HA   ILE  35           HA       ILE  35  -6.443   0.739  -0.936
  255    HB   ILE  35           HB       ILE  35  -6.158   3.183  -2.687
  256   1HG1  ILE  35          1HG1      ILE  35  -5.049   2.900   0.089
  257   2HG1  ILE  35          2HG1      ILE  35  -4.055   2.539  -1.312
  258   1HG2  ILE  35          1HG2      ILE  35  -8.315   2.867  -1.469
  259   2HG2  ILE  35          2HG2      ILE  35  -7.396   2.846   0.053
  260   3HG2  ILE  35          3HG2      ILE  35  -7.403   4.299  -0.970
  261   1HD1  ILE  35          1HD1      ILE  35  -5.410   5.169  -0.802
  262   2HD1  ILE  35          2HD1      ILE  35  -3.737   4.798  -0.412
  263   3HD1  ILE  35          3HD1      ILE  35  -4.277   4.783  -2.085
  264    H    VAL  36           H        VAL  36  -8.145  -0.457  -1.553
  265    HA   VAL  36           HA       VAL  36  -9.084  -0.480  -4.277
  266    HB   VAL  36           HB       VAL  36 -10.320  -1.742  -1.840
  267   1HG1  VAL  36          1HG1      VAL  36 -10.741  -2.218  -4.791
  268   2HG1  VAL  36          2HG1      VAL  36 -11.362  -3.255  -3.513
  269   3HG1  VAL  36          3HG1      VAL  36 -11.914  -1.591  -3.639
  270   1HG2  VAL  36          1HG2      VAL  36  -8.358  -2.881  -3.824
  271   2HG2  VAL  36          2HG2      VAL  36  -8.059  -2.554  -2.123
  272   3HG2  VAL  36          3HG2      VAL  36  -9.205  -3.803  -2.588
  273    H    LEU  37           H        LEU  37 -10.422   0.918  -5.117
  274    HA   LEU  37           HA       LEU  37 -12.626   2.015  -3.539
  275   1HB   LEU  37          1HB       LEU  37 -11.967   4.291  -4.585
  276   2HB   LEU  37          2HB       LEU  37 -11.227   3.762  -3.106
  277    HG   LEU  37           HG       LEU  37  -9.319   2.859  -4.617
  278   1HD1  LEU  37          1HD1      LEU  37 -10.792   4.653  -6.528
  279   2HD1  LEU  37          2HD1      LEU  37  -9.069   4.304  -6.685
  280   3HD1  LEU  37          3HD1      LEU  37 -10.238   3.005  -6.744
  281   1HD2  LEU  37          1HD2      LEU  37  -9.878   5.595  -3.680
  282   2HD2  LEU  37          2HD2      LEU  37  -8.520   4.513  -3.364
  283   3HD2  LEU  37          3HD2      LEU  37  -8.582   5.435  -4.862
  284    H    LYS  38           H        LYS  38 -14.220   3.085  -4.900
  285    HA   LYS  38           HA       LYS  38 -14.398   1.752  -7.486
  286   1HB   LYS  38          1HB       LYS  38 -16.321   1.652  -6.023
  287   2HB   LYS  38          2HB       LYS  38 -16.711   2.505  -7.509
  288   1HG   LYS  38          1HG       LYS  38 -16.354   3.561  -4.734
  289   2HG   LYS  38          2HG       LYS  38 -16.165   4.644  -6.099
  290   1HD   LYS  38          1HD       LYS  38 -18.353   4.948  -6.079
  291   2HD   LYS  38          2HD       LYS  38 -18.535   3.303  -6.683
  292   1HE   LYS  38          1HE       LYS  38 -19.906   3.712  -4.697
  293   2HE   LYS  38          2HE       LYS  38 -18.695   2.463  -4.412
  294   1HZ   LYS  38          1HZ       LYS  38 -18.052   5.248  -3.691
  295   2HZ   LYS  38          2HZ       LYS  38 -19.079   4.352  -2.688
  296   3HZ   LYS  38          3HZ       LYS  38 -17.516   3.796  -3.000
  297    H    GLU  39           H        GLU  39 -15.190   2.904  -9.373
  298    HA   GLU  39           HA       GLU  39 -13.557   4.920 -10.254
  299   1HB   GLU  39          1HB       GLU  39 -15.295   3.430 -11.504
  300   2HB   GLU  39          2HB       GLU  39 -16.399   4.762 -11.218
  301   1HG   GLU  39          1HG       GLU  39 -15.655   5.581 -13.135
  302   2HG   GLU  39          2HG       GLU  39 -14.214   6.069 -12.247
  303    H    GLY  40           H        GLY  40 -13.309   7.021  -9.792
  304   1HA   GLY  40          1HA       GLY  40 -14.175   9.215  -9.616
  305   2HA   GLY  40          2HA       GLY  40 -15.682   8.585  -8.981
  306    H    SER  41           H        SER  41 -13.463   6.839  -7.358
  307    HA   SER  41           HA       SER  41 -13.825   8.267  -4.940
  308   1HB   SER  41          1HB       SER  41 -13.501   5.841  -4.980
  309   2HB   SER  41          2HB       SER  41 -11.880   6.066  -5.626
  310    HG   SER  41           HG       SER  41 -12.854   6.719  -3.058
  311    H    ALA  42           H        ALA  42 -11.406   8.239  -3.642
  312    HA   ALA  42           HA       ALA  42 -10.226  10.668  -4.559
  313   1HB   ALA  42          1HB       ALA  42  -8.713  10.390  -2.644
  314   2HB   ALA  42          2HB       ALA  42  -9.358   8.763  -2.381
  315   3HB   ALA  42          3HB       ALA  42 -10.406  10.170  -2.193
  316    H    MET  43           H        MET  43  -9.297  10.378  -6.563
  317    HA   MET  43           HA       MET  43  -7.001   8.539  -6.636
  318   1HB   MET  43          1HB       MET  43  -8.985   7.882  -8.050
  319   2HB   MET  43          2HB       MET  43  -8.649   9.289  -9.046
  320   1HG   MET  43          1HG       MET  43  -6.519   7.272  -8.462
  321   2HG   MET  43          2HG       MET  43  -7.723   6.964  -9.689
  322   1HE   MET  43          1HE       MET  43  -7.134   7.201 -11.942
  323   2HE   MET  43          2HE       MET  43  -5.761   8.108 -12.579
  324   3HE   MET  43          3HE       MET  43  -5.491   6.771 -11.462
  325    H    THR  44           H        THR  44  -5.515  10.021  -6.055
  326    HA   THR  44           HA       THR  44  -5.295  12.542  -7.434
  327    HB   THR  44           HB       THR  44  -3.492  13.022  -5.986
  328    HG1  THR  44           HG1      THR  44  -3.401  10.263  -5.395
  329   1HG2  THR  44          1HG2      THR  44  -5.700  12.843  -4.826
  330   2HG2  THR  44          2HG2      THR  44  -5.216  11.228  -4.304
  331   3HG2  THR  44          3HG2      THR  44  -4.288  12.635  -3.791
  332    H    LYS  45           H        LYS  45  -3.533  13.157  -8.736
  333    HA   LYS  45           HA       LYS  45  -2.613  11.055 -10.506
  334   1HB   LYS  45          1HB       LYS  45  -2.491  14.044 -10.453
  335   2HB   LYS  45          2HB       LYS  45  -1.350  13.182 -11.475
  336   1HG   LYS  45          1HG       LYS  45  -3.068  12.199 -12.756
  337   2HG   LYS  45          2HG       LYS  45  -4.322  12.737 -11.636
  338   1HD   LYS  45          1HD       LYS  45  -2.525  14.706 -13.057
  339   2HD   LYS  45          2HD       LYS  45  -3.961  14.041 -13.830
  340   1HE   LYS  45          1HE       LYS  45  -5.328  15.353 -12.681
  341   2HE   LYS  45          2HE       LYS  45  -4.559  14.974 -11.141
  342   1HZ   LYS  45          1HZ       LYS  45  -2.842  16.616 -11.657
  343   2HZ   LYS  45          2HZ       LYS  45  -3.630  17.000 -13.108
  344   3HZ   LYS  45          3HZ       LYS  45  -4.385  17.310 -11.628
  345    H    ASP  46           H        ASP  46  -1.368  12.856  -7.819
  346    HA   ASP  46           HA       ASP  46   1.336  12.839  -8.169
  347   1HB   ASP  46          1HB       ASP  46  -0.485  12.743  -5.851
  348   2HB   ASP  46          2HB       ASP  46   1.100  12.066  -5.509
  349    H    PHE  47           H        PHE  47   3.029  11.400  -7.331
  350    HA   PHE  47           HA       PHE  47   2.336   8.585  -7.898
  351   1HB   PHE  47          1HB       PHE  47   3.988   9.536  -9.380
  352   2HB   PHE  47          2HB       PHE  47   4.980  10.033  -8.013
  353    HD1  PHE  47           HD1      PHE  47   6.415   8.484  -6.902
  354    HD2  PHE  47           HD2      PHE  47   3.710   7.140  -9.908
  355    HE1  PHE  47           HE1      PHE  47   7.531   6.296  -6.930
  356    HE2  PHE  47           HE2      PHE  47   4.830   4.965  -9.944
  357    HZ   PHE  47           HZ       PHE  47   6.729   4.540  -8.463
  358    H    ARG  48           H        ARG  48   2.562   7.038  -6.416
  359    HA   ARG  48           HA       ARG  48   4.212   7.467  -4.032
  360   1HB   ARG  48          1HB       ARG  48   1.240   7.006  -3.976
  361   2HB   ARG  48          2HB       ARG  48   2.274   6.651  -2.613
  362   1HG   ARG  48          1HG       ARG  48   3.023   9.127  -2.864
  363   2HG   ARG  48          2HG       ARG  48   1.562   9.290  -3.844
  364   1HD   ARG  48          1HD       ARG  48   1.153   9.907  -1.531
  365   2HD   ARG  48          2HD       ARG  48   0.213   8.517  -1.998
  366    HE   ARG  48           HE       ARG  48   1.691   7.098  -0.761
  367   1HH1  ARG  48          1HH1      ARG  48   2.069  10.543  -0.119
  368   2HH1  ARG  48          2HH1      ARG  48   2.829  10.273   1.398
  369   1HH2  ARG  48          1HH2      ARG  48   2.742   6.791   1.225
  370   2HH2  ARG  48          2HH2      ARG  48   3.183   8.164   2.186
  371    H    CYS  49           H        CYS  49   5.489   5.753  -4.085
  372    HA   CYS  49           HA       CYS  49   5.022   3.365  -5.404
  373   1HB   CYS  49          1HB       CYS  49   7.189   4.421  -4.274
  374   2HB   CYS  49          2HB       CYS  49   6.768   3.304  -2.986
  375    H    ASP  50           H        ASP  50   4.595   4.058  -1.948
  376    HA   ASP  50           HA       ASP  50   3.633   1.405  -1.429
  377   1HB   ASP  50          1HB       ASP  50   3.193   2.217   0.850
  378   2HB   ASP  50          2HB       ASP  50   4.832   2.556   0.304
  379    H    ARG  51           H        ARG  51   2.148   3.815  -3.076
  380    HA   ARG  51           HA       ARG  51  -0.484   3.044  -2.036
  381   1HB   ARG  51          1HB       ARG  51   0.307   5.497  -1.724
  382   2HB   ARG  51          2HB       ARG  51   0.019   5.633  -3.451
  383   1HG   ARG  51          1HG       ARG  51  -2.322   4.666  -2.906
  384   2HG   ARG  51          2HG       ARG  51  -1.918   5.141  -1.254
  385   1HD   ARG  51          1HD       ARG  51  -1.467   7.425  -2.079
  386   2HD   ARG  51          2HD       ARG  51  -3.142   6.926  -2.249
  387    HE   ARG  51           HE       ARG  51  -2.197   6.298  -4.662
  388   1HH1  ARG  51          1HH1      ARG  51  -1.829   9.234  -2.754
  389   2HH1  ARG  51          2HH1      ARG  51  -1.655  10.235  -4.140
  390   1HH2  ARG  51          1HH2      ARG  51  -2.064   7.678  -6.465
  391   2HH2  ARG  51          2HH2      ARG  51  -1.771   9.359  -6.250
  392    H    VAL  52           H        VAL  52  -1.347   1.657  -3.398
  393    HA   VAL  52           HA       VAL  52  -1.042   2.127  -6.307
  394    HB   VAL  52           HB       VAL  52  -1.651  -0.448  -4.856
  395   1HG1  VAL  52          1HG1      VAL  52  -1.479   0.208  -7.777
  396   2HG1  VAL  52          2HG1      VAL  52  -1.320  -1.435  -7.164
  397   3HG1  VAL  52          3HG1      VAL  52  -2.812  -0.539  -6.908
  398   1HG2  VAL  52          1HG2      VAL  52   0.818   0.799  -5.340
  399   2HG2  VAL  52          2HG2      VAL  52   0.519  -0.834  -4.780
  400   3HG2  VAL  52          3HG2      VAL  52   0.696  -0.513  -6.496
  401    H    TRP  53           H        TRP  53  -2.823   2.901  -7.263
  402    HA   TRP  53           HA       TRP  53  -5.309   3.002  -5.827
  403   1HB   TRP  53          1HB       TRP  53  -4.441   3.908  -8.559
  404   2HB   TRP  53          2HB       TRP  53  -6.135   3.960  -8.104
  405    HD1  TRP  53           HD1      TRP  53  -3.999   6.445  -8.760
  406    HE1  TRP  53           HE1      TRP  53  -4.077   8.440  -7.136
  407    HE3  TRP  53           HE3      TRP  53  -6.186   4.151  -4.762
  408    HZ2  TRP  53           HZ2      TRP  53  -4.910   8.947  -4.477
  409    HZ3  TRP  53           HZ3      TRP  53  -6.581   5.446  -2.725
  410    HH2  TRP  53           HH2      TRP  53  -5.962   7.802  -2.584
  411    H    VAL  54           H        VAL  54  -6.981   1.637  -5.927
  412    HA   VAL  54           HA       VAL  54  -7.011  -0.341  -8.138
  413    HB   VAL  54           HB       VAL  54  -7.607  -0.704  -5.213
  414   1HG1  VAL  54          1HG1      VAL  54  -8.296  -2.493  -7.530
  415   2HG1  VAL  54          2HG1      VAL  54  -8.207  -3.072  -5.869
  416   3HG1  VAL  54          3HG1      VAL  54  -9.399  -1.864  -6.307
  417   1HG2  VAL  54          1HG2      VAL  54  -5.255  -0.892  -6.002
  418   2HG2  VAL  54          2HG2      VAL  54  -5.906  -2.348  -5.243
  419   3HG2  VAL  54          3HG2      VAL  54  -5.770  -2.255  -7.003
  420    H    ILE  55           H        ILE  55  -8.337   1.173  -9.265
  421    HA   ILE  55           HA       ILE  55 -10.882   1.936  -8.178
  422    HB   ILE  55           HB       ILE  55  -9.973   2.169 -11.022
  423   1HG1  ILE  55          1HG1      ILE  55  -9.851   4.420  -9.032
  424   2HG1  ILE  55          2HG1      ILE  55  -8.526   3.276  -9.103
  425   1HG2  ILE  55          1HG2      ILE  55 -12.166   3.497  -9.450
  426   2HG2  ILE  55          2HG2      ILE  55 -11.589   4.090 -11.007
  427   3HG2  ILE  55          3HG2      ILE  55 -12.316   2.490 -10.893
  428   1HD1  ILE  55          1HD1      ILE  55  -8.499   3.804 -11.628
  429   2HD1  ILE  55          2HD1      ILE  55  -9.417   5.227 -11.151
  430   3HD1  ILE  55          3HD1      ILE  55  -7.816   4.942 -10.476
  431    H    VAL  56           H        VAL  56 -12.729   0.871  -8.283
  432    HA   VAL  56           HA       VAL  56 -12.968  -1.325 -10.216
  433    HB   VAL  56           HB       VAL  56 -14.327  -2.520  -8.552
  434   1HG1  VAL  56          1HG1      VAL  56 -11.479  -2.101  -8.414
  435   2HG1  VAL  56          2HG1      VAL  56 -12.125  -2.465  -6.821
  436   3HG1  VAL  56          3HG1      VAL  56 -12.416  -3.565  -8.155
  437   1HG2  VAL  56          1HG2      VAL  56 -15.053  -0.509  -7.275
  438   2HG2  VAL  56          2HG2      VAL  56 -14.454  -1.821  -6.267
  439   3HG2  VAL  56          3HG2      VAL  56 -13.427  -0.430  -6.594
  440    H    ASN  57           H        ASN  57 -15.152  -1.909 -10.788
  441    HA   ASN  57           HA       ASN  57 -16.768   0.475 -11.229
  442   1HB   ASN  57          1HB       ASN  57 -18.108  -0.992 -12.696
  443   2HB   ASN  57          2HB       ASN  57 -16.397  -1.072 -13.073
  444   2HD2  ASN  57          2HD2      ASN  57 -17.038  -3.079 -14.149
  445   1HD2  ASN  57          1HD2      ASN  57 -17.162  -4.517 -13.202
  446    H    ASP  58           H        ASP  58 -19.322  -0.384 -11.271
  447    HA   ASP  58           HA       ASP  58 -20.125  -0.216  -8.609
  448   1HB   ASP  58          1HB       ASP  58 -21.585  -1.149 -11.088
  449   2HB   ASP  58          2HB       ASP  58 -22.386  -0.945  -9.530
  450    H    HIS  59           H        HIS  59 -19.127  -2.993 -10.424
  451    HA   HIS  59           HA       HIS  59 -20.392  -4.854  -8.563
  452   1HB   HIS  59          1HB       HIS  59 -18.870  -5.218 -11.145
  453   2HB   HIS  59          2HB       HIS  59 -19.369  -6.569 -10.129
  454    HD1  HIS  59           HD1      HIS  59 -20.599  -4.258 -12.697
  455    HD2  HIS  59           HD2      HIS  59 -22.216  -6.882  -9.910
  456    HE1  HIS  59           HE1      HIS  59 -22.984  -4.614 -13.413
  457    HE2  HIS  59           HE2      HIS  59 -23.964  -6.144 -11.666
  458    H    GLY  60           H        GLY  60 -17.823  -3.014  -8.134
  459   1HA   GLY  60          1HA       GLY  60 -15.982  -3.213  -6.824
  460   2HA   GLY  60          2HA       GLY  60 -16.568  -4.794  -6.333
  461    H    VAL  61           H        VAL  61 -16.077  -4.100  -9.713
  462    HA   VAL  61           HA       VAL  61 -13.887  -6.056  -9.774
  463    HB   VAL  61           HB       VAL  61 -15.407  -4.862 -12.091
  464   1HG1  VAL  61          1HG1      VAL  61 -13.233  -5.758 -12.698
  465   2HG1  VAL  61          2HG1      VAL  61 -13.636  -7.283 -11.905
  466   3HG1  VAL  61          3HG1      VAL  61 -14.528  -6.764 -13.336
  467   1HG2  VAL  61          1HG2      VAL  61 -16.924  -6.100 -10.592
  468   2HG2  VAL  61          2HG2      VAL  61 -16.720  -6.900 -12.147
  469   3HG2  VAL  61          3HG2      VAL  61 -15.871  -7.503 -10.725
  470    H    VAL  62           H        VAL  62 -11.839  -5.498 -10.448
  471    HA   VAL  62           HA       VAL  62 -11.197  -2.705 -10.413
  472    HB   VAL  62           HB       VAL  62  -9.375  -5.022 -11.066
  473   1HG1  VAL  62          1HG1      VAL  62  -8.792  -2.162 -10.261
  474   2HG1  VAL  62          2HG1      VAL  62  -7.614  -3.455 -10.381
  475   3HG1  VAL  62          3HG1      VAL  62  -8.447  -2.921 -11.815
  476   1HG2  VAL  62          1HG2      VAL  62 -10.461  -5.201  -8.828
  477   2HG2  VAL  62          2HG2      VAL  62  -8.745  -4.948  -8.756
  478   3HG2  VAL  62          3HG2      VAL  62  -9.823  -3.619  -8.438
  479    H    THR  63           H        THR  63 -11.454  -1.402 -12.072
  480    HA   THR  63           HA       THR  63 -11.442  -2.461 -14.810
  481    HB   THR  63           HB       THR  63 -12.454  -0.385 -15.439
  482    HG1  THR  63           HG1      THR  63 -11.544   1.201 -14.299
  483   1HG2  THR  63          1HG2      THR  63 -13.981  -1.982 -14.374
  484   2HG2  THR  63          2HG2      THR  63 -13.672  -1.212 -12.811
  485   3HG2  THR  63          3HG2      THR  63 -14.461  -0.302 -14.104
  486    H    SER  64           H        SER  64  -9.674  -0.245 -12.703
  487    HA   SER  64           HA       SER  64  -7.909   0.514 -14.912
  488   1HB   SER  64          1HB       SER  64  -8.745   1.746 -12.449
  489   2HB   SER  64          2HB       SER  64  -6.994   1.676 -12.502
  490    HG   SER  64           HG       SER  64  -8.785   3.019 -14.172
  491    H    VAL  65           H        VAL  65  -5.782   0.031 -15.016
  492    HA   VAL  65           HA       VAL  65  -4.884  -2.415 -13.967
  493    HB   VAL  65           HB       VAL  65  -3.112  -0.208 -14.995
  494   1HG1  VAL  65          1HG1      VAL  65  -2.711  -3.004 -14.269
  495   2HG1  VAL  65          2HG1      VAL  65  -2.138  -2.626 -15.893
  496   3HG1  VAL  65          3HG1      VAL  65  -1.554  -1.709 -14.516
  497   1HG2  VAL  65          1HG2      VAL  65  -5.090  -1.867 -16.421
  498   2HG2  VAL  65          2HG2      VAL  65  -4.421  -0.295 -16.799
  499   3HG2  VAL  65          3HG2      VAL  65  -3.506  -1.747 -17.173
  500   1HB   PRO  66          1HB       PRO  66  -3.019  -3.476  -9.413
  501   2HB   PRO  66          2HB       PRO  66  -4.129  -2.506  -8.462
  502   1HG   PRO  66          1HG       PRO  66  -5.016  -4.486  -9.991
  503   2HG   PRO  66          2HG       PRO  66  -5.920  -3.028  -9.739
  504   1HD   PRO  66          1HD       PRO  66  -5.877  -2.963 -12.030
  505   2HD   PRO  66          2HD       PRO  66  -4.378  -3.859 -12.130
  506    H    HIS  67           H        HIS  67  -2.264   0.584 -10.492
  507    HA   HIS  67           HA       HIS  67   0.380  -0.705 -10.437
  508   1HB   HIS  67          1HB       HIS  67  -0.118  -0.065 -12.739
  509   2HB   HIS  67          2HB       HIS  67   1.183   0.923 -12.088
  510    HD1  HIS  67           HD1      HIS  67   0.249   2.377 -14.272
  511    HD2  HIS  67           HD2      HIS  67  -2.054   2.392 -10.817
  512    HE1  HIS  67           HE1      HIS  67  -1.220   4.411 -14.433
  513    HE2  HIS  67           HE2      HIS  67  -2.669   4.332 -12.375
  514    H    ILE  68           H        ILE  68   1.967   0.310  -9.364
  515    HA   ILE  68           HA       ILE  68   1.477   1.780  -7.139
  516    HB   ILE  68           HB       ILE  68   3.839   1.176  -8.786
  517   1HG1  ILE  68          1HG1      ILE  68   4.310   1.443  -5.954
  518   2HG1  ILE  68          2HG1      ILE  68   2.830   0.555  -6.210
  519   1HG2  ILE  68          1HG2      ILE  68   3.837   3.728  -7.197
  520   2HG2  ILE  68          2HG2      ILE  68   5.292   2.794  -7.499
  521   3HG2  ILE  68          3HG2      ILE  68   4.371   3.392  -8.843
  522   1HD1  ILE  68          1HD1      ILE  68   5.452  -0.130  -7.497
  523   2HD1  ILE  68          2HD1      ILE  68   4.855  -0.832  -5.996
  524   3HD1  ILE  68          3HD1      ILE  68   3.961  -1.074  -7.489
  525    H    THR  69           H        THR  69   0.381   3.614  -6.966
  526    HA   THR  69           HA       THR  69   1.339   6.017  -8.264
  527    HB   THR  69           HB       THR  69  -1.343   4.811  -8.962
  528    HG1  THR  69           HG1      THR  69   0.823   5.767 -10.555
  529   1HG2  THR  69          1HG2      THR  69  -0.435   7.652  -9.339
  530   2HG2  THR  69          2HG2      THR  69  -1.717   6.900 -10.283
  531   3HG2  THR  69          3HG2      THR  69  -1.894   7.073  -8.544

  No H/Q in entry =         531
  Start of MODEL   14
    1    H    SER   1           H        SER   1  16.036  11.086  -7.265
    2    HA   SER   1           HA       SER   1  16.270   8.224  -7.294
    3   1HB   SER   1          1HB       SER   1  15.986   8.348  -4.846
    4   2HB   SER   1          2HB       SER   1  17.017   9.645  -5.421
    5    HG   SER   1           HG       SER   1  14.200   9.972  -5.005
    6    H    ARG   2           H        ARG   2  14.785   6.752  -7.978
    7    HA   ARG   2           HA       ARG   2  12.057   6.576  -7.099
    8   1HB   ARG   2          1HB       ARG   2  12.615   8.326  -9.249
    9   2HB   ARG   2          2HB       ARG   2  11.900   6.924  -9.992
   10   1HG   ARG   2          1HG       ARG   2   9.883   7.512  -9.368
   11   2HG   ARG   2          2HG       ARG   2  10.348   7.592  -7.675
   12   1HD   ARG   2          1HD       ARG   2  11.430   9.918  -8.752
   13   2HD   ARG   2          2HD       ARG   2   9.989   9.758  -7.786
   14    HE   ARG   2           HE       ARG   2   8.677  10.017  -9.632
   15   1HH1  ARG   2          1HH1      ARG   2  12.038   9.753 -10.617
   16   2HH1  ARG   2          2HH1      ARG   2  11.734  10.270 -12.221
   17   1HH2  ARG   2          1HH2      ARG   2   8.291  10.696 -11.772
   18   2HH2  ARG   2          2HH2      ARG   2   9.607  10.808 -12.893
   19    H    ARG   3           H        ARG   3  13.354   4.570  -6.649
   20    HA   ARG   3           HA       ARG   3  12.759   2.627  -8.769
   21   1HB   ARG   3          1HB       ARG   3  15.462   2.980  -7.454
   22   2HB   ARG   3          2HB       ARG   3  14.997   1.510  -8.304
   23   1HG   ARG   3          1HG       ARG   3  15.198   4.268  -9.498
   24   2HG   ARG   3          2HG       ARG   3  16.337   2.939  -9.714
   25   1HD   ARG   3          1HD       ARG   3  14.028   1.731 -10.452
   26   2HD   ARG   3          2HD       ARG   3  13.684   3.373 -10.935
   27    HE   ARG   3           HE       ARG   3  15.823   1.639 -11.947
   28   1HH1  ARG   3          1HH1      ARG   3  14.058   4.669 -12.185
   29   2HH1  ARG   3          2HH1      ARG   3  14.675   5.042 -13.743
   30   1HH2  ARG   3          1HH2      ARG   3  16.640   2.159 -14.012
   31   2HH2  ARG   3          2HH2      ARG   3  16.147   3.631 -14.781
   32    H    CYS   4           H        CYS   4  11.021   2.263  -7.297
   33    HA   CYS   4           HA       CYS   4  11.632   1.150  -4.697
   34   1HB   CYS   4          1HB       CYS   4   9.138   0.836  -4.549
   35   2HB   CYS   4          2HB       CYS   4   9.682   2.487  -4.807
   36   1HB   PRO   5          1HB       PRO   5  10.971  -4.303  -3.620
   37   2HB   PRO   5          2HB       PRO   5  12.511  -3.463  -3.802
   38   1HG   PRO   5          1HG       PRO   5   9.999  -2.518  -2.553
   39   2HG   PRO   5          2HG       PRO   5  11.648  -2.361  -1.943
   40   1HD   PRO   5          1HD       PRO   5  10.318  -0.343  -3.218
   41   2HD   PRO   5          2HD       PRO   5  12.075  -0.530  -3.280
   42    H    GLY   6           H        GLY   6  10.229  -5.184  -5.488
   43   1HA   GLY   6          1HA       GLY   6   8.256  -6.229  -5.944
   44   2HA   GLY   6          2HA       GLY   6   7.453  -4.851  -5.249
   45    H    LYS   7           H        LYS   7   6.019  -5.783  -7.107
   46    HA   LYS   7           HA       LYS   7   6.753  -4.946  -9.768
   47   1HB   LYS   7          1HB       LYS   7   5.340  -6.916  -9.149
   48   2HB   LYS   7          2HB       LYS   7   4.072  -5.823  -8.759
   49   1HG   LYS   7          1HG       LYS   7   3.781  -5.101 -10.942
   50   2HG   LYS   7          2HG       LYS   7   5.324  -5.777 -11.464
   51   1HD   LYS   7          1HD       LYS   7   2.888  -7.327 -10.604
   52   2HD   LYS   7          2HD       LYS   7   3.454  -7.128 -12.253
   53   1HE   LYS   7          1HE       LYS   7   5.626  -8.132 -10.668
   54   2HE   LYS   7          2HE       LYS   7   4.189  -9.095 -10.340
   55   1HZ   LYS   7          1HZ       LYS   7   3.953  -9.469 -12.702
   56   2HZ   LYS   7          2HZ       LYS   7   5.315  -8.518 -13.027
   57   3HZ   LYS   7          3HZ       LYS   7   5.482  -9.970 -12.175
   58    H    ASN   8           H        ASN   8   5.719  -3.302 -11.009
   59    HA   ASN   8           HA       ASN   8   4.687  -1.067  -9.356
   60   1HB   ASN   8          1HB       ASN   8   6.051  -0.975 -12.051
   61   2HB   ASN   8          2HB       ASN   8   5.545   0.411 -11.086
   62   2HD2  ASN   8          2HD2      ASN   8   8.034   0.558 -11.737
   63   1HD2  ASN   8          1HD2      ASN   8   9.086   0.082 -10.453
   64    H    ALA   9           H        ALA   9   3.710  -3.285 -11.767
   65    HA   ALA   9           HA       ALA   9   1.187  -1.886 -12.044
   66   1HB   ALA   9          1HB       ALA   9   2.844  -2.589 -14.455
   67   2HB   ALA   9          2HB       ALA   9   1.198  -1.955 -14.479
   68   3HB   ALA   9          3HB       ALA   9   2.520  -0.957 -13.870
   69    H    TRP  10           H        TRP  10  -0.436  -3.300 -11.971
   70    HA   TRP  10           HA       TRP  10   0.189  -6.149 -12.497
   71   1HB   TRP  10          1HB       TRP  10  -1.690  -4.867 -10.521
   72   2HB   TRP  10          2HB       TRP  10  -1.709  -6.574 -10.918
   73    HD1  TRP  10           HD1      TRP  10   0.191  -8.107  -9.910
   74    HE1  TRP  10           HE1      TRP  10   1.999  -7.705  -8.123
   75    HE3  TRP  10           HE3      TRP  10  -0.109  -3.033  -9.556
   76    HZ2  TRP  10           HZ2      TRP  10   3.126  -5.519  -6.741
   77    HZ3  TRP  10           HZ3      TRP  10   1.352  -1.848  -7.995
   78    HH2  TRP  10           HH2      TRP  10   2.947  -3.071  -6.604
   79   1HB   PRO  11          1HB       PRO  11  -1.814  -6.278 -17.661
   80   2HB   PRO  11          2HB       PRO  11  -1.431  -4.578 -17.393
   81   1HG   PRO  11          1HG       PRO  11   0.059  -7.006 -16.497
   82   2HG   PRO  11          2HG       PRO  11   0.684  -5.477 -17.140
   83   1HD   PRO  11          1HD       PRO  11   0.741  -6.039 -14.532
   84   2HD   PRO  11          2HD       PRO  11   0.448  -4.386 -15.112
   85    H    GLU  12           H        GLU  12  -1.563  -7.821 -14.847
   86    HA   GLU  12           HA       GLU  12  -3.635  -9.417 -15.895
   87   1HB   GLU  12          1HB       GLU  12  -1.456 -10.317 -15.281
   88   2HB   GLU  12          2HB       GLU  12  -2.757 -11.181 -14.476
   89   1HG   GLU  12          1HG       GLU  12  -2.127  -9.238 -12.623
   90   2HG   GLU  12          2HG       GLU  12  -1.595 -10.914 -12.620
   91    H    LEU  13           H        LEU  13  -3.672  -7.266 -13.237
   92    HA   LEU  13           HA       LEU  13  -5.657  -8.708 -11.730
   93   1HB   LEU  13          1HB       LEU  13  -4.427  -5.980 -11.493
   94   2HB   LEU  13          2HB       LEU  13  -5.808  -6.431 -10.520
   95    HG   LEU  13           HG       LEU  13  -3.066  -7.680 -10.463
   96   1HD1  LEU  13          1HD1      LEU  13  -4.612  -5.911  -8.630
   97   2HD1  LEU  13          2HD1      LEU  13  -3.375  -6.958  -7.992
   98   3HD1  LEU  13          3HD1      LEU  13  -2.987  -5.745  -9.175
   99   1HD2  LEU  13          1HD2      LEU  13  -5.674  -8.617  -9.358
  100   2HD2  LEU  13          2HD2      LEU  13  -4.381  -9.520 -10.140
  101   3HD2  LEU  13          3HD2      LEU  13  -4.193  -8.948  -8.507
  102    H    VAL  14           H        VAL  14  -5.604  -6.489 -14.356
  103    HA   VAL  14           HA       VAL  14  -8.067  -5.217 -14.075
  104    HB   VAL  14           HB       VAL  14  -6.794  -6.129 -16.666
  105   1HG1  VAL  14          1HG1      VAL  14  -8.839  -3.984 -16.070
  106   2HG1  VAL  14          2HG1      VAL  14  -8.010  -4.169 -17.618
  107   3HG1  VAL  14          3HG1      VAL  14  -9.068  -5.443 -17.035
  108   1HG2  VAL  14          1HG2      VAL  14  -5.279  -4.759 -15.189
  109   2HG2  VAL  14          2HG2      VAL  14  -5.671  -4.058 -16.743
  110   3HG2  VAL  14          3HG2      VAL  14  -6.469  -3.471 -15.290
  111    H    GLY  15           H        GLY  15 -10.000  -6.165 -13.760
  112   1HA   GLY  15          1HA       GLY  15 -11.814  -7.352 -14.818
  113   2HA   GLY  15          2HA       GLY  15 -10.675  -8.556 -15.391
  114    H    LYS  16           H        LYS  16  -9.503  -8.025 -12.440
  115    HA   LYS  16           HA       LYS  16 -11.073 -10.212 -11.291
  116   1HB   LYS  16          1HB       LYS  16  -8.295  -9.398 -11.196
  117   2HB   LYS  16          2HB       LYS  16  -8.923  -9.582  -9.572
  118   1HG   LYS  16          1HG       LYS  16  -9.465 -11.729 -11.589
  119   2HG   LYS  16          2HG       LYS  16  -7.846 -11.570 -10.912
  120   1HD   LYS  16          1HD       LYS  16  -8.468 -12.601  -9.069
  121   2HD   LYS  16          2HD       LYS  16  -9.704 -11.399  -8.736
  122   1HE   LYS  16          1HE       LYS  16 -10.079 -13.746 -10.599
  123   2HE   LYS  16          2HE       LYS  16 -10.490 -13.773  -8.886
  124   1HZ   LYS  16          1HZ       LYS  16 -12.011 -11.888  -9.300
  125   2HZ   LYS  16          2HZ       LYS  16 -11.663 -12.004 -10.950
  126   3HZ   LYS  16          3HZ       LYS  16 -12.430 -13.278 -10.165
  127    H    SER  17           H        SER  17 -11.270 -10.074  -8.803
  128    HA   SER  17           HA       SER  17 -12.954  -7.858  -8.243
  129   1HB   SER  17          1HB       SER  17 -13.408  -8.884  -6.194
  130   2HB   SER  17          2HB       SER  17 -13.032 -10.247  -7.247
  131    HG   SER  17           HG       SER  17 -11.915 -10.456  -5.305
  132    H    GLY  18           H        GLY  18 -12.641  -6.065  -6.947
  133   1HA   GLY  18          1HA       GLY  18 -10.170  -4.819  -6.873
  134   2HA   GLY  18          2HA       GLY  18 -11.504  -4.434  -5.821
  135    H    ASN  19           H        ASN  19 -11.567  -7.075  -4.580
  136    HA   ASN  19           HA       ASN  19  -9.665  -6.575  -2.510
  137   1HB   ASN  19          1HB       ASN  19 -10.542  -8.596  -1.480
  138   2HB   ASN  19          2HB       ASN  19 -11.344  -9.055  -2.982
  139   2HD2  ASN  19          2HD2      ASN  19 -13.283  -8.110  -3.529
  140   1HD2  ASN  19          1HD2      ASN  19 -14.127  -7.046  -2.466
  141    H    MET  20           H        MET  20  -9.972  -9.042  -5.052
  142    HA   MET  20           HA       MET  20  -7.659 -10.499  -4.354
  143   1HB   MET  20          1HB       MET  20  -9.651 -10.834  -6.181
  144   2HB   MET  20          2HB       MET  20  -8.357 -10.359  -7.247
  145   1HG   MET  20          1HG       MET  20  -8.333 -12.628  -5.267
  146   2HG   MET  20          2HG       MET  20  -8.534 -12.781  -7.001
  147   1HE   MET  20          1HE       MET  20  -6.723 -11.707  -8.663
  148   2HE   MET  20          2HE       MET  20  -6.204 -10.320  -7.744
  149   3HE   MET  20          3HE       MET  20  -5.033 -11.510  -8.271
  150    H    ALA  21           H        ALA  21  -8.188  -7.638  -6.323
  151    HA   ALA  21           HA       ALA  21  -5.626  -7.508  -7.473
  152   1HB   ALA  21          1HB       ALA  21  -7.781  -5.485  -7.002
  153   2HB   ALA  21          2HB       ALA  21  -7.222  -6.177  -8.524
  154   3HB   ALA  21          3HB       ALA  21  -6.211  -5.016  -7.678
  155    H    ALA  22           H        ALA  22  -6.974  -5.530  -4.831
  156    HA   ALA  22           HA       ALA  22  -4.633  -4.357  -4.004
  157   1HB   ALA  22          1HB       ALA  22  -5.843  -4.495  -1.636
  158   2HB   ALA  22          2HB       ALA  22  -6.395  -3.441  -2.931
  159   3HB   ALA  22          3HB       ALA  22  -7.199  -4.989  -2.650
  160    H    ALA  23           H        ALA  23  -5.869  -7.559  -3.261
  161    HA   ALA  23           HA       ALA  23  -3.998  -8.201  -1.233
  162   1HB   ALA  23          1HB       ALA  23  -4.780 -10.412  -1.422
  163   2HB   ALA  23          2HB       ALA  23  -6.158  -9.402  -1.777
  164   3HB   ALA  23          3HB       ALA  23  -5.294 -10.194  -3.093
  165    H    THR  24           H        THR  24  -4.055  -8.781  -4.744
  166    HA   THR  24           HA       THR  24  -1.656 -10.224  -4.913
  167    HB   THR  24           HB       THR  24  -2.831  -8.374  -6.984
  168    HG1  THR  24           HG1      THR  24  -3.376 -11.117  -6.460
  169   1HG2  THR  24          1HG2      THR  24  -0.990 -10.725  -7.248
  170   2HG2  THR  24          2HG2      THR  24  -1.837  -9.974  -8.600
  171   3HG2  THR  24          3HG2      THR  24  -0.650  -9.048  -7.680
  172    H    VAL  25           H        VAL  25  -2.268  -6.735  -5.029
  173    HA   VAL  25           HA       VAL  25   0.395  -5.995  -5.674
  174    HB   VAL  25           HB       VAL  25  -1.585  -4.303  -4.140
  175   1HG1  VAL  25          1HG1      VAL  25   1.059  -3.833  -5.087
  176   2HG1  VAL  25          2HG1      VAL  25  -0.052  -2.859  -6.036
  177   3HG1  VAL  25          3HG1      VAL  25  -0.040  -2.722  -4.294
  178   1HG2  VAL  25          1HG2      VAL  25  -1.461  -4.978  -7.066
  179   2HG2  VAL  25          2HG2      VAL  25  -2.842  -4.926  -5.980
  180   3HG2  VAL  25          3HG2      VAL  25  -2.110  -3.434  -6.510
  181    H    GLU  26           H        GLU  26  -1.346  -6.082  -2.556
  182    HA   GLU  26           HA       GLU  26   0.911  -5.287  -1.016
  183   1HB   GLU  26          1HB       GLU  26  -0.386  -5.915   0.912
  184   2HB   GLU  26          2HB       GLU  26  -1.493  -6.858  -0.079
  185   1HG   GLU  26          1HG       GLU  26  -1.428  -4.189  -1.116
  186   2HG   GLU  26          2HG       GLU  26  -2.765  -5.106  -0.432
  187    H    ARG  27           H        ARG  27  -0.247  -8.426  -2.126
  188    HA   ARG  27           HA       ARG  27   1.534  -9.899  -0.389
  189   1HB   ARG  27          1HB       ARG  27  -0.598 -10.552  -2.291
  190   2HB   ARG  27          2HB       ARG  27   0.766 -11.607  -2.471
  191   1HG   ARG  27          1HG       ARG  27  -0.284 -12.792  -0.916
  192   2HG   ARG  27          2HG       ARG  27   0.566 -11.717   0.190
  193   1HD   ARG  27          1HD       ARG  27  -1.644 -11.690   0.951
  194   2HD   ARG  27          2HD       ARG  27  -1.496 -10.209   0.026
  195    HE   ARG  27           HE       ARG  27  -2.901 -11.050  -1.581
  196   1HH1  ARG  27          1HH1      ARG  27  -2.150 -13.578   0.728
  197   2HH1  ARG  27          2HH1      ARG  27  -3.404 -14.612   0.167
  198   1HH2  ARG  27          1HH2      ARG  27  -4.567 -12.441  -2.306
  199   2HH2  ARG  27          2HH2      ARG  27  -4.766 -13.987  -1.552
  200    H    GLU  28           H        GLU  28   1.407  -9.237  -3.889
  201    HA   GLU  28           HA       GLU  28   3.903 -10.488  -4.443
  202   1HB   GLU  28          1HB       GLU  28   2.341  -8.425  -6.011
  203   2HB   GLU  28          2HB       GLU  28   3.764  -9.260  -6.608
  204   1HG   GLU  28          1HG       GLU  28   2.387 -11.414  -6.000
  205   2HG   GLU  28          2HG       GLU  28   1.019 -10.321  -6.138
  206    H    ASN  29           H        ASN  29   2.952  -7.163  -3.671
  207    HA   ASN  29           HA       ASN  29   5.824  -6.453  -3.539
  208   1HB   ASN  29          1HB       ASN  29   4.604  -5.296  -5.332
  209   2HB   ASN  29          2HB       ASN  29   3.500  -4.620  -4.154
  210   2HD2  ASN  29          2HD2      ASN  29   5.315  -3.247  -5.999
  211   1HD2  ASN  29          1HD2      ASN  29   6.373  -2.320  -4.997
  212    H    ARG  30           H        ARG  30   5.805  -7.260  -1.374
  213    HA   ARG  30           HA       ARG  30   4.129  -6.259   0.651
  214   1HB   ARG  30          1HB       ARG  30   6.332  -8.051   0.463
  215   2HB   ARG  30          2HB       ARG  30   6.760  -6.879   1.693
  216   1HG   ARG  30          1HG       ARG  30   4.090  -7.604   2.240
  217   2HG   ARG  30          2HG       ARG  30   4.924  -9.091   1.790
  218   1HD   ARG  30          1HD       ARG  30   6.761  -8.267   3.433
  219   2HD   ARG  30          2HD       ARG  30   5.514  -7.183   4.011
  220    HE   ARG  30           HE       ARG  30   4.221  -9.010   4.741
  221   1HH1  ARG  30          1HH1      ARG  30   7.397  -9.978   3.559
  222   2HH1  ARG  30          2HH1      ARG  30   7.357 -11.486   4.378
  223   1HH2  ARG  30          1HH2      ARG  30   4.201 -11.039   5.803
  224   2HH2  ARG  30          2HH2      ARG  30   5.562 -12.096   5.631
  225    H    ASN  31           H        ASN  31   6.386  -4.532  -1.153
  226    HA   ASN  31           HA       ASN  31   7.117  -2.747   1.039
  227   1HB   ASN  31          1HB       ASN  31   8.838  -3.505  -0.574
  228   2HB   ASN  31          2HB       ASN  31   7.958  -2.700  -1.866
  229   2HD2  ASN  31          2HD2      ASN  31   8.173  -0.514  -2.126
  230   1HD2  ASN  31          1HD2      ASN  31   9.198   0.457  -1.134
  231    H    VAL  32           H        VAL  32   4.424  -3.057  -0.739
  232    HA   VAL  32           HA       VAL  32   3.893  -0.183  -0.632
  233    HB   VAL  32           HB       VAL  32   3.003  -0.063  -2.841
  234   1HG1  VAL  32          1HG1      VAL  32   5.424   0.279  -2.642
  235   2HG1  VAL  32          2HG1      VAL  32   5.692  -1.414  -2.942
  236   3HG1  VAL  32          3HG1      VAL  32   5.005  -0.425  -4.200
  237   1HG2  VAL  32          1HG2      VAL  32   3.350  -3.014  -2.827
  238   2HG2  VAL  32          2HG2      VAL  32   1.991  -2.057  -3.359
  239   3HG2  VAL  32          3HG2      VAL  32   3.424  -2.169  -4.368
  240    H    HIS  33           H        HIS  33   1.525   0.254  -1.072
  241    HA   HIS  33           HA       HIS  33  -0.141  -1.994  -0.176
  242   1HB   HIS  33          1HB       HIS  33  -0.949  -0.919   1.660
  243   2HB   HIS  33          2HB       HIS  33   0.584  -0.086   1.579
  244    HD1  HIS  33           HD1      HIS  33  -2.665   0.712   2.313
  245    HD2  HIS  33           HD2      HIS  33   0.011   2.319  -0.394
  246    HE1  HIS  33           HE1      HIS  33  -3.486   3.043   1.850
  247    HE2  HIS  33           HE2      HIS  33  -1.701   4.055   0.402
  248    H    ALA  34           H        ALA  34  -2.127  -2.162  -1.097
  249    HA   ALA  34           HA       ALA  34  -2.730  -0.218  -3.213
  250   1HB   ALA  34          1HB       ALA  34  -4.174  -2.135  -4.098
  251   2HB   ALA  34          2HB       ALA  34  -2.418  -2.301  -4.201
  252   3HB   ALA  34          3HB       ALA  34  -3.306  -3.134  -2.933
  253    H    ILE  35           H        ILE  35  -4.556   0.932  -3.179
  254    HA   ILE  35           HA       ILE  35  -6.475   0.406  -0.992
  255    HB   ILE  35           HB       ILE  35  -6.184   2.934  -2.547
  256   1HG1  ILE  35          1HG1      ILE  35  -4.705   1.947  -0.150
  257   2HG1  ILE  35          2HG1      ILE  35  -5.101   3.661  -0.237
  258   1HG2  ILE  35          1HG2      ILE  35  -7.505   2.309   0.067
  259   2HG2  ILE  35          2HG2      ILE  35  -7.388   3.921  -0.636
  260   3HG2  ILE  35          3HG2      ILE  35  -8.328   2.673  -1.452
  261   1HD1  ILE  35          1HD1      ILE  35  -4.007   3.103  -2.730
  262   2HD1  ILE  35          2HD1      ILE  35  -3.278   3.920  -1.363
  263   3HD1  ILE  35          3HD1      ILE  35  -3.020   2.199  -1.576
  264    H    VAL  36           H        VAL  36  -8.250  -0.618  -1.640
  265    HA   VAL  36           HA       VAL  36  -9.092  -0.596  -4.395
  266    HB   VAL  36           HB       VAL  36 -10.450  -1.801  -1.995
  267   1HG1  VAL  36          1HG1      VAL  36 -10.831  -2.231  -4.959
  268   2HG1  VAL  36          2HG1      VAL  36 -11.523  -3.260  -3.709
  269   3HG1  VAL  36          3HG1      VAL  36 -12.005  -1.572  -3.819
  270   1HG2  VAL  36          1HG2      VAL  36  -8.483  -3.004  -3.944
  271   2HG2  VAL  36          2HG2      VAL  36  -8.249  -2.730  -2.213
  272   3HG2  VAL  36          3HG2      VAL  36  -9.430  -3.909  -2.761
  273    H    LEU  37           H        LEU  37 -10.316   0.902  -5.274
  274    HA   LEU  37           HA       LEU  37 -12.567   2.025  -3.792
  275   1HB   LEU  37          1HB       LEU  37 -11.805   4.319  -4.788
  276   2HB   LEU  37          2HB       LEU  37 -11.249   3.761  -3.241
  277    HG   LEU  37           HG       LEU  37  -9.274   2.792  -4.933
  278   1HD1  LEU  37          1HD1      LEU  37 -10.300   4.011  -6.820
  279   2HD1  LEU  37          2HD1      LEU  37 -10.026   5.518  -5.942
  280   3HD1  LEU  37          3HD1      LEU  37  -8.659   4.530  -6.436
  281   1HD2  LEU  37          1HD2      LEU  37  -9.540   4.750  -2.851
  282   2HD2  LEU  37          2HD2      LEU  37  -8.151   3.804  -3.355
  283   3HD2  LEU  37          3HD2      LEU  37  -8.463   5.358  -4.109
  284    H    LYS  38           H        LYS  38 -14.124   2.988  -5.176
  285    HA   LYS  38           HA       LYS  38 -14.165   1.766  -7.799
  286   1HB   LYS  38          1HB       LYS  38 -16.516   2.815  -7.874
  287   2HB   LYS  38          2HB       LYS  38 -16.213   1.463  -6.808
  288   1HG   LYS  38          1HG       LYS  38 -15.712   3.979  -5.417
  289   2HG   LYS  38          2HG       LYS  38 -17.280   3.974  -6.193
  290   1HD   LYS  38          1HD       LYS  38 -17.794   3.061  -4.169
  291   2HD   LYS  38          2HD       LYS  38 -17.576   1.613  -5.148
  292   1HE   LYS  38          1HE       LYS  38 -15.297   2.786  -3.556
  293   2HE   LYS  38          2HE       LYS  38 -16.489   1.729  -2.821
  294   1HZ   LYS  38          1HZ       LYS  38 -15.175   0.803  -5.275
  295   2HZ   LYS  38          2HZ       LYS  38 -14.338   0.747  -3.832
  296   3HZ   LYS  38          3HZ       LYS  38 -15.801  -0.070  -3.994
  297    H    GLU  39           H        GLU  39 -14.735   2.893  -9.723
  298    HA   GLU  39           HA       GLU  39 -13.151   5.055 -10.368
  299   1HB   GLU  39          1HB       GLU  39 -14.730   5.380 -12.321
  300   2HB   GLU  39          2HB       GLU  39 -14.040   3.775 -12.132
  301   1HG   GLU  39          1HG       GLU  39 -16.020   2.838 -11.393
  302   2HG   GLU  39          2HG       GLU  39 -16.732   4.387 -10.965
  303    H    GLY  40           H        GLY  40 -13.122   7.088  -9.686
  304   1HA   GLY  40          1HA       GLY  40 -14.218   9.224  -9.711
  305   2HA   GLY  40          2HA       GLY  40 -15.717   8.454  -9.231
  306    H    SER  41           H        SER  41 -13.516   6.885  -7.419
  307    HA   SER  41           HA       SER  41 -14.247   8.143  -5.016
  308   1HB   SER  41          1HB       SER  41 -13.513   5.823  -5.069
  309   2HB   SER  41          2HB       SER  41 -11.918   6.316  -5.626
  310    HG   SER  41           HG       SER  41 -12.275   5.896  -3.259
  311    H    ALA  42           H        ALA  42 -12.237   8.688  -3.433
  312    HA   ALA  42           HA       ALA  42 -11.099  11.128  -4.571
  313   1HB   ALA  42          1HB       ALA  42 -10.461  11.642  -2.284
  314   2HB   ALA  42          2HB       ALA  42 -12.166  11.210  -2.376
  315   3HB   ALA  42          3HB       ALA  42 -10.999  10.047  -1.750
  316    H    MET  43           H        MET  43  -9.471  10.408  -5.950
  317    HA   MET  43           HA       MET  43  -7.180   9.090  -4.618
  318   1HB   MET  43          1HB       MET  43  -6.670   8.161  -6.907
  319   2HB   MET  43          2HB       MET  43  -8.009   7.445  -6.047
  320   1HG   MET  43          1HG       MET  43  -9.507   8.069  -7.560
  321   2HG   MET  43          2HG       MET  43  -8.783   9.650  -7.817
  322   1HE   MET  43          1HE       MET  43  -7.997  10.341  -9.731
  323   2HE   MET  43          2HE       MET  43  -7.317   9.444 -11.090
  324   3HE   MET  43          3HE       MET  43  -9.054   9.409 -10.793
  325    H    THR  44           H        THR  44  -5.458  10.343  -4.559
  326    HA   THR  44           HA       THR  44  -5.315  12.780  -6.047
  327    HB   THR  44           HB       THR  44  -2.761  12.423  -5.145
  328    HG1  THR  44           HG1      THR  44  -2.918  11.305  -3.154
  329   1HG2  THR  44          1HG2      THR  44  -4.205  14.278  -4.525
  330   2HG2  THR  44          2HG2      THR  44  -5.067  13.238  -3.394
  331   3HG2  THR  44          3HG2      THR  44  -3.357  13.601  -3.135
  332    H    LYS  45           H        LYS  45  -3.641  13.330  -7.584
  333    HA   LYS  45           HA       LYS  45  -3.224  11.155  -9.491
  334   1HB   LYS  45          1HB       LYS  45  -3.105  14.137  -9.575
  335   2HB   LYS  45          2HB       LYS  45  -2.133  13.248 -10.738
  336   1HG   LYS  45          1HG       LYS  45  -4.228  13.798 -11.729
  337   2HG   LYS  45          2HG       LYS  45  -4.140  12.049 -11.491
  338   1HD   LYS  45          1HD       LYS  45  -5.507  12.260  -9.464
  339   2HD   LYS  45          2HD       LYS  45  -5.585  14.008  -9.696
  340   1HE   LYS  45          1HE       LYS  45  -6.422  12.867 -12.135
  341   2HE   LYS  45          2HE       LYS  45  -7.173  11.914 -10.870
  342   1HZ   LYS  45          1HZ       LYS  45  -7.334  14.864 -11.108
  343   2HZ   LYS  45          2HZ       LYS  45  -8.560  13.771 -11.520
  344   3HZ   LYS  45          3HZ       LYS  45  -8.075  13.926  -9.908
  345    H    ASP  46           H        ASP  46  -1.421  12.981  -7.161
  346    HA   ASP  46           HA       ASP  46   1.136  12.872  -8.096
  347   1HB   ASP  46          1HB       ASP  46   0.085  13.657  -5.774
  348   2HB   ASP  46          2HB       ASP  46   0.694  12.102  -5.222
  349    H    PHE  47           H        PHE  47   2.797  11.396  -8.163
  350    HA   PHE  47           HA       PHE  47   1.996   8.609  -8.258
  351   1HB   PHE  47          1HB       PHE  47   3.392   9.372 -10.030
  352   2HB   PHE  47          2HB       PHE  47   4.563  10.054  -8.909
  353    HD1  PHE  47           HD1      PHE  47   3.401   7.040 -10.567
  354    HD2  PHE  47           HD2      PHE  47   6.055   8.587  -7.614
  355    HE1  PHE  47           HE1      PHE  47   4.640   4.931 -10.575
  356    HE2  PHE  47           HE2      PHE  47   7.292   6.466  -7.613
  357    HZ   PHE  47           HZ       PHE  47   6.588   4.630  -9.095
  358    H    ARG  48           H        ARG  48   2.466   7.050  -6.798
  359    HA   ARG  48           HA       ARG  48   4.503   7.519  -4.742
  360   1HB   ARG  48          1HB       ARG  48   1.753   6.662  -3.920
  361   2HB   ARG  48          2HB       ARG  48   3.086   7.147  -2.896
  362   1HG   ARG  48          1HG       ARG  48   2.750   9.420  -4.240
  363   2HG   ARG  48          2HG       ARG  48   1.126   8.769  -4.432
  364   1HD   ARG  48          1HD       ARG  48   1.139  10.144  -2.530
  365   2HD   ARG  48          2HD       ARG  48   2.631   9.430  -1.915
  366    HE   ARG  48           HE       ARG  48   1.011   7.315  -1.912
  367   1HH1  ARG  48          1HH1      ARG  48   0.516  10.562  -0.705
  368   2HH1  ARG  48          2HH1      ARG  48  -0.564  10.049   0.533
  369   1HH2  ARG  48          1HH2      ARG  48  -0.422   6.651  -0.273
  370   2HH2  ARG  48          2HH2      ARG  48  -1.098   7.847   0.783
  371    H    CYS  49           H        CYS  49   5.758   5.798  -4.867
  372    HA   CYS  49           HA       CYS  49   5.085   3.375  -6.068
  373   1HB   CYS  49          1HB       CYS  49   7.346   4.390  -4.456
  374   2HB   CYS  49          2HB       CYS  49   7.175   2.644  -4.489
  375    H    ASP  50           H        ASP  50   4.985   4.345  -2.693
  376    HA   ASP  50           HA       ASP  50   4.329   1.692  -1.769
  377   1HB   ASP  50          1HB       ASP  50   3.948   2.812   0.418
  378   2HB   ASP  50          2HB       ASP  50   5.531   3.134  -0.279
  379    H    ARG  51           H        ARG  51   2.524   3.822  -3.527
  380    HA   ARG  51           HA       ARG  51   0.040   2.908  -2.268
  381   1HB   ARG  51          1HB       ARG  51   0.621   5.374  -1.998
  382   2HB   ARG  51          2HB       ARG  51   0.335   5.518  -3.727
  383   1HG   ARG  51          1HG       ARG  51  -1.967   4.506  -3.249
  384   2HG   ARG  51          2HG       ARG  51  -1.590   4.826  -1.556
  385   1HD   ARG  51          1HD       ARG  51  -1.146   7.186  -2.241
  386   2HD   ARG  51          2HD       ARG  51  -2.807   6.690  -2.282
  387    HE   ARG  51           HE       ARG  51  -2.084   6.258  -4.806
  388   1HH1  ARG  51          1HH1      ARG  51  -1.527   9.045  -2.732
  389   2HH1  ARG  51          2HH1      ARG  51  -1.444  10.143  -4.048
  390   1HH2  ARG  51          1HH2      ARG  51  -2.025   7.775  -6.539
  391   2HH2  ARG  51          2HH2      ARG  51  -1.749   9.437  -6.176
  392    H    VAL  52           H        VAL  52  -1.311   1.849  -3.533
  393    HA   VAL  52           HA       VAL  52  -1.040   2.140  -6.466
  394    HB   VAL  52           HB       VAL  52  -1.574  -0.463  -5.024
  395   1HG1  VAL  52          1HG1      VAL  52  -1.360   0.295  -7.915
  396   2HG1  VAL  52          2HG1      VAL  52  -1.108  -1.358  -7.376
  397   3HG1  VAL  52          3HG1      VAL  52  -2.656  -0.566  -7.114
  398   1HG2  VAL  52          1HG2      VAL  52   0.942   0.771  -6.011
  399   2HG2  VAL  52          2HG2      VAL  52   0.645  -0.267  -4.633
  400   3HG2  VAL  52          3HG2      VAL  52   0.731  -0.956  -6.239
  401    H    TRP  53           H        TRP  53  -2.875   3.076  -7.148
  402    HA   TRP  53           HA       TRP  53  -5.310   2.855  -5.630
  403   1HB   TRP  53          1HB       TRP  53  -4.641   4.161  -8.260
  404   2HB   TRP  53          2HB       TRP  53  -6.289   4.111  -7.660
  405    HD1  TRP  53           HD1      TRP  53  -4.255   6.710  -8.149
  406    HE1  TRP  53           HE1      TRP  53  -4.198   8.460  -6.268
  407    HE3  TRP  53           HE3      TRP  53  -6.062   3.865  -4.341
  408    HZ2  TRP  53           HZ2      TRP  53  -4.762   8.588  -3.510
  409    HZ3  TRP  53           HZ3      TRP  53  -6.277   4.891  -2.121
  410    HH2  TRP  53           HH2      TRP  53  -5.659   7.187  -1.708
  411    H    VAL  54           H        VAL  54  -7.012   1.553  -5.959
  412    HA   VAL  54           HA       VAL  54  -6.916  -0.233  -8.325
  413    HB   VAL  54           HB       VAL  54  -7.734  -0.796  -5.485
  414   1HG1  VAL  54          1HG1      VAL  54  -8.377  -2.307  -7.992
  415   2HG1  VAL  54          2HG1      VAL  54  -8.180  -3.155  -6.459
  416   3HG1  VAL  54          3HG1      VAL  54  -9.422  -1.924  -6.626
  417   1HG2  VAL  54          1HG2      VAL  54  -5.354  -0.965  -5.985
  418   2HG2  VAL  54          2HG2      VAL  54  -6.051  -2.529  -5.575
  419   3HG2  VAL  54          3HG2      VAL  54  -5.711  -2.129  -7.259
  420    H    ILE  55           H        ILE  55  -8.238   1.094  -9.573
  421    HA   ILE  55           HA       ILE  55 -10.756   2.027  -8.559
  422    HB   ILE  55           HB       ILE  55  -9.922   1.995 -11.416
  423   1HG1  ILE  55          1HG1      ILE  55  -8.747   3.446  -9.222
  424   2HG1  ILE  55          2HG1      ILE  55  -9.591   4.572 -10.267
  425   1HG2  ILE  55          1HG2      ILE  55 -11.927   3.558  -9.897
  426   2HG2  ILE  55          2HG2      ILE  55 -11.439   3.969 -11.539
  427   3HG2  ILE  55          3HG2      ILE  55 -12.235   2.423 -11.205
  428   1HD1  ILE  55          1HD1      ILE  55  -8.336   3.726 -12.183
  429   2HD1  ILE  55          2HD1      ILE  55  -7.312   4.414 -10.929
  430   3HD1  ILE  55          3HD1      ILE  55  -7.431   2.663 -11.101
  431    H    VAL  56           H        VAL  56 -12.527   0.844  -8.404
  432    HA   VAL  56           HA       VAL  56 -12.875  -1.436 -10.216
  433    HB   VAL  56           HB       VAL  56 -14.209  -2.490  -8.470
  434   1HG1  VAL  56          1HG1      VAL  56 -11.466  -1.671  -7.529
  435   2HG1  VAL  56          2HG1      VAL  56 -12.411  -3.020  -6.908
  436   3HG1  VAL  56          3HG1      VAL  56 -11.855  -3.039  -8.568
  437   1HG2  VAL  56          1HG2      VAL  56 -15.037  -0.486  -7.332
  438   2HG2  VAL  56          2HG2      VAL  56 -14.265  -1.592  -6.199
  439   3HG2  VAL  56          3HG2      VAL  56 -13.411  -0.170  -6.756
  440    H    ASN  57           H        ASN  57 -15.118  -2.038 -10.669
  441    HA   ASN  57           HA       ASN  57 -16.636   0.330 -11.382
  442   1HB   ASN  57          1HB       ASN  57 -16.397  -1.535 -12.962
  443   2HB   ASN  57          2HB       ASN  57 -18.077  -1.210 -12.606
  444   2HD2  ASN  57          2HD2      ASN  57 -17.346  -3.583 -13.711
  445   1HD2  ASN  57          1HD2      ASN  57 -17.535  -4.852 -12.553
  446    H    ASP  58           H        ASP  58 -19.203  -0.276 -11.225
  447    HA   ASP  58           HA       ASP  58 -19.913   0.287  -8.591
  448   1HB   ASP  58          1HB       ASP  58 -22.249  -0.256  -9.337
  449   2HB   ASP  58          2HB       ASP  58 -21.387   0.859 -10.392
  450    H    HIS  59           H        HIS  59 -19.270  -2.778 -10.077
  451    HA   HIS  59           HA       HIS  59 -20.653  -4.265  -8.014
  452   1HB   HIS  59          1HB       HIS  59 -19.548  -4.831 -10.671
  453   2HB   HIS  59          2HB       HIS  59 -19.146  -6.083  -9.504
  454    HD1  HIS  59           HD1      HIS  59 -21.774  -6.081  -7.870
  455    HD2  HIS  59           HD2      HIS  59 -21.552  -6.091 -12.020
  456    HE1  HIS  59           HE1      HIS  59 -23.960  -7.040  -8.656
  457    HE2  HIS  59           HE2      HIS  59 -23.826  -6.988 -11.172
  458    H    GLY  60           H        GLY  60 -17.513  -2.970  -8.513
  459   1HA   GLY  60          1HA       GLY  60 -15.935  -2.920  -6.775
  460   2HA   GLY  60          2HA       GLY  60 -16.563  -4.426  -6.140
  461    H    VAL  61           H        VAL  61 -16.031  -4.091  -9.564
  462    HA   VAL  61           HA       VAL  61 -13.841  -6.047  -9.394
  463    HB   VAL  61           HB       VAL  61 -15.445  -5.190 -11.814
  464   1HG1  VAL  61          1HG1      VAL  61 -13.532  -7.468 -11.342
  465   2HG1  VAL  61          2HG1      VAL  61 -14.520  -7.285 -12.792
  466   3HG1  VAL  61          3HG1      VAL  61 -13.289  -6.088 -12.406
  467   1HG2  VAL  61          1HG2      VAL  61 -16.909  -6.255 -10.170
  468   2HG2  VAL  61          2HG2      VAL  61 -16.650  -7.315 -11.554
  469   3HG2  VAL  61          3HG2      VAL  61 -15.782  -7.608 -10.047
  470    H    VAL  62           H        VAL  62 -11.855  -5.646 -10.370
  471    HA   VAL  62           HA       VAL  62 -11.089  -2.890 -10.545
  472    HB   VAL  62           HB       VAL  62  -9.467  -5.307 -11.366
  473   1HG1  VAL  62          1HG1      VAL  62  -8.726  -2.973 -12.091
  474   2HG1  VAL  62          2HG1      VAL  62  -8.459  -2.642 -10.385
  475   3HG1  VAL  62          3HG1      VAL  62  -7.588  -3.945 -11.186
  476   1HG2  VAL  62          1HG2      VAL  62 -10.448  -4.636  -8.807
  477   2HG2  VAL  62          2HG2      VAL  62  -9.287  -5.865  -9.243
  478   3HG2  VAL  62          3HG2      VAL  62  -8.738  -4.253  -8.798
  479    H    THR  63           H        THR  63 -11.452  -1.629 -12.245
  480    HA   THR  63           HA       THR  63 -11.802  -2.837 -14.900
  481    HB   THR  63           HB       THR  63 -12.759  -0.730 -15.557
  482    HG1  THR  63           HG1      THR  63 -11.718   0.848 -14.528
  483   1HG2  THR  63          1HG2      THR  63 -14.253  -2.243 -14.342
  484   2HG2  THR  63          2HG2      THR  63 -13.814  -1.444 -12.832
  485   3HG2  THR  63          3HG2      THR  63 -14.659  -0.543 -14.093
  486    H    SER  64           H        SER  64  -9.657  -0.664 -13.132
  487    HA   SER  64           HA       SER  64  -8.103  -0.237 -15.606
  488   1HB   SER  64          1HB       SER  64  -6.920   1.479 -13.998
  489   2HB   SER  64          2HB       SER  64  -8.462   1.860 -14.761
  490    HG   SER  64           HG       SER  64  -9.513   1.426 -12.899
  491    H    VAL  65           H        VAL  65  -5.813  -0.290 -15.463
  492    HA   VAL  65           HA       VAL  65  -4.819  -2.691 -14.327
  493    HB   VAL  65           HB       VAL  65  -3.167  -0.425 -15.408
  494   1HG1  VAL  65          1HG1      VAL  65  -2.585  -3.119 -14.495
  495   2HG1  VAL  65          2HG1      VAL  65  -2.055  -2.854 -16.159
  496   3HG1  VAL  65          3HG1      VAL  65  -1.510  -1.781 -14.883
  497   1HG2  VAL  65          1HG2      VAL  65  -5.003  -1.042 -16.996
  498   2HG2  VAL  65          2HG2      VAL  65  -3.386  -1.358 -17.591
  499   3HG2  VAL  65          3HG2      VAL  65  -4.364  -2.673 -16.995
  500   1HB   PRO  66          1HB       PRO  66  -4.305  -2.448  -8.813
  501   2HB   PRO  66          2HB       PRO  66  -3.124  -3.468  -9.624
  502   1HG   PRO  66          1HG       PRO  66  -5.045  -4.543 -10.244
  503   2HG   PRO  66          2HG       PRO  66  -6.010  -3.096 -10.171
  504   1HD   PRO  66          1HD       PRO  66  -4.227  -4.036 -12.360
  505   2HD   PRO  66          2HD       PRO  66  -5.783  -3.244 -12.462
  506    H    HIS  67           H        HIS  67  -2.310   0.525 -10.789
  507    HA   HIS  67           HA       HIS  67   0.316  -0.801 -10.665
  508   1HB   HIS  67          1HB       HIS  67   1.181   0.719 -12.343
  509   2HB   HIS  67          2HB       HIS  67  -0.202  -0.145 -12.996
  510    HD1  HIS  67           HD1      HIS  67   0.515   2.377 -14.399
  511    HD2  HIS  67           HD2      HIS  67  -2.050   2.335 -11.138
  512    HE1  HIS  67           HE1      HIS  67  -0.855   4.478 -14.578
  513    HE2  HIS  67           HE2      HIS  67  -2.428   4.396 -12.614
  514    H    ILE  68           H        ILE  68   1.989   0.389  -9.797
  515    HA   ILE  68           HA       ILE  68   1.500   1.786  -7.511
  516    HB   ILE  68           HB       ILE  68   3.802   1.153  -9.141
  517   1HG1  ILE  68          1HG1      ILE  68   3.587   1.881  -6.236
  518   2HG1  ILE  68          2HG1      ILE  68   3.253   0.289  -6.882
  519   1HG2  ILE  68          1HG2      ILE  68   3.851   3.908  -7.917
  520   2HG2  ILE  68          2HG2      ILE  68   5.293   2.984  -8.318
  521   3HG2  ILE  68          3HG2      ILE  68   4.176   3.396  -9.574
  522   1HD1  ILE  68          1HD1      ILE  68   5.827   1.032  -7.807
  523   2HD1  ILE  68          2HD1      ILE  68   5.757   1.322  -6.076
  524   3HD1  ILE  68          3HD1      ILE  68   5.352  -0.251  -6.714
  525    H    THR  69           H        THR  69   0.329   3.560  -7.267
  526    HA   THR  69           HA       THR  69   1.075   6.005  -8.638
  527    HB   THR  69           HB       THR  69  -1.560   4.616  -9.116
  528    HG1  THR  69           HG1      THR  69   0.313   5.884 -10.867
  529   1HG2  THR  69          1HG2      THR  69  -0.993   7.554  -9.419
  530   2HG2  THR  69          2HG2      THR  69  -2.270   6.711 -10.304
  531   3HG2  THR  69          3HG2      THR  69  -2.305   6.781  -8.562

  No H/Q in entry =         531
  Start of MODEL   15
    1    H    SER   1           H        SER   1   9.462   8.200  -9.628
    2    HA   SER   1           HA       SER   1   9.818   7.149  -7.566
    3   1HB   SER   1          1HB       SER   1  10.229   4.785  -7.406
    4   2HB   SER   1          2HB       SER   1   9.343   5.037  -8.905
    5    HG   SER   1           HG       SER   1  11.527   5.150  -9.917
    6    H    ARG   2           H        ARG   2  11.405   6.267  -5.986
    7    HA   ARG   2           HA       ARG   2  14.243   6.919  -6.523
    8   1HB   ARG   2          1HB       ARG   2  12.887   6.831  -3.821
    9   2HB   ARG   2          2HB       ARG   2  14.622   6.986  -4.084
   10   1HG   ARG   2          1HG       ARG   2  13.662   9.066  -5.581
   11   2HG   ARG   2          2HG       ARG   2  12.474   8.982  -4.277
   12   1HD   ARG   2          1HD       ARG   2  14.217   9.149  -2.629
   13   2HD   ARG   2          2HD       ARG   2  15.463   9.122  -3.880
   14    HE   ARG   2           HE       ARG   2  13.986  11.256  -4.601
   15   1HH1  ARG   2          1HH1      ARG   2  15.428  10.318  -1.531
   16   2HH1  ARG   2          2HH1      ARG   2  15.628  11.945  -1.011
   17   1HH2  ARG   2          1HH2      ARG   2  14.272  13.397  -3.881
   18   2HH2  ARG   2          2HH2      ARG   2  14.984  13.693  -2.330
   19    H    ARG   3           H        ARG   3  13.555   4.750  -7.671
   20    HA   ARG   3           HA       ARG   3  13.775   2.508  -7.810
   21   1HB   ARG   3          1HB       ARG   3  16.035   3.491  -6.583
   22   2HB   ARG   3          2HB       ARG   3  15.554   2.245  -5.453
   23   1HG   ARG   3          1HG       ARG   3  16.966   1.128  -6.871
   24   2HG   ARG   3          2HG       ARG   3  15.380   0.711  -7.517
   25   1HD   ARG   3          1HD       ARG   3  15.971   3.011  -8.906
   26   2HD   ARG   3          2HD       ARG   3  16.174   1.369  -9.473
   27    HE   ARG   3           HE       ARG   3  18.471   1.437  -8.944
   28   1HH1  ARG   3          1HH1      ARG   3  16.878   4.562  -8.583
   29   2HH1  ARG   3          2HH1      ARG   3  18.353   5.436  -8.674
   30   1HH2  ARG   3          1HH2      ARG   3  20.404   2.640  -9.048
   31   2HH2  ARG   3          2HH2      ARG   3  20.348   4.367  -8.930
   32    H    CYS   4           H        CYS   4  11.796   1.674  -7.282
   33    HA   CYS   4           HA       CYS   4  11.363   1.002  -4.448
   34   1HB   CYS   4          1HB       CYS   4   9.346   1.568  -6.612
   35   2HB   CYS   4          2HB       CYS   4   8.931   0.949  -5.014
   36   1HB   PRO   5          1HB       PRO   5  10.879  -4.425  -3.522
   37   2HB   PRO   5          2HB       PRO   5  12.399  -3.541  -3.689
   38   1HG   PRO   5          1HG       PRO   5   9.863  -2.674  -2.431
   39   2HG   PRO   5          2HG       PRO   5  11.503  -2.464  -1.825
   40   1HD   PRO   5          1HD       PRO   5  10.063  -0.511  -3.119
   41   2HD   PRO   5          2HD       PRO   5  11.836  -0.593  -3.104
   42    H    GLY   6           H        GLY   6  10.199  -5.169  -5.922
   43   1HA   GLY   6          1HA       GLY   6   8.253  -6.249  -6.371
   44   2HA   GLY   6          2HA       GLY   6   7.429  -5.100  -5.365
   45    H    LYS   7           H        LYS   7   6.379  -6.202  -7.711
   46    HA   LYS   7           HA       LYS   7   6.684  -4.798 -10.059
   47   1HB   LYS   7          1HB       LYS   7   5.336  -6.837  -9.708
   48   2HB   LYS   7          2HB       LYS   7   4.104  -5.878  -8.949
   49   1HG   LYS   7          1HG       LYS   7   3.575  -4.766 -10.923
   50   2HG   LYS   7          2HG       LYS   7   5.033  -5.320 -11.739
   51   1HD   LYS   7          1HD       LYS   7   3.129  -7.386 -10.712
   52   2HD   LYS   7          2HD       LYS   7   2.618  -6.443 -12.097
   53   1HE   LYS   7          1HE       LYS   7   5.277  -7.840 -11.988
   54   2HE   LYS   7          2HE       LYS   7   3.807  -8.595 -12.602
   55   1HZ   LYS   7          1HZ       LYS   7   3.628  -6.843 -14.257
   56   2HZ   LYS   7          2HZ       LYS   7   5.043  -6.115 -13.678
   57   3HZ   LYS   7          3HZ       LYS   7   5.109  -7.646 -14.385
   58    H    ASN   8           H        ASN   8   5.670  -2.987 -11.012
   59    HA   ASN   8           HA       ASN   8   4.603  -1.022  -9.061
   60   1HB   ASN   8          1HB       ASN   8   6.172  -0.664 -11.612
   61   2HB   ASN   8          2HB       ASN   8   5.391   0.671 -10.771
   62   2HD2  ASN   8          2HD2      ASN   8   6.733   1.786  -9.531
   63   1HD2  ASN   8          1HD2      ASN   8   8.098   1.139  -8.698
   64    H    ALA   9           H        ALA   9   3.522  -3.018 -11.457
   65    HA   ALA   9           HA       ALA   9   1.066  -1.599 -11.729
   66   1HB   ALA   9          1HB       ALA   9   2.750  -2.073 -14.176
   67   2HB   ALA   9          2HB       ALA   9   1.088  -1.474 -14.172
   68   3HB   ALA   9          3HB       ALA   9   2.380  -0.499 -13.472
   69    H    TRP  10           H        TRP  10  -0.593  -3.026 -11.894
   70    HA   TRP  10           HA       TRP  10   0.137  -5.806 -12.621
   71   1HB   TRP  10          1HB       TRP  10  -1.773  -4.798 -10.538
   72   2HB   TRP  10          2HB       TRP  10  -1.721  -6.463 -11.088
   73    HD1  TRP  10           HD1      TRP  10   0.122  -8.012 -10.083
   74    HE1  TRP  10           HE1      TRP  10   1.947  -7.684  -8.299
   75    HE3  TRP  10           HE3      TRP  10  -0.127  -2.941  -9.569
   76    HZ2  TRP  10           HZ2      TRP  10   3.119  -5.557  -6.864
   77    HZ3  TRP  10           HZ3      TRP  10   1.369  -1.829  -7.973
   78    HH2  TRP  10           HH2      TRP  10   2.956  -3.115  -6.637
   79   1HB   PRO  11          1HB       PRO  11  -1.909  -5.717 -17.728
   80   2HB   PRO  11          2HB       PRO  11  -1.550  -4.021 -17.402
   81   1HG   PRO  11          1HG       PRO  11  -0.018  -6.458 -16.619
   82   2HG   PRO  11          2HG       PRO  11   0.577  -4.891 -17.192
   83   1HD   PRO  11          1HD       PRO  11   0.669  -5.561 -14.610
   84   2HD   PRO  11          2HD       PRO  11   0.330  -3.894 -15.114
   85    H    GLU  12           H        GLU  12  -1.652  -7.380 -15.063
   86    HA   GLU  12           HA       GLU  12  -3.758  -8.906 -16.151
   87   1HB   GLU  12          1HB       GLU  12  -2.861 -10.733 -14.649
   88   2HB   GLU  12          2HB       GLU  12  -1.725 -10.012 -15.778
   89   1HG   GLU  12          1HG       GLU  12  -1.765  -8.671 -13.172
   90   2HG   GLU  12          2HG       GLU  12  -1.345 -10.379 -13.088
   91    H    LEU  13           H        LEU  13  -3.776  -6.916 -13.389
   92    HA   LEU  13           HA       LEU  13  -5.651  -8.497 -11.888
   93   1HB   LEU  13          1HB       LEU  13  -4.504  -5.753 -11.596
   94   2HB   LEU  13          2HB       LEU  13  -5.879  -6.211 -10.627
   95    HG   LEU  13           HG       LEU  13  -3.142  -7.474 -10.600
   96   1HD1  LEU  13          1HD1      LEU  13  -4.681  -5.808  -8.648
   97   2HD1  LEU  13          2HD1      LEU  13  -3.310  -6.774  -8.164
   98   3HD1  LEU  13          3HD1      LEU  13  -3.128  -5.485  -9.318
   99   1HD2  LEU  13          1HD2      LEU  13  -5.753  -8.417  -9.513
  100   2HD2  LEU  13          2HD2      LEU  13  -4.437  -9.322 -10.259
  101   3HD2  LEU  13          3HD2      LEU  13  -4.278  -8.726  -8.627
  102    H    VAL  14           H        VAL  14  -5.776  -6.200 -14.431
  103    HA   VAL  14           HA       VAL  14  -8.304  -5.079 -14.042
  104    HB   VAL  14           HB       VAL  14  -7.046  -5.779 -16.707
  105   1HG1  VAL  14          1HG1      VAL  14  -9.117  -3.726 -15.922
  106   2HG1  VAL  14          2HG1      VAL  14  -8.338  -3.816 -17.501
  107   3HG1  VAL  14          3HG1      VAL  14  -9.360  -5.138 -16.950
  108   1HG2  VAL  14          1HG2      VAL  14  -5.583  -4.431 -15.069
  109   2HG2  VAL  14          2HG2      VAL  14  -5.877  -3.766 -16.662
  110   3HG2  VAL  14          3HG2      VAL  14  -6.765  -3.156 -15.272
  111    H    GLY  15           H        GLY  15 -10.155  -6.188 -13.731
  112   1HA   GLY  15          1HA       GLY  15 -11.903  -7.415 -14.895
  113   2HA   GLY  15          2HA       GLY  15 -10.690  -8.542 -15.472
  114    H    LYS  16           H        LYS  16  -9.735  -7.891 -12.400
  115    HA   LYS  16           HA       LYS  16 -11.193 -10.233 -11.362
  116   1HB   LYS  16          1HB       LYS  16  -8.445  -9.307 -11.197
  117   2HB   LYS  16          2HB       LYS  16  -9.087  -9.589  -9.596
  118   1HG   LYS  16          1HG       LYS  16  -9.225 -11.589 -11.845
  119   2HG   LYS  16          2HG       LYS  16  -7.927 -11.519 -10.651
  120   1HD   LYS  16          1HD       LYS  16  -9.299 -12.173  -8.903
  121   2HD   LYS  16          2HD       LYS  16 -10.778 -11.683  -9.729
  122   1HE   LYS  16          1HE       LYS  16 -10.755 -13.541 -11.140
  123   2HE   LYS  16          2HE       LYS  16  -9.080 -13.938 -10.752
  124   1HZ   LYS  16          1HZ       LYS  16  -9.782 -14.492  -8.498
  125   2HZ   LYS  16          2HZ       LYS  16 -11.391 -14.140  -8.893
  126   3HZ   LYS  16          3HZ       LYS  16 -10.595 -15.430  -9.645
  127    H    SER  17           H        SER  17 -11.020 -10.001  -8.716
  128    HA   SER  17           HA       SER  17 -12.907  -7.881  -8.161
  129   1HB   SER  17          1HB       SER  17 -13.348  -8.992  -6.149
  130   2HB   SER  17          2HB       SER  17 -12.978 -10.308  -7.262
  131    HG   SER  17           HG       SER  17 -11.880 -10.494  -5.242
  132    H    GLY  18           H        GLY  18 -12.574  -6.099  -6.867
  133   1HA   GLY  18          1HA       GLY  18 -10.111  -4.878  -6.730
  134   2HA   GLY  18          2HA       GLY  18 -11.439  -4.513  -5.659
  135    H    ASN  19           H        ASN  19 -11.455  -7.250  -4.541
  136    HA   ASN  19           HA       ASN  19  -9.566  -6.803  -2.455
  137   1HB   ASN  19          1HB       ASN  19 -11.918  -8.186  -2.633
  138   2HB   ASN  19          2HB       ASN  19 -10.767  -9.514  -2.699
  139   2HD2  ASN  19          2HD2      ASN  19 -11.937  -6.809  -0.799
  140   1HD2  ASN  19          1HD2      ASN  19 -11.299  -7.370   0.705
  141    H    MET  20           H        MET  20  -9.811  -9.217  -5.071
  142    HA   MET  20           HA       MET  20  -7.408 -10.553  -4.389
  143   1HB   MET  20          1HB       MET  20  -9.341 -11.295  -5.994
  144   2HB   MET  20          2HB       MET  20  -8.474 -10.379  -7.202
  145   1HG   MET  20          1HG       MET  20  -7.466 -12.318  -7.616
  146   2HG   MET  20          2HG       MET  20  -6.427 -11.857  -6.272
  147   1HE   MET  20          1HE       MET  20  -7.466 -12.427  -3.658
  148   2HE   MET  20          2HE       MET  20  -9.157 -12.246  -4.127
  149   3HE   MET  20          3HE       MET  20  -8.597 -13.743  -3.399
  150    H    ALA  21           H        ALA  21  -8.122  -7.688  -6.228
  151    HA   ALA  21           HA       ALA  21  -5.632  -7.447  -7.528
  152   1HB   ALA  21          1HB       ALA  21  -7.814  -5.511  -6.878
  153   2HB   ALA  21          2HB       ALA  21  -6.336  -4.982  -7.678
  154   3HB   ALA  21          3HB       ALA  21  -7.372  -6.187  -8.443
  155    H    ALA  22           H        ALA  22  -6.922  -5.611  -4.758
  156    HA   ALA  22           HA       ALA  22  -4.537  -4.378  -4.023
  157   1HB   ALA  22          1HB       ALA  22  -5.686  -4.505  -1.630
  158   2HB   ALA  22          2HB       ALA  22  -6.297  -3.478  -2.918
  159   3HB   ALA  22          3HB       ALA  22  -7.067  -5.031  -2.596
  160    H    ALA  23           H        ALA  23  -5.777  -7.582  -3.263
  161    HA   ALA  23           HA       ALA  23  -3.853  -8.255  -1.291
  162   1HB   ALA  23          1HB       ALA  23  -5.419 -10.069  -3.131
  163   2HB   ALA  23          2HB       ALA  23  -4.579 -10.553  -1.655
  164   3HB   ALA  23          3HB       ALA  23  -5.963  -9.465  -1.567
  165    H    THR  24           H        THR  24  -4.020  -8.798  -4.803
  166    HA   THR  24           HA       THR  24  -1.658 -10.287  -5.062
  167    HB   THR  24           HB       THR  24  -2.916  -8.383  -7.037
  168    HG1  THR  24           HG1      THR  24  -3.778 -10.463  -7.848
  169   1HG2  THR  24          1HG2      THR  24  -0.940 -10.607  -7.458
  170   2HG2  THR  24          2HG2      THR  24  -1.889  -9.865  -8.745
  171   3HG2  THR  24          3HG2      THR  24  -0.733  -8.896  -7.839
  172    H    VAL  25           H        VAL  25  -2.218  -6.794  -5.061
  173    HA   VAL  25           HA       VAL  25   0.432  -6.061  -5.761
  174    HB   VAL  25           HB       VAL  25  -1.472  -4.387  -4.109
  175   1HG1  VAL  25          1HG1      VAL  25   1.132  -3.924  -5.170
  176   2HG1  VAL  25          2HG1      VAL  25  -0.007  -2.899  -6.035
  177   3HG1  VAL  25          3HG1      VAL  25   0.078  -2.840  -4.293
  178   1HG2  VAL  25          1HG2      VAL  25  -1.589  -5.169  -6.980
  179   2HG2  VAL  25          2HG2      VAL  25  -2.866  -4.794  -5.832
  180   3HG2  VAL  25          3HG2      VAL  25  -1.965  -3.495  -6.569
  181    H    GLU  26           H        GLU  26  -1.202  -6.035  -2.576
  182    HA   GLU  26           HA       GLU  26   1.128  -5.381  -1.113
  183   1HB   GLU  26          1HB       GLU  26  -0.101  -5.966   0.847
  184   2HB   GLU  26          2HB       GLU  26  -1.232  -6.951  -0.071
  185   1HG   GLU  26          1HG       GLU  26  -1.293  -4.316  -1.176
  186   2HG   GLU  26          2HG       GLU  26  -2.561  -5.237  -0.375
  187    H    ARG  27           H        ARG  27  -0.057  -8.432  -2.357
  188    HA   ARG  27           HA       ARG  27   1.667 -10.026  -0.673
  189   1HB   ARG  27          1HB       ARG  27  -0.601 -10.672  -1.814
  190   2HB   ARG  27          2HB       ARG  27   0.401 -11.066  -3.201
  191   1HG   ARG  27          1HG       ARG  27   1.722 -12.543  -1.619
  192   2HG   ARG  27          2HG       ARG  27   0.452 -12.244  -0.430
  193   1HD   ARG  27          1HD       ARG  27  -0.007 -14.314  -1.548
  194   2HD   ARG  27          2HD       ARG  27  -1.208 -13.126  -2.055
  195    HE   ARG  27           HE       ARG  27   0.969 -13.149  -3.870
  196   1HH1  ARG  27          1HH1      ARG  27  -1.806 -15.077  -2.909
  197   2HH1  ARG  27          2HH1      ARG  27  -1.966 -15.812  -4.461
  198   1HH2  ARG  27          1HH2      ARG  27   0.735 -14.132  -5.907
  199   2HH2  ARG  27          2HH2      ARG  27  -0.532 -15.285  -6.162
  200    H    GLU  28           H        GLU  28   1.532  -9.398  -4.195
  201    HA   GLU  28           HA       GLU  28   4.045 -10.586  -4.745
  202   1HB   GLU  28          1HB       GLU  28   2.511  -8.482  -6.289
  203   2HB   GLU  28          2HB       GLU  28   3.908  -9.364  -6.903
  204   1HG   GLU  28          1HG       GLU  28   2.472 -11.471  -6.329
  205   2HG   GLU  28          2HG       GLU  28   1.132 -10.338  -6.380
  206    H    ASN  29           H        ASN  29   3.080  -7.348  -3.786
  207    HA   ASN  29           HA       ASN  29   5.936  -6.597  -3.621
  208   1HB   ASN  29          1HB       ASN  29   4.763  -5.416  -5.451
  209   2HB   ASN  29          2HB       ASN  29   3.616  -4.770  -4.290
  210   2HD2  ASN  29          2HD2      ASN  29   5.577  -3.438  -6.065
  211   1HD2  ASN  29          1HD2      ASN  29   6.563  -2.484  -5.019
  212    H    ARG  30           H        ARG  30   5.801  -7.456  -1.461
  213    HA   ARG  30           HA       ARG  30   4.033  -6.462   0.506
  214   1HB   ARG  30          1HB       ARG  30   6.562  -8.012   0.466
  215   2HB   ARG  30          2HB       ARG  30   6.217  -7.178   1.967
  216   1HG   ARG  30          1HG       ARG  30   3.854  -8.562   1.023
  217   2HG   ARG  30          2HG       ARG  30   5.235  -9.649   1.089
  218   1HD   ARG  30          1HD       ARG  30   4.902  -7.871   3.441
  219   2HD   ARG  30          2HD       ARG  30   3.632  -9.061   3.169
  220    HE   ARG  30           HE       ARG  30   6.241 -10.221   2.986
  221   1HH1  ARG  30          1HH1      ARG  30   3.766  -9.172   5.254
  222   2HH1  ARG  30          2HH1      ARG  30   4.287 -10.258   6.485
  223   1HH2  ARG  30          1HH2      ARG  30   6.905 -11.645   4.635
  224   2HH2  ARG  30          2HH2      ARG  30   6.062 -11.655   6.149
  225    H    ASN  31           H        ASN  31   6.273  -4.653  -1.158
  226    HA   ASN  31           HA       ASN  31   6.977  -3.005   1.156
  227   1HB   ASN  31          1HB       ASN  31   8.782  -3.687  -0.373
  228   2HB   ASN  31          2HB       ASN  31   7.950  -2.876  -1.695
  229   2HD2  ASN  31          2HD2      ASN  31   9.689  -2.426   1.312
  230   1HD2  ASN  31          1HD2      ASN  31  10.034  -0.751   1.066
  231    H    VAL  32           H        VAL  32   4.446  -3.196  -0.965
  232    HA   VAL  32           HA       VAL  32   4.013  -0.288  -0.810
  233    HB   VAL  32           HB       VAL  32   3.003  -0.251  -2.960
  234   1HG1  VAL  32          1HG1      VAL  32   5.674  -1.640  -2.957
  235   2HG1  VAL  32          2HG1      VAL  32   4.928  -1.024  -4.413
  236   3HG1  VAL  32          3HG1      VAL  32   5.344   0.058  -3.100
  237   1HG2  VAL  32          1HG2      VAL  32   3.261  -3.222  -2.865
  238   2HG2  VAL  32          2HG2      VAL  32   1.848  -2.245  -3.194
  239   3HG2  VAL  32          3HG2      VAL  32   3.116  -2.385  -4.401
  240    H    HIS  33           H        HIS  33   1.671   0.275  -1.120
  241    HA   HIS  33           HA       HIS  33  -0.089  -1.781  -0.005
  242   1HB   HIS  33          1HB       HIS  33  -0.154  -0.682   1.933
  243   2HB   HIS  33          2HB       HIS  33   0.782   0.657   1.288
  244    HD1  HIS  33           HD1      HIS  33  -2.694  -0.412   2.071
  245    HD2  HIS  33           HD2      HIS  33  -0.740   2.873   0.456
  246    HE1  HIS  33           HE1      HIS  33  -4.397   1.438   2.032
  247    HE2  HIS  33           HE2      HIS  33  -3.086   3.453   1.312
  248    H    ALA  34           H        ALA  34  -1.879  -2.061  -1.178
  249    HA   ALA  34           HA       ALA  34  -2.558  -0.009  -3.173
  250   1HB   ALA  34          1HB       ALA  34  -3.424  -2.882  -2.995
  251   2HB   ALA  34          2HB       ALA  34  -3.794  -1.761  -4.308
  252   3HB   ALA  34          3HB       ALA  34  -2.128  -2.255  -4.008
  253    H    ILE  35           H        ILE  35  -4.474   1.015  -3.244
  254    HA   ILE  35           HA       ILE  35  -6.354   0.501  -1.019
  255    HB   ILE  35           HB       ILE  35  -6.129   3.040  -2.640
  256   1HG1  ILE  35          1HG1      ILE  35  -4.983   2.507   0.085
  257   2HG1  ILE  35          2HG1      ILE  35  -4.005   2.544  -1.376
  258   1HG2  ILE  35          1HG2      ILE  35  -8.278   2.643  -1.510
  259   2HG2  ILE  35          2HG2      ILE  35  -7.429   2.449   0.021
  260   3HG2  ILE  35          3HG2      ILE  35  -7.421   4.000  -0.810
  261   1HD1  ILE  35          1HD1      ILE  35  -5.628   4.857  -0.327
  262   2HD1  ILE  35          2HD1      ILE  35  -3.908   4.628  -0.095
  263   3HD1  ILE  35          3HD1      ILE  35  -4.539   4.850  -1.707
  264    H    VAL  36           H        VAL  36  -8.204  -0.452  -1.591
  265    HA   VAL  36           HA       VAL  36  -9.014  -0.550  -4.372
  266    HB   VAL  36           HB       VAL  36 -10.337  -1.705  -1.926
  267   1HG1  VAL  36          1HG1      VAL  36 -10.890  -2.061  -4.866
  268   2HG1  VAL  36          2HG1      VAL  36 -11.479  -3.167  -3.633
  269   3HG1  VAL  36          3HG1      VAL  36 -11.990  -1.486  -3.621
  270   1HG2  VAL  36          1HG2      VAL  36  -8.517  -2.974  -3.974
  271   2HG2  VAL  36          2HG2      VAL  36  -8.146  -2.658  -2.279
  272   3HG2  VAL  36          3HG2      VAL  36  -9.381  -3.837  -2.700
  273    H    LEU  37           H        LEU  37 -10.142   1.006  -5.269
  274    HA   LEU  37           HA       LEU  37 -12.283   2.327  -3.723
  275   1HB   LEU  37          1HB       LEU  37 -11.580   4.409  -5.062
  276   2HB   LEU  37          2HB       LEU  37 -10.714   3.985  -3.616
  277    HG   LEU  37           HG       LEU  37  -9.093   2.748  -5.315
  278   1HD1  LEU  37          1HD1      LEU  37 -10.490   3.179  -7.280
  279   2HD1  LEU  37          2HD1      LEU  37 -10.300   4.896  -7.043
  280   3HD1  LEU  37          3HD1      LEU  37  -8.903   3.892  -7.425
  281   1HD2  LEU  37          1HD2      LEU  37  -9.217   5.623  -4.541
  282   2HD2  LEU  37          2HD2      LEU  37  -8.134   4.340  -4.004
  283   3HD2  LEU  37          3HD2      LEU  37  -7.956   5.038  -5.617
  284    H    LYS  38           H        LYS  38 -13.984   3.186  -5.021
  285    HA   LYS  38           HA       LYS  38 -14.337   1.649  -7.474
  286   1HB   LYS  38          1HB       LYS  38 -16.038   2.255  -5.430
  287   2HB   LYS  38          2HB       LYS  38 -16.495   3.473  -6.611
  288   1HG   LYS  38          1HG       LYS  38 -16.702   1.562  -8.265
  289   2HG   LYS  38          2HG       LYS  38 -16.565   0.479  -6.885
  290   1HD   LYS  38          1HD       LYS  38 -18.538   2.701  -6.672
  291   2HD   LYS  38          2HD       LYS  38 -18.881   1.451  -7.856
  292   1HE   LYS  38          1HE       LYS  38 -19.887   0.510  -6.059
  293   2HE   LYS  38          2HE       LYS  38 -18.278  -0.157  -5.811
  294   1HZ   LYS  38          1HZ       LYS  38 -19.369   2.291  -4.513
  295   2HZ   LYS  38          2HZ       LYS  38 -19.187   0.775  -3.785
  296   3HZ   LYS  38          3HZ       LYS  38 -17.822   1.649  -4.261
  297    H    GLU  39           H        GLU  39 -15.074   2.565  -9.434
  298    HA   GLU  39           HA       GLU  39 -13.598   4.598 -10.496
  299   1HB   GLU  39          1HB       GLU  39 -15.361   2.898 -11.532
  300   2HB   GLU  39          2HB       GLU  39 -16.399   4.316 -11.500
  301   1HG   GLU  39          1HG       GLU  39 -14.954   5.515 -12.939
  302   2HG   GLU  39          2HG       GLU  39 -13.671   4.318 -12.772
  303    H    GLY  40           H        GLY  40 -13.402   6.683 -10.052
  304   1HA   GLY  40          1HA       GLY  40 -14.357   8.860 -10.093
  305   2HA   GLY  40          2HA       GLY  40 -15.852   8.227  -9.436
  306    H    SER  41           H        SER  41 -13.348   6.766  -7.780
  307    HA   SER  41           HA       SER  41 -13.907   8.190  -5.391
  308   1HB   SER  41          1HB       SER  41 -13.210   5.826  -5.420
  309   2HB   SER  41          2HB       SER  41 -11.617   6.309  -6.007
  310    HG   SER  41           HG       SER  41 -12.800   6.799  -3.487
  311    H    ALA  42           H        ALA  42 -11.502   8.558  -4.131
  312    HA   ALA  42           HA       ALA  42 -10.556  11.012  -5.397
  313   1HB   ALA  42          1HB       ALA  42  -9.482  11.443  -3.256
  314   2HB   ALA  42          2HB       ALA  42 -11.190  11.062  -3.044
  315   3HB   ALA  42          3HB       ALA  42  -9.965   9.848  -2.674
  316    H    MET  43           H        MET  43  -9.107  10.526  -6.969
  317    HA   MET  43           HA       MET  43  -6.794   8.893  -6.177
  318   1HB   MET  43          1HB       MET  43  -6.706   8.486  -8.763
  319   2HB   MET  43          2HB       MET  43  -7.624   7.466  -7.691
  320   1HG   MET  43          1HG       MET  43  -9.665   8.314  -8.320
  321   2HG   MET  43          2HG       MET  43  -8.978   9.805  -8.963
  322   1HE   MET  43          1HE       MET  43  -6.913   9.432 -10.711
  323   2HE   MET  43          2HE       MET  43  -6.479   7.720 -10.732
  324   3HE   MET  43          3HE       MET  43  -7.166   8.474 -12.167
  325    H    THR  44           H        THR  44  -5.363  10.417  -5.701
  326    HA   THR  44           HA       THR  44  -5.048  12.796  -7.267
  327    HB   THR  44           HB       THR  44  -3.235  13.327  -5.809
  328    HG1  THR  44           HG1      THR  44  -2.123  11.873  -4.706
  329   1HG2  THR  44          1HG2      THR  44  -5.516  13.370  -4.775
  330   2HG2  THR  44          2HG2      THR  44  -5.143  11.798  -4.066
  331   3HG2  THR  44          3HG2      THR  44  -4.173  13.207  -3.646
  332    H    LYS  45           H        LYS  45  -3.143  13.362  -8.459
  333    HA   LYS  45           HA       LYS  45  -2.226  11.180 -10.133
  334   1HB   LYS  45          1HB       LYS  45  -2.001  14.167 -10.176
  335   2HB   LYS  45          2HB       LYS  45  -0.849  13.226 -11.106
  336   1HG   LYS  45          1HG       LYS  45  -2.391  13.497 -12.696
  337   2HG   LYS  45          2HG       LYS  45  -3.011  12.012 -11.997
  338   1HD   LYS  45          1HD       LYS  45  -4.942  12.996 -11.564
  339   2HD   LYS  45          2HD       LYS  45  -4.147  14.142 -10.490
  340   1HE   LYS  45          1HE       LYS  45  -3.619  15.060 -13.111
  341   2HE   LYS  45          2HE       LYS  45  -5.303  14.543 -13.097
  342   1HZ   LYS  45          1HZ       LYS  45  -4.074  16.441 -11.173
  343   2HZ   LYS  45          2HZ       LYS  45  -5.055  16.859 -12.484
  344   3HZ   LYS  45          3HZ       LYS  45  -5.700  15.967 -11.199
  345    H    ASP  46           H        ASP  46  -1.023  13.015  -7.447
  346    HA   ASP  46           HA       ASP  46   1.675  12.927  -7.677
  347   1HB   ASP  46          1HB       ASP  46  -0.087  13.390  -5.602
  348   2HB   ASP  46          2HB       ASP  46   0.765  11.965  -5.026
  349    H    PHE  47           H        PHE  47   3.327  11.454  -7.411
  350    HA   PHE  47           HA       PHE  47   2.548   8.665  -7.778
  351   1HB   PHE  47          1HB       PHE  47   4.199   9.625  -9.279
  352   2HB   PHE  47          2HB       PHE  47   5.256   9.996  -7.919
  353    HD1  PHE  47           HD1      PHE  47   3.695   7.240  -9.832
  354    HD2  PHE  47           HD2      PHE  47   6.692   8.346  -7.014
  355    HE1  PHE  47           HE1      PHE  47   4.680   5.009 -10.006
  356    HE2  PHE  47           HE2      PHE  47   7.681   6.116  -7.190
  357    HZ   PHE  47           HZ       PHE  47   6.666   4.421  -8.667
  358    H    ARG  48           H        ARG  48   2.814   7.076  -6.357
  359    HA   ARG  48           HA       ARG  48   4.582   7.339  -4.061
  360   1HB   ARG  48          1HB       ARG  48   1.591   7.385  -3.863
  361   2HB   ARG  48          2HB       ARG  48   2.499   6.550  -2.613
  362   1HG   ARG  48          1HG       ARG  48   3.589   8.499  -1.921
  363   2HG   ARG  48          2HG       ARG  48   3.111   9.389  -3.358
  364   1HD   ARG  48          1HD       ARG  48   0.673   8.691  -2.377
  365   2HD   ARG  48          2HD       ARG  48   1.507  10.216  -2.099
  366    HE   ARG  48           HE       ARG  48   2.163   8.131  -0.203
  367   1HH1  ARG  48          1HH1      ARG  48  -0.031  10.782  -0.938
  368   2HH1  ARG  48          2HH1      ARG  48  -0.464  11.015   0.711
  369   1HH2  ARG  48          1HH2      ARG  48   1.563   8.465   1.964
  370   2HH2  ARG  48          2HH2      ARG  48   0.427   9.711   2.360
  371    H    CYS  49           H        CYS  49   5.670   5.495  -4.188
  372    HA   CYS  49           HA       CYS  49   4.849   3.199  -5.534
  373   1HB   CYS  49          1HB       CYS  49   6.891   3.467  -3.334
  374   2HB   CYS  49          2HB       CYS  49   6.730   2.060  -4.380
  375    H    ASP  50           H        ASP  50   4.527   4.080  -2.137
  376    HA   ASP  50           HA       ASP  50   3.534   1.489  -1.374
  377   1HB   ASP  50          1HB       ASP  50   4.773   2.862   0.215
  378   2HB   ASP  50          2HB       ASP  50   3.158   2.512   0.821
  379    H    ARG  51           H        ARG  51   2.090   3.910  -3.137
  380    HA   ARG  51           HA       ARG  51  -0.563   3.183  -2.106
  381   1HB   ARG  51          1HB       ARG  51   0.145   5.558  -1.694
  382   2HB   ARG  51          2HB       ARG  51   0.150   5.790  -3.439
  383   1HG   ARG  51          1HG       ARG  51  -2.303   4.919  -3.311
  384   2HG   ARG  51          2HG       ARG  51  -2.151   5.272  -1.589
  385   1HD   ARG  51          1HD       ARG  51  -3.078   7.196  -2.531
  386   2HD   ARG  51          2HD       ARG  51  -1.386   7.576  -2.272
  387    HE   ARG  51           HE       ARG  51  -2.165   6.603  -4.924
  388   1HH1  ARG  51          1HH1      ARG  51  -1.343   9.371  -2.904
  389   2HH1  ARG  51          2HH1      ARG  51  -0.933  10.354  -4.249
  390   1HH2  ARG  51          1HH2      ARG  51  -1.713   7.988  -6.677
  391   2HH2  ARG  51          2HH2      ARG  51  -1.163   9.595  -6.386
  392    H    VAL  52           H        VAL  52  -1.399   1.766  -3.481
  393    HA   VAL  52           HA       VAL  52  -1.104   2.267  -6.385
  394    HB   VAL  52           HB       VAL  52  -1.690  -0.329  -4.970
  395   1HG1  VAL  52          1HG1      VAL  52  -1.558   0.388  -7.867
  396   2HG1  VAL  52          2HG1      VAL  52  -1.298  -1.261  -7.308
  397   3HG1  VAL  52          3HG1      VAL  52  -2.830  -0.457  -7.001
  398   1HG2  VAL  52          1HG2      VAL  52   0.765   0.908  -5.282
  399   2HG2  VAL  52          2HG2      VAL  52   0.475  -0.794  -4.975
  400   3HG2  VAL  52          3HG2      VAL  52   0.692  -0.224  -6.624
  401    H    TRP  53           H        TRP  53  -2.890   3.048  -7.330
  402    HA   TRP  53           HA       TRP  53  -5.406   3.065  -5.931
  403   1HB   TRP  53          1HB       TRP  53  -4.571   4.033  -8.660
  404   2HB   TRP  53          2HB       TRP  53  -6.233   4.141  -8.109
  405    HD1  TRP  53           HD1      TRP  53  -4.004   6.552  -8.817
  406    HE1  TRP  53           HE1      TRP  53  -3.909   8.505  -7.142
  407    HE3  TRP  53           HE3      TRP  53  -6.101   4.259  -4.778
  408    HZ2  TRP  53           HZ2      TRP  53  -4.614   8.987  -4.446
  409    HZ3  TRP  53           HZ3      TRP  53  -6.370   5.521  -2.700
  410    HH2  TRP  53           HH2      TRP  53  -5.637   7.845  -2.532
  411    H    VAL  54           H        VAL  54  -6.979   1.592  -6.037
  412    HA   VAL  54           HA       VAL  54  -6.961  -0.302  -8.321
  413    HB   VAL  54           HB       VAL  54  -7.549  -0.733  -5.405
  414   1HG1  VAL  54          1HG1      VAL  54  -8.531  -2.297  -7.751
  415   2HG1  VAL  54          2HG1      VAL  54  -8.135  -3.127  -6.249
  416   3HG1  VAL  54          3HG1      VAL  54  -9.359  -1.879  -6.259
  417   1HG2  VAL  54          1HG2      VAL  54  -5.221  -0.977  -6.266
  418   2HG2  VAL  54          2HG2      VAL  54  -5.899  -2.421  -5.518
  419   3HG2  VAL  54          3HG2      VAL  54  -5.809  -2.303  -7.268
  420    H    ILE  55           H        ILE  55  -8.374   0.974  -9.540
  421    HA   ILE  55           HA       ILE  55 -10.905   1.811  -8.470
  422    HB   ILE  55           HB       ILE  55 -10.120   1.776 -11.353
  423   1HG1  ILE  55          1HG1      ILE  55  -9.728   4.035  -9.400
  424   2HG1  ILE  55          2HG1      ILE  55  -8.427   2.973  -9.895
  425   1HG2  ILE  55          1HG2      ILE  55 -12.152   3.331  -9.780
  426   2HG2  ILE  55          2HG2      ILE  55 -11.717   3.707 -11.447
  427   3HG2  ILE  55          3HG2      ILE  55 -12.455   2.159 -11.062
  428   1HD1  ILE  55          1HD1      ILE  55  -9.402   3.820 -12.293
  429   2HD1  ILE  55          2HD1      ILE  55  -9.652   5.223 -11.258
  430   3HD1  ILE  55          3HD1      ILE  55  -8.045   4.524 -11.421
  431    H    VAL  56           H        VAL  56 -12.725   0.697  -8.389
  432    HA   VAL  56           HA       VAL  56 -13.030  -1.628 -10.156
  433    HB   VAL  56           HB       VAL  56 -14.232  -2.770  -8.384
  434   1HG1  VAL  56          1HG1      VAL  56 -11.448  -2.303  -8.436
  435   2HG1  VAL  56          2HG1      VAL  56 -11.933  -2.340  -6.749
  436   3HG1  VAL  56          3HG1      VAL  56 -12.317  -3.692  -7.802
  437   1HG2  VAL  56          1HG2      VAL  56 -13.557  -0.358  -6.723
  438   2HG2  VAL  56          2HG2      VAL  56 -15.154  -0.955  -7.146
  439   3HG2  VAL  56          3HG2      VAL  56 -14.140  -1.878  -6.057
  440    H    ASN  57           H        ASN  57 -15.306  -2.322 -10.435
  441    HA   ASN  57           HA       ASN  57 -16.925   0.015 -11.056
  442   1HB   ASN  57          1HB       ASN  57 -18.365  -1.532 -12.249
  443   2HB   ASN  57          2HB       ASN  57 -16.687  -1.823 -12.675
  444   2HD2  ASN  57          2HD2      ASN  57 -17.517  -3.893 -13.423
  445   1HD2  ASN  57          1HD2      ASN  57 -17.712  -5.169 -12.275
  446    H    ASP  58           H        ASP  58 -19.439  -0.579 -10.780
  447    HA   ASP  58           HA       ASP  58 -20.079  -0.097  -8.139
  448   1HB   ASP  58          1HB       ASP  58 -22.424  -0.791  -8.805
  449   2HB   ASP  58          2HB       ASP  58 -21.666   0.447  -9.800
  450    H    HIS  59           H        HIS  59 -19.490  -3.164  -9.680
  451    HA   HIS  59           HA       HIS  59 -20.696  -4.664  -7.507
  452   1HB   HIS  59          1HB       HIS  59 -20.815  -5.420  -9.884
  453   2HB   HIS  59          2HB       HIS  59 -19.075  -5.684  -9.856
  454    HD1  HIS  59           HD1      HIS  59 -18.371  -7.966  -9.188
  455    HD2  HIS  59           HD2      HIS  59 -22.187  -7.059  -7.817
  456    HE1  HIS  59           HE1      HIS  59 -19.211 -10.072  -8.102
  457    HE2  HIS  59           HE2      HIS  59 -21.563  -9.530  -7.372
  458    H    GLY  60           H        GLY  60 -17.563  -3.437  -8.382
  459   1HA   GLY  60          1HA       GLY  60 -15.906  -3.286  -6.670
  460   2HA   GLY  60          2HA       GLY  60 -16.411  -4.843  -6.050
  461    H    VAL  61           H        VAL  61 -16.122  -4.371  -9.492
  462    HA   VAL  61           HA       VAL  61 -13.884  -6.260  -9.545
  463    HB   VAL  61           HB       VAL  61 -15.607  -5.252 -11.807
  464   1HG1  VAL  61          1HG1      VAL  61 -13.401  -5.998 -12.548
  465   2HG1  VAL  61          2HG1      VAL  61 -13.658  -7.532 -11.719
  466   3HG1  VAL  61          3HG1      VAL  61 -14.670  -7.086 -13.084
  467   1HG2  VAL  61          1HG2      VAL  61 -15.748  -7.842 -10.273
  468   2HG2  VAL  61          2HG2      VAL  61 -16.935  -6.537 -10.216
  469   3HG2  VAL  61          3HG2      VAL  61 -16.699  -7.448 -11.706
  470    H    VAL  62           H        VAL  62 -11.871  -5.676 -10.268
  471    HA   VAL  62           HA       VAL  62 -11.240  -2.913 -10.429
  472    HB   VAL  62           HB       VAL  62  -9.516  -5.279 -11.164
  473   1HG1  VAL  62          1HG1      VAL  62  -8.878  -2.359 -10.757
  474   2HG1  VAL  62          2HG1      VAL  62  -7.660  -3.630 -10.658
  475   3HG1  VAL  62          3HG1      VAL  62  -8.537  -3.374 -12.161
  476   1HG2  VAL  62          1HG2      VAL  62 -10.406  -4.260  -8.624
  477   2HG2  VAL  62          2HG2      VAL  62  -9.476  -5.696  -8.990
  478   3HG2  VAL  62          3HG2      VAL  62  -8.665  -4.156  -8.746
  479    H    THR  63           H        THR  63 -11.727  -1.659 -12.111
  480    HA   THR  63           HA       THR  63 -11.830  -2.824 -14.813
  481    HB   THR  63           HB       THR  63 -12.995  -0.798 -15.448
  482    HG1  THR  63           HG1      THR  63 -13.148   0.913 -14.158
  483   1HG2  THR  63          1HG2      THR  63 -14.373  -2.540 -14.460
  484   2HG2  THR  63          2HG2      THR  63 -14.103  -1.851 -12.858
  485   3HG2  THR  63          3HG2      THR  63 -14.986  -0.932 -14.077
  486    H    SER  64           H        SER  64 -10.036  -0.515 -12.861
  487    HA   SER  64           HA       SER  64  -8.476   0.297 -15.220
  488   1HB   SER  64          1HB       SER  64  -9.495   1.845 -13.273
  489   2HB   SER  64          2HB       SER  64  -7.916   1.518 -12.561
  490    HG   SER  64           HG       SER  64  -7.730   3.310 -13.856
  491    H    VAL  65           H        VAL  65  -6.265   0.110 -15.285
  492    HA   VAL  65           HA       VAL  65  -5.148  -2.234 -14.203
  493    HB   VAL  65           HB       VAL  65  -3.602   0.085 -15.325
  494   1HG1  VAL  65          1HG1      VAL  65  -2.922  -2.637 -14.508
  495   2HG1  VAL  65          2HG1      VAL  65  -2.395  -2.250 -16.148
  496   3HG1  VAL  65          3HG1      VAL  65  -1.905  -1.238 -14.799
  497   1HG2  VAL  65          1HG2      VAL  65  -5.519  -1.678 -16.637
  498   2HG2  VAL  65          2HG2      VAL  65  -4.773  -0.193 -17.177
  499   3HG2  VAL  65          3HG2      VAL  65  -3.932  -1.716 -17.391
  500   1HB   PRO  66          1HB       PRO  66  -3.514  -2.563  -8.921
  501   2HB   PRO  66          2HB       PRO  66  -5.178  -2.018  -9.136
  502   1HG   PRO  66          1HG       PRO  66  -3.643  -3.988 -10.766
  503   2HG   PRO  66          2HG       PRO  66  -5.292  -4.109 -10.128
  504   1HD   PRO  66          1HD       PRO  66  -4.797  -3.445 -12.674
  505   2HD   PRO  66          2HD       PRO  66  -6.135  -2.745 -11.772
  506    H    HIS  67           H        HIS  67  -2.354   0.867 -10.464
  507    HA   HIS  67           HA       HIS  67   0.155  -0.646 -10.400
  508   1HB   HIS  67          1HB       HIS  67   1.154   0.786 -12.104
  509   2HB   HIS  67          2HB       HIS  67  -0.263  -0.019 -12.751
  510    HD1  HIS  67           HD1      HIS  67   0.600   2.382 -14.246
  511    HD2  HIS  67           HD2      HIS  67  -1.967   2.649 -10.995
  512    HE1  HIS  67           HE1      HIS  67  -0.617   4.566 -14.513
  513    HE2  HIS  67           HE2      HIS  67  -2.208   4.665 -12.563
  514    H    ILE  68           H        ILE  68   1.869   0.361  -9.444
  515    HA   ILE  68           HA       ILE  68   1.495   1.858  -7.220
  516    HB   ILE  68           HB       ILE  68   3.771   1.072  -8.852
  517   1HG1  ILE  68          1HG1      ILE  68   3.548   1.718  -5.933
  518   2HG1  ILE  68          2HG1      ILE  68   3.144   0.174  -6.632
  519   1HG2  ILE  68          1HG2      ILE  68   3.949   3.798  -7.580
  520   2HG2  ILE  68          2HG2      ILE  68   5.356   2.806  -7.916
  521   3HG2  ILE  68          3HG2      ILE  68   4.330   3.280  -9.224
  522   1HD1  ILE  68          1HD1      ILE  68   5.874   1.134  -7.222
  523   2HD1  ILE  68          2HD1      ILE  68   5.521   0.715  -5.561
  524   3HD1  ILE  68          3HD1      ILE  68   5.266  -0.463  -6.832
  525    H    THR  69           H        THR  69   0.561   3.765  -6.962
  526    HA   THR  69           HA       THR  69   1.528   6.110  -8.314
  527    HB   THR  69           HB       THR  69  -1.140   4.926  -9.064
  528    HG1  THR  69           HG1      THR  69   1.009   6.044 -10.572
  529   1HG2  THR  69          1HG2      THR  69  -0.361   7.821  -9.155
  530   2HG2  THR  69          2HG2      THR  69  -1.500   7.118 -10.301
  531   3HG2  THR  69          3HG2      THR  69  -1.854   7.087  -8.585

  No H/Q in entry =         531
  Start of MODEL   16
    1    H    SER   1           H        SER   1  18.278   7.276  -8.434
    2    HA   SER   1           HA       SER   1  15.743   7.357  -6.860
    3   1HB   SER   1          1HB       SER   1  17.149   9.375  -7.448
    4   2HB   SER   1          2HB       SER   1  16.701   9.191  -9.150
    5    HG   SER   1           HG       SER   1  15.401  10.669  -7.830
    6    H    ARG   2           H        ARG   2  13.604   7.567  -7.741
    7    HA   ARG   2           HA       ARG   2  11.732   6.640  -8.628
    8   1HB   ARG   2          1HB       ARG   2  13.360   7.135 -11.124
    9   2HB   ARG   2          2HB       ARG   2  11.685   6.598 -11.169
   10   1HG   ARG   2          1HG       ARG   2  11.455   8.723  -9.538
   11   2HG   ARG   2          2HG       ARG   2  12.834   9.233 -10.499
   12   1HD   ARG   2          1HD       ARG   2  11.178  10.035 -11.830
   13   2HD   ARG   2          2HD       ARG   2  11.306   8.413 -12.510
   14    HE   ARG   2           HE       ARG   2   9.164   8.070 -11.850
   15   1HH1  ARG   2          1HH1      ARG   2  10.533  10.537  -9.739
   16   2HH1  ARG   2          2HH1      ARG   2   9.068  10.750  -8.872
   17   1HH2  ARG   2          1HH2      ARG   2   7.223   8.413 -10.685
   18   2HH2  ARG   2          2HH2      ARG   2   7.187   9.614  -9.436
   19    H    ARG   3           H        ARG   3  12.852   4.693  -7.452
   20    HA   ARG   3           HA       ARG   3  12.311   2.383  -9.104
   21   1HB   ARG   3          1HB       ARG   3  14.683   2.923  -9.661
   22   2HB   ARG   3          2HB       ARG   3  15.112   2.685  -7.973
   23   1HG   ARG   3          1HG       ARG   3  13.634   0.437  -9.195
   24   2HG   ARG   3          2HG       ARG   3  15.195   0.782  -9.928
   25   1HD   ARG   3          1HD       ARG   3  14.790   0.418  -6.971
   26   2HD   ARG   3          2HD       ARG   3  15.224  -0.871  -8.063
   27    HE   ARG   3           HE       ARG   3  17.257   0.381  -8.623
   28   1HH1  ARG   3          1HH1      ARG   3  15.657   1.064  -5.555
   29   2HH1  ARG   3          2HH1      ARG   3  17.097   1.643  -4.819
   30   1HH2  ARG   3          1HH2      ARG   3  19.135   1.179  -7.612
   31   2HH2  ARG   3          2HH2      ARG   3  19.061   1.726  -5.970
   32    H    CYS   4           H        CYS   4  10.811   1.703  -7.634
   33    HA   CYS   4           HA       CYS   4  11.748   1.272  -4.886
   34   1HB   CYS   4          1HB       CYS   4   9.521   1.514  -4.115
   35   2HB   CYS   4          2HB       CYS   4   8.880   1.456  -5.762
   36   1HB   PRO   5          1HB       PRO   5  10.204  -3.153  -2.659
   37   2HB   PRO   5          2HB       PRO   5  11.701  -3.920  -3.191
   38   1HG   PRO   5          1HG       PRO   5  11.698  -1.790  -1.571
   39   2HG   PRO   5          2HG       PRO   5  12.956  -2.033  -2.799
   40   1HD   PRO   5          1HD       PRO   5  10.627  -0.172  -2.824
   41   2HD   PRO   5          2HD       PRO   5  12.264   0.043  -3.452
   42    H    GLY   6           H        GLY   6  10.188  -4.823  -5.706
   43   1HA   GLY   6          1HA       GLY   6   8.209  -5.917  -6.070
   44   2HA   GLY   6          2HA       GLY   6   7.366  -4.631  -5.265
   45    H    LYS   7           H        LYS   7   6.172  -5.697  -7.363
   46    HA   LYS   7           HA       LYS   7   6.830  -4.554  -9.883
   47   1HB   LYS   7          1HB       LYS   7   5.527  -6.598  -9.576
   48   2HB   LYS   7          2HB       LYS   7   4.218  -5.675  -8.893
   49   1HG   LYS   7          1HG       LYS   7   3.758  -4.592 -10.905
   50   2HG   LYS   7          2HG       LYS   7   5.258  -5.150 -11.650
   51   1HD   LYS   7          1HD       LYS   7   3.209  -7.125 -10.663
   52   2HD   LYS   7          2HD       LYS   7   2.980  -6.321 -12.201
   53   1HE   LYS   7          1HE       LYS   7   5.552  -7.722 -11.536
   54   2HE   LYS   7          2HE       LYS   7   4.160  -8.567 -12.220
   55   1HZ   LYS   7          1HZ       LYS   7   4.216  -7.054 -14.121
   56   2HZ   LYS   7          2HZ       LYS   7   5.572  -6.280 -13.463
   57   3HZ   LYS   7          3HZ       LYS   7   5.667  -7.897 -13.949
   58    H    ASN   8           H        ASN   8   5.565  -2.942 -11.074
   59    HA   ASN   8           HA       ASN   8   4.492  -0.841  -9.280
   60   1HB   ASN   8          1HB       ASN   8   6.201  -0.719 -11.740
   61   2HB   ASN   8          2HB       ASN   8   5.186   0.652 -11.312
   62   2HD2  ASN   8          2HD2      ASN   8   5.872   2.030  -9.789
   63   1HD2  ASN   8          1HD2      ASN   8   7.272   1.810  -8.815
   64    H    ALA   9           H        ALA   9   3.562  -2.967 -11.740
   65    HA   ALA   9           HA       ALA   9   1.021  -1.618 -11.981
   66   1HB   ALA   9          1HB       ALA   9   2.662  -2.238 -14.425
   67   2HB   ALA   9          2HB       ALA   9   1.013  -1.605 -14.409
   68   3HB   ALA   9          3HB       ALA   9   2.346  -0.627 -13.788
   69    H    TRP  10           H        TRP  10  -0.602  -3.067 -11.955
   70    HA   TRP  10           HA       TRP  10   0.093  -5.880 -12.605
   71   1HB   TRP  10          1HB       TRP  10  -1.801  -4.760 -10.554
   72   2HB   TRP  10          2HB       TRP  10  -1.789  -6.439 -11.063
   73    HD1  TRP  10           HD1      TRP  10   0.045  -8.016 -10.049
   74    HE1  TRP  10           HE1      TRP  10   1.887  -7.683  -8.278
   75    HE3  TRP  10           HE3      TRP  10  -0.121  -2.949  -9.637
   76    HZ2  TRP  10           HZ2      TRP  10   3.096  -5.541  -6.892
   77    HZ3  TRP  10           HZ3      TRP  10   1.383  -1.816  -8.083
   78    HH2  TRP  10           HH2      TRP  10   2.968  -3.089  -6.721
   79   1HB   PRO  11          1HB       PRO  11  -1.962  -5.929 -17.743
   80   2HB   PRO  11          2HB       PRO  11  -1.587  -4.240 -17.423
   81   1HG   PRO  11          1HG       PRO  11   0.534  -5.144 -17.216
   82   2HG   PRO  11          2HG       PRO  11  -0.083  -6.696 -16.620
   83   1HD   PRO  11          1HD       PRO  11   0.607  -5.805 -14.625
   84   2HD   PRO  11          2HD       PRO  11   0.318  -4.126 -15.152
   85    H    GLU  12           H        GLU  12  -1.643  -7.548 -14.988
   86    HA   GLU  12           HA       GLU  12  -3.708  -9.158 -16.042
   87   1HB   GLU  12          1HB       GLU  12  -2.766 -10.931 -14.588
   88   2HB   GLU  12          2HB       GLU  12  -1.568 -10.110 -15.583
   89   1HG   GLU  12          1HG       GLU  12  -1.891  -8.880 -12.951
   90   2HG   GLU  12          2HG       GLU  12  -1.404 -10.571 -12.882
   91    H    LEU  13           H        LEU  13  -3.731  -7.098 -13.319
   92    HA   LEU  13           HA       LEU  13  -5.619  -8.653 -11.797
   93   1HB   LEU  13          1HB       LEU  13  -4.457  -5.900 -11.517
   94   2HB   LEU  13          2HB       LEU  13  -5.813  -6.408 -10.530
   95    HG   LEU  13           HG       LEU  13  -3.051  -7.611 -10.548
   96   1HD1  LEU  13          1HD1      LEU  13  -3.362  -5.472  -9.317
   97   2HD1  LEU  13          2HD1      LEU  13  -4.584  -6.248  -8.351
   98   3HD1  LEU  13          3HD1      LEU  13  -2.938  -6.822  -8.280
   99   1HD2  LEU  13          1HD2      LEU  13  -5.635  -8.637  -9.500
  100   2HD2  LEU  13          2HD2      LEU  13  -4.253  -9.493 -10.173
  101   3HD2  LEU  13          3HD2      LEU  13  -4.194  -8.865  -8.551
  102    H    VAL  14           H        VAL  14  -5.731  -6.418 -14.382
  103    HA   VAL  14           HA       VAL  14  -8.175  -5.156 -13.994
  104    HB   VAL  14           HB       VAL  14  -7.068  -6.136 -16.637
  105   1HG1  VAL  14          1HG1      VAL  14  -9.047  -3.957 -15.969
  106   2HG1  VAL  14          2HG1      VAL  14  -8.327  -4.200 -17.559
  107   3HG1  VAL  14          3HG1      VAL  14  -9.361  -5.446 -16.867
  108   1HG2  VAL  14          1HG2      VAL  14  -5.716  -4.495 -14.926
  109   2HG2  VAL  14          2HG2      VAL  14  -5.603  -4.455 -16.676
  110   3HG2  VAL  14          3HG2      VAL  14  -6.659  -3.325 -15.829
  111    H    GLY  15           H        GLY  15 -10.101  -6.078 -13.574
  112   1HA   GLY  15          1HA       GLY  15 -11.975  -7.289 -14.473
  113   2HA   GLY  15          2HA       GLY  15 -10.872  -8.505 -15.103
  114    H    LYS  16           H        LYS  16  -9.535  -7.908 -12.229
  115    HA   LYS  16           HA       LYS  16 -10.994 -10.116 -10.958
  116   1HB   LYS  16          1HB       LYS  16  -8.233  -9.061 -10.857
  117   2HB   LYS  16          2HB       LYS  16  -8.869  -9.577  -9.312
  118   1HG   LYS  16          1HG       LYS  16  -9.278 -11.430 -11.589
  119   2HG   LYS  16          2HG       LYS  16  -7.614 -11.183 -11.040
  120   1HD   LYS  16          1HD       LYS  16  -8.057 -11.960  -8.885
  121   2HD   LYS  16          2HD       LYS  16  -9.803 -11.798  -9.079
  122   1HE   LYS  16          1HE       LYS  16  -9.818 -13.970  -9.533
  123   2HE   LYS  16          2HE       LYS  16  -9.129 -13.564 -11.100
  124   1HZ   LYS  16          1HZ       LYS  16  -7.569 -14.249  -8.662
  125   2HZ   LYS  16          2HZ       LYS  16  -7.867 -15.281  -9.967
  126   3HZ   LYS  16          3HZ       LYS  16  -6.926 -13.891 -10.194
  127    H    SER  17           H        SER  17 -11.529  -9.998  -8.696
  128    HA   SER  17           HA       SER  17 -12.996  -7.699  -8.028
  129   1HB   SER  17          1HB       SER  17 -13.200 -10.105  -7.088
  130   2HB   SER  17          2HB       SER  17 -13.498  -8.761  -5.988
  131    HG   SER  17           HG       SER  17 -12.118 -10.169  -4.967
  132    H    GLY  18           H        GLY  18 -12.587  -5.933  -6.718
  133   1HA   GLY  18          1HA       GLY  18 -10.062  -4.836  -6.620
  134   2HA   GLY  18          2HA       GLY  18 -11.364  -4.392  -5.532
  135    H    ASN  19           H        ASN  19 -11.528  -7.107  -4.367
  136    HA   ASN  19           HA       ASN  19  -9.632  -6.719  -2.287
  137   1HB   ASN  19          1HB       ASN  19 -11.988  -7.822  -2.203
  138   2HB   ASN  19          2HB       ASN  19 -11.157  -9.293  -2.702
  139   2HD2  ASN  19          2HD2      ASN  19 -12.182  -9.852  -0.526
  140   1HD2  ASN  19          1HD2      ASN  19 -11.171  -9.614   0.855
  141    H    MET  20           H        MET  20  -9.999  -9.298  -4.739
  142    HA   MET  20           HA       MET  20  -7.646 -10.677  -4.015
  143   1HB   MET  20          1HB       MET  20  -9.693 -11.079  -5.850
  144   2HB   MET  20          2HB       MET  20  -8.313 -10.811  -6.887
  145   1HG   MET  20          1HG       MET  20  -7.998 -12.995  -6.651
  146   2HG   MET  20          2HG       MET  20  -7.213 -12.549  -5.141
  147   1HE   MET  20          1HE       MET  20  -8.016 -12.897  -2.931
  148   2HE   MET  20          2HE       MET  20  -9.531 -11.985  -2.956
  149   3HE   MET  20          3HE       MET  20  -9.517 -13.666  -2.417
  150    H    ALA  21           H        ALA  21  -8.238  -7.991  -6.222
  151    HA   ALA  21           HA       ALA  21  -5.704  -7.931  -7.428
  152   1HB   ALA  21          1HB       ALA  21  -7.914  -5.961  -7.086
  153   2HB   ALA  21          2HB       ALA  21  -6.357  -5.401  -7.697
  154   3HB   ALA  21          3HB       ALA  21  -7.237  -6.656  -8.561
  155    H    ALA  22           H        ALA  22  -6.997  -5.955  -4.753
  156    HA   ALA  22           HA       ALA  22  -4.638  -4.631  -4.109
  157   1HB   ALA  22          1HB       ALA  22  -6.849  -5.500  -2.250
  158   2HB   ALA  22          2HB       ALA  22  -6.780  -3.992  -3.159
  159   3HB   ALA  22          3HB       ALA  22  -5.614  -4.295  -1.867
  160    H    ALA  23           H        ALA  23  -5.766  -7.842  -3.192
  161    HA   ALA  23           HA       ALA  23  -3.762  -8.372  -1.255
  162   1HB   ALA  23          1HB       ALA  23  -5.327 -10.307  -2.969
  163   2HB   ALA  23          2HB       ALA  23  -4.412 -10.718  -1.517
  164   3HB   ALA  23          3HB       ALA  23  -5.829  -9.672  -1.405
  165    H    THR  24           H        THR  24  -3.998  -8.955  -4.743
  166    HA   THR  24           HA       THR  24  -1.630 -10.429  -5.054
  167    HB   THR  24           HB       THR  24  -2.835  -8.495  -7.042
  168    HG1  THR  24           HG1      THR  24  -3.820 -10.666  -7.726
  169   1HG2  THR  24          1HG2      THR  24  -1.222 -10.994  -7.477
  170   2HG2  THR  24          2HG2      THR  24  -1.984 -10.025  -8.737
  171   3HG2  THR  24          3HG2      THR  24  -0.678  -9.344  -7.769
  172    H    VAL  25           H        VAL  25  -2.223  -6.939  -5.153
  173    HA   VAL  25           HA       VAL  25   0.417  -6.186  -5.856
  174    HB   VAL  25           HB       VAL  25  -1.586  -4.548  -4.289
  175   1HG1  VAL  25          1HG1      VAL  25   1.085  -3.997  -5.235
  176   2HG1  VAL  25          2HG1      VAL  25  -0.072  -2.919  -5.998
  177   3HG1  VAL  25          3HG1      VAL  25   0.011  -3.023  -4.252
  178   1HG2  VAL  25          1HG2      VAL  25  -1.266  -4.905  -7.265
  179   2HG2  VAL  25          2HG2      VAL  25  -2.662  -5.293  -6.287
  180   3HG2  VAL  25          3HG2      VAL  25  -2.211  -3.624  -6.521
  181    H    GLU  26           H        GLU  26  -1.222  -6.236  -2.683
  182    HA   GLU  26           HA       GLU  26   1.061  -5.440  -1.202
  183   1HB   GLU  26          1HB       GLU  26  -1.246  -7.100  -0.178
  184   2HB   GLU  26          2HB       GLU  26  -0.146  -6.098   0.752
  185   1HG   GLU  26          1HG       GLU  26  -1.336  -4.419  -1.228
  186   2HG   GLU  26          2HG       GLU  26  -2.609  -5.421  -0.534
  187    H    ARG  27           H        ARG  27  -0.025  -8.573  -2.362
  188    HA   ARG  27           HA       ARG  27   1.804 -10.053  -0.680
  189   1HB   ARG  27          1HB       ARG  27  -0.440 -10.852  -1.719
  190   2HB   ARG  27          2HB       ARG  27   0.497 -11.156  -3.170
  191   1HG   ARG  27          1HG       ARG  27   1.804 -12.283  -0.833
  192   2HG   ARG  27          2HG       ARG  27   0.122 -12.797  -0.912
  193   1HD   ARG  27          1HD       ARG  27   2.092 -12.998  -3.181
  194   2HD   ARG  27          2HD       ARG  27   1.698 -14.319  -2.095
  195    HE   ARG  27           HE       ARG  27   0.044 -13.201  -4.217
  196   1HH1  ARG  27          1HH1      ARG  27   0.195 -15.356  -1.436
  197   2HH1  ARG  27          2HH1      ARG  27  -1.205 -16.234  -1.910
  198   1HH2  ARG  27          1HH2      ARG  27  -1.814 -14.388  -4.809
  199   2HH2  ARG  27          2HH2      ARG  27  -2.354 -15.692  -3.803
  200    H    GLU  28           H        GLU  28   1.602  -9.438  -4.198
  201    HA   GLU  28           HA       GLU  28   4.144 -10.553  -4.789
  202   1HB   GLU  28          1HB       GLU  28   2.429  -8.560  -6.287
  203   2HB   GLU  28          2HB       GLU  28   3.928  -9.220  -6.929
  204   1HG   GLU  28          1HG       GLU  28   2.950 -11.503  -6.673
  205   2HG   GLU  28          2HG       GLU  28   1.423 -10.732  -6.243
  206    H    ASN  29           H        ASN  29   3.088  -7.327  -3.851
  207    HA   ASN  29           HA       ASN  29   5.920  -6.498  -3.699
  208   1HB   ASN  29          1HB       ASN  29   4.777  -5.318  -5.518
  209   2HB   ASN  29          2HB       ASN  29   3.528  -4.781  -4.406
  210   2HD2  ASN  29          2HD2      ASN  29   5.146  -3.077  -5.977
  211   1HD2  ASN  29          1HD2      ASN  29   6.184  -2.185  -4.935
  212    H    ARG  30           H        ARG  30   5.839  -7.343  -1.529
  213    HA   ARG  30           HA       ARG  30   4.054  -6.349   0.436
  214   1HB   ARG  30          1HB       ARG  30   5.619  -8.407   0.499
  215   2HB   ARG  30          2HB       ARG  30   6.853  -7.275   1.040
  216   1HG   ARG  30          1HG       ARG  30   6.140  -7.656   3.093
  217   2HG   ARG  30          2HG       ARG  30   4.728  -6.676   2.712
  218   1HD   ARG  30          1HD       ARG  30   3.670  -8.806   1.835
  219   2HD   ARG  30          2HD       ARG  30   5.009  -9.677   2.577
  220    HE   ARG  30           HE       ARG  30   4.019  -8.114   4.594
  221   1HH1  ARG  30          1HH1      ARG  30   2.635 -10.517   2.432
  222   2HH1  ARG  30          2HH1      ARG  30   1.440 -11.004   3.570
  223   1HH2  ARG  30          1HH2      ARG  30   2.429  -8.784   6.080
  224   2HH2  ARG  30          2HH2      ARG  30   1.332 -10.053   5.645
  225    H    ASN  31           H        ASN  31   6.431  -4.678  -1.259
  226    HA   ASN  31           HA       ASN  31   7.202  -2.966   0.949
  227   1HB   ASN  31          1HB       ASN  31   8.844  -3.626  -0.777
  228   2HB   ASN  31          2HB       ASN  31   7.887  -2.789  -1.993
  229   2HD2  ASN  31          2HD2      ASN  31   9.763  -2.345   0.957
  230   1HD2  ASN  31          1HD2      ASN  31  10.148  -0.688   0.655
  231    H    VAL  32           H        VAL  32   4.514  -3.196  -0.983
  232    HA   VAL  32           HA       VAL  32   3.927  -0.345  -0.620
  233    HB   VAL  32           HB       VAL  32   3.029  -0.105  -2.792
  234   1HG1  VAL  32          1HG1      VAL  32   5.688  -1.527  -2.947
  235   2HG1  VAL  32          2HG1      VAL  32   4.978  -0.615  -4.241
  236   3HG1  VAL  32          3HG1      VAL  32   5.419   0.170  -2.740
  237   1HG2  VAL  32          1HG2      VAL  32   3.250  -3.081  -2.944
  238   2HG2  VAL  32          2HG2      VAL  32   1.901  -2.038  -3.322
  239   3HG2  VAL  32          3HG2      VAL  32   3.259  -2.134  -4.425
  240    H    HIS  33           H        HIS  33   1.543   0.067  -1.038
  241    HA   HIS  33           HA       HIS  33  -0.091  -2.210  -0.215
  242   1HB   HIS  33          1HB       HIS  33  -0.729  -1.300   1.757
  243   2HB   HIS  33          2HB       HIS  33   0.666  -0.262   1.582
  244    HD1  HIS  33           HD1      HIS  33  -2.738  -0.028   2.378
  245    HD2  HIS  33           HD2      HIS  33  -0.235   2.191  -0.062
  246    HE1  HIS  33           HE1      HIS  33  -3.847   2.215   2.125
  247    HE2  HIS  33           HE2      HIS  33  -2.266   3.562   0.705
  248    H    ALA  34           H        ALA  34  -2.054  -2.350  -1.170
  249    HA   ALA  34           HA       ALA  34  -2.665  -0.258  -3.141
  250   1HB   ALA  34          1HB       ALA  34  -3.588  -3.117  -3.073
  251   2HB   ALA  34          2HB       ALA  34  -3.890  -1.942  -4.360
  252   3HB   ALA  34          3HB       ALA  34  -2.253  -2.489  -4.038
  253    H    ILE  35           H        ILE  35  -4.378   1.006  -2.876
  254    HA   ILE  35           HA       ILE  35  -6.302   0.360  -0.756
  255    HB   ILE  35           HB       ILE  35  -6.179   2.898  -2.386
  256   1HG1  ILE  35          1HG1      ILE  35  -4.416   1.937  -0.231
  257   2HG1  ILE  35          2HG1      ILE  35  -5.057   3.544   0.048
  258   1HG2  ILE  35          1HG2      ILE  35  -7.357   2.249   0.307
  259   2HG2  ILE  35          2HG2      ILE  35  -7.316   3.857  -0.429
  260   3HG2  ILE  35          3HG2      ILE  35  -8.247   2.570  -1.183
  261   1HD1  ILE  35          1HD1      ILE  35  -4.027   3.195  -2.657
  262   2HD1  ILE  35          2HD1      ILE  35  -3.728   4.435  -1.445
  263   3HD1  ILE  35          3HD1      ILE  35  -2.829   2.927  -1.401
  264    H    VAL  36           H        VAL  36  -8.510   0.123  -1.150
  265    HA   VAL  36           HA       VAL  36  -9.179  -0.453  -3.952
  266    HB   VAL  36           HB       VAL  36 -10.626  -1.208  -1.428
  267   1HG1  VAL  36          1HG1      VAL  36 -11.134  -1.892  -4.324
  268   2HG1  VAL  36          2HG1      VAL  36 -11.862  -2.755  -2.973
  269   3HG1  VAL  36          3HG1      VAL  36 -12.217  -1.048  -3.213
  270   1HG2  VAL  36          1HG2      VAL  36  -8.858  -2.816  -3.275
  271   2HG2  VAL  36          2HG2      VAL  36  -8.504  -2.349  -1.604
  272   3HG2  VAL  36          3HG2      VAL  36  -9.819  -3.484  -1.939
  273    H    LEU  37           H        LEU  37 -10.120   1.090  -5.064
  274    HA   LEU  37           HA       LEU  37 -12.355   2.551  -3.873
  275   1HB   LEU  37          1HB       LEU  37 -11.336   4.598  -5.221
  276   2HB   LEU  37          2HB       LEU  37 -11.002   4.285  -3.542
  277    HG   LEU  37           HG       LEU  37  -9.014   2.876  -5.082
  278   1HD1  LEU  37          1HD1      LEU  37  -9.551   5.661  -6.010
  279   2HD1  LEU  37          2HD1      LEU  37  -7.953   4.926  -6.107
  280   3HD1  LEU  37          3HD1      LEU  37  -9.313   4.207  -6.947
  281   1HD2  LEU  37          1HD2      LEU  37  -9.088   4.052  -2.716
  282   2HD2  LEU  37          2HD2      LEU  37  -7.624   3.838  -3.615
  283   3HD2  LEU  37          3HD2      LEU  37  -8.414   5.387  -3.617
  284    H    LYS  38           H        LYS  38 -13.920   3.186  -5.309
  285    HA   LYS  38           HA       LYS  38 -13.920   1.724  -7.797
  286   1HB   LYS  38          1HB       LYS  38 -16.228   2.217  -7.927
  287   2HB   LYS  38          2HB       LYS  38 -16.048   3.585  -6.835
  288   1HG   LYS  38          1HG       LYS  38 -16.677   0.854  -6.257
  289   2HG   LYS  38          2HG       LYS  38 -15.182   1.253  -5.427
  290   1HD   LYS  38          1HD       LYS  38 -17.088   1.719  -4.011
  291   2HD   LYS  38          2HD       LYS  38 -16.266   3.224  -4.433
  292   1HE   LYS  38          1HE       LYS  38 -17.999   3.483  -6.290
  293   2HE   LYS  38          2HE       LYS  38 -18.566   3.658  -4.643
  294   1HZ   LYS  38          1HZ       LYS  38 -19.384   1.403  -4.685
  295   2HZ   LYS  38          2HZ       LYS  38 -20.059   2.304  -5.946
  296   3HZ   LYS  38          3HZ       LYS  38 -18.825   1.188  -6.270
  297    H    GLU  39           H        GLU  39 -14.354   2.638  -9.855
  298    HA   GLU  39           HA       GLU  39 -12.799   4.861 -10.524
  299   1HB   GLU  39          1HB       GLU  39 -13.879   2.935 -11.981
  300   2HB   GLU  39          2HB       GLU  39 -15.152   4.117 -12.236
  301   1HG   GLU  39          1HG       GLU  39 -12.578   5.358 -12.645
  302   2HG   GLU  39          2HG       GLU  39 -12.668   3.851 -13.554
  303    H    GLY  40           H        GLY  40 -13.095   6.829  -9.759
  304   1HA   GLY  40          1HA       GLY  40 -14.519   8.814 -10.346
  305   2HA   GLY  40          2HA       GLY  40 -15.863   7.914  -9.668
  306    H    SER  41           H        SER  41 -13.475   6.937  -7.731
  307    HA   SER  41           HA       SER  41 -14.273   8.618  -5.592
  308   1HB   SER  41          1HB       SER  41 -13.509   6.279  -5.319
  309   2HB   SER  41          2HB       SER  41 -11.876   6.774  -5.711
  310    HG   SER  41           HG       SER  41 -12.457   6.679  -3.401
  311    H    ALA  42           H        ALA  42 -12.806   9.953  -4.289
  312    HA   ALA  42           HA       ALA  42 -11.289  11.755  -6.014
  313   1HB   ALA  42          1HB       ALA  42 -12.873  12.641  -4.373
  314   2HB   ALA  42          2HB       ALA  42 -11.236  13.227  -4.094
  315   3HB   ALA  42          3HB       ALA  42 -11.907  11.956  -3.067
  316    H    MET  43           H        MET  43  -9.424  10.520  -6.522
  317    HA   MET  43           HA       MET  43  -7.570  10.127  -4.242
  318   1HB   MET  43          1HB       MET  43  -8.148   8.466  -6.675
  319   2HB   MET  43          2HB       MET  43  -6.580   8.418  -5.936
  320   1HG   MET  43          1HG       MET  43  -7.919   6.663  -5.056
  321   2HG   MET  43          2HG       MET  43  -7.571   7.803  -3.798
  322   1HE   MET  43          1HE       MET  43  -9.057   8.184  -2.180
  323   2HE   MET  43          2HE       MET  43 -10.820   8.111  -2.220
  324   3HE   MET  43          3HE       MET  43  -9.875   6.629  -2.330
  325    H    THR  44           H        THR  44  -5.545  10.916  -4.410
  326    HA   THR  44           HA       THR  44  -5.067  13.055  -6.183
  327    HB   THR  44           HB       THR  44  -2.562  12.486  -5.318
  328    HG1  THR  44           HG1      THR  44  -2.911  11.581  -3.147
  329   1HG2  THR  44          1HG2      THR  44  -3.803  14.511  -4.741
  330   2HG2  THR  44          2HG2      THR  44  -4.696  13.604  -3.517
  331   3HG2  THR  44          3HG2      THR  44  -2.951  13.820  -3.358
  332    H    LYS  45           H        LYS  45  -3.264  13.273  -7.690
  333    HA   LYS  45           HA       LYS  45  -3.108  10.922  -9.456
  334   1HB   LYS  45          1HB       LYS  45  -2.818  13.871  -9.803
  335   2HB   LYS  45          2HB       LYS  45  -1.985  12.818 -10.931
  336   1HG   LYS  45          1HG       LYS  45  -3.809  12.300 -12.042
  337   2HG   LYS  45          2HG       LYS  45  -4.739  11.999 -10.567
  338   1HD   LYS  45          1HD       LYS  45  -4.450  14.772 -10.604
  339   2HD   LYS  45          2HD       LYS  45  -4.618  14.352 -12.304
  340   1HE   LYS  45          1HE       LYS  45  -6.795  14.159 -12.035
  341   2HE   LYS  45          2HE       LYS  45  -6.574  12.850 -10.880
  342   1HZ   LYS  45          1HZ       LYS  45  -6.373  14.521  -9.115
  343   2HZ   LYS  45          2HZ       LYS  45  -6.643  15.748 -10.251
  344   3HZ   LYS  45          3HZ       LYS  45  -7.851  14.603  -9.905
  345    H    ASP  46           H        ASP  46  -1.189  12.880  -7.350
  346    HA   ASP  46           HA       ASP  46   1.358  12.712  -8.238
  347   1HB   ASP  46          1HB       ASP  46   2.083  12.582  -5.879
  348   2HB   ASP  46          2HB       ASP  46   0.443  12.127  -5.405
  349    H    PHE  47           H        PHE  47   3.164  11.253  -7.616
  350    HA   PHE  47           HA       PHE  47   2.340   8.456  -8.063
  351   1HB   PHE  47          1HB       PHE  47   3.805   9.251  -9.749
  352   2HB   PHE  47          2HB       PHE  47   4.922   9.930  -8.574
  353    HD1  PHE  47           HD1      PHE  47   3.696   6.839 -10.133
  354    HD2  PHE  47           HD2      PHE  47   6.509   8.532  -7.414
  355    HE1  PHE  47           HE1      PHE  47   4.965   4.748 -10.133
  356    HE2  PHE  47           HE2      PHE  47   7.765   6.429  -7.411
  357    HZ   PHE  47           HZ       PHE  47   6.982   4.514  -8.750
  358    H    ARG  48           H        ARG  48   2.647   6.928  -6.580
  359    HA   ARG  48           HA       ARG  48   4.628   7.279  -4.448
  360   1HB   ARG  48          1HB       ARG  48   1.687   6.859  -3.964
  361   2HB   ARG  48          2HB       ARG  48   2.917   6.613  -2.728
  362   1HG   ARG  48          1HG       ARG  48   3.484   8.910  -2.719
  363   2HG   ARG  48          2HG       ARG  48   2.521   9.237  -4.153
  364   1HD   ARG  48          1HD       ARG  48   0.509   8.573  -2.883
  365   2HD   ARG  48          2HD       ARG  48   1.312  10.020  -2.304
  366    HE   ARG  48           HE       ARG  48   1.739   7.370  -1.048
  367   1HH1  ARG  48          1HH1      ARG  48   0.793  10.752  -0.742
  368   2HH1  ARG  48          2HH1      ARG  48   0.755  10.687   0.974
  369   1HH2  ARG  48          1HH2      ARG  48   1.671   7.331   1.224
  370   2HH2  ARG  48          2HH2      ARG  48   1.239   8.764   2.097
  371    H    CYS  49           H        CYS  49   5.800   5.487  -4.589
  372    HA   CYS  49           HA       CYS  49   5.056   3.147  -5.868
  373   1HB   CYS  49          1HB       CYS  49   7.137   3.358  -3.704
  374   2HB   CYS  49          2HB       CYS  49   7.029   2.115  -4.943
  375    H    ASP  50           H        ASP  50   4.903   3.991  -2.455
  376    HA   ASP  50           HA       ASP  50   4.035   1.379  -1.663
  377   1HB   ASP  50          1HB       ASP  50   5.320   2.745  -0.133
  378   2HB   ASP  50          2HB       ASP  50   3.752   2.340   0.557
  379    H    ARG  51           H        ARG  51   2.412   3.645  -3.383
  380    HA   ARG  51           HA       ARG  51  -0.151   2.889  -2.164
  381   1HB   ARG  51          1HB       ARG  51   0.532   5.309  -1.864
  382   2HB   ARG  51          2HB       ARG  51   0.381   5.480  -3.605
  383   1HG   ARG  51          1HG       ARG  51  -2.006   4.628  -3.338
  384   2HG   ARG  51          2HG       ARG  51  -1.730   4.850  -1.606
  385   1HD   ARG  51          1HD       ARG  51  -2.737   6.827  -2.234
  386   2HD   ARG  51          2HD       ARG  51  -1.041   7.226  -2.169
  387    HE   ARG  51           HE       ARG  51  -1.969   6.412  -4.790
  388   1HH1  ARG  51          1HH1      ARG  51  -1.604   9.133  -2.584
  389   2HH1  ARG  51          2HH1      ARG  51  -1.580  10.285  -3.859
  390   1HH2  ARG  51          1HH2      ARG  51  -1.987   7.990  -6.441
  391   2HH2  ARG  51          2HH2      ARG  51  -1.807   9.654  -6.034
  392    H    VAL  52           H        VAL  52  -1.288   1.640  -3.446
  393    HA   VAL  52           HA       VAL  52  -1.055   2.010  -6.379
  394    HB   VAL  52           HB       VAL  52  -1.568  -0.592  -4.946
  395   1HG1  VAL  52          1HG1      VAL  52  -1.364   0.135  -7.842
  396   2HG1  VAL  52          2HG1      VAL  52  -1.177  -1.514  -7.270
  397   3HG1  VAL  52          3HG1      VAL  52  -2.691  -0.659  -7.016
  398   1HG2  VAL  52          1HG2      VAL  52   0.899   0.740  -5.591
  399   2HG2  VAL  52          2HG2      VAL  52   0.612  -0.736  -4.684
  400   3HG2  VAL  52          3HG2      VAL  52   0.769  -0.798  -6.429
  401    H    TRP  53           H        TRP  53  -2.875   2.833  -7.162
  402    HA   TRP  53           HA       TRP  53  -5.333   2.739  -5.675
  403   1HB   TRP  53          1HB       TRP  53  -4.607   3.856  -8.370
  404   2HB   TRP  53          2HB       TRP  53  -6.257   3.893  -7.776
  405    HD1  TRP  53           HD1      TRP  53  -4.373   6.460  -8.491
  406    HE1  TRP  53           HE1      TRP  53  -4.196   8.316  -6.723
  407    HE3  TRP  53           HE3      TRP  53  -5.716   3.800  -4.344
  408    HZ2  TRP  53           HZ2      TRP  53  -4.532   8.603  -3.959
  409    HZ3  TRP  53           HZ3      TRP  53  -5.774   4.944  -2.192
  410    HH2  TRP  53           HH2      TRP  53  -5.177   7.289  -1.986
  411    H    VAL  54           H        VAL  54  -6.858   1.255  -5.768
  412    HA   VAL  54           HA       VAL  54  -6.845  -0.627  -8.056
  413    HB   VAL  54           HB       VAL  54  -7.830  -0.907  -5.227
  414   1HG1  VAL  54          1HG1      VAL  54  -8.451  -2.556  -7.620
  415   2HG1  VAL  54          2HG1      VAL  54  -8.394  -3.292  -6.021
  416   3HG1  VAL  54          3HG1      VAL  54  -9.535  -1.997  -6.353
  417   1HG2  VAL  54          1HG2      VAL  54  -5.438  -1.258  -5.601
  418   2HG2  VAL  54          2HG2      VAL  54  -6.260  -2.736  -5.100
  419   3HG2  VAL  54          3HG2      VAL  54  -5.826  -2.500  -6.796
  420    H    ILE  55           H        ILE  55  -8.008   0.734  -9.422
  421    HA   ILE  55           HA       ILE  55 -10.516   1.863  -8.618
  422    HB   ILE  55           HB       ILE  55  -9.420   1.708 -11.408
  423   1HG1  ILE  55          1HG1      ILE  55  -8.869   4.210 -10.726
  424   2HG1  ILE  55          2HG1      ILE  55  -8.843   3.550  -9.094
  425   1HG2  ILE  55          1HG2      ILE  55 -11.503   3.428 -10.094
  426   2HG2  ILE  55          2HG2      ILE  55 -10.856   3.729 -11.704
  427   3HG2  ILE  55          3HG2      ILE  55 -11.758   2.246 -11.376
  428   1HD1  ILE  55          1HD1      ILE  55  -7.269   1.975 -10.984
  429   2HD1  ILE  55          2HD1      ILE  55  -6.753   3.650 -10.853
  430   3HD1  ILE  55          3HD1      ILE  55  -6.846   2.647  -9.420
  431    H    VAL  56           H        VAL  56 -12.296   0.676  -8.417
  432    HA   VAL  56           HA       VAL  56 -12.746  -1.512 -10.315
  433    HB   VAL  56           HB       VAL  56 -14.001  -2.666  -8.594
  434   1HG1  VAL  56          1HG1      VAL  56 -11.210  -1.848  -7.843
  435   2HG1  VAL  56          2HG1      VAL  56 -12.119  -3.046  -6.934
  436   3HG1  VAL  56          3HG1      VAL  56 -11.753  -3.322  -8.612
  437   1HG2  VAL  56          1HG2      VAL  56 -13.284  -0.346  -6.831
  438   2HG2  VAL  56          2HG2      VAL  56 -14.901  -0.809  -7.357
  439   3HG2  VAL  56          3HG2      VAL  56 -14.005  -1.853  -6.266
  440    H    ASN  57           H        ASN  57 -15.065  -2.083 -10.601
  441    HA   ASN  57           HA       ASN  57 -16.547   0.354 -11.182
  442   1HB   ASN  57          1HB       ASN  57 -16.439  -1.431 -12.859
  443   2HB   ASN  57          2HB       ASN  57 -18.077  -1.117 -12.400
  444   2HD2  ASN  57          2HD2      ASN  57 -17.371  -3.458 -13.650
  445   1HD2  ASN  57          1HD2      ASN  57 -17.576  -4.756 -12.531
  446    H    ASP  58           H        ASP  58 -19.138  -0.244 -10.935
  447    HA   ASP  58           HA       ASP  58 -19.682   0.211  -8.227
  448   1HB   ASP  58          1HB       ASP  58 -21.541  -0.789 -10.402
  449   2HB   ASP  58          2HB       ASP  58 -22.043  -0.118  -8.849
  450    H    HIS  59           H        HIS  59 -19.206  -2.759  -9.952
  451    HA   HIS  59           HA       HIS  59 -20.542  -4.371  -7.930
  452   1HB   HIS  59          1HB       HIS  59 -19.323  -4.866 -10.617
  453   2HB   HIS  59          2HB       HIS  59 -19.394  -6.216  -9.488
  454    HD1  HIS  59           HD1      HIS  59 -21.812  -6.909  -8.638
  455    HD2  HIS  59           HD2      HIS  59 -21.710  -4.275 -11.852
  456    HE1  HIS  59           HE1      HIS  59 -24.114  -6.991  -9.654
  457    HE2  HIS  59           HE2      HIS  59 -24.047  -5.332 -11.545
  458    H    GLY  60           H        GLY  60 -17.435  -3.034  -8.387
  459   1HA   GLY  60          1HA       GLY  60 -15.760  -3.159  -6.775
  460   2HA   GLY  60          2HA       GLY  60 -16.407  -4.689  -6.205
  461    H    VAL  61           H        VAL  61 -15.961  -4.097  -9.605
  462    HA   VAL  61           HA       VAL  61 -13.848  -6.145  -9.663
  463    HB   VAL  61           HB       VAL  61 -15.461  -5.054 -11.975
  464   1HG1  VAL  61          1HG1      VAL  61 -13.751  -7.514 -11.684
  465   2HG1  VAL  61          2HG1      VAL  61 -14.734  -7.118 -13.094
  466   3HG1  VAL  61          3HG1      VAL  61 -13.382  -6.085 -12.650
  467   1HG2  VAL  61          1HG2      VAL  61 -15.964  -7.501 -10.288
  468   2HG2  VAL  61          2HG2      VAL  61 -16.990  -6.070 -10.402
  469   3HG2  VAL  61          3HG2      VAL  61 -16.793  -7.122 -11.799
  470    H    VAL  62           H        VAL  62 -11.821  -5.648 -10.378
  471    HA   VAL  62           HA       VAL  62 -11.056  -2.909 -10.539
  472    HB   VAL  62           HB       VAL  62  -9.476  -5.370 -11.283
  473   1HG1  VAL  62          1HG1      VAL  62  -8.670  -3.197 -12.291
  474   2HG1  VAL  62          2HG1      VAL  62  -8.377  -2.626 -10.646
  475   3HG1  VAL  62          3HG1      VAL  62  -7.557  -4.051 -11.271
  476   1HG2  VAL  62          1HG2      VAL  62  -9.593  -3.743  -8.749
  477   2HG2  VAL  62          2HG2      VAL  62 -10.130  -5.393  -8.949
  478   3HG2  VAL  62          3HG2      VAL  62  -8.434  -5.005  -9.081
  479    H    THR  63           H        THR  63 -11.690  -1.670 -12.181
  480    HA   THR  63           HA       THR  63 -11.909  -2.769 -14.879
  481    HB   THR  63           HB       THR  63 -12.944  -0.656 -15.450
  482    HG1  THR  63           HG1      THR  63 -12.870   1.064 -14.174
  483   1HG2  THR  63          1HG2      THR  63 -14.370  -2.321 -14.303
  484   2HG2  THR  63          2HG2      THR  63 -14.032  -1.519 -12.775
  485   3HG2  THR  63          3HG2      THR  63 -14.875  -0.651 -14.056
  486    H    SER  64           H        SER  64  -9.917  -0.567 -13.010
  487    HA   SER  64           HA       SER  64  -8.326   0.040 -15.422
  488   1HB   SER  64          1HB       SER  64  -9.275   1.783 -13.599
  489   2HB   SER  64          2HB       SER  64  -7.730   1.398 -12.852
  490    HG   SER  64           HG       SER  64  -6.965   2.790 -14.242
  491    H    VAL  65           H        VAL  65  -6.072  -0.122 -15.347
  492    HA   VAL  65           HA       VAL  65  -5.093  -2.514 -14.218
  493    HB   VAL  65           HB       VAL  65  -3.449  -0.223 -15.281
  494   1HG1  VAL  65          1HG1      VAL  65  -2.829  -2.940 -14.381
  495   2HG1  VAL  65          2HG1      VAL  65  -2.203  -2.562 -15.986
  496   3HG1  VAL  65          3HG1      VAL  65  -1.791  -1.544 -14.611
  497   1HG2  VAL  65          1HG2      VAL  65  -5.176  -0.836 -16.904
  498   2HG2  VAL  65          2HG2      VAL  65  -3.584  -1.342 -17.443
  499   3HG2  VAL  65          3HG2      VAL  65  -4.692  -2.519 -16.780
  500   1HB   PRO  66          1HB       PRO  66  -3.391  -3.319  -9.423
  501   2HB   PRO  66          2HB       PRO  66  -4.674  -2.350  -8.713
  502   1HG   PRO  66          1HG       PRO  66  -5.136  -4.513 -10.213
  503   2HG   PRO  66          2HG       PRO  66  -6.237  -3.176 -10.082
  504   1HD   PRO  66          1HD       PRO  66  -4.424  -3.887 -12.314
  505   2HD   PRO  66          2HD       PRO  66  -5.998  -3.140 -12.376
  506    H    HIS  67           H        HIS  67  -2.605   0.601 -10.919
  507    HA   HIS  67           HA       HIS  67   0.029  -0.691 -10.654
  508   1HB   HIS  67          1HB       HIS  67  -0.435  -0.035 -12.981
  509   2HB   HIS  67          2HB       HIS  67   0.915   0.870 -12.305
  510    HD1  HIS  67           HD1      HIS  67   0.203   2.477 -14.405
  511    HD2  HIS  67           HD2      HIS  67  -2.349   2.425 -11.134
  512    HE1  HIS  67           HE1      HIS  67  -1.206   4.555 -14.594
  513    HE2  HIS  67           HE2      HIS  67  -2.647   4.552 -12.534
  514    H    ILE  68           H        ILE  68   1.637   0.366  -9.637
  515    HA   ILE  68           HA       ILE  68   1.141   1.826  -7.407
  516    HB   ILE  68           HB       ILE  68   3.462   1.043  -8.934
  517   1HG1  ILE  68          1HG1      ILE  68   3.318   1.939  -6.082
  518   2HG1  ILE  68          2HG1      ILE  68   2.761   0.378  -6.607
  519   1HG2  ILE  68          1HG2      ILE  68   3.565   3.867  -7.909
  520   2HG2  ILE  68          2HG2      ILE  68   4.994   2.879  -8.090
  521   3HG2  ILE  68          3HG2      ILE  68   4.000   3.208  -9.490
  522   1HD1  ILE  68          1HD1      ILE  68   5.064  -0.003  -7.548
  523   2HD1  ILE  68          2HD1      ILE  68   5.583   1.391  -6.630
  524   3HD1  ILE  68          3HD1      ILE  68   4.914   0.002  -5.816
  525    H    THR  69           H        THR  69   0.272   3.752  -7.094
  526    HA   THR  69           HA       THR  69   1.164   6.082  -8.547
  527    HB   THR  69           HB       THR  69  -1.544   4.878  -9.085
  528    HG1  THR  69           HG1      THR  69   0.467   6.048 -10.740
  529   1HG2  THR  69          1HG2      THR  69  -0.819   7.787  -9.294
  530   2HG2  THR  69          2HG2      THR  69  -2.083   7.040 -10.263
  531   3HG2  THR  69          3HG2      THR  69  -2.217   7.061  -8.515

  No H/Q in entry =         531
  Start of MODEL   17
    1    H    SER   1           H        SER   1  16.317   8.204  -8.446
    2    HA   SER   1           HA       SER   1  15.359   8.516 -10.623
    3   1HB   SER   1          1HB       SER   1  17.536   6.450 -11.230
    4   2HB   SER   1          2HB       SER   1  16.757   7.477 -12.426
    5    HG   SER   1           HG       SER   1  18.460   8.231 -10.314
    6    H    ARG   2           H        ARG   2  13.353   7.299  -9.629
    7    HA   ARG   2           HA       ARG   2  11.487   6.032  -9.811
    8   1HB   ARG   2          1HB       ARG   2  12.327   6.155 -12.710
    9   2HB   ARG   2          2HB       ARG   2  10.817   5.434 -12.183
   10   1HG   ARG   2          1HG       ARG   2   9.863   7.415 -11.630
   11   2HG   ARG   2          2HG       ARG   2  11.397   8.201 -11.270
   12   1HD   ARG   2          1HD       ARG   2  11.623   8.980 -13.326
   13   2HD   ARG   2          2HD       ARG   2  11.231   7.434 -14.075
   14    HE   ARG   2           HE       ARG   2   9.536   9.658 -13.866
   15   1HH1  ARG   2          1HH1      ARG   2   9.430   6.160 -13.495
   16   2HH1  ARG   2          2HH1      ARG   2   7.769   6.062 -13.860
   17   1HH2  ARG   2          1HH2      ARG   2   7.322   9.479 -14.398
   18   2HH2  ARG   2          2HH2      ARG   2   6.565   7.920 -14.398
   19    H    ARG   3           H        ARG   3  12.452   4.345  -8.561
   20    HA   ARG   3           HA       ARG   3  12.272   1.804  -9.836
   21   1HB   ARG   3          1HB       ARG   3  14.869   3.011  -9.779
   22   2HB   ARG   3          2HB       ARG   3  14.907   1.658  -8.667
   23   1HG   ARG   3          1HG       ARG   3  13.743   1.282 -11.402
   24   2HG   ARG   3          2HG       ARG   3  15.490   1.375 -11.188
   25   1HD   ARG   3          1HD       ARG   3  15.592  -0.692 -10.442
   26   2HD   ARG   3          2HD       ARG   3  14.384  -0.404  -9.201
   27    HE   ARG   3           HE       ARG   3  14.009  -1.585 -11.827
   28   1HH1  ARG   3          1HH1      ARG   3  12.441  -0.191  -9.035
   29   2HH1  ARG   3          2HH1      ARG   3  10.914  -0.871  -9.376
   30   1HH2  ARG   3          1HH2      ARG   3  11.983  -2.543 -12.255
   31   2HH2  ARG   3          2HH2      ARG   3  10.650  -2.243 -11.189
   32    H    CYS   4           H        CYS   4  10.793   1.322  -8.255
   33    HA   CYS   4           HA       CYS   4  11.820   1.238  -5.499
   34   1HB   CYS   4          1HB       CYS   4   9.642   1.609  -4.678
   35   2HB   CYS   4          2HB       CYS   4   8.910   1.311  -6.251
   36   1HB   PRO   5          1HB       PRO   5  11.588  -3.687  -3.101
   37   2HB   PRO   5          2HB       PRO   5  10.076  -2.845  -2.751
   38   1HG   PRO   5          1HG       PRO   5  11.561  -1.364  -1.780
   39   2HG   PRO   5          2HG       PRO   5  12.855  -1.765  -2.925
   40   1HD   PRO   5          1HD       PRO   5  12.188   0.223  -3.847
   41   2HD   PRO   5          2HD       PRO   5  10.520   0.067  -3.260
   42    H    GLY   6           H        GLY   6  10.148  -4.952  -5.357
   43   1HA   GLY   6          1HA       GLY   6   8.218  -6.039  -5.881
   44   2HA   GLY   6          2HA       GLY   6   7.355  -4.756  -5.101
   45    H    LYS   7           H        LYS   7   6.121  -5.812  -7.144
   46    HA   LYS   7           HA       LYS   7   6.773  -4.759  -9.704
   47   1HB   LYS   7          1HB       LYS   7   5.426  -6.771  -9.312
   48   2HB   LYS   7          2HB       LYS   7   4.148  -5.793  -8.661
   49   1HG   LYS   7          1HG       LYS   7   3.738  -4.761 -10.735
   50   2HG   LYS   7          2HG       LYS   7   5.191  -5.455 -11.452
   51   1HD   LYS   7          1HD       LYS   7   3.051  -7.238 -10.325
   52   2HD   LYS   7          2HD       LYS   7   2.831  -6.511 -11.903
   53   1HE   LYS   7          1HE       LYS   7   4.429  -7.763 -12.869
   54   2HE   LYS   7          2HE       LYS   7   5.440  -7.815 -11.426
   55   1HZ   LYS   7          1HZ       LYS   7   3.904  -9.419 -10.454
   56   2HZ   LYS   7          2HZ       LYS   7   2.953  -9.387 -11.859
   57   3HZ   LYS   7          3HZ       LYS   7   4.526  -9.981 -11.925
   58    H    ASN   8           H        ASN   8   5.893  -3.006 -10.833
   59    HA   ASN   8           HA       ASN   8   4.758  -0.886  -9.109
   60   1HB   ASN   8          1HB       ASN   8   6.328  -0.779 -11.684
   61   2HB   ASN   8          2HB       ASN   8   5.564   0.632 -10.951
   62   2HD2  ASN   8          2HD2      ASN   8   7.827   1.398 -10.987
   63   1HD2  ASN   8          1HD2      ASN   8   8.829   0.990  -9.643
   64    H    ALA   9           H        ALA   9   3.714  -3.053 -11.444
   65    HA   ALA   9           HA       ALA   9   1.246  -1.663 -11.759
   66   1HB   ALA   9          1HB       ALA   9   2.963  -2.164 -14.177
   67   2HB   ALA   9          2HB       ALA   9   1.285  -1.609 -14.217
   68   3HB   ALA   9          3HB       ALA   9   2.542  -0.587 -13.519
   69    H    TRP  10           H        TRP  10  -0.384  -3.104 -11.779
   70    HA   TRP  10           HA       TRP  10   0.331  -5.900 -12.466
   71   1HB   TRP  10          1HB       TRP  10  -1.691  -4.827 -10.513
   72   2HB   TRP  10          2HB       TRP  10  -1.591  -6.504 -11.020
   73    HD1  TRP  10           HD1      TRP  10   0.185  -8.024  -9.873
   74    HE1  TRP  10           HE1      TRP  10   1.939  -7.647  -8.031
   75    HE3  TRP  10           HE3      TRP  10  -0.077  -2.956  -9.520
   76    HZ2  TRP  10           HZ2      TRP  10   3.056  -5.477  -6.618
   77    HZ3  TRP  10           HZ3      TRP  10   1.348  -1.786  -7.903
   78    HH2  TRP  10           HH2      TRP  10   2.887  -3.030  -6.465
   79   1HB   PRO  11          1HB       PRO  11  -1.470  -5.876 -17.658
   80   2HB   PRO  11          2HB       PRO  11  -1.132  -4.167 -17.375
   81   1HG   PRO  11          1HG       PRO  11   0.988  -5.003 -17.037
   82   2HG   PRO  11          2HG       PRO  11   0.381  -6.566 -16.459
   83   1HD   PRO  11          1HD       PRO  11   0.964  -5.630 -14.447
   84   2HD   PRO  11          2HD       PRO  11   0.636  -3.971 -14.995
   85    H    GLU  12           H        GLU  12  -1.374  -7.501 -15.010
   86    HA   GLU  12           HA       GLU  12  -3.503  -8.958 -16.159
   87   1HB   GLU  12          1HB       GLU  12  -1.375  -9.986 -15.693
   88   2HB   GLU  12          2HB       GLU  12  -2.666 -10.850 -14.873
   89   1HG   GLU  12          1HG       GLU  12  -1.846  -9.032 -12.956
   90   2HG   GLU  12          2HG       GLU  12  -1.415 -10.734 -13.056
   91    H    LEU  13           H        LEU  13  -3.626  -6.934 -13.464
   92    HA   LEU  13           HA       LEU  13  -5.514  -8.539 -11.981
   93   1HB   LEU  13          1HB       LEU  13  -4.369  -5.791 -11.628
   94   2HB   LEU  13          2HB       LEU  13  -5.722  -6.321 -10.654
   95    HG   LEU  13           HG       LEU  13  -2.996  -7.618 -10.740
   96   1HD1  LEU  13          1HD1      LEU  13  -3.338  -5.375  -9.487
   97   2HD1  LEU  13          2HD1      LEU  13  -4.236  -6.326  -8.353
   98   3HD1  LEU  13          3HD1      LEU  13  -2.574  -6.712  -8.649
   99   1HD2  LEU  13          1HD2      LEU  13  -5.572  -8.418  -9.458
  100   2HD2  LEU  13          2HD2      LEU  13  -4.399  -9.386 -10.345
  101   3HD2  LEU  13          3HD2      LEU  13  -4.043  -8.844  -8.721
  102    H    VAL  14           H        VAL  14  -5.599  -6.312 -14.574
  103    HA   VAL  14           HA       VAL  14  -8.091  -5.105 -14.181
  104    HB   VAL  14           HB       VAL  14  -6.875  -5.927 -16.837
  105   1HG1  VAL  14          1HG1      VAL  14  -8.947  -3.845 -16.143
  106   2HG1  VAL  14          2HG1      VAL  14  -8.214  -4.065 -17.732
  107   3HG1  VAL  14          3HG1      VAL  14  -9.222  -5.333 -17.051
  108   1HG2  VAL  14          1HG2      VAL  14  -5.365  -4.533 -15.404
  109   2HG2  VAL  14          2HG2      VAL  14  -5.854  -3.764 -16.903
  110   3HG2  VAL  14          3HG2      VAL  14  -6.607  -3.300 -15.379
  111    H    GLY  15           H        GLY  15  -9.981  -6.125 -13.825
  112   1HA   GLY  15          1HA       GLY  15 -11.770  -7.380 -14.906
  113   2HA   GLY  15          2HA       GLY  15 -10.585  -8.572 -15.408
  114    H    LYS  16           H        LYS  16  -9.456  -7.921 -12.478
  115    HA   LYS  16           HA       LYS  16 -11.080 -10.029 -11.226
  116   1HB   LYS  16          1HB       LYS  16  -8.253  -9.127 -10.987
  117   2HB   LYS  16          2HB       LYS  16  -8.999  -9.760  -9.531
  118   1HG   LYS  16          1HG       LYS  16  -9.110 -11.296 -12.121
  119   2HG   LYS  16          2HG       LYS  16  -7.691 -11.333 -11.085
  120   1HD   LYS  16          1HD       LYS  16  -8.775 -13.096 -10.199
  121   2HD   LYS  16          2HD       LYS  16  -9.477 -11.839  -9.188
  122   1HE   LYS  16          1HE       LYS  16 -11.017 -12.110 -11.630
  123   2HE   LYS  16          2HE       LYS  16 -10.779 -13.684 -10.880
  124   1HZ   LYS  16          1HZ       LYS  16 -11.456 -12.023  -8.787
  125   2HZ   LYS  16          2HZ       LYS  16 -12.452 -11.547 -10.066
  126   3HZ   LYS  16          3HZ       LYS  16 -12.448 -13.155  -9.568
  127    H    SER  17           H        SER  17 -11.671  -9.841  -8.984
  128    HA   SER  17           HA       SER  17 -12.996  -7.475  -8.379
  129   1HB   SER  17          1HB       SER  17 -13.633  -8.459  -6.385
  130   2HB   SER  17          2HB       SER  17 -13.257  -9.869  -7.373
  131    HG   SER  17           HG       SER  17 -12.246 -10.096  -5.389
  132    H    GLY  18           H        GLY  18 -12.607  -5.752  -6.978
  133   1HA   GLY  18          1HA       GLY  18 -10.059  -4.656  -6.853
  134   2HA   GLY  18          2HA       GLY  18 -11.382  -4.227  -5.812
  135    H    ASN  19           H        ASN  19 -11.648  -6.849  -4.620
  136    HA   ASN  19           HA       ASN  19  -9.777  -6.504  -2.507
  137   1HB   ASN  19          1HB       ASN  19 -12.101  -8.203  -3.068
  138   2HB   ASN  19          2HB       ASN  19 -10.841  -9.076  -2.210
  139   2HD2  ASN  19          2HD2      ASN  19 -11.670  -9.206  -0.206
  140   1HD2  ASN  19          1HD2      ASN  19 -12.114  -7.837   0.747
  141    H    MET  20           H        MET  20 -10.085  -8.939  -5.089
  142    HA   MET  20           HA       MET  20  -7.860 -10.473  -4.282
  143   1HB   MET  20          1HB       MET  20  -9.777 -10.684  -6.272
  144   2HB   MET  20          2HB       MET  20  -8.325 -10.375  -7.199
  145   1HG   MET  20          1HG       MET  20  -7.995 -12.553  -7.102
  146   2HG   MET  20          2HG       MET  20  -7.427 -12.282  -5.459
  147   1HE   MET  20          1HE       MET  20  -8.884 -12.557  -3.342
  148   2HE   MET  20          2HE       MET  20 -10.224 -11.571  -3.929
  149   3HE   MET  20          3HE       MET  20 -10.528 -13.197  -3.314
  150    H    ALA  21           H        ALA  21  -8.165  -7.752  -6.553
  151    HA   ALA  21           HA       ALA  21  -5.515  -7.727  -7.440
  152   1HB   ALA  21          1HB       ALA  21  -7.571  -5.557  -7.198
  153   2HB   ALA  21          2HB       ALA  21  -7.086  -6.442  -8.642
  154   3HB   ALA  21          3HB       ALA  21  -5.986  -5.266  -7.926
  155    H    ALA  22           H        ALA  22  -7.059  -5.858  -4.844
  156    HA   ALA  22           HA       ALA  22  -4.843  -4.484  -3.925
  157   1HB   ALA  22          1HB       ALA  22  -7.123  -5.587  -2.288
  158   2HB   ALA  22          2HB       ALA  22  -7.091  -4.034  -3.121
  159   3HB   ALA  22          3HB       ALA  22  -6.003  -4.327  -1.762
  160    H    ALA  23           H        ALA  23  -5.969  -7.731  -3.029
  161    HA   ALA  23           HA       ALA  23  -3.958  -8.239  -1.100
  162   1HB   ALA  23          1HB       ALA  23  -6.062  -9.526  -1.299
  163   2HB   ALA  23          2HB       ALA  23  -5.455 -10.254  -2.786
  164   3HB   ALA  23          3HB       ALA  23  -4.631 -10.552  -1.254
  165    H    THR  24           H        THR  24  -4.154  -8.778  -4.595
  166    HA   THR  24           HA       THR  24  -1.800 -10.290  -4.891
  167    HB   THR  24           HB       THR  24  -3.027  -8.355  -6.871
  168    HG1  THR  24           HG1      THR  24  -3.561 -11.126  -6.463
  169   1HG2  THR  24          1HG2      THR  24  -1.296 -10.766  -7.319
  170   2HG2  THR  24          2HG2      THR  24  -2.095  -9.831  -8.570
  171   3HG2  THR  24          3HG2      THR  24  -0.838  -9.082  -7.590
  172    H    VAL  25           H        VAL  25  -2.381  -6.793  -4.970
  173    HA   VAL  25           HA       VAL  25   0.281  -6.069  -5.643
  174    HB   VAL  25           HB       VAL  25  -1.776  -4.425  -4.165
  175   1HG1  VAL  25          1HG1      VAL  25   0.936  -3.865  -4.908
  176   2HG1  VAL  25          2HG1      VAL  25  -0.142  -2.857  -5.850
  177   3HG1  VAL  25          3HG1      VAL  25  -0.239  -2.838  -4.106
  178   1HG2  VAL  25          1HG2      VAL  25  -1.384  -4.976  -7.091
  179   2HG2  VAL  25          2HG2      VAL  25  -2.851  -5.010  -6.131
  180   3HG2  VAL  25          3HG2      VAL  25  -2.129  -3.475  -6.540
  181    H    GLU  26           H        GLU  26  -1.446  -6.203  -2.533
  182    HA   GLU  26           HA       GLU  26   0.777  -5.364  -0.966
  183   1HB   GLU  26          1HB       GLU  26  -0.524  -6.096   0.946
  184   2HB   GLU  26          2HB       GLU  26  -1.583  -7.036  -0.093
  185   1HG   GLU  26          1HG       GLU  26  -1.803  -4.522  -1.201
  186   2HG   GLU  26          2HG       GLU  26  -2.935  -5.303  -0.104
  187    H    ARG  27           H        ARG  27  -0.278  -8.502  -2.156
  188    HA   ARG  27           HA       ARG  27   1.529  -9.957  -0.428
  189   1HB   ARG  27          1HB       ARG  27  -0.690 -10.805  -1.312
  190   2HB   ARG  27          2HB       ARG  27   0.094 -11.028  -2.870
  191   1HG   ARG  27          1HG       ARG  27   1.408 -12.761  -2.109
  192   2HG   ARG  27          2HG       ARG  27   1.318 -12.242  -0.424
  193   1HD   ARG  27          1HD       ARG  27  -0.031 -14.078  -0.418
  194   2HD   ARG  27          2HD       ARG  27  -1.222 -12.800  -0.646
  195    HE   ARG  27           HE       ARG  27  -0.628 -13.506  -3.188
  196   1HH1  ARG  27          1HH1      ARG  27  -1.561 -15.391  -0.367
  197   2HH1  ARG  27          2HH1      ARG  27  -2.319 -16.615  -1.310
  198   1HH2  ARG  27          1HH2      ARG  27  -1.647 -15.142  -4.402
  199   2HH2  ARG  27          2HH2      ARG  27  -2.374 -16.486  -3.585
  200    H    GLU  28           H        GLU  28   1.329  -9.363  -3.949
  201    HA   GLU  28           HA       GLU  28   3.844 -10.545  -4.533
  202   1HB   GLU  28          1HB       GLU  28   2.151  -8.555  -6.047
  203   2HB   GLU  28          2HB       GLU  28   3.657  -9.192  -6.679
  204   1HG   GLU  28          1HG       GLU  28   2.705 -11.491  -6.439
  205   2HG   GLU  28          2HG       GLU  28   1.160 -10.741  -6.037
  206    H    ASN  29           H        ASN  29   2.873  -7.293  -3.576
  207    HA   ASN  29           HA       ASN  29   5.737  -6.567  -3.451
  208   1HB   ASN  29          1HB       ASN  29   4.645  -5.418  -5.323
  209   2HB   ASN  29          2HB       ASN  29   3.447  -4.742  -4.224
  210   2HD2  ASN  29          2HD2      ASN  29   5.151  -3.217  -5.887
  211   1HD2  ASN  29          1HD2      ASN  29   6.220  -2.329  -4.876
  212    H    ARG  30           H        ARG  30   5.622  -7.297  -1.265
  213    HA   ARG  30           HA       ARG  30   3.884  -6.214   0.680
  214   1HB   ARG  30          1HB       ARG  30   5.601  -6.978   2.306
  215   2HB   ARG  30          2HB       ARG  30   5.092  -8.211   1.166
  216   1HG   ARG  30          1HG       ARG  30   7.102  -8.006  -0.103
  217   2HG   ARG  30          2HG       ARG  30   7.608  -6.590   0.817
  218   1HD   ARG  30          1HD       ARG  30   7.282  -9.393   1.863
  219   2HD   ARG  30          2HD       ARG  30   8.799  -8.592   1.517
  220    HE   ARG  30           HE       ARG  30   6.896  -7.860   3.665
  221   1HH1  ARG  30          1HH1      ARG  30  10.171  -7.837   2.374
  222   2HH1  ARG  30          2HH1      ARG  30  10.833  -7.144   3.802
  223   1HH2  ARG  30          1HH2      ARG  30   7.815  -6.936   5.531
  224   2HH2  ARG  30          2HH2      ARG  30   9.519  -6.627   5.585
  225    H    ASN  31           H        ASN  31   6.318  -4.648  -1.093
  226    HA   ASN  31           HA       ASN  31   7.101  -2.832   1.014
  227   1HB   ASN  31          1HB       ASN  31   8.684  -3.596  -0.735
  228   2HB   ASN  31          2HB       ASN  31   7.746  -2.738  -1.944
  229   2HD2  ASN  31          2HD2      ASN  31   7.998  -0.558  -2.171
  230   1HD2  ASN  31          1HD2      ASN  31   9.111   0.366  -1.230
  231    H    VAL  32           H        VAL  32   4.364  -3.099  -0.851
  232    HA   VAL  32           HA       VAL  32   3.806  -0.230  -0.569
  233    HB   VAL  32           HB       VAL  32   2.941   0.006  -2.740
  234   1HG1  VAL  32          1HG1      VAL  32   5.512  -1.545  -2.956
  235   2HG1  VAL  32          2HG1      VAL  32   4.857  -0.511  -4.200
  236   3HG1  VAL  32          3HG1      VAL  32   5.370   0.156  -2.651
  237   1HG2  VAL  32          1HG2      VAL  32   3.101  -2.986  -2.914
  238   2HG2  VAL  32          2HG2      VAL  32   1.739  -1.921  -3.223
  239   3HG2  VAL  32          3HG2      VAL  32   3.063  -2.009  -4.376
  240    H    HIS  33           H        HIS  33   1.421   0.172  -1.070
  241    HA   HIS  33           HA       HIS  33  -0.222  -2.083  -0.179
  242   1HB   HIS  33          1HB       HIS  33  -1.170  -1.008   1.612
  243   2HB   HIS  33          2HB       HIS  33   0.448  -0.342   1.681
  244    HD1  HIS  33           HD1      HIS  33  -2.606   0.820   2.439
  245    HD2  HIS  33           HD2      HIS  33   0.110   2.143  -0.377
  246    HE1  HIS  33           HE1      HIS  33  -3.177   3.234   2.033
  247    HE2  HIS  33           HE2      HIS  33  -1.427   4.047   0.415
  248    H    ALA  34           H        ALA  34  -2.166  -2.265  -1.155
  249    HA   ALA  34           HA       ALA  34  -2.735  -0.317  -3.256
  250   1HB   ALA  34          1HB       ALA  34  -4.248  -2.198  -4.097
  251   2HB   ALA  34          2HB       ALA  34  -2.507  -2.396  -4.217
  252   3HB   ALA  34          3HB       ALA  34  -3.396  -3.215  -2.938
  253    H    ILE  35           H        ILE  35  -4.408   1.008  -3.093
  254    HA   ILE  35           HA       ILE  35  -6.341   0.579  -0.916
  255    HB   ILE  35           HB       ILE  35  -6.069   3.012  -2.629
  256   1HG1  ILE  35          1HG1      ILE  35  -4.795   2.650   0.078
  257   2HG1  ILE  35          2HG1      ILE  35  -3.911   2.384  -1.417
  258   1HG2  ILE  35          1HG2      ILE  35  -7.272   2.540   0.085
  259   2HG2  ILE  35          2HG2      ILE  35  -7.151   4.112  -0.688
  260   3HG2  ILE  35          3HG2      ILE  35  -8.154   2.853  -1.404
  261   1HD1  ILE  35          1HD1      ILE  35  -5.239   4.993  -0.744
  262   2HD1  ILE  35          2HD1      ILE  35  -3.560   4.597  -0.394
  263   3HD1  ILE  35          3HD1      ILE  35  -4.113   4.630  -2.051
  264    H    VAL  36           H        VAL  36  -8.109  -0.523  -1.510
  265    HA   VAL  36           HA       VAL  36  -9.011  -0.559  -4.235
  266    HB   VAL  36           HB       VAL  36  -9.083  -2.541  -2.744
  267   1HG1  VAL  36          1HG1      VAL  36  -9.929  -1.278  -0.731
  268   2HG1  VAL  36          2HG1      VAL  36 -11.523  -1.286  -1.494
  269   3HG1  VAL  36          3HG1      VAL  36 -10.733  -2.802  -1.078
  270   1HG2  VAL  36          1HG2      VAL  36 -11.671  -1.659  -4.026
  271   2HG2  VAL  36          2HG2      VAL  36 -10.354  -2.552  -4.772
  272   3HG2  VAL  36          3HG2      VAL  36 -11.311  -3.307  -3.519
  273    H    LEU  37           H        LEU  37 -10.398   0.718  -5.163
  274    HA   LEU  37           HA       LEU  37 -12.611   1.905  -3.724
  275   1HB   LEU  37          1HB       LEU  37 -11.851   4.209  -4.703
  276   2HB   LEU  37          2HB       LEU  37 -11.314   3.660  -3.146
  277    HG   LEU  37           HG       LEU  37  -9.279   2.707  -4.686
  278   1HD1  LEU  37          1HD1      LEU  37 -10.237   3.615  -6.737
  279   2HD1  LEU  37          2HD1      LEU  37 -10.171   5.236  -6.046
  280   3HD1  LEU  37          3HD1      LEU  37  -8.682   4.347  -6.349
  281   1HD2  LEU  37          1HD2      LEU  37  -9.682   4.892  -2.866
  282   2HD2  LEU  37          2HD2      LEU  37  -8.246   3.945  -3.215
  283   3HD2  LEU  37          3HD2      LEU  37  -8.592   5.386  -4.154
  284    H    LYS  38           H        LYS  38 -14.217   2.694  -5.115
  285    HA   LYS  38           HA       LYS  38 -14.041   1.594  -7.801
  286   1HB   LYS  38          1HB       LYS  38 -16.003   1.061  -6.529
  287   2HB   LYS  38          2HB       LYS  38 -16.446   2.025  -7.925
  288   1HG   LYS  38          1HG       LYS  38 -16.730   2.557  -5.067
  289   2HG   LYS  38          2HG       LYS  38 -16.056   3.933  -5.938
  290   1HD   LYS  38          1HD       LYS  38 -17.925   3.954  -7.457
  291   2HD   LYS  38          2HD       LYS  38 -18.572   2.474  -6.741
  292   1HE   LYS  38          1HE       LYS  38 -18.307   4.148  -4.554
  293   2HE   LYS  38          2HE       LYS  38 -18.769   5.249  -5.855
  294   1HZ   LYS  38          1HZ       LYS  38 -20.693   3.860  -6.304
  295   2HZ   LYS  38          2HZ       LYS  38 -20.242   2.791  -5.065
  296   3HZ   LYS  38          3HZ       LYS  38 -20.691   4.371  -4.690
  297    H    GLU  39           H        GLU  39 -14.763   2.755  -9.679
  298    HA   GLU  39           HA       GLU  39 -13.411   5.051 -10.231
  299   1HB   GLU  39          1HB       GLU  39 -15.652   3.602 -11.451
  300   2HB   GLU  39          2HB       GLU  39 -15.695   5.318 -11.810
  301   1HG   GLU  39          1HG       GLU  39 -13.101   4.827 -12.339
  302   2HG   GLU  39          2HG       GLU  39 -13.776   3.229 -12.647
  303    H    GLY  40           H        GLY  40 -13.525   7.118  -9.607
  304   1HA   GLY  40          1HA       GLY  40 -14.822   9.124  -9.389
  305   2HA   GLY  40          2HA       GLY  40 -16.149   8.190  -8.725
  306    H    SER  41           H        SER  41 -13.693   6.763  -7.230
  307    HA   SER  41           HA       SER  41 -14.129   8.120  -4.773
  308   1HB   SER  41          1HB       SER  41 -13.589   5.723  -4.879
  309   2HB   SER  41          2HB       SER  41 -12.000   6.111  -5.527
  310    HG   SER  41           HG       SER  41 -13.022   6.610  -2.941
  311    H    ALA  42           H        ALA  42 -11.655   8.269  -3.563
  312    HA   ALA  42           HA       ALA  42 -10.612  10.722  -4.749
  313   1HB   ALA  42          1HB       ALA  42  -9.386  10.909  -2.609
  314   2HB   ALA  42          2HB       ALA  42 -11.131  10.777  -2.408
  315   3HB   ALA  42          3HB       ALA  42 -10.104   9.379  -2.100
  316    H    MET  43           H        MET  43  -9.264  10.207  -6.418
  317    HA   MET  43           HA       MET  43  -6.984   8.473  -5.756
  318   1HB   MET  43          1HB       MET  43  -7.011   8.125  -8.368
  319   2HB   MET  43          2HB       MET  43  -7.912   7.100  -7.269
  320   1HG   MET  43          1HG       MET  43  -9.951   8.291  -7.698
  321   2HG   MET  43          2HG       MET  43  -9.094   9.468  -8.697
  322   1HE   MET  43          1HE       MET  43  -7.493   8.602 -10.603
  323   2HE   MET  43          2HE       MET  43  -7.100   6.924 -10.232
  324   3HE   MET  43          3HE       MET  43  -7.964   7.325 -11.721
  325    H    THR  44           H        THR  44  -5.559  10.019  -5.247
  326    HA   THR  44           HA       THR  44  -5.230  12.423  -6.687
  327    HB   THR  44           HB       THR  44  -2.807  12.134  -5.525
  328    HG1  THR  44           HG1      THR  44  -3.397  10.929  -3.482
  329   1HG2  THR  44          1HG2      THR  44  -4.436  13.852  -4.919
  330   2HG2  THR  44          2HG2      THR  44  -5.309  12.663  -3.949
  331   3HG2  THR  44          3HG2      THR  44  -3.665  13.127  -3.508
  332    H    LYS  45           H        LYS  45  -3.592  13.044  -8.133
  333    HA   LYS  45           HA       LYS  45  -2.845  10.927  -9.980
  334   1HB   LYS  45          1HB       LYS  45  -2.817  13.909 -10.002
  335   2HB   LYS  45          2HB       LYS  45  -1.737  13.075 -11.104
  336   1HG   LYS  45          1HG       LYS  45  -3.363  12.616 -12.517
  337   2HG   LYS  45          2HG       LYS  45  -4.368  11.899 -11.259
  338   1HD   LYS  45          1HD       LYS  45  -5.536  13.751 -12.256
  339   2HD   LYS  45          2HD       LYS  45  -5.103  14.164 -10.594
  340   1HE   LYS  45          1HE       LYS  45  -3.251  15.507 -11.370
  341   2HE   LYS  45          2HE       LYS  45  -3.523  14.987 -13.033
  342   1HZ   LYS  45          1HZ       LYS  45  -5.469  16.544 -11.412
  343   2HZ   LYS  45          2HZ       LYS  45  -4.402  17.205 -12.559
  344   3HZ   LYS  45          3HZ       LYS  45  -5.614  16.136 -13.046
  345    H    ASP  46           H        ASP  46  -1.366  12.805  -7.472
  346    HA   ASP  46           HA       ASP  46   1.286  12.823  -8.139
  347   1HB   ASP  46          1HB       ASP  46   0.086  12.219  -5.426
  348   2HB   ASP  46          2HB       ASP  46   1.762  12.694  -5.704
  349    H    PHE  47           H        PHE  47   2.984  11.417  -8.083
  350    HA   PHE  47           HA       PHE  47   2.302   8.600  -8.273
  351   1HB   PHE  47          1HB       PHE  47   3.769   9.453  -9.939
  352   2HB   PHE  47          2HB       PHE  47   4.839  10.162  -8.735
  353    HD1  PHE  47           HD1      PHE  47   3.747   7.030 -10.315
  354    HD2  PHE  47           HD2      PHE  47   6.479   8.831  -7.582
  355    HE1  PHE  47           HE1      PHE  47   5.093   4.993 -10.313
  356    HE2  PHE  47           HE2      PHE  47   7.816   6.771  -7.562
  357    HZ   PHE  47           HZ       PHE  47   7.114   4.844  -8.941
  358    H    ARG  48           H        ARG  48   2.690   7.067  -6.789
  359    HA   ARG  48           HA       ARG  48   4.613   7.523  -4.634
  360   1HB   ARG  48          1HB       ARG  48   1.677   7.576  -4.290
  361   2HB   ARG  48          2HB       ARG  48   2.516   6.505  -3.180
  362   1HG   ARG  48          1HG       ARG  48   3.970   8.392  -2.520
  363   2HG   ARG  48          2HG       ARG  48   3.016   9.443  -3.566
  364   1HD   ARG  48          1HD       ARG  48   1.674   9.790  -1.825
  365   2HD   ARG  48          2HD       ARG  48   1.098   8.145  -2.033
  366    HE   ARG  48           HE       ARG  48   2.231   7.523  -0.156
  367   1HH1  ARG  48          1HH1      ARG  48   3.429  10.656  -1.199
  368   2HH1  ARG  48          2HH1      ARG  48   4.388  10.880   0.215
  369   1HH2  ARG  48          1HH2      ARG  48   3.517   7.847   1.704
  370   2HH2  ARG  48          2HH2      ARG  48   4.453   9.298   1.858
  371    H    CYS  49           H        CYS  49   5.864   5.796  -4.857
  372    HA   CYS  49           HA       CYS  49   5.132   3.376  -6.016
  373   1HB   CYS  49          1HB       CYS  49   7.400   4.134  -4.212
  374   2HB   CYS  49          2HB       CYS  49   7.230   2.488  -4.809
  375    H    ASP  50           H        ASP  50   5.003   4.407  -2.671
  376    HA   ASP  50           HA       ASP  50   4.467   1.752  -1.675
  377   1HB   ASP  50          1HB       ASP  50   4.000   2.927   0.472
  378   2HB   ASP  50          2HB       ASP  50   5.579   3.281  -0.214
  379    H    ARG  51           H        ARG  51   2.556   3.868  -3.420
  380    HA   ARG  51           HA       ARG  51   0.120   2.771  -2.205
  381   1HB   ARG  51          1HB       ARG  51   0.461   5.232  -1.851
  382   2HB   ARG  51          2HB       ARG  51   0.362   5.439  -3.596
  383   1HG   ARG  51          1HG       ARG  51  -1.922   4.386  -3.491
  384   2HG   ARG  51          2HG       ARG  51  -1.779   4.434  -1.734
  385   1HD   ARG  51          1HD       ARG  51  -2.970   6.370  -2.317
  386   2HD   ARG  51          2HD       ARG  51  -1.331   6.904  -1.966
  387    HE   ARG  51           HE       ARG  51  -1.953   6.335  -4.764
  388   1HH1  ARG  51          1HH1      ARG  51  -1.705   8.792  -2.256
  389   2HH1  ARG  51          2HH1      ARG  51  -1.479  10.069  -3.384
  390   1HH2  ARG  51          1HH2      ARG  51  -1.705   8.065  -6.226
  391   2HH2  ARG  51          2HH2      ARG  51  -1.489   9.667  -5.628
  392    H    VAL  52           H        VAL  52  -1.278   1.770  -3.496
  393    HA   VAL  52           HA       VAL  52  -0.914   2.023  -6.418
  394    HB   VAL  52           HB       VAL  52  -1.462  -0.587  -4.986
  395   1HG1  VAL  52          1HG1      VAL  52  -0.976   0.059  -7.886
  396   2HG1  VAL  52          2HG1      VAL  52  -1.106  -1.564  -7.226
  397   3HG1  VAL  52          3HG1      VAL  52  -2.489  -0.486  -7.186
  398   1HG2  VAL  52          1HG2      VAL  52   1.071   0.560  -6.128
  399   2HG2  VAL  52          2HG2      VAL  52   0.787  -0.110  -4.530
  400   3HG2  VAL  52          3HG2      VAL  52   0.847  -1.155  -5.932
  401    H    TRP  53           H        TRP  53  -2.740   2.803  -7.247
  402    HA   TRP  53           HA       TRP  53  -5.189   2.744  -5.755
  403   1HB   TRP  53          1HB       TRP  53  -4.409   3.823  -8.449
  404   2HB   TRP  53          2HB       TRP  53  -6.089   3.817  -7.945
  405    HD1  TRP  53           HD1      TRP  53  -3.987   6.366  -8.479
  406    HE1  TRP  53           HE1      TRP  53  -4.038   8.248  -6.725
  407    HE3  TRP  53           HE3      TRP  53  -6.094   3.801  -4.619
  408    HZ2  TRP  53           HZ2      TRP  53  -4.859   8.575  -4.041
  409    HZ3  TRP  53           HZ3      TRP  53  -6.491   4.983  -2.513
  410    HH2  TRP  53           HH2      TRP  53  -5.869   7.298  -2.209
  411    H    VAL  54           H        VAL  54  -6.881   1.416  -5.931
  412    HA   VAL  54           HA       VAL  54  -6.851  -0.551  -8.152
  413    HB   VAL  54           HB       VAL  54  -7.664  -0.834  -5.276
  414   1HG1  VAL  54          1HG1      VAL  54  -8.273  -2.723  -7.531
  415   2HG1  VAL  54          2HG1      VAL  54  -8.499  -3.078  -5.827
  416   3HG1  VAL  54          3HG1      VAL  54  -9.471  -1.837  -6.605
  417   1HG2  VAL  54          1HG2      VAL  54  -5.324  -1.229  -5.772
  418   2HG2  VAL  54          2HG2      VAL  54  -6.130  -2.726  -5.314
  419   3HG2  VAL  54          3HG2      VAL  54  -5.778  -2.400  -7.009
  420    H    ILE  55           H        ILE  55  -8.103   0.714  -9.516
  421    HA   ILE  55           HA       ILE  55 -10.616   1.822  -8.650
  422    HB   ILE  55           HB       ILE  55  -9.819   1.482 -11.522
  423   1HG1  ILE  55          1HG1      ILE  55  -7.876   2.474 -10.430
  424   2HG1  ILE  55          2HG1      ILE  55  -8.715   3.693 -11.367
  425   1HG2  ILE  55          1HG2      ILE  55 -11.487   3.521 -10.061
  426   2HG2  ILE  55          2HG2      ILE  55 -11.106   3.560 -11.783
  427   3HG2  ILE  55          3HG2      ILE  55 -12.073   2.247 -11.124
  428   1HD1  ILE  55          1HD1      ILE  55  -9.791   4.501  -9.293
  429   2HD1  ILE  55          2HD1      ILE  55  -8.831   3.325  -8.397
  430   3HD1  ILE  55          3HD1      ILE  55  -8.042   4.624  -9.278
  431    H    VAL  56           H        VAL  56 -12.459   0.727  -8.494
  432    HA   VAL  56           HA       VAL  56 -12.853  -1.622 -10.208
  433    HB   VAL  56           HB       VAL  56 -14.196  -2.609  -8.417
  434   1HG1  VAL  56          1HG1      VAL  56 -11.303  -2.125  -8.187
  435   2HG1  VAL  56          2HG1      VAL  56 -12.089  -2.674  -6.719
  436   3HG1  VAL  56          3HG1      VAL  56 -12.219  -3.630  -8.185
  437   1HG2  VAL  56          1HG2      VAL  56 -14.870  -0.547  -7.284
  438   2HG2  VAL  56          2HG2      VAL  56 -14.149  -1.698  -6.161
  439   3HG2  VAL  56          3HG2      VAL  56 -13.219  -0.331  -6.734
  440    H    ASN  57           H        ASN  57 -15.137  -2.201 -10.547
  441    HA   ASN  57           HA       ASN  57 -16.609   0.188 -11.310
  442   1HB   ASN  57          1HB       ASN  57 -16.426  -1.731 -12.838
  443   2HB   ASN  57          2HB       ASN  57 -18.086  -1.339 -12.483
  444   2HD2  ASN  57          2HD2      ASN  57 -17.462  -3.773 -13.529
  445   1HD2  ASN  57          1HD2      ASN  57 -17.685  -4.989 -12.319
  446    H    ASP  58           H        ASP  58 -19.160  -0.263 -11.102
  447    HA   ASP  58           HA       ASP  58 -19.827   0.330  -8.473
  448   1HB   ASP  58          1HB       ASP  58 -21.284  -0.280 -10.968
  449   2HB   ASP  58          2HB       ASP  58 -22.182  -0.692  -9.515
  450    H    HIS  59           H        HIS  59 -19.307  -2.774  -9.921
  451    HA   HIS  59           HA       HIS  59 -20.720  -4.191  -7.816
  452   1HB   HIS  59          1HB       HIS  59 -19.220  -5.082 -10.280
  453   2HB   HIS  59          2HB       HIS  59 -19.830  -6.217  -9.084
  454    HD1  HIS  59           HD1      HIS  59 -22.492  -6.148  -8.712
  455    HD2  HIS  59           HD2      HIS  59 -21.052  -4.308 -12.147
  456    HE1  HIS  59           HE1      HIS  59 -24.483  -5.904 -10.225
  457    HE2  HIS  59           HE2      HIS  59 -23.610  -4.687 -12.253
  458    H    GLY  60           H        GLY  60 -17.488  -3.125  -8.522
  459   1HA   GLY  60          1HA       GLY  60 -15.904  -3.060  -6.746
  460   2HA   GLY  60          2HA       GLY  60 -16.537  -4.574  -6.126
  461    H    VAL  61           H        VAL  61 -16.070  -4.209  -9.557
  462    HA   VAL  61           HA       VAL  61 -13.875  -6.142  -9.454
  463    HB   VAL  61           HB       VAL  61 -15.545  -5.325 -11.830
  464   1HG1  VAL  61          1HG1      VAL  61 -13.634  -7.614 -11.406
  465   2HG1  VAL  61          2HG1      VAL  61 -14.655  -7.393 -12.826
  466   3HG1  VAL  61          3HG1      VAL  61 -13.390  -6.226 -12.465
  467   1HG2  VAL  61          1HG2      VAL  61 -15.836  -7.714 -10.011
  468   2HG2  VAL  61          2HG2      VAL  61 -16.968  -6.372 -10.165
  469   3HG2  VAL  61          3HG2      VAL  61 -16.714  -7.465 -11.522
  470    H    VAL  62           H        VAL  62 -11.858  -5.607 -10.178
  471    HA   VAL  62           HA       VAL  62 -11.197  -2.890 -10.498
  472    HB   VAL  62           HB       VAL  62  -9.512  -5.281 -11.237
  473   1HG1  VAL  62          1HG1      VAL  62  -8.764  -2.390 -10.759
  474   2HG1  VAL  62          2HG1      VAL  62  -7.639  -3.718 -10.945
  475   3HG1  VAL  62          3HG1      VAL  62  -8.666  -3.274 -12.286
  476   1HG2  VAL  62          1HG2      VAL  62  -9.644  -3.676  -8.692
  477   2HG2  VAL  62          2HG2      VAL  62 -10.192  -5.320  -8.893
  478   3HG2  VAL  62          3HG2      VAL  62  -8.498  -4.943  -9.048
  479    H    THR  63           H        THR  63 -11.626  -1.647 -12.201
  480    HA   THR  63           HA       THR  63 -11.910  -2.876 -14.860
  481    HB   THR  63           HB       THR  63 -13.008  -0.840 -15.513
  482    HG1  THR  63           HG1      THR  63 -12.093   0.823 -14.512
  483   1HG2  THR  63          1HG2      THR  63 -14.396  -2.432 -14.274
  484   2HG2  THR  63          2HG2      THR  63 -14.002  -1.584 -12.777
  485   3HG2  THR  63          3HG2      THR  63 -14.905  -0.760 -14.050
  486    H    SER  64           H        SER  64  -9.948  -0.533 -13.090
  487    HA   SER  64           HA       SER  64  -8.402  -0.022 -15.552
  488   1HB   SER  64          1HB       SER  64  -8.471   1.484 -12.937
  489   2HB   SER  64          2HB       SER  64  -7.449   1.889 -14.307
  490    HG   SER  64           HG       SER  64 -10.233   2.110 -14.055
  491    H    VAL  65           H        VAL  65  -6.106   0.068 -15.392
  492    HA   VAL  65           HA       VAL  65  -4.996  -2.254 -14.253
  493    HB   VAL  65           HB       VAL  65  -3.334   0.096 -15.125
  494   1HG1  VAL  65          1HG1      VAL  65  -2.857  -2.714 -14.500
  495   2HG1  VAL  65          2HG1      VAL  65  -2.217  -2.238 -16.074
  496   3HG1  VAL  65          3HG1      VAL  65  -1.744  -1.354 -14.634
  497   1HG2  VAL  65          1HG2      VAL  65  -4.795  -1.881 -16.869
  498   2HG2  VAL  65          2HG2      VAL  65  -4.923  -0.121 -16.879
  499   3HG2  VAL  65          3HG2      VAL  65  -3.446  -0.904 -17.416
  500   1HB   PRO  66          1HB       PRO  66  -3.405  -2.868  -9.184
  501   2HB   PRO  66          2HB       PRO  66  -4.900  -1.976  -8.942
  502   1HG   PRO  66          1HG       PRO  66  -4.692  -4.320 -10.326
  503   2HG   PRO  66          2HG       PRO  66  -6.007  -3.195 -10.448
  504   1HD   PRO  66          1HD       PRO  66  -3.707  -3.583 -12.277
  505   2HD   PRO  66          2HD       PRO  66  -5.395  -3.195 -12.641
  506    H    HIS  67           H        HIS  67  -2.280   0.817 -10.914
  507    HA   HIS  67           HA       HIS  67   0.231  -0.681 -10.514
  508   1HB   HIS  67          1HB       HIS  67   1.256   0.872 -12.222
  509   2HB   HIS  67          2HB       HIS  67   0.081  -0.270 -12.855
  510    HD1  HIS  67           HD1      HIS  67  -2.469   0.870 -12.963
  511    HD2  HIS  67           HD2      HIS  67   0.824   3.335 -13.239
  512    HE1  HIS  67           HE1      HIS  67  -3.346   3.012 -13.914
  513    HE2  HIS  67           HE2      HIS  67  -1.308   4.471 -14.157
  514    H    ILE  68           H        ILE  68   1.939   0.426  -9.619
  515    HA   ILE  68           HA       ILE  68   1.546   1.954  -7.437
  516    HB   ILE  68           HB       ILE  68   3.815   1.334  -9.157
  517   1HG1  ILE  68          1HG1      ILE  68   3.648   1.900  -6.210
  518   2HG1  ILE  68          2HG1      ILE  68   3.302   0.347  -6.934
  519   1HG2  ILE  68          1HG2      ILE  68   3.881   3.999  -7.754
  520   2HG2  ILE  68          2HG2      ILE  68   5.309   3.130  -8.290
  521   3HG2  ILE  68          3HG2      ILE  68   4.129   3.627  -9.462
  522   1HD1  ILE  68          1HD1      ILE  68   5.874   1.166  -7.846
  523   2HD1  ILE  68          2HD1      ILE  68   5.416  -0.199  -6.846
  524   3HD1  ILE  68          3HD1      ILE  68   5.805   1.334  -6.105
  525    H    THR  69           H        THR  69   0.394   3.746  -7.218
  526    HA   THR  69           HA       THR  69   1.139   6.146  -8.682
  527    HB   THR  69           HB       THR  69  -1.543   4.803  -9.021
  528    HG1  THR  69           HG1      THR  69  -1.001   4.770 -11.091
  529   1HG2  THR  69          1HG2      THR  69  -2.016   7.157  -8.468
  530   2HG2  THR  69          2HG2      THR  69  -0.911   7.656  -9.724
  531   3HG2  THR  69          3HG2      THR  69  -2.373   6.771 -10.139

  No H/Q in entry =         531
  Start of MODEL   18
    1    H    SER   1           H        SER   1  12.034   9.115  -7.391
    2    HA   SER   1           HA       SER   1   9.593   8.868  -9.112
    3   1HB   SER   1          1HB       SER   1  11.271  10.717  -9.322
    4   2HB   SER   1          2HB       SER   1  12.463   9.557  -9.940
    5    HG   SER   1           HG       SER   1  11.263  10.614 -11.606
    6    H    ARG   2           H        ARG   2   9.209   6.640  -8.781
    7    HA   ARG   2           HA       ARG   2   8.926   4.469  -9.324
    8   1HB   ARG   2          1HB       ARG   2   8.982   5.713 -11.658
    9   2HB   ARG   2          2HB       ARG   2  10.483   4.833 -11.871
   10   1HG   ARG   2          1HG       ARG   2   8.907   2.809 -11.092
   11   2HG   ARG   2          2HG       ARG   2   7.680   3.873 -11.775
   12   1HD   ARG   2          1HD       ARG   2   9.861   3.810 -13.615
   13   2HD   ARG   2          2HD       ARG   2   9.584   2.162 -13.067
   14    HE   ARG   2           HE       ARG   2   7.102   3.289 -13.724
   15   1HH1  ARG   2          1HH1      ARG   2  10.080   2.291 -15.297
   16   2HH1  ARG   2          2HH1      ARG   2   9.289   1.909 -16.782
   17   1HH2  ARG   2          1HH2      ARG   2   6.089   2.799 -15.696
   18   2HH2  ARG   2          2HH2      ARG   2   7.031   2.185 -17.015
   19    H    ARG   3           H        ARG   3  10.410   3.957  -7.575
   20    HA   ARG   3           HA       ARG   3  12.485   2.186  -8.476
   21   1HB   ARG   3          1HB       ARG   3  13.311   4.793  -8.059
   22   2HB   ARG   3          2HB       ARG   3  13.676   4.067  -6.513
   23   1HG   ARG   3          1HG       ARG   3  14.573   2.930  -9.155
   24   2HG   ARG   3          2HG       ARG   3  15.516   4.060  -8.192
   25   1HD   ARG   3          1HD       ARG   3  14.942   2.200  -6.309
   26   2HD   ARG   3          2HD       ARG   3  14.900   1.206  -7.752
   27    HE   ARG   3           HE       ARG   3  17.159   1.839  -8.249
   28   1HH1  ARG   3          1HH1      ARG   3  16.074   2.576  -4.975
   29   2HH1  ARG   3          2HH1      ARG   3  17.673   2.634  -4.353
   30   1HH2  ARG   3          1HH2      ARG   3  19.258   1.911  -7.374
   31   2HH2  ARG   3          2HH2      ARG   3  19.475   2.254  -5.689
   32    H    CYS   4           H        CYS   4  10.639   1.055  -7.369
   33    HA   CYS   4           HA       CYS   4  11.351   0.717  -4.530
   34   1HB   CYS   4          1HB       CYS   4   8.877   0.290  -4.101
   35   2HB   CYS   4          2HB       CYS   4   9.357   1.957  -4.387
   36   1HB   PRO   5          1HB       PRO   5  10.877  -4.657  -3.121
   37   2HB   PRO   5          2HB       PRO   5  12.466  -3.975  -3.460
   38   1HG   PRO   5          1HG       PRO   5  10.166  -2.745  -2.059
   39   2HG   PRO   5          2HG       PRO   5  11.876  -2.674  -1.645
   40   1HD   PRO   5          1HD       PRO   5  10.584  -0.644  -2.855
   41   2HD   PRO   5          2HD       PRO   5  12.296  -0.985  -3.177
   42    H    GLY   6           H        GLY   6  10.300  -5.300  -6.119
   43   1HA   GLY   6          1HA       GLY   6   8.328  -6.491  -6.300
   44   2HA   GLY   6          2HA       GLY   6   7.451  -5.251  -5.423
   45    H    LYS   7           H        LYS   7   6.150  -6.161  -7.457
   46    HA   LYS   7           HA       LYS   7   6.757  -5.070 -10.003
   47   1HB   LYS   7          1HB       LYS   7   5.281  -7.019  -9.451
   48   2HB   LYS   7          2HB       LYS   7   4.076  -5.895  -8.960
   49   1HG   LYS   7          1HG       LYS   7   3.739  -5.040 -11.090
   50   2HG   LYS   7          2HG       LYS   7   5.229  -5.757 -11.706
   51   1HD   LYS   7          1HD       LYS   7   2.743  -7.241 -10.870
   52   2HD   LYS   7          2HD       LYS   7   3.316  -6.998 -12.506
   53   1HE   LYS   7          1HE       LYS   7   5.403  -8.228 -11.865
   54   2HE   LYS   7          2HE       LYS   7   4.628  -8.622 -10.331
   55   1HZ   LYS   7          1HZ       LYS   7   2.869  -9.741 -11.538
   56   2HZ   LYS   7          2HZ       LYS   7   3.627  -9.395 -13.008
   57   3HZ   LYS   7          3HZ       LYS   7   4.381 -10.414 -11.881
   58    H    ASN   8           H        ASN   8   5.775  -3.310 -11.117
   59    HA   ASN   8           HA       ASN   8   4.942  -1.137  -9.328
   60   1HB   ASN   8          1HB       ASN   8   6.903  -1.305 -11.323
   61   2HB   ASN   8          2HB       ASN   8   5.662  -0.238 -11.971
   62   2HD2  ASN   8          2HD2      ASN   8   8.495   0.021 -10.750
   63   1HD2  ASN   8          1HD2      ASN   8   8.309   1.351  -9.665
   64    H    ALA   9           H        ALA   9   3.784  -3.083 -11.904
   65    HA   ALA   9           HA       ALA   9   1.280  -1.644 -11.871
   66   1HB   ALA   9          1HB       ALA   9   2.790  -2.115 -14.422
   67   2HB   ALA   9          2HB       ALA   9   1.154  -1.462 -14.306
   68   3HB   ALA   9          3HB       ALA   9   2.520  -0.545 -13.671
   69    H    TRP  10           H        TRP  10  -0.369  -3.027 -11.802
   70    HA   TRP  10           HA       TRP  10   0.184  -5.829 -12.600
   71   1HB   TRP  10          1HB       TRP  10  -1.698  -4.692 -10.534
   72   2HB   TRP  10          2HB       TRP  10  -1.678  -6.364 -11.052
   73    HD1  TRP  10           HD1      TRP  10   0.127  -7.957 -10.033
   74    HE1  TRP  10           HE1      TRP  10   1.980  -7.644  -8.269
   75    HE3  TRP  10           HE3      TRP  10   0.002  -2.884  -9.604
   76    HZ2  TRP  10           HZ2      TRP  10   3.212  -5.506  -6.883
   77    HZ3  TRP  10           HZ3      TRP  10   1.524  -1.768  -8.050
   78    HH2  TRP  10           HH2      TRP  10   3.099  -3.057  -6.703
   79   1HB   PRO  11          1HB       PRO  11  -1.867  -5.503 -17.747
   80   2HB   PRO  11          2HB       PRO  11  -1.483  -3.832 -17.348
   81   1HG   PRO  11          1HG       PRO  11   0.641  -4.761 -17.201
   82   2HG   PRO  11          2HG       PRO  11   0.006  -6.330 -16.671
   83   1HD   PRO  11          1HD       PRO  11   0.714  -5.551 -14.658
   84   2HD   PRO  11          2HD       PRO  11   0.446  -3.842 -15.074
   85    H    GLU  12           H        GLU  12  -1.556  -7.293 -15.157
   86    HA   GLU  12           HA       GLU  12  -3.690  -8.764 -16.265
   87   1HB   GLU  12          1HB       GLU  12  -1.486  -9.737 -15.909
   88   2HB   GLU  12          2HB       GLU  12  -2.742 -10.674 -15.112
   89   1HG   GLU  12          1HG       GLU  12  -1.970  -8.968 -13.100
   90   2HG   GLU  12          2HG       GLU  12  -1.453 -10.635 -13.331
   91    H    LEU  13           H        LEU  13  -3.660  -6.887 -13.430
   92    HA   LEU  13           HA       LEU  13  -5.450  -8.562 -11.933
   93   1HB   LEU  13          1HB       LEU  13  -4.359  -5.797 -11.565
   94   2HB   LEU  13          2HB       LEU  13  -5.723  -6.329 -10.608
   95    HG   LEU  13           HG       LEU  13  -2.970  -7.548 -10.626
   96   1HD1  LEU  13          1HD1      LEU  13  -3.184  -5.444  -9.386
   97   2HD1  LEU  13          2HD1      LEU  13  -4.490  -6.105  -8.484
   98   3HD1  LEU  13          3HD1      LEU  13  -2.898  -6.789  -8.314
   99   1HD2  LEU  13          1HD2      LEU  13  -5.562  -8.627  -9.775
  100   2HD2  LEU  13          2HD2      LEU  13  -4.038  -9.436 -10.124
  101   3HD2  LEU  13          3HD2      LEU  13  -4.311  -8.693  -8.572
  102    H    VAL  14           H        VAL  14  -5.725  -6.227 -14.426
  103    HA   VAL  14           HA       VAL  14  -8.226  -5.122 -13.935
  104    HB   VAL  14           HB       VAL  14  -7.088  -5.902 -16.635
  105   1HG1  VAL  14          1HG1      VAL  14  -9.263  -3.959 -15.861
  106   2HG1  VAL  14          2HG1      VAL  14  -8.527  -4.036 -17.462
  107   3HG1  VAL  14          3HG1      VAL  14  -9.433  -5.415 -16.843
  108   1HG2  VAL  14          1HG2      VAL  14  -5.615  -4.418 -15.202
  109   2HG2  VAL  14          2HG2      VAL  14  -6.128  -3.741 -16.739
  110   3HG2  VAL  14          3HG2      VAL  14  -6.904  -3.231 -15.246
  111    H    GLY  15           H        GLY  15 -10.138  -6.094 -13.608
  112   1HA   GLY  15          1HA       GLY  15 -11.927  -7.375 -14.578
  113   2HA   GLY  15          2HA       GLY  15 -10.773  -8.559 -15.151
  114    H    LYS  16           H        LYS  16  -9.502  -7.979 -12.270
  115    HA   LYS  16           HA       LYS  16 -11.039 -10.124 -10.988
  116   1HB   LYS  16          1HB       LYS  16  -8.320  -8.942 -10.502
  117   2HB   LYS  16          2HB       LYS  16  -9.051 -10.058  -9.361
  118   1HG   LYS  16          1HG       LYS  16  -9.020 -10.964 -12.178
  119   2HG   LYS  16          2HG       LYS  16  -7.435 -10.715 -11.463
  120   1HD   LYS  16          1HD       LYS  16  -7.571 -12.636 -10.383
  121   2HD   LYS  16          2HD       LYS  16  -9.016 -12.110  -9.530
  122   1HE   LYS  16          1HE       LYS  16 -10.387 -13.300 -10.842
  123   2HE   LYS  16          2HE       LYS  16  -9.490 -12.958 -12.316
  124   1HZ   LYS  16          1HZ       LYS  16  -8.721 -14.956 -10.256
  125   2HZ   LYS  16          2HZ       LYS  16  -9.398 -15.284 -11.771
  126   3HZ   LYS  16          3HZ       LYS  16  -7.853 -14.605 -11.671
  127    H    SER  17           H        SER  17 -11.542  -9.967  -8.701
  128    HA   SER  17           HA       SER  17 -12.999  -7.668  -8.071
  129   1HB   SER  17          1HB       SER  17 -13.207 -10.024  -7.049
  130   2HB   SER  17          2HB       SER  17 -13.412  -8.642  -5.970
  131    HG   SER  17           HG       SER  17 -12.021 -10.230  -5.082
  132    H    GLY  18           H        GLY  18 -12.627  -5.892  -6.743
  133   1HA   GLY  18          1HA       GLY  18 -10.157  -4.662  -6.702
  134   2HA   GLY  18          2HA       GLY  18 -11.454  -4.342  -5.588
  135    H    ASN  19           H        ASN  19 -11.468  -7.002  -4.417
  136    HA   ASN  19           HA       ASN  19  -9.473  -6.564  -2.427
  137   1HB   ASN  19          1HB       ASN  19 -11.865  -7.838  -2.432
  138   2HB   ASN  19          2HB       ASN  19 -10.805  -9.238  -2.555
  139   2HD2  ASN  19          2HD2      ASN  19 -11.465  -6.304  -0.685
  140   1HD2  ASN  19          1HD2      ASN  19 -10.857  -6.924   0.809
  141    H    MET  20           H        MET  20  -9.892  -8.987  -5.011
  142    HA   MET  20           HA       MET  20  -7.570 -10.478  -4.397
  143   1HB   MET  20          1HB       MET  20  -9.476 -11.122  -5.949
  144   2HB   MET  20          2HB       MET  20  -8.737 -10.103  -7.171
  145   1HG   MET  20          1HG       MET  20  -7.520 -11.839  -7.791
  146   2HG   MET  20          2HG       MET  20  -6.643 -11.721  -6.268
  147   1HE   MET  20          1HE       MET  20  -7.188 -13.042  -4.155
  148   2HE   MET  20          2HE       MET  20  -8.898 -12.610  -4.094
  149   3HE   MET  20          3HE       MET  20  -8.407 -14.304  -4.010
  150    H    ALA  21           H        ALA  21  -8.147  -7.635  -6.411
  151    HA   ALA  21           HA       ALA  21  -5.609  -7.474  -7.582
  152   1HB   ALA  21          1HB       ALA  21  -7.764  -5.478  -7.048
  153   2HB   ALA  21          2HB       ALA  21  -7.244  -6.148  -8.594
  154   3HB   ALA  21          3HB       ALA  21  -6.235  -4.973  -7.753
  155    H    ALA  22           H        ALA  22  -6.931  -5.570  -4.877
  156    HA   ALA  22           HA       ALA  22  -4.603  -4.327  -4.095
  157   1HB   ALA  22          1HB       ALA  22  -6.791  -5.301  -2.260
  158   2HB   ALA  22          2HB       ALA  22  -6.827  -3.806  -3.190
  159   3HB   ALA  22          3HB       ALA  22  -5.631  -4.007  -1.908
  160    H    ALA  23           H        ALA  23  -5.835  -7.500  -3.129
  161    HA   ALA  23           HA       ALA  23  -3.816  -8.123  -1.266
  162   1HB   ALA  23          1HB       ALA  23  -5.906  -9.385  -1.461
  163   2HB   ALA  23          2HB       ALA  23  -4.500 -10.444  -1.562
  164   3HB   ALA  23          3HB       ALA  23  -5.389 -10.014  -3.027
  165    H    THR  24           H        THR  24  -4.071  -8.759  -4.759
  166    HA   THR  24           HA       THR  24  -1.718 -10.220  -5.081
  167    HB   THR  24           HB       THR  24  -3.019  -8.298  -7.003
  168    HG1  THR  24           HG1      THR  24  -3.747 -10.525  -7.812
  169   1HG2  THR  24          1HG2      THR  24  -1.041 -10.500  -7.521
  170   2HG2  THR  24          2HG2      THR  24  -2.022  -9.711  -8.759
  171   3HG2  THR  24          3HG2      THR  24  -0.844  -8.775  -7.855
  172    H    VAL  25           H        VAL  25  -2.245  -6.721  -5.138
  173    HA   VAL  25           HA       VAL  25   0.414  -6.031  -5.842
  174    HB   VAL  25           HB       VAL  25  -1.610  -4.376  -4.311
  175   1HG1  VAL  25          1HG1      VAL  25   1.118  -3.846  -5.122
  176   2HG1  VAL  25          2HG1      VAL  25  -0.003  -2.722  -5.884
  177   3HG1  VAL  25          3HG1      VAL  25   0.023  -2.890  -4.140
  178   1HG2  VAL  25          1HG2      VAL  25  -1.163  -4.779  -7.260
  179   2HG2  VAL  25          2HG2      VAL  25  -2.638  -4.973  -6.337
  180   3HG2  VAL  25          3HG2      VAL  25  -1.997  -3.370  -6.614
  181    H    GLU  26           H        GLU  26  -1.232  -5.994  -2.667
  182    HA   GLU  26           HA       GLU  26   1.086  -5.289  -1.206
  183   1HB   GLU  26          1HB       GLU  26  -0.145  -5.781   0.750
  184   2HB   GLU  26          2HB       GLU  26  -1.230  -6.878  -0.098
  185   1HG   GLU  26          1HG       GLU  26  -1.232  -4.121  -1.141
  186   2HG   GLU  26          2HG       GLU  26  -2.541  -5.253  -0.846
  187    H    ARG  27           H        ARG  27  -0.049  -8.371  -2.417
  188    HA   ARG  27           HA       ARG  27   1.733  -9.879  -0.699
  189   1HB   ARG  27          1HB       ARG  27  -0.549 -10.500  -2.203
  190   2HB   ARG  27          2HB       ARG  27   0.743 -11.333  -3.024
  191   1HG   ARG  27          1HG       ARG  27   0.974 -12.849  -1.432
  192   2HG   ARG  27          2HG       ARG  27   0.875 -11.670  -0.133
  193   1HD   ARG  27          1HD       ARG  27  -0.979 -13.375  -0.180
  194   2HD   ARG  27          2HD       ARG  27  -1.458 -11.683  -0.116
  195    HE   ARG  27           HE       ARG  27  -2.518 -11.945  -2.097
  196   1HH1  ARG  27          1HH1      ARG  27  -0.115 -14.505  -1.826
  197   2HH1  ARG  27          2HH1      ARG  27  -0.583 -15.242  -3.304
  198   1HH2  ARG  27          1HH2      ARG  27  -3.128 -12.971  -4.043
  199   2HH2  ARG  27          2HH2      ARG  27  -2.291 -14.398  -4.559
  200    H    GLU  28           H        GLU  28   1.509  -9.340  -4.227
  201    HA   GLU  28           HA       GLU  28   4.013 -10.506  -4.823
  202   1HB   GLU  28          1HB       GLU  28   2.227  -8.561  -6.263
  203   2HB   GLU  28          2HB       GLU  28   3.821  -8.912  -6.903
  204   1HG   GLU  28          1HG       GLU  28   2.987 -11.419  -6.607
  205   2HG   GLU  28          2HG       GLU  28   1.411 -10.633  -6.722
  206    H    ASN  29           H        ASN  29   3.053  -7.249  -3.883
  207    HA   ASN  29           HA       ASN  29   5.908  -6.535  -3.645
  208   1HB   ASN  29          1HB       ASN  29   4.872  -5.347  -5.529
  209   2HB   ASN  29          2HB       ASN  29   3.624  -4.718  -4.461
  210   2HD2  ASN  29          2HD2      ASN  29   5.501  -3.220  -6.062
  211   1HD2  ASN  29          1HD2      ASN  29   6.426  -2.269  -4.955
  212    H    ARG  30           H        ARG  30   5.572  -7.434  -1.511
  213    HA   ARG  30           HA       ARG  30   3.826  -6.336   0.404
  214   1HB   ARG  30          1HB       ARG  30   5.506  -7.298   2.083
  215   2HB   ARG  30          2HB       ARG  30   4.744  -8.394   0.939
  216   1HG   ARG  30          1HG       ARG  30   6.678  -8.593  -0.386
  217   2HG   ARG  30          2HG       ARG  30   7.451  -7.226   0.422
  218   1HD   ARG  30          1HD       ARG  30   7.771  -8.423   2.391
  219   2HD   ARG  30          2HD       ARG  30   6.697  -9.733   1.917
  220    HE   ARG  30           HE       ARG  30   9.456  -9.278   1.086
  221   1HH1  ARG  30          1HH1      ARG  30   6.516 -11.165   0.626
  222   2HH1  ARG  30          2HH1      ARG  30   7.346 -12.461  -0.138
  223   1HH2  ARG  30          1HH2      ARG  30  10.513 -11.005   0.035
  224   2HH2  ARG  30          2HH2      ARG  30   9.594 -12.369  -0.510
  225    H    ASN  31           H        ASN  31   6.185  -4.629  -1.164
  226    HA   ASN  31           HA       ASN  31   7.032  -3.113   1.177
  227   1HB   ASN  31          1HB       ASN  31   8.717  -3.683  -0.506
  228   2HB   ASN  31          2HB       ASN  31   7.793  -2.830  -1.734
  229   2HD2  ASN  31          2HD2      ASN  31   9.467  -2.389   1.352
  230   1HD2  ASN  31          1HD2      ASN  31   9.891  -0.739   1.067
  231    H    VAL  32           H        VAL  32   4.416  -3.106  -0.904
  232    HA   VAL  32           HA       VAL  32   3.849  -0.299  -0.249
  233    HB   VAL  32           HB       VAL  32   3.187   0.260  -2.452
  234   1HG1  VAL  32          1HG1      VAL  32   5.627   0.347  -2.038
  235   2HG1  VAL  32          2HG1      VAL  32   5.772  -1.289  -2.671
  236   3HG1  VAL  32          3HG1      VAL  32   5.263   0.007  -3.721
  237   1HG2  VAL  32          1HG2      VAL  32   3.416  -2.675  -3.021
  238   2HG2  VAL  32          2HG2      VAL  32   2.074  -1.581  -3.324
  239   3HG2  VAL  32          3HG2      VAL  32   3.513  -1.496  -4.328
  240    H    HIS  33           H        HIS  33   1.495   0.231  -0.655
  241    HA   HIS  33           HA       HIS  33  -0.179  -2.185  -0.286
  242   1HB   HIS  33          1HB       HIS  33  -1.216  -1.375   1.584
  243   2HB   HIS  33          2HB       HIS  33   0.369  -0.683   1.811
  244    HD1  HIS  33           HD1      HIS  33  -3.032   0.216   2.042
  245    HD2  HIS  33           HD2      HIS  33   0.373   2.128   0.675
  246    HE1  HIS  33           HE1      HIS  33  -3.586   2.668   2.050
  247    HE2  HIS  33           HE2      HIS  33  -1.466   3.810   1.303
  248    H    ALA  34           H        ALA  34  -2.220  -2.175  -1.132
  249    HA   ALA  34           HA       ALA  34  -2.706  -0.054  -3.113
  250   1HB   ALA  34          1HB       ALA  34  -3.667  -2.897  -3.080
  251   2HB   ALA  34          2HB       ALA  34  -4.033  -1.709  -4.325
  252   3HB   ALA  34          3HB       ALA  34  -2.373  -2.248  -4.082
  253    H    ILE  35           H        ILE  35  -4.577   1.056  -3.139
  254    HA   ILE  35           HA       ILE  35  -6.470   0.530  -0.937
  255    HB   ILE  35           HB       ILE  35  -6.158   3.073  -2.539
  256   1HG1  ILE  35          1HG1      ILE  35  -5.171   2.686   0.291
  257   2HG1  ILE  35          2HG1      ILE  35  -4.138   2.309  -1.078
  258   1HG2  ILE  35          1HG2      ILE  35  -7.623   2.429   0.023
  259   2HG2  ILE  35          2HG2      ILE  35  -7.415   4.053  -0.635
  260   3HG2  ILE  35          3HG2      ILE  35  -8.342   2.855  -1.533
  261   1HD1  ILE  35          1HD1      ILE  35  -5.398   5.000  -0.661
  262   2HD1  ILE  35          2HD1      ILE  35  -3.806   4.519  -0.112
  263   3HD1  ILE  35          3HD1      ILE  35  -4.144   4.551  -1.836
  264    H    VAL  36           H        VAL  36  -8.238  -0.539  -1.567
  265    HA   VAL  36           HA       VAL  36  -9.076  -0.573  -4.313
  266    HB   VAL  36           HB       VAL  36  -9.228  -2.542  -2.801
  267   1HG1  VAL  36          1HG1      VAL  36 -10.138  -1.134  -0.852
  268   2HG1  VAL  36          2HG1      VAL  36 -11.706  -1.282  -1.650
  269   3HG1  VAL  36          3HG1      VAL  36 -10.837  -2.723  -1.127
  270   1HG2  VAL  36          1HG2      VAL  36 -10.471  -2.425  -4.883
  271   2HG2  VAL  36          2HG2      VAL  36 -11.392  -3.307  -3.671
  272   3HG2  VAL  36          3HG2      VAL  36 -11.813  -1.639  -4.077
  273    H    LEU  37           H        LEU  37 -10.312   0.862  -5.244
  274    HA   LEU  37           HA       LEU  37 -12.509   2.135  -3.781
  275   1HB   LEU  37          1HB       LEU  37 -11.730   4.298  -4.980
  276   2HB   LEU  37          2HB       LEU  37 -10.991   3.837  -3.465
  277    HG   LEU  37           HG       LEU  37  -9.173   2.703  -4.967
  278   1HD1  LEU  37          1HD1      LEU  37 -10.705   4.345  -6.938
  279   2HD1  LEU  37          2HD1      LEU  37  -8.959   4.146  -7.110
  280   3HD1  LEU  37          3HD1      LEU  37 -10.006   2.753  -7.082
  281   1HD2  LEU  37          1HD2      LEU  37  -9.516   5.593  -4.353
  282   2HD2  LEU  37          2HD2      LEU  37  -8.352   4.417  -3.742
  283   3HD2  LEU  37          3HD2      LEU  37  -8.170   5.082  -5.361
  284    H    LYS  38           H        LYS  38 -14.105   3.031  -5.208
  285    HA   LYS  38           HA       LYS  38 -14.181   1.603  -7.743
  286   1HB   LYS  38          1HB       LYS  38 -16.543   2.354  -7.845
  287   2HB   LYS  38          2HB       LYS  38 -16.136   1.379  -6.441
  288   1HG   LYS  38          1HG       LYS  38 -15.752   4.123  -5.729
  289   2HG   LYS  38          2HG       LYS  38 -17.287   3.984  -6.571
  290   1HD   LYS  38          1HD       LYS  38 -16.591   2.011  -4.410
  291   2HD   LYS  38          2HD       LYS  38 -17.169   3.629  -4.001
  292   1HE   LYS  38          1HE       LYS  38 -18.709   2.101  -6.038
  293   2HE   LYS  38          2HE       LYS  38 -18.833   1.600  -4.352
  294   1HZ   LYS  38          1HZ       LYS  38 -19.486   3.864  -3.772
  295   2HZ   LYS  38          2HZ       LYS  38 -19.394   4.326  -5.401
  296   3HZ   LYS  38          3HZ       LYS  38 -20.536   3.181  -4.905
  297    H    GLU  39           H        GLU  39 -14.831   2.598  -9.724
  298    HA   GLU  39           HA       GLU  39 -13.292   4.753 -10.507
  299   1HB   GLU  39          1HB       GLU  39 -14.851   2.979 -11.828
  300   2HB   GLU  39          2HB       GLU  39 -15.880   4.399 -11.938
  301   1HG   GLU  39          1HG       GLU  39 -14.043   5.652 -12.954
  302   2HG   GLU  39          2HG       GLU  39 -13.030   4.207 -12.872
  303    H    GLY  40           H        GLY  40 -13.328   6.757  -9.734
  304   1HA   GLY  40          1HA       GLY  40 -14.561   8.870  -9.973
  305   2HA   GLY  40          2HA       GLY  40 -15.976   8.059  -9.326
  306    H    SER  41           H        SER  41 -13.466   6.783  -7.633
  307    HA   SER  41           HA       SER  41 -14.120   8.201  -5.270
  308   1HB   SER  41          1HB       SER  41 -13.398   5.913  -5.105
  309   2HB   SER  41          2HB       SER  41 -11.882   6.279  -5.902
  310    HG   SER  41           HG       SER  41 -11.634   6.152  -3.642
  311    H    ALA  42           H        ALA  42 -11.960   8.842  -3.898
  312    HA   ALA  42           HA       ALA  42 -10.919  11.181  -5.315
  313   1HB   ALA  42          1HB       ALA  42 -10.172  11.917  -3.125
  314   2HB   ALA  42          2HB       ALA  42 -10.650  10.370  -2.417
  315   3HB   ALA  42          3HB       ALA  42 -11.873  11.450  -3.089
  316    H    MET  43           H        MET  43  -9.279  10.579  -6.624
  317    HA   MET  43           HA       MET  43  -7.025   9.122  -5.394
  318   1HB   MET  43          1HB       MET  43  -6.640   8.283  -7.827
  319   2HB   MET  43          2HB       MET  43  -7.834   7.515  -6.787
  320   1HG   MET  43          1HG       MET  43  -9.524   9.128  -7.928
  321   2HG   MET  43          2HG       MET  43  -8.264   9.313  -9.134
  322   1HE   MET  43          1HE       MET  43 -10.449   6.768  -7.165
  323   2HE   MET  43          2HE       MET  43 -11.419   7.564  -8.400
  324   3HE   MET  43          3HE       MET  43 -11.098   5.834  -8.513
  325    H    THR  44           H        THR  44  -5.605  10.680  -5.066
  326    HA   THR  44           HA       THR  44  -5.297  12.954  -6.726
  327    HB   THR  44           HB       THR  44  -3.337  13.445  -5.453
  328    HG1  THR  44           HG1      THR  44  -2.161  11.608  -5.420
  329   1HG2  THR  44          1HG2      THR  44  -5.526  13.502  -4.191
  330   2HG2  THR  44          2HG2      THR  44  -5.046  11.946  -3.504
  331   3HG2  THR  44          3HG2      THR  44  -4.055  13.373  -3.226
  332    H    LYS  45           H        LYS  45  -3.588  13.432  -8.187
  333    HA   LYS  45           HA       LYS  45  -2.909  11.172  -9.865
  334   1HB   LYS  45          1HB       LYS  45  -2.713  14.150 -10.065
  335   2HB   LYS  45          2HB       LYS  45  -1.681  13.184 -11.102
  336   1HG   LYS  45          1HG       LYS  45  -3.351  13.115 -12.533
  337   2HG   LYS  45          2HG       LYS  45  -4.119  11.965 -11.449
  338   1HD   LYS  45          1HD       LYS  45  -4.962  14.189 -10.233
  339   2HD   LYS  45          2HD       LYS  45  -5.798  13.462 -11.605
  340   1HE   LYS  45          1HE       LYS  45  -3.760  15.666 -11.865
  341   2HE   LYS  45          2HE       LYS  45  -4.753  14.968 -13.146
  342   1HZ   LYS  45          1HZ       LYS  45  -6.731  15.780 -11.964
  343   2HZ   LYS  45          2HZ       LYS  45  -5.733  16.514 -10.809
  344   3HZ   LYS  45          3HZ       LYS  45  -5.697  17.043 -12.419
  345    H    ASP  46           H        ASP  46  -1.337  13.092  -7.441
  346    HA   ASP  46           HA       ASP  46   1.305  12.978  -8.058
  347   1HB   ASP  46          1HB       ASP  46  -0.147  12.603  -5.445
  348   2HB   ASP  46          2HB       ASP  46   1.617  12.544  -5.486
  349    H    PHE  47           H        PHE  47   3.012  11.513  -7.791
  350    HA   PHE  47           HA       PHE  47   2.177   8.718  -8.049
  351   1HB   PHE  47          1HB       PHE  47   3.660   9.567  -9.744
  352   2HB   PHE  47          2HB       PHE  47   4.834  10.064  -8.531
  353    HD1  PHE  47           HD1      PHE  47   3.348   7.218 -10.295
  354    HD2  PHE  47           HD2      PHE  47   6.238   8.444  -7.415
  355    HE1  PHE  47           HE1      PHE  47   4.385   5.002 -10.395
  356    HE2  PHE  47           HE2      PHE  47   7.276   6.220  -7.507
  357    HZ   PHE  47           HZ       PHE  47   6.353   4.494  -8.995
  358    H    ARG  48           H        ARG  48   2.610   7.152  -6.616
  359    HA   ARG  48           HA       ARG  48   4.546   7.576  -4.461
  360   1HB   ARG  48          1HB       ARG  48   1.694   6.821  -3.836
  361   2HB   ARG  48          2HB       ARG  48   3.006   7.081  -2.697
  362   1HG   ARG  48          1HG       ARG  48   2.956   9.487  -3.884
  363   2HG   ARG  48          2HG       ARG  48   1.272   9.019  -4.120
  364   1HD   ARG  48          1HD       ARG  48   2.815   9.240  -1.541
  365   2HD   ARG  48          2HD       ARG  48   1.491  10.260  -2.103
  366    HE   ARG  48           HE       ARG  48   0.763   7.487  -1.849
  367   1HH1  ARG  48          1HH1      ARG  48   1.125  10.499  -0.084
  368   2HH1  ARG  48          2HH1      ARG  48  -0.005  10.038   1.130
  369   1HH2  ARG  48          1HH2      ARG  48  -0.710   6.899  -0.215
  370   2HH2  ARG  48          2HH2      ARG  48  -1.048   8.013   1.061
  371    H    CYS  49           H        CYS  49   5.783   5.834  -4.649
  372    HA   CYS  49           HA       CYS  49   5.067   3.438  -5.870
  373   1HB   CYS  49          1HB       CYS  49   7.375   4.500  -4.500
  374   2HB   CYS  49          2HB       CYS  49   7.155   2.814  -4.080
  375    H    ASP  50           H        ASP  50   4.916   4.383  -2.505
  376    HA   ASP  50           HA       ASP  50   4.248   1.747  -1.585
  377   1HB   ASP  50          1HB       ASP  50   5.449   3.301  -0.167
  378   2HB   ASP  50          2HB       ASP  50   3.942   2.789   0.585
  379    H    ARG  51           H        ARG  51   2.441   3.891  -3.350
  380    HA   ARG  51           HA       ARG  51  -0.045   2.918  -2.119
  381   1HB   ARG  51          1HB       ARG  51   0.430   5.317  -1.669
  382   2HB   ARG  51          2HB       ARG  51   0.339   5.630  -3.397
  383   1HG   ARG  51          1HG       ARG  51  -2.005   4.580  -3.244
  384   2HG   ARG  51          2HG       ARG  51  -1.839   4.799  -1.499
  385   1HD   ARG  51          1HD       ARG  51  -1.253   7.212  -2.072
  386   2HD   ARG  51          2HD       ARG  51  -2.925   6.752  -2.247
  387    HE   ARG  51           HE       ARG  51  -1.975   6.335  -4.732
  388   1HH1  ARG  51          1HH1      ARG  51  -1.711   9.083  -2.546
  389   2HH1  ARG  51          2HH1      ARG  51  -1.567  10.215  -3.831
  390   1HH2  ARG  51          1HH2      ARG  51  -1.835   7.885  -6.401
  391   2HH2  ARG  51          2HH2      ARG  51  -1.614   9.550  -6.007
  392    H    VAL  52           H        VAL  52  -1.265   1.782  -3.429
  393    HA   VAL  52           HA       VAL  52  -1.006   2.204  -6.353
  394    HB   VAL  52           HB       VAL  52  -1.559  -0.421  -4.955
  395   1HG1  VAL  52          1HG1      VAL  52  -1.370   0.382  -7.838
  396   2HG1  VAL  52          2HG1      VAL  52  -1.082  -1.283  -7.334
  397   3HG1  VAL  52          3HG1      VAL  52  -2.634  -0.513  -7.019
  398   1HG2  VAL  52          1HG2      VAL  52   0.936   0.895  -5.440
  399   2HG2  VAL  52          2HG2      VAL  52   0.620  -0.680  -4.743
  400   3HG2  VAL  52          3HG2      VAL  52   0.829  -0.517  -6.479
  401    H    TRP  53           H        TRP  53  -2.846   3.020  -7.175
  402    HA   TRP  53           HA       TRP  53  -5.308   2.919  -5.674
  403   1HB   TRP  53          1HB       TRP  53  -4.636   4.000  -8.415
  404   2HB   TRP  53          2HB       TRP  53  -6.269   4.035  -7.776
  405    HD1  TRP  53           HD1      TRP  53  -4.103   6.527  -8.521
  406    HE1  TRP  53           HE1      TRP  53  -4.023   8.452  -6.813
  407    HE3  TRP  53           HE3      TRP  53  -6.095   4.113  -4.504
  408    HZ2  TRP  53           HZ2      TRP  53  -4.677   8.864  -4.090
  409    HZ3  TRP  53           HZ3      TRP  53  -6.348   5.327  -2.407
  410    HH2  TRP  53           HH2      TRP  53  -5.635   7.650  -2.183
  411    H    VAL  54           H        VAL  54  -7.001   1.552  -5.936
  412    HA   VAL  54           HA       VAL  54  -6.862  -0.350  -8.207
  413    HB   VAL  54           HB       VAL  54  -7.589  -0.802  -5.325
  414   1HG1  VAL  54          1HG1      VAL  54  -8.333  -2.461  -7.719
  415   2HG1  VAL  54          2HG1      VAL  54  -8.201  -3.154  -6.104
  416   3HG1  VAL  54          3HG1      VAL  54  -9.370  -1.891  -6.424
  417   1HG2  VAL  54          1HG2      VAL  54  -5.227  -1.020  -6.070
  418   2HG2  VAL  54          2HG2      VAL  54  -5.929  -2.480  -5.368
  419   3HG2  VAL  54          3HG2      VAL  54  -5.742  -2.346  -7.115
  420    H    ILE  55           H        ILE  55  -8.202   0.860  -9.506
  421    HA   ILE  55           HA       ILE  55 -10.745   1.804  -8.560
  422    HB   ILE  55           HB       ILE  55  -9.778   1.695 -11.382
  423   1HG1  ILE  55          1HG1      ILE  55  -8.973   3.396  -9.128
  424   2HG1  ILE  55          2HG1      ILE  55  -9.558   4.321 -10.494
  425   1HG2  ILE  55          1HG2      ILE  55 -11.983   3.193 -10.017
  426   2HG2  ILE  55          2HG2      ILE  55 -11.366   3.639 -11.609
  427   3HG2  ILE  55          3HG2      ILE  55 -12.104   2.058 -11.368
  428   1HD1  ILE  55          1HD1      ILE  55  -7.457   2.216 -10.810
  429   2HD1  ILE  55          2HD1      ILE  55  -7.915   3.525 -11.896
  430   3HD1  ILE  55          3HD1      ILE  55  -7.085   3.879 -10.392
  431    H    VAL  56           H        VAL  56 -12.558   0.716  -8.476
  432    HA   VAL  56           HA       VAL  56 -12.935  -1.586 -10.253
  433    HB   VAL  56           HB       VAL  56 -14.190  -2.699  -8.479
  434   1HG1  VAL  56          1HG1      VAL  56 -11.375  -2.136  -8.387
  435   2HG1  VAL  56          2HG1      VAL  56 -11.961  -2.585  -6.766
  436   3HG1  VAL  56          3HG1      VAL  56 -12.223  -3.650  -8.135
  437   1HG2  VAL  56          1HG2      VAL  56 -13.377  -0.376  -6.758
  438   2HG2  VAL  56          2HG2      VAL  56 -15.010  -0.754  -7.276
  439   3HG2  VAL  56          3HG2      VAL  56 -14.163  -1.832  -6.178
  440    H    ASN  57           H        ASN  57 -15.261  -2.191 -10.499
  441    HA   ASN  57           HA       ASN  57 -16.777   0.236 -11.085
  442   1HB   ASN  57          1HB       ASN  57 -18.306  -1.248 -12.280
  443   2HB   ASN  57          2HB       ASN  57 -16.646  -1.530 -12.775
  444   2HD2  ASN  57          2HD2      ASN  57 -17.503  -3.567 -13.572
  445   1HD2  ASN  57          1HD2      ASN  57 -17.696  -4.879 -12.467
  446    H    ASP  58           H        ASP  58 -19.362  -0.426 -10.806
  447    HA   ASP  58           HA       ASP  58 -19.847   0.007  -8.077
  448   1HB   ASP  58          1HB       ASP  58 -21.549  -0.646 -10.459
  449   2HB   ASP  58          2HB       ASP  58 -22.285  -0.763  -8.867
  450    H    HIS  59           H        HIS  59 -19.368  -2.944  -9.809
  451    HA   HIS  59           HA       HIS  59 -20.640  -4.554  -7.749
  452   1HB   HIS  59          1HB       HIS  59 -20.463  -4.908 -10.410
  453   2HB   HIS  59          2HB       HIS  59 -19.066  -5.852  -9.930
  454    HD1  HIS  59           HD1      HIS  59 -19.534  -8.128  -8.922
  455    HD2  HIS  59           HD2      HIS  59 -22.958  -5.813  -9.354
  456    HE1  HIS  59           HE1      HIS  59 -21.454  -9.667  -8.405
  457    HE2  HIS  59           HE2      HIS  59 -23.520  -8.268  -8.773
  458    H    GLY  60           H        GLY  60 -17.597  -3.153  -8.201
  459   1HA   GLY  60          1HA       GLY  60 -15.852  -3.322  -6.687
  460   2HA   GLY  60          2HA       GLY  60 -16.474  -4.860  -6.111
  461    H    VAL  61           H        VAL  61 -16.112  -4.203  -9.530
  462    HA   VAL  61           HA       VAL  61 -13.994  -6.243  -9.672
  463    HB   VAL  61           HB       VAL  61 -15.647  -5.101 -11.922
  464   1HG1  VAL  61          1HG1      VAL  61 -13.919  -7.548 -11.740
  465   2HG1  VAL  61          2HG1      VAL  61 -14.924  -7.115 -13.123
  466   3HG1  VAL  61          3HG1      VAL  61 -13.571  -6.087 -12.663
  467   1HG2  VAL  61          1HG2      VAL  61 -16.095  -7.629 -10.333
  468   2HG2  VAL  61          2HG2      VAL  61 -17.123  -6.193 -10.328
  469   3HG2  VAL  61          3HG2      VAL  61 -16.974  -7.155 -11.793
  470    H    VAL  62           H        VAL  62 -11.966  -5.725 -10.418
  471    HA   VAL  62           HA       VAL  62 -11.254  -2.971 -10.517
  472    HB   VAL  62           HB       VAL  62  -9.569  -5.352 -11.322
  473   1HG1  VAL  62          1HG1      VAL  62  -8.697  -3.190 -12.101
  474   2HG1  VAL  62          2HG1      VAL  62  -8.759  -2.574 -10.451
  475   3HG1  VAL  62          3HG1      VAL  62  -7.691  -3.910 -10.866
  476   1HG2  VAL  62          1HG2      VAL  62 -10.656  -4.993  -8.832
  477   2HG2  VAL  62          2HG2      VAL  62  -9.143  -5.788  -9.210
  478   3HG2  VAL  62          3HG2      VAL  62  -9.137  -4.127  -8.677
  479    H    THR  63           H        THR  63 -11.615  -1.675 -12.195
  480    HA   THR  63           HA       THR  63 -11.716  -2.802 -14.921
  481    HB   THR  63           HB       THR  63 -12.814  -0.755 -15.562
  482    HG1  THR  63           HG1      THR  63 -11.978   0.851 -14.396
  483   1HG2  THR  63          1HG2      THR  63 -14.273  -2.422 -14.545
  484   2HG2  THR  63          2HG2      THR  63 -13.999  -1.701 -12.958
  485   3HG2  THR  63          3HG2      THR  63 -14.818  -0.779 -14.217
  486    H    SER  64           H        SER  64  -9.925  -0.564 -12.891
  487    HA   SER  64           HA       SER  64  -8.274   0.243 -15.192
  488   1HB   SER  64          1HB       SER  64  -9.281   1.841 -13.334
  489   2HB   SER  64          2HB       SER  64  -7.844   1.326 -12.464
  490    HG   SER  64           HG       SER  64  -7.858   3.249 -14.082
  491    H    VAL  65           H        VAL  65  -6.013   0.166 -15.075
  492    HA   VAL  65           HA       VAL  65  -4.972  -2.297 -14.130
  493    HB   VAL  65           HB       VAL  65  -3.410   0.102 -15.077
  494   1HG1  VAL  65          1HG1      VAL  65  -2.666  -2.607 -14.267
  495   2HG1  VAL  65          2HG1      VAL  65  -2.091  -2.181 -15.885
  496   3HG1  VAL  65          3HG1      VAL  65  -1.692  -1.166 -14.509
  497   1HG2  VAL  65          1HG2      VAL  65  -4.646  -2.149 -16.651
  498   2HG2  VAL  65          2HG2      VAL  65  -5.056  -0.439 -16.750
  499   3HG2  VAL  65          3HG2      VAL  65  -3.478  -0.997 -17.288
  500   1HB   PRO  66          1HB       PRO  66  -4.585  -2.304  -8.648
  501   2HB   PRO  66          2HB       PRO  66  -3.301  -3.299  -9.299
  502   1HG   PRO  66          1HG       PRO  66  -5.054  -4.450 -10.179
  503   2HG   PRO  66          2HG       PRO  66  -6.119  -3.073 -10.090
  504   1HD   PRO  66          1HD       PRO  66  -4.189  -3.773 -12.229
  505   2HD   PRO  66          2HD       PRO  66  -5.787  -3.075 -12.357
  506    H    HIS  67           H        HIS  67  -2.336   0.589 -10.809
  507    HA   HIS  67           HA       HIS  67   0.242  -0.800 -10.524
  508   1HB   HIS  67          1HB       HIS  67   1.169   0.551 -12.293
  509   2HB   HIS  67          2HB       HIS  67  -0.298  -0.221 -12.882
  510    HD1  HIS  67           HD1      HIS  67   1.054   2.483 -13.958
  511    HD2  HIS  67           HD2      HIS  67  -2.343   2.179 -11.588
  512    HE1  HIS  67           HE1      HIS  67  -0.263   4.580 -14.379
  513    HE2  HIS  67           HE2      HIS  67  -2.264   4.409 -12.859
  514    H    ILE  68           H        ILE  68   1.875   0.252  -9.512
  515    HA   ILE  68           HA       ILE  68   1.425   1.785  -7.345
  516    HB   ILE  68           HB       ILE  68   3.739   1.167  -9.005
  517   1HG1  ILE  68          1HG1      ILE  68   4.252   1.642  -6.209
  518   2HG1  ILE  68          2HG1      ILE  68   2.838   0.654  -6.383
  519   1HG2  ILE  68          1HG2      ILE  68   3.755   3.811  -7.564
  520   2HG2  ILE  68          2HG2      ILE  68   5.220   2.899  -7.912
  521   3HG2  ILE  68          3HG2      ILE  68   4.199   3.401  -9.222
  522   1HD1  ILE  68          1HD1      ILE  68   5.507   0.070  -7.631
  523   2HD1  ILE  68          2HD1      ILE  68   4.941  -0.580  -6.099
  524   3HD1  ILE  68          3HD1      ILE  68   4.085  -0.971  -7.580
  525    H    THR  69           H        THR  69   0.429   3.651  -7.075
  526    HA   THR  69           HA       THR  69   1.259   6.023  -8.495
  527    HB   THR  69           HB       THR  69  -1.450   4.789  -9.000
  528    HG1  THR  69           HG1      THR  69   0.602   5.767 -10.722
  529   1HG2  THR  69          1HG2      THR  69  -0.613   7.642  -9.396
  530   2HG2  THR  69          2HG2      THR  69  -1.952   6.907 -10.275
  531   3HG2  THR  69          3HG2      THR  69  -2.009   7.034  -8.527

  No H/Q in entry =         531
  Start of MODEL   19
    1    H    SER   1           H        SER   1  12.094  10.746 -10.517
    2    HA   SER   1           HA       SER   1  11.750   9.036  -8.102
    3   1HB   SER   1          1HB       SER   1   9.447   9.894  -8.097
    4   2HB   SER   1          2HB       SER   1  10.634  11.186  -8.248
    5    HG   SER   1           HG       SER   1   8.777  11.299  -9.709
    6    H    ARG   2           H        ARG   2  12.480   7.018  -9.281
    7    HA   ARG   2           HA       ARG   2  10.255   5.288  -9.341
    8   1HB   ARG   2          1HB       ARG   2  10.756   4.179 -11.504
    9   2HB   ARG   2          2HB       ARG   2  10.095   5.787 -11.669
   10   1HG   ARG   2          1HG       ARG   2  11.989   6.686 -12.515
   11   2HG   ARG   2          2HG       ARG   2  13.069   5.560 -11.705
   12   1HD   ARG   2          1HD       ARG   2  11.283   4.981 -14.058
   13   2HD   ARG   2          2HD       ARG   2  13.025   5.166 -14.106
   14    HE   ARG   2           HE       ARG   2  11.494   2.919 -12.975
   15   1HH1  ARG   2          1HH1      ARG   2  14.630   4.277 -13.836
   16   2HH1  ARG   2          2HH1      ARG   2  15.433   2.765 -13.689
   17   1HH2  ARG   2          1HH2      ARG   2  12.606   0.941 -12.775
   18   2HH2  ARG   2          2HH2      ARG   2  14.303   0.875 -13.115
   19    H    ARG   3           H        ARG   3  11.418   4.590  -7.497
   20    HA   ARG   3           HA       ARG   3  13.353   2.502  -8.103
   21   1HB   ARG   3          1HB       ARG   3  14.698   4.591  -7.799
   22   2HB   ARG   3          2HB       ARG   3  14.076   4.715  -6.164
   23   1HG   ARG   3          1HG       ARG   3  15.656   3.372  -5.418
   24   2HG   ARG   3          2HG       ARG   3  15.115   2.075  -6.483
   25   1HD   ARG   3          1HD       ARG   3  16.647   2.559  -8.097
   26   2HD   ARG   3          2HD       ARG   3  16.792   4.260  -7.650
   27    HE   ARG   3           HE       ARG   3  17.784   2.577  -5.582
   28   1HH1  ARG   3          1HH1      ARG   3  18.591   3.825  -8.765
   29   2HH1  ARG   3          2HH1      ARG   3  20.289   3.683  -8.508
   30   1HH2  ARG   3          1HH2      ARG   3  20.031   2.435  -5.254
   31   2HH2  ARG   3          2HH2      ARG   3  21.115   2.920  -6.516
   32    H    CYS   4           H        CYS   4  11.411   1.355  -7.384
   33    HA   CYS   4           HA       CYS   4  11.430   1.085  -4.463
   34   1HB   CYS   4          1HB       CYS   4   8.892   0.772  -4.593
   35   2HB   CYS   4          2HB       CYS   4   9.528   2.405  -4.737
   36   1HB   PRO   5          1HB       PRO   5  10.828  -4.268  -3.086
   37   2HB   PRO   5          2HB       PRO   5  12.420  -3.541  -3.311
   38   1HG   PRO   5          1HG       PRO   5   9.989  -2.376  -2.111
   39   2HG   PRO   5          2HG       PRO   5  11.648  -2.246  -1.541
   40   1HD   PRO   5          1HD       PRO   5  10.385  -0.262  -2.906
   41   2HD   PRO   5          2HD       PRO   5  12.132  -0.554  -3.024
   42    H    GLY   6           H        GLY   6  10.344  -5.074  -5.813
   43   1HA   GLY   6          1HA       GLY   6   8.362  -6.209  -6.153
   44   2HA   GLY   6          2HA       GLY   6   7.506  -4.942  -5.312
   45    H    LYS   7           H        LYS   7   6.226  -5.894  -7.383
   46    HA   LYS   7           HA       LYS   7   6.883  -4.709  -9.894
   47   1HB   LYS   7          1HB       LYS   7   5.551  -6.754  -9.630
   48   2HB   LYS   7          2HB       LYS   7   4.262  -5.822  -8.933
   49   1HG   LYS   7          1HG       LYS   7   3.805  -4.710 -10.913
   50   2HG   LYS   7          2HG       LYS   7   5.316  -5.212 -11.666
   51   1HD   LYS   7          1HD       LYS   7   3.226  -7.216 -10.801
   52   2HD   LYS   7          2HD       LYS   7   3.103  -6.370 -12.335
   53   1HE   LYS   7          1HE       LYS   7   5.776  -7.416 -11.998
   54   2HE   LYS   7          2HE       LYS   7   4.566  -8.678 -11.785
   55   1HZ   LYS   7          1HZ       LYS   7   4.724  -6.858 -14.129
   56   2HZ   LYS   7          2HZ       LYS   7   5.267  -8.463 -14.086
   57   3HZ   LYS   7          3HZ       LYS   7   3.616  -8.133 -13.910
   58    H    ASN   8           H        ASN   8   5.715  -3.033 -11.028
   59    HA   ASN   8           HA       ASN   8   4.698  -0.948  -9.190
   60   1HB   ASN   8          1HB       ASN   8   6.866  -0.771 -10.772
   61   2HB   ASN   8          2HB       ASN   8   5.652  -0.223 -11.920
   62   2HD2  ASN   8          2HD2      ASN   8   7.424   0.506  -9.060
   63   1HD2  ASN   8          1HD2      ASN   8   6.890   2.143  -8.946
   64    H    ALA   9           H        ALA   9   3.584  -3.053 -11.547
   65    HA   ALA   9           HA       ALA   9   1.078  -1.692 -11.719
   66   1HB   ALA   9          1HB       ALA   9   2.678  -2.122 -14.231
   67   2HB   ALA   9          2HB       ALA   9   1.003  -1.564 -14.161
   68   3HB   ALA   9          3HB       ALA   9   2.297  -0.561 -13.502
   69    H    TRP  10           H        TRP  10  -0.503  -3.211 -11.663
   70    HA   TRP  10           HA       TRP  10   0.237  -5.956 -12.515
   71   1HB   TRP  10          1HB       TRP  10  -1.685  -5.030 -10.399
   72   2HB   TRP  10          2HB       TRP  10  -1.554  -6.688 -10.966
   73    HD1  TRP  10           HD1      TRP  10   0.282  -8.166  -9.908
   74    HE1  TRP  10           HE1      TRP  10   2.117  -7.770  -8.156
   75    HE3  TRP  10           HE3      TRP  10   0.005  -3.085  -9.547
   76    HZ2  TRP  10           HZ2      TRP  10   3.280  -5.594  -6.798
   77    HZ3  TRP  10           HZ3      TRP  10   1.501  -1.912  -7.997
   78    HH2  TRP  10           HH2      TRP  10   3.110  -3.151  -6.643
   79   1HB   PRO  11          1HB       PRO  11  -1.913  -5.929 -17.583
   80   2HB   PRO  11          2HB       PRO  11  -1.547  -4.235 -17.259
   81   1HG   PRO  11          1HG       PRO  11   0.581  -5.120 -17.087
   82   2HG   PRO  11          2HG       PRO  11  -0.014  -6.677 -16.483
   83   1HD   PRO  11          1HD       PRO  11   0.707  -5.770 -14.513
   84   2HD   PRO  11          2HD       PRO  11   0.375  -4.098 -15.016
   85    H    GLU  12           H        GLU  12  -1.613  -7.586 -14.828
   86    HA   GLU  12           HA       GLU  12  -3.684  -9.153 -15.922
   87   1HB   GLU  12          1HB       GLU  12  -1.505 -10.070 -15.354
   88   2HB   GLU  12          2HB       GLU  12  -2.791 -10.965 -14.557
   89   1HG   GLU  12          1HG       GLU  12  -2.134  -9.050 -12.679
   90   2HG   GLU  12          2HG       GLU  12  -1.621 -10.731 -12.695
   91    H    LEU  13           H        LEU  13  -3.705  -7.110 -13.181
   92    HA   LEU  13           HA       LEU  13  -5.667  -8.602 -11.710
   93   1HB   LEU  13          1HB       LEU  13  -4.457  -5.890 -11.432
   94   2HB   LEU  13          2HB       LEU  13  -5.801  -6.355 -10.422
   95    HG   LEU  13           HG       LEU  13  -3.053  -7.586 -10.495
   96   1HD1  LEU  13          1HD1      LEU  13  -4.581  -6.072  -8.405
   97   2HD1  LEU  13          2HD1      LEU  13  -3.096  -6.926  -8.079
   98   3HD1  LEU  13          3HD1      LEU  13  -3.106  -5.589  -9.187
   99   1HD2  LEU  13          1HD2      LEU  13  -5.587  -8.665  -9.586
  100   2HD2  LEU  13          2HD2      LEU  13  -4.127  -9.501 -10.055
  101   3HD2  LEU  13          3HD2      LEU  13  -4.295  -8.818  -8.456
  102    H    VAL  14           H        VAL  14  -5.643  -6.302 -14.246
  103    HA   VAL  14           HA       VAL  14  -8.137  -5.083 -13.876
  104    HB   VAL  14           HB       VAL  14  -6.856  -5.745 -16.537
  105   1HG1  VAL  14          1HG1      VAL  14  -8.927  -3.727 -15.647
  106   2HG1  VAL  14          2HG1      VAL  14  -7.995  -3.556 -17.171
  107   3HG1  VAL  14          3HG1      VAL  14  -9.040  -4.986 -16.925
  108   1HG2  VAL  14          1HG2      VAL  14  -5.294  -4.570 -14.896
  109   2HG2  VAL  14          2HG2      VAL  14  -5.641  -3.732 -16.406
  110   3HG2  VAL  14          3HG2      VAL  14  -6.459  -3.240 -14.927
  111    H    GLY  15           H        GLY  15 -10.043  -6.122 -13.681
  112   1HA   GLY  15          1HA       GLY  15 -11.773  -7.259 -14.931
  113   2HA   GLY  15          2HA       GLY  15 -10.586  -8.422 -15.488
  114    H    LYS  16           H        LYS  16  -9.647  -7.964 -12.404
  115    HA   LYS  16           HA       LYS  16 -11.371 -10.161 -11.438
  116   1HB   LYS  16          1HB       LYS  16  -8.917 -10.577 -11.603
  117   2HB   LYS  16          2HB       LYS  16  -9.616 -10.823 -10.012
  118   1HG   LYS  16          1HG       LYS  16  -7.536  -9.008 -10.897
  119   2HG   LYS  16          2HG       LYS  16  -8.743  -8.168  -9.943
  120   1HD   LYS  16          1HD       LYS  16  -7.122  -8.945  -8.458
  121   2HD   LYS  16          2HD       LYS  16  -8.484  -9.999  -8.236
  122   1HE   LYS  16          1HE       LYS  16  -6.607 -10.951 -10.277
  123   2HE   LYS  16          2HE       LYS  16  -5.860 -10.749  -8.697
  124   1HZ   LYS  16          1HZ       LYS  16  -8.418 -12.091  -8.614
  125   2HZ   LYS  16          2HZ       LYS  16  -7.213 -12.915  -9.462
  126   3HZ   LYS  16          3HZ       LYS  16  -6.951 -12.469  -7.864
  127    H    SER  17           H        SER  17 -11.384 -10.143  -8.895
  128    HA   SER  17           HA       SER  17 -12.969  -7.911  -8.149
  129   1HB   SER  17          1HB       SER  17 -13.335  -9.021  -6.147
  130   2HB   SER  17          2HB       SER  17 -12.914 -10.362  -7.212
  131    HG   SER  17           HG       SER  17 -11.730 -10.536  -5.324
  132    H    GLY  18           H        GLY  18 -12.569  -6.182  -6.770
  133   1HA   GLY  18          1HA       GLY  18 -10.009  -5.043  -6.830
  134   2HA   GLY  18          2HA       GLY  18 -11.320  -4.506  -5.814
  135    H    ASN  19           H        ASN  19 -11.465  -7.210  -4.518
  136    HA   ASN  19           HA       ASN  19  -9.603  -6.657  -2.424
  137   1HB   ASN  19          1HB       ASN  19 -11.939  -7.777  -2.274
  138   2HB   ASN  19          2HB       ASN  19 -11.110  -9.261  -2.722
  139   2HD2  ASN  19          2HD2      ASN  19 -12.161  -7.488  -0.154
  140   1HD2  ASN  19          1HD2      ASN  19 -11.088  -8.104   1.048
  141    H    MET  20           H        MET  20  -9.944  -9.368  -4.717
  142    HA   MET  20           HA       MET  20  -7.562 -10.665  -3.946
  143   1HB   MET  20          1HB       MET  20  -9.594 -11.030  -5.951
  144   2HB   MET  20          2HB       MET  20  -8.048 -11.147  -6.709
  145   1HG   MET  20          1HG       MET  20  -8.936 -12.746  -4.350
  146   2HG   MET  20          2HG       MET  20  -8.879 -13.308  -6.015
  147   1HE   MET  20          1HE       MET  20  -7.200 -12.471  -2.851
  148   2HE   MET  20          2HE       MET  20  -6.955 -14.210  -2.967
  149   3HE   MET  20          3HE       MET  20  -5.569 -13.121  -2.988
  150    H    ALA  21           H        ALA  21  -8.225  -7.993  -6.092
  151    HA   ALA  21           HA       ALA  21  -5.750  -7.940  -7.437
  152   1HB   ALA  21          1HB       ALA  21  -7.872  -5.910  -6.928
  153   2HB   ALA  21          2HB       ALA  21  -7.476  -6.720  -8.436
  154   3HB   ALA  21          3HB       ALA  21  -6.407  -5.469  -7.807
  155    H    ALA  22           H        ALA  22  -6.925  -5.839  -4.816
  156    HA   ALA  22           HA       ALA  22  -4.526  -4.604  -4.230
  157   1HB   ALA  22          1HB       ALA  22  -6.722  -5.378  -2.307
  158   2HB   ALA  22          2HB       ALA  22  -6.614  -3.885  -3.238
  159   3HB   ALA  22          3HB       ALA  22  -5.438  -4.214  -1.967
  160    H    ALA  23           H        ALA  23  -5.744  -7.741  -3.189
  161    HA   ALA  23           HA       ALA  23  -3.750  -8.351  -1.298
  162   1HB   ALA  23          1HB       ALA  23  -4.445 -10.666  -1.584
  163   2HB   ALA  23          2HB       ALA  23  -5.308 -10.246  -3.061
  164   3HB   ALA  23          3HB       ALA  23  -5.849  -9.600  -1.512
  165    H    THR  24           H        THR  24  -3.972  -8.976  -4.788
  166    HA   THR  24           HA       THR  24  -1.600 -10.440  -5.067
  167    HB   THR  24           HB       THR  24  -2.717  -8.528  -7.116
  168    HG1  THR  24           HG1      THR  24  -4.452  -9.734  -6.674
  169   1HG2  THR  24          1HG2      THR  24  -1.260 -11.136  -7.425
  170   2HG2  THR  24          2HG2      THR  24  -1.943 -10.174  -8.739
  171   3HG2  THR  24          3HG2      THR  24  -0.617  -9.528  -7.777
  172    H    VAL  25           H        VAL  25  -2.202  -6.950  -5.201
  173    HA   VAL  25           HA       VAL  25   0.440  -6.200  -5.872
  174    HB   VAL  25           HB       VAL  25  -1.572  -4.560  -4.312
  175   1HG1  VAL  25          1HG1      VAL  25   1.118  -4.031  -5.150
  176   2HG1  VAL  25          2HG1      VAL  25   0.001  -2.980  -6.033
  177   3HG1  VAL  25          3HG1      VAL  25  -0.006  -3.005  -4.289
  178   1HG2  VAL  25          1HG2      VAL  25  -1.244  -4.999  -7.271
  179   2HG2  VAL  25          2HG2      VAL  25  -2.677  -5.226  -6.287
  180   3HG2  VAL  25          3HG2      VAL  25  -2.089  -3.606  -6.601
  181    H    GLU  26           H        GLU  26  -1.218  -5.973  -2.701
  182    HA   GLU  26           HA       GLU  26   1.088  -5.348  -1.238
  183   1HB   GLU  26          1HB       GLU  26  -1.486  -6.692  -0.428
  184   2HB   GLU  26          2HB       GLU  26  -0.254  -6.222   0.738
  185   1HG   GLU  26          1HG       GLU  26  -0.749  -4.050   0.628
  186   2HG   GLU  26          2HG       GLU  26  -1.080  -4.072  -1.103
  187    H    ARG  27           H        ARG  27  -0.011  -8.398  -2.503
  188    HA   ARG  27           HA       ARG  27   1.608  -9.998  -0.726
  189   1HB   ARG  27          1HB       ARG  27  -0.518 -10.788  -1.738
  190   2HB   ARG  27          2HB       ARG  27   0.248 -10.792  -3.315
  191   1HG   ARG  27          1HG       ARG  27   0.818 -12.891  -2.907
  192   2HG   ARG  27          2HG       ARG  27   1.981 -12.293  -1.729
  193   1HD   ARG  27          1HD       ARG  27   0.631 -13.950  -0.674
  194   2HD   ARG  27          2HD       ARG  27   0.200 -12.374  -0.007
  195    HE   ARG  27           HE       ARG  27  -1.462 -13.235  -2.218
  196   1HH1  ARG  27          1HH1      ARG  27  -1.026 -13.343   1.269
  197   2HH1  ARG  27          2HH1      ARG  27  -2.693 -13.647   1.572
  198   1HH2  ARG  27          1HH2      ARG  27  -3.663 -13.647  -1.783
  199   2HH2  ARG  27          2HH2      ARG  27  -4.170 -13.903  -0.147
  200    H    GLU  28           H        GLU  28   1.666  -9.472  -4.270
  201    HA   GLU  28           HA       GLU  28   4.235 -10.595  -4.629
  202   1HB   GLU  28          1HB       GLU  28   2.466  -8.818  -6.282
  203   2HB   GLU  28          2HB       GLU  28   4.120  -9.102  -6.799
  204   1HG   GLU  28          1HG       GLU  28   3.606 -11.578  -6.645
  205   2HG   GLU  28          2HG       GLU  28   1.915 -11.111  -6.462
  206    H    ASN  29           H        ASN  29   3.146  -7.366  -3.803
  207    HA   ASN  29           HA       ASN  29   5.969  -6.537  -3.536
  208   1HB   ASN  29          1HB       ASN  29   4.950  -5.420  -5.465
  209   2HB   ASN  29          2HB       ASN  29   3.640  -4.824  -4.445
  210   2HD2  ASN  29          2HD2      ASN  29   5.315  -3.173  -5.962
  211   1HD2  ASN  29          1HD2      ASN  29   6.293  -2.238  -4.896
  212    H    ARG  30           H        ARG  30   5.763  -7.284  -1.347
  213    HA   ARG  30           HA       ARG  30   3.860  -6.278   0.486
  214   1HB   ARG  30          1HB       ARG  30   6.507  -7.630   0.669
  215   2HB   ARG  30          2HB       ARG  30   5.930  -6.823   2.114
  216   1HG   ARG  30          1HG       ARG  30   4.469  -8.391   2.578
  217   2HG   ARG  30          2HG       ARG  30   3.841  -8.456   0.939
  218   1HD   ARG  30          1HD       ARG  30   4.965 -10.297   0.478
  219   2HD   ARG  30          2HD       ARG  30   6.495  -9.631   1.042
  220    HE   ARG  30           HE       ARG  30   4.911 -10.340   3.266
  221   1HH1  ARG  30          1HH1      ARG  30   6.711 -11.828   0.641
  222   2HH1  ARG  30          2HH1      ARG  30   6.892 -13.327   1.480
  223   1HH2  ARG  30          1HH2      ARG  30   5.328 -12.261   4.419
  224   2HH2  ARG  30          2HH2      ARG  30   6.328 -13.480   3.696
  225    H    ASN  31           H        ASN  31   6.304  -4.564  -1.107
  226    HA   ASN  31           HA       ASN  31   6.822  -2.758   1.099
  227   1HB   ASN  31          1HB       ASN  31   8.639  -3.367  -0.423
  228   2HB   ASN  31          2HB       ASN  31   7.757  -2.668  -1.773
  229   2HD2  ASN  31          2HD2      ASN  31   9.285  -1.927   1.318
  230   1HD2  ASN  31          1HD2      ASN  31   9.602  -0.269   0.951
  231    H    VAL  32           H        VAL  32   4.297  -3.106  -1.057
  232    HA   VAL  32           HA       VAL  32   3.690  -0.220  -0.902
  233    HB   VAL  32           HB       VAL  32   2.723  -0.235  -3.073
  234   1HG1  VAL  32          1HG1      VAL  32   5.457  -1.498  -3.074
  235   2HG1  VAL  32          2HG1      VAL  32   4.696  -0.771  -4.481
  236   3HG1  VAL  32          3HG1      VAL  32   5.070   0.186  -3.059
  237   1HG2  VAL  32          1HG2      VAL  32   3.177  -3.195  -2.985
  238   2HG2  VAL  32          2HG2      VAL  32   1.712  -2.311  -3.333
  239   3HG2  VAL  32          3HG2      VAL  32   3.009  -2.362  -4.520
  240    H    HIS  33           H        HIS  33   1.329   0.205  -1.279
  241    HA   HIS  33           HA       HIS  33  -0.367  -1.973  -0.235
  242   1HB   HIS  33          1HB       HIS  33  -1.095  -0.829   1.565
  243   2HB   HIS  33          2HB       HIS  33   0.470  -0.042   1.454
  244    HD1  HIS  33           HD1      HIS  33  -2.977   0.707   1.848
  245    HD2  HIS  33           HD2      HIS  33   0.206   2.545  -0.048
  246    HE1  HIS  33           HE1      HIS  33  -3.675   3.093   1.509
  247    HE2  HIS  33           HE2      HIS  33  -1.601   4.190   0.646
  248    H    ALA  34           H        ALA  34  -2.319  -2.158  -1.188
  249    HA   ALA  34           HA       ALA  34  -2.936  -0.175  -3.266
  250   1HB   ALA  34          1HB       ALA  34  -3.730  -3.057  -3.080
  251   2HB   ALA  34          2HB       ALA  34  -4.197  -1.951  -4.370
  252   3HB   ALA  34          3HB       ALA  34  -2.496  -2.373  -4.133
  253    H    ILE  35           H        ILE  35  -4.634   1.097  -3.016
  254    HA   ILE  35           HA       ILE  35  -6.605   0.464  -0.923
  255    HB   ILE  35           HB       ILE  35  -6.317   3.045  -2.464
  256   1HG1  ILE  35          1HG1      ILE  35  -4.952   2.038   0.011
  257   2HG1  ILE  35          2HG1      ILE  35  -5.305   3.757  -0.135
  258   1HG2  ILE  35          1HG2      ILE  35  -8.498   2.701  -1.443
  259   2HG2  ILE  35          2HG2      ILE  35  -7.729   2.382   0.124
  260   3HG2  ILE  35          3HG2      ILE  35  -7.603   3.989  -0.619
  261   1HD1  ILE  35          1HD1      ILE  35  -4.133   3.173  -2.552
  262   2HD1  ILE  35          2HD1      ILE  35  -3.392   3.924  -1.161
  263   3HD1  ILE  35          3HD1      ILE  35  -3.225   2.187  -1.405
  264    H    VAL  36           H        VAL  36  -8.408  -0.537  -1.585
  265    HA   VAL  36           HA       VAL  36  -9.198  -0.520  -4.358
  266    HB   VAL  36           HB       VAL  36 -10.615  -1.696  -1.973
  267   1HG1  VAL  36          1HG1      VAL  36 -10.987  -2.129  -4.939
  268   2HG1  VAL  36          2HG1      VAL  36 -11.704  -3.130  -3.684
  269   3HG1  VAL  36          3HG1      VAL  36 -12.137  -1.430  -3.809
  270   1HG2  VAL  36          1HG2      VAL  36  -8.653  -2.934  -3.903
  271   2HG2  VAL  36          2HG2      VAL  36  -8.421  -2.666  -2.173
  272   3HG2  VAL  36          3HG2      VAL  36  -9.620  -3.828  -2.730
  273    H    LEU  37           H        LEU  37 -10.209   1.124  -5.210
  274    HA   LEU  37           HA       LEU  37 -12.449   2.370  -3.746
  275   1HB   LEU  37          1HB       LEU  37 -11.656   4.504  -4.977
  276   2HB   LEU  37          2HB       LEU  37 -10.954   4.050  -3.457
  277    HG   LEU  37           HG       LEU  37  -9.194   2.837  -5.141
  278   1HD1  LEU  37          1HD1      LEU  37 -10.387   3.693  -7.137
  279   2HD1  LEU  37          2HD1      LEU  37 -10.042   5.334  -6.584
  280   3HD1  LEU  37          3HD1      LEU  37  -8.718   4.246  -7.008
  281   1HD2  LEU  37          1HD2      LEU  37  -9.274   5.419  -3.728
  282   2HD2  LEU  37          2HD2      LEU  37  -8.131   4.082  -3.632
  283   3HD2  LEU  37          3HD2      LEU  37  -8.048   5.239  -4.963
  284    H    LYS  38           H        LYS  38 -14.111   3.158  -5.085
  285    HA   LYS  38           HA       LYS  38 -14.239   1.788  -7.650
  286   1HB   LYS  38          1HB       LYS  38 -16.597   2.306  -7.628
  287   2HB   LYS  38          2HB       LYS  38 -16.109   1.585  -6.098
  288   1HG   LYS  38          1HG       LYS  38 -15.935   3.971  -5.207
  289   2HG   LYS  38          2HG       LYS  38 -16.757   4.456  -6.689
  290   1HD   LYS  38          1HD       LYS  38 -18.726   3.389  -6.127
  291   2HD   LYS  38          2HD       LYS  38 -17.938   2.294  -4.988
  292   1HE   LYS  38          1HE       LYS  38 -18.024   5.258  -4.485
  293   2HE   LYS  38          2HE       LYS  38 -19.367   4.204  -4.047
  294   1HZ   LYS  38          1HZ       LYS  38 -17.823   2.873  -2.698
  295   2HZ   LYS  38          2HZ       LYS  38 -16.560   3.950  -3.102
  296   3HZ   LYS  38          3HZ       LYS  38 -17.891   4.500  -2.186
  297    H    GLU  39           H        GLU  39 -14.981   2.809  -9.584
  298    HA   GLU  39           HA       GLU  39 -13.539   4.939 -10.464
  299   1HB   GLU  39          1HB       GLU  39 -15.048   3.347 -11.773
  300   2HB   GLU  39          2HB       GLU  39 -16.365   4.463 -11.434
  301   1HG   GLU  39          1HG       GLU  39 -14.903   6.254 -12.494
  302   2HG   GLU  39          2HG       GLU  39 -13.860   4.939 -13.038
  303    H    GLY  40           H        GLY  40 -13.471   7.065 -10.044
  304   1HA   GLY  40          1HA       GLY  40 -14.497   9.191  -9.900
  305   2HA   GLY  40          2HA       GLY  40 -15.959   8.457  -9.274
  306    H    SER  41           H        SER  41 -13.527   6.938  -7.653
  307    HA   SER  41           HA       SER  41 -14.062   8.305  -5.224
  308   1HB   SER  41          1HB       SER  41 -13.507   6.015  -5.051
  309   2HB   SER  41          2HB       SER  41 -12.056   6.209  -6.036
  310    HG   SER  41           HG       SER  41 -12.166   6.250  -3.440
  311    H    ALA  42           H        ALA  42 -11.939   8.823  -3.829
  312    HA   ALA  42           HA       ALA  42 -10.726  11.120  -5.153
  313   1HB   ALA  42          1HB       ALA  42  -9.835  11.647  -2.938
  314   2HB   ALA  42          2HB       ALA  42 -10.491  10.128  -2.306
  315   3HB   ALA  42          3HB       ALA  42 -11.582  11.384  -2.898
  316    H    MET  43           H        MET  43  -9.158  10.499  -6.518
  317    HA   MET  43           HA       MET  43  -6.957   8.875  -5.410
  318   1HB   MET  43          1HB       MET  43  -6.710   8.133  -7.887
  319   2HB   MET  43          2HB       MET  43  -7.832   7.328  -6.822
  320   1HG   MET  43          1HG       MET  43  -9.690   8.168  -7.808
  321   2HG   MET  43          2HG       MET  43  -8.881   9.607  -8.427
  322   1HE   MET  43          1HE       MET  43  -6.762   9.262  -9.969
  323   2HE   MET  43          2HE       MET  43  -6.223   7.570  -9.822
  324   3HE   MET  43          3HE       MET  43  -6.807   8.178 -11.388
  325    H    THR  44           H        THR  44  -5.530  10.454  -5.025
  326    HA   THR  44           HA       THR  44  -5.146  12.731  -6.613
  327    HB   THR  44           HB       THR  44  -2.826  12.743  -5.502
  328    HG1  THR  44           HG1      THR  44  -2.493  11.292  -3.856
  329   1HG2  THR  44          1HG2      THR  44  -4.689  13.973  -4.538
  330   2HG2  THR  44          2HG2      THR  44  -5.219  12.519  -3.694
  331   3HG2  THR  44          3HG2      THR  44  -3.668  13.252  -3.290
  332    H    LYS  45           H        LYS  45  -3.625  13.243  -8.181
  333    HA   LYS  45           HA       LYS  45  -2.955  11.054  -9.942
  334   1HB   LYS  45          1HB       LYS  45  -2.837  14.038 -10.068
  335   2HB   LYS  45          2HB       LYS  45  -1.841  13.128 -11.193
  336   1HG   LYS  45          1HG       LYS  45  -4.818  12.767 -10.893
  337   2HG   LYS  45          2HG       LYS  45  -4.042  13.812 -12.084
  338   1HD   LYS  45          1HD       LYS  45  -2.925  11.928 -13.090
  339   2HD   LYS  45          2HD       LYS  45  -3.555  10.835 -11.860
  340   1HE   LYS  45          1HE       LYS  45  -5.877  11.615 -12.662
  341   2HE   LYS  45          2HE       LYS  45  -5.012  12.238 -14.070
  342   1HZ   LYS  45          1HZ       LYS  45  -4.174  10.006 -14.501
  343   2HZ   LYS  45          2HZ       LYS  45  -5.008   9.415 -13.130
  344   3HZ   LYS  45          3HZ       LYS  45  -5.875  10.027 -14.463
  345    H    ASP  46           H        ASP  46  -1.322  12.966  -7.566
  346    HA   ASP  46           HA       ASP  46   1.290  12.912  -8.313
  347   1HB   ASP  46          1HB       ASP  46  -0.153  13.053  -5.797
  348   2HB   ASP  46          2HB       ASP  46   1.317  12.116  -5.583
  349    H    PHE  47           H        PHE  47   3.096  11.489  -7.663
  350    HA   PHE  47           HA       PHE  47   2.336   8.671  -8.123
  351   1HB   PHE  47          1HB       PHE  47   3.769   9.518  -9.809
  352   2HB   PHE  47          2HB       PHE  47   4.891  10.192  -8.633
  353    HD1  PHE  47           HD1      PHE  47   6.501   8.773  -7.513
  354    HD2  PHE  47           HD2      PHE  47   3.665   7.125 -10.233
  355    HE1  PHE  47           HE1      PHE  47   7.762   6.666  -7.551
  356    HE2  PHE  47           HE2      PHE  47   4.939   5.035 -10.291
  357    HZ   PHE  47           HZ       PHE  47   6.976   4.796  -8.954
  358    H    ARG  48           H        ARG  48   2.676   7.154  -6.652
  359    HA   ARG  48           HA       ARG  48   4.637   7.549  -4.509
  360   1HB   ARG  48          1HB       ARG  48   1.768   6.809  -3.910
  361   2HB   ARG  48          2HB       ARG  48   3.074   6.991  -2.760
  362   1HG   ARG  48          1HG       ARG  48   2.994   9.449  -4.041
  363   2HG   ARG  48          2HG       ARG  48   1.308   8.974  -3.927
  364   1HD   ARG  48          1HD       ARG  48   3.295   9.081  -1.668
  365   2HD   ARG  48          2HD       ARG  48   2.083  10.293  -2.033
  366    HE   ARG  48           HE       ARG  48   1.413   7.500  -1.299
  367   1HH1  ARG  48          1HH1      ARG  48   0.842  10.963  -0.961
  368   2HH1  ARG  48          2HH1      ARG  48  -0.455  10.741   0.141
  369   1HH2  ARG  48          1HH2      ARG  48  -0.334   7.255   0.139
  370   2HH2  ARG  48          2HH2      ARG  48  -1.115   8.658   0.786
  371    H    CYS  49           H        CYS  49   5.888   5.823  -4.807
  372    HA   CYS  49           HA       CYS  49   5.128   3.446  -6.020
  373   1HB   CYS  49          1HB       CYS  49   7.475   4.389  -4.498
  374   2HB   CYS  49          2HB       CYS  49   7.264   2.652  -4.536
  375    H    ASP  50           H        ASP  50   5.038   4.389  -2.656
  376    HA   ASP  50           HA       ASP  50   4.510   1.714  -1.705
  377   1HB   ASP  50          1HB       ASP  50   4.179   2.779   0.465
  378   2HB   ASP  50          2HB       ASP  50   5.648   3.373  -0.300
  379    H    ARG  51           H        ARG  51   2.608   3.861  -3.409
  380    HA   ARG  51           HA       ARG  51   0.163   2.813  -2.172
  381   1HB   ARG  51          1HB       ARG  51   0.642   5.325  -1.971
  382   2HB   ARG  51          2HB       ARG  51   0.347   5.395  -3.705
  383   1HG   ARG  51          1HG       ARG  51  -1.913   4.431  -3.302
  384   2HG   ARG  51          2HG       ARG  51  -1.573   4.531  -1.576
  385   1HD   ARG  51          1HD       ARG  51  -1.213   6.938  -1.806
  386   2HD   ARG  51          2HD       ARG  51  -2.856   6.457  -2.213
  387    HE   ARG  51           HE       ARG  51  -1.751   6.456  -4.624
  388   1HH1  ARG  51          1HH1      ARG  51  -1.588   8.848  -2.064
  389   2HH1  ARG  51          2HH1      ARG  51  -1.052  10.094  -3.112
  390   1HH2  ARG  51          1HH2      ARG  51  -1.434   8.231  -6.048
  391   2HH2  ARG  51          2HH2      ARG  51  -1.171   9.797  -5.379
  392    H    VAL  52           H        VAL  52  -1.413   2.019  -3.462
  393    HA   VAL  52           HA       VAL  52  -1.022   2.091  -6.383
  394    HB   VAL  52           HB       VAL  52  -1.525  -0.447  -4.803
  395   1HG1  VAL  52          1HG1      VAL  52  -2.803  -0.382  -6.921
  396   2HG1  VAL  52          2HG1      VAL  52  -1.249  -0.030  -7.794
  397   3HG1  VAL  52          3HG1      VAL  52  -1.466  -1.608  -6.935
  398   1HG2  VAL  52          1HG2      VAL  52   0.889   0.650  -6.188
  399   2HG2  VAL  52          2HG2      VAL  52   0.746  -0.083  -4.594
  400   3HG2  VAL  52          3HG2      VAL  52   0.666  -1.085  -6.037
  401    H    TRP  53           H        TRP  53  -2.834   2.978  -7.155
  402    HA   TRP  53           HA       TRP  53  -5.290   2.921  -5.657
  403   1HB   TRP  53          1HB       TRP  53  -4.512   4.044  -8.337
  404   2HB   TRP  53          2HB       TRP  53  -6.182   4.084  -7.802
  405    HD1  TRP  53           HD1      TRP  53  -4.009   6.572  -8.355
  406    HE1  TRP  53           HE1      TRP  53  -3.946   8.432  -6.573
  407    HE3  TRP  53           HE3      TRP  53  -6.088   4.025  -4.468
  408    HZ2  TRP  53           HZ2      TRP  53  -4.669   8.752  -3.864
  409    HZ3  TRP  53           HZ3      TRP  53  -6.371   5.162  -2.318
  410    HH2  TRP  53           HH2      TRP  53  -5.670   7.479  -2.016
  411    H    VAL  54           H        VAL  54  -7.006   1.586  -5.887
  412    HA   VAL  54           HA       VAL  54  -6.961  -0.277  -8.194
  413    HB   VAL  54           HB       VAL  54  -7.613  -0.747  -5.299
  414   1HG1  VAL  54          1HG1      VAL  54  -8.690  -2.238  -7.678
  415   2HG1  VAL  54          2HG1      VAL  54  -8.394  -3.061  -6.148
  416   3HG1  VAL  54          3HG1      VAL  54  -9.518  -1.727  -6.213
  417   1HG2  VAL  54          1HG2      VAL  54  -5.303  -1.139  -6.280
  418   2HG2  VAL  54          2HG2      VAL  54  -6.069  -2.485  -5.415
  419   3HG2  VAL  54          3HG2      VAL  54  -6.047  -2.479  -7.179
  420    H    ILE  55           H        ILE  55  -8.280   1.053  -9.451
  421    HA   ILE  55           HA       ILE  55 -10.797   2.002  -8.457
  422    HB   ILE  55           HB       ILE  55  -9.863   1.920 -11.309
  423   1HG1  ILE  55          1HG1      ILE  55  -9.734   4.521 -10.029
  424   2HG1  ILE  55          2HG1      ILE  55  -8.753   3.380  -9.133
  425   1HG2  ILE  55          1HG2      ILE  55 -12.013   3.511  -9.924
  426   2HG2  ILE  55          2HG2      ILE  55 -11.451   3.811 -11.569
  427   3HG2  ILE  55          3HG2      ILE  55 -12.227   2.283 -11.174
  428   1HD1  ILE  55          1HD1      ILE  55  -8.532   3.852 -12.097
  429   2HD1  ILE  55          2HD1      ILE  55  -7.530   4.612 -10.857
  430   3HD1  ILE  55          3HD1      ILE  55  -7.473   2.868 -11.081
  431    H    VAL  56           H        VAL  56 -12.620   0.869  -8.345
  432    HA   VAL  56           HA       VAL  56 -12.979  -1.409 -10.156
  433    HB   VAL  56           HB       VAL  56 -14.216  -2.554  -8.432
  434   1HG1  VAL  56          1HG1      VAL  56 -11.746  -2.804  -8.560
  435   2HG1  VAL  56          2HG1      VAL  56 -11.616  -1.581  -7.255
  436   3HG1  VAL  56          3HG1      VAL  56 -12.440  -3.151  -6.952
  437   1HG2  VAL  56          1HG2      VAL  56 -13.637  -0.156  -6.712
  438   2HG2  VAL  56          2HG2      VAL  56 -15.220  -0.705  -7.258
  439   3HG2  VAL  56          3HG2      VAL  56 -14.300  -1.679  -6.121
  440    H    ASN  57           H        ASN  57 -15.255  -2.030 -10.492
  441    HA   ASN  57           HA       ASN  57 -16.822   0.360 -11.101
  442   1HB   ASN  57          1HB       ASN  57 -18.264  -1.195 -12.366
  443   2HB   ASN  57          2HB       ASN  57 -16.574  -1.341 -12.818
  444   2HD2  ASN  57          2HD2      ASN  57 -16.975  -3.428 -13.646
  445   1HD2  ASN  57          1HD2      ASN  57 -17.274  -4.768 -12.598
  446    H    ASP  58           H        ASP  58 -19.373  -0.322 -10.947
  447    HA   ASP  58           HA       ASP  58 -20.043   0.028  -8.267
  448   1HB   ASP  58          1HB       ASP  58 -21.686  -0.941 -10.612
  449   2HB   ASP  58          2HB       ASP  58 -22.384  -0.583  -9.034
  450    H    HIS  59           H        HIS  59 -19.388  -2.906 -10.019
  451    HA   HIS  59           HA       HIS  59 -20.700  -4.606  -8.068
  452   1HB   HIS  59          1HB       HIS  59 -18.984  -5.226 -10.487
  453   2HB   HIS  59          2HB       HIS  59 -19.690  -6.440  -9.434
  454    HD1  HIS  59           HD1      HIS  59 -20.454  -6.423 -12.367
  455    HD2  HIS  59           HD2      HIS  59 -22.562  -4.349  -9.449
  456    HE1  HIS  59           HE1      HIS  59 -22.823  -6.299 -13.204
  457    HE2  HIS  59           HE2      HIS  59 -24.024  -4.852 -11.522
  458    H    GLY  60           H        GLY  60 -17.577  -3.180  -8.518
  459   1HA   GLY  60          1HA       GLY  60 -16.013  -3.127  -6.763
  460   2HA   GLY  60          2HA       GLY  60 -16.594  -4.677  -6.183
  461    H    VAL  61           H        VAL  61 -16.051  -4.201  -9.594
  462    HA   VAL  61           HA       VAL  61 -13.814  -6.101  -9.473
  463    HB   VAL  61           HB       VAL  61 -15.315  -5.161 -11.915
  464   1HG1  VAL  61          1HG1      VAL  61 -13.540  -7.535 -11.407
  465   2HG1  VAL  61          2HG1      VAL  61 -14.457  -7.247 -12.884
  466   3HG1  VAL  61          3HG1      VAL  61 -13.173  -6.138 -12.422
  467   1HG2  VAL  61          1HG2      VAL  61 -15.877  -7.492 -10.094
  468   2HG2  VAL  61          2HG2      VAL  61 -16.969  -6.159 -10.506
  469   3HG2  VAL  61          3HG2      VAL  61 -16.523  -7.359 -11.737
  470    H    VAL  62           H        VAL  62 -11.813  -5.622 -10.418
  471    HA   VAL  62           HA       VAL  62 -11.119  -2.838 -10.468
  472    HB   VAL  62           HB       VAL  62  -9.415  -5.202 -11.268
  473   1HG1  VAL  62          1HG1      VAL  62  -8.836  -2.289 -10.796
  474   2HG1  VAL  62          2HG1      VAL  62  -7.591  -3.515 -10.553
  475   3HG1  VAL  62          3HG1      VAL  62  -8.353  -3.348 -12.128
  476   1HG2  VAL  62          1HG2      VAL  62 -10.088  -4.002  -8.615
  477   2HG2  VAL  62          2HG2      VAL  62  -9.822  -5.697  -9.073
  478   3HG2  VAL  62          3HG2      VAL  62  -8.445  -4.592  -8.892
  479    H    THR  63           H        THR  63 -11.574  -1.561 -12.129
  480    HA   THR  63           HA       THR  63 -11.751  -2.687 -14.835
  481    HB   THR  63           HB       THR  63 -12.786  -0.589 -15.443
  482    HG1  THR  63           HG1      THR  63 -11.838   0.960 -14.265
  483   1HG2  THR  63          1HG2      THR  63 -14.257  -2.235 -14.406
  484   2HG2  THR  63          2HG2      THR  63 -13.916  -1.539 -12.821
  485   3HG2  THR  63          3HG2      THR  63 -14.757  -0.583 -14.043
  486    H    SER  64           H        SER  64  -9.801  -0.488 -12.898
  487    HA   SER  64           HA       SER  64  -8.170   0.149 -15.269
  488   1HB   SER  64          1HB       SER  64  -9.130   1.805 -13.314
  489   2HB   SER  64          2HB       SER  64  -7.502   1.482 -12.726
  490    HG   SER  64           HG       SER  64  -6.673   2.341 -14.570
  491    H    VAL  65           H        VAL  65  -5.914   0.015 -15.148
  492    HA   VAL  65           HA       VAL  65  -4.908  -2.386 -14.059
  493    HB   VAL  65           HB       VAL  65  -3.178  -0.111 -14.971
  494   1HG1  VAL  65          1HG1      VAL  65  -2.759  -2.888 -14.270
  495   2HG1  VAL  65          2HG1      VAL  65  -2.205  -2.555 -15.913
  496   3HG1  VAL  65          3HG1      VAL  65  -1.600  -1.599 -14.569
  497   1HG2  VAL  65          1HG2      VAL  65  -4.833  -1.985 -16.641
  498   2HG2  VAL  65          2HG2      VAL  65  -4.715  -0.208 -16.709
  499   3HG2  VAL  65          3HG2      VAL  65  -3.363  -1.211 -17.258
  500   1HB   PRO  66          1HB       PRO  66  -3.441  -2.844  -8.771
  501   2HB   PRO  66          2HB       PRO  66  -5.107  -2.289  -8.894
  502   1HG   PRO  66          1HG       PRO  66  -5.287  -4.307  -9.986
  503   2HG   PRO  66          2HG       PRO  66  -3.645  -4.201 -10.650
  504   1HD   PRO  66          1HD       PRO  66  -4.860  -3.579 -12.513
  505   2HD   PRO  66          2HD       PRO  66  -6.114  -2.830 -11.549
  506    H    HIS  67           H        HIS  67  -2.458   0.720 -10.686
  507    HA   HIS  67           HA       HIS  67   0.139  -0.650 -10.511
  508   1HB   HIS  67          1HB       HIS  67  -0.359  -0.028 -12.814
  509   2HB   HIS  67          2HB       HIS  67   0.969   0.945 -12.193
  510    HD1  HIS  67           HD1      HIS  67  -2.840   1.380 -12.296
  511    HD2  HIS  67           HD2      HIS  67   0.645   3.500 -12.933
  512    HE1  HIS  67           HE1      HIS  67  -3.586   3.639 -13.027
  513    HE2  HIS  67           HE2      HIS  67  -1.458   4.905 -13.468
  514    H    ILE  68           H        ILE  68   1.864   0.545  -9.685
  515    HA   ILE  68           HA       ILE  68   1.446   1.949  -7.381
  516    HB   ILE  68           HB       ILE  68   3.688   1.331  -9.069
  517   1HG1  ILE  68          1HG1      ILE  68   3.501   1.915  -6.141
  518   2HG1  ILE  68          2HG1      ILE  68   3.265   0.343  -6.884
  519   1HG2  ILE  68          1HG2      ILE  68   3.835   4.002  -7.674
  520   2HG2  ILE  68          2HG2      ILE  68   5.223   3.148  -8.318
  521   3HG2  ILE  68          3HG2      ILE  68   3.969   3.667  -9.394
  522   1HD1  ILE  68          1HD1      ILE  68   5.828   1.866  -6.982
  523   2HD1  ILE  68          2HD1      ILE  68   5.494   0.580  -5.868
  524   3HD1  ILE  68          3HD1      ILE  68   5.542   0.268  -7.585
  525    H    THR  69           H        THR  69   0.440   3.805  -7.021
  526    HA   THR  69           HA       THR  69   1.166   6.201  -8.467
  527    HB   THR  69           HB       THR  69  -1.570   4.960  -8.798
  528    HG1  THR  69           HG1      THR  69   0.264   5.991 -10.726
  529   1HG2  THR  69          1HG2      THR  69  -0.745   7.778  -9.439
  530   2HG2  THR  69          2HG2      THR  69  -2.209   6.992 -10.016
  531   3HG2  THR  69          3HG2      THR  69  -1.991   7.295  -8.305

  No H/Q in entry =         531
  Start of MODEL   20
    1    H    SER   1           H        SER   1   9.472   9.310 -10.418
    2    HA   SER   1           HA       SER   1   9.775   6.673  -9.123
    3   1HB   SER   1          1HB       SER   1   9.076   7.039 -11.505
    4   2HB   SER   1          2HB       SER   1  10.724   7.555 -11.906
    5    HG   SER   1           HG       SER   1  10.482   5.361 -12.328
    6    H    ARG   2           H        ARG   2  11.573   5.781  -7.951
    7    HA   ARG   2           HA       ARG   2  14.243   6.611  -8.765
    8   1HB   ARG   2          1HB       ARG   2  14.912   7.269  -6.497
    9   2HB   ARG   2          2HB       ARG   2  13.700   8.344  -7.168
   10   1HG   ARG   2          1HG       ARG   2  12.256   7.947  -5.550
   11   2HG   ARG   2          2HG       ARG   2  12.440   6.200  -5.664
   12   1HD   ARG   2          1HD       ARG   2  14.826   7.137  -4.489
   13   2HD   ARG   2          2HD       ARG   2  13.527   8.069  -3.749
   14    HE   ARG   2           HE       ARG   2  12.648   5.476  -3.660
   15   1HH1  ARG   2          1HH1      ARG   2  15.479   7.201  -2.486
   16   2HH1  ARG   2          2HH1      ARG   2  15.691   6.143  -1.143
   17   1HH2  ARG   2          1HH2      ARG   2  12.950   4.106  -1.873
   18   2HH2  ARG   2          2HH2      ARG   2  14.269   4.391  -0.786
   19    H    ARG   3           H        ARG   3  13.613   4.228  -9.319
   20    HA   ARG   3           HA       ARG   3  13.983   2.023  -8.999
   21   1HB   ARG   3          1HB       ARG   3  16.261   3.000  -8.548
   22   2HB   ARG   3          2HB       ARG   3  15.922   2.890  -6.830
   23   1HG   ARG   3          1HG       ARG   3  15.624   0.451  -8.557
   24   2HG   ARG   3          2HG       ARG   3  17.236   1.018  -8.122
   25   1HD   ARG   3          1HD       ARG   3  15.859   1.086  -5.709
   26   2HD   ARG   3          2HD       ARG   3  15.241  -0.356  -6.508
   27    HE   ARG   3           HE       ARG   3  17.796   0.008  -5.337
   28   1HH1  ARG   3          1HH1      ARG   3  16.190  -1.593  -8.028
   29   2HH1  ARG   3          2HH1      ARG   3  17.385  -2.820  -8.148
   30   1HH2  ARG   3          1HH2      ARG   3  19.353  -1.657  -5.512
   31   2HH2  ARG   3          2HH2      ARG   3  19.167  -2.879  -6.727
   32    H    CYS   4           H        CYS   4  11.943   1.449  -8.207
   33    HA   CYS   4           HA       CYS   4  11.741   1.240  -5.283
   34   1HB   CYS   4          1HB       CYS   4   9.475   1.319  -7.270
   35   2HB   CYS   4          2HB       CYS   4   9.331   1.270  -5.513
   36   1HB   PRO   5          1HB       PRO   5  12.185  -3.791  -3.727
   37   2HB   PRO   5          2HB       PRO   5  10.508  -3.508  -3.262
   38   1HG   PRO   5          1HG       PRO   5  11.388  -1.800  -2.043
   39   2HG   PRO   5          2HG       PRO   5  12.858  -1.727  -3.031
   40   1HD   PRO   5          1HD       PRO   5  11.826   0.179  -3.771
   41   2HD   PRO   5          2HD       PRO   5  10.190  -0.455  -3.496
   42    H    GLY   6           H        GLY   6  10.357  -5.068  -5.759
   43   1HA   GLY   6          1HA       GLY   6   8.424  -6.130  -6.305
   44   2HA   GLY   6          2HA       GLY   6   7.591  -4.892  -5.424
   45    H    LYS   7           H        LYS   7   6.319  -5.922  -7.485
   46    HA   LYS   7           HA       LYS   7   6.818  -4.736 -10.012
   47   1HB   LYS   7          1HB       LYS   7   5.533  -6.797  -9.534
   48   2HB   LYS   7          2HB       LYS   7   4.234  -5.832  -8.933
   49   1HG   LYS   7          1HG       LYS   7   3.759  -4.902 -11.012
   50   2HG   LYS   7          2HG       LYS   7   5.280  -5.455 -11.710
   51   1HD   LYS   7          1HD       LYS   7   2.974  -7.194 -10.819
   52   2HD   LYS   7          2HD       LYS   7   3.396  -6.808 -12.483
   53   1HE   LYS   7          1HE       LYS   7   5.606  -7.892 -12.107
   54   2HE   LYS   7          2HE       LYS   7   5.045  -8.388 -10.511
   55   1HZ   LYS   7          1HZ       LYS   7   3.252  -9.626 -11.572
   56   2HZ   LYS   7          2HZ       LYS   7   3.842  -9.185 -13.097
   57   3HZ   LYS   7          3HZ       LYS   7   4.775 -10.160 -12.078
   58    H    ASN   8           H        ASN   8   5.795  -2.976 -11.051
   59    HA   ASN   8           HA       ASN   8   4.679  -0.969  -9.191
   60   1HB   ASN   8          1HB       ASN   8   5.468   0.710 -10.739
   61   2HB   ASN   8          2HB       ASN   8   5.953  -0.534 -11.893
   62   2HD2  ASN   8          2HD2      ASN   8   7.916   1.013 -11.452
   63   1HD2  ASN   8          1HD2      ASN   8   9.034   0.395 -10.290
   64    H    ALA   9           H        ALA   9   3.589  -3.076 -11.524
   65    HA   ALA   9           HA       ALA   9   1.061  -1.729 -11.716
   66   1HB   ALA   9          1HB       ALA   9   2.657  -2.174 -14.235
   67   2HB   ALA   9          2HB       ALA   9   0.993  -1.588 -14.141
   68   3HB   ALA   9          3HB       ALA   9   2.311  -0.607 -13.502
   69    H    TRP  10           H        TRP  10  -0.558  -3.218 -11.900
   70    HA   TRP  10           HA       TRP  10   0.272  -5.977 -12.610
   71   1HB   TRP  10          1HB       TRP  10  -1.674  -5.016 -10.529
   72   2HB   TRP  10          2HB       TRP  10  -1.549  -6.685 -11.057
   73    HD1  TRP  10           HD1      TRP  10   0.291  -8.150  -9.983
   74    HE1  TRP  10           HE1      TRP  10   2.101  -7.744  -8.208
   75    HE3  TRP  10           HE3      TRP  10  -0.006  -3.065  -9.632
   76    HZ2  TRP  10           HZ2      TRP  10   3.245  -5.567  -6.840
   77    HZ3  TRP  10           HZ3      TRP  10   1.472  -1.887  -8.062
   78    HH2  TRP  10           HH2      TRP  10   3.062  -3.123  -6.683
   79   1HB   PRO  11          1HB       PRO  11  -1.979  -4.783 -17.752
   80   2HB   PRO  11          2HB       PRO  11  -1.289  -6.341 -17.283
   81   1HG   PRO  11          1HG       PRO  11   0.615  -5.038 -17.200
   82   2HG   PRO  11          2HG       PRO  11  -0.285  -3.580 -16.747
   83   1HD   PRO  11          1HD       PRO  11   0.481  -4.101 -14.680
   84   2HD   PRO  11          2HD       PRO  11   0.675  -5.821 -15.033
   85    H    GLU  12           H        GLU  12  -1.587  -7.610 -15.005
   86    HA   GLU  12           HA       GLU  12  -3.697  -9.159 -16.027
   87   1HB   GLU  12          1HB       GLU  12  -2.816 -10.956 -14.551
   88   2HB   GLU  12          2HB       GLU  12  -1.602 -10.184 -15.558
   89   1HG   GLU  12          1HG       GLU  12  -1.881  -8.917 -12.930
   90   2HG   GLU  12          2HG       GLU  12  -1.451 -10.623 -12.853
   91    H    LEU  13           H        LEU  13  -3.676  -7.131 -13.275
   92    HA   LEU  13           HA       LEU  13  -5.621  -8.630 -11.784
   93   1HB   LEU  13          1HB       LEU  13  -4.432  -5.900 -11.502
   94   2HB   LEU  13          2HB       LEU  13  -5.755  -6.403 -10.480
   95    HG   LEU  13           HG       LEU  13  -3.004  -7.626 -10.611
   96   1HD1  LEU  13          1HD1      LEU  13  -3.143  -5.553  -9.321
   97   2HD1  LEU  13          2HD1      LEU  13  -4.439  -6.200  -8.401
   98   3HD1  LEU  13          3HD1      LEU  13  -2.860  -6.916  -8.283
   99   1HD2  LEU  13          1HD2      LEU  13  -5.552  -8.673  -9.538
  100   2HD2  LEU  13          2HD2      LEU  13  -4.149  -9.512 -10.188
  101   3HD2  LEU  13          3HD2      LEU  13  -4.121  -8.878  -8.566
  102    H    VAL  14           H        VAL  14  -5.652  -6.300 -14.317
  103    HA   VAL  14           HA       VAL  14  -8.093  -5.045 -13.950
  104    HB   VAL  14           HB       VAL  14  -6.917  -5.955 -16.591
  105   1HG1  VAL  14          1HG1      VAL  14  -8.938  -3.803 -15.949
  106   2HG1  VAL  14          2HG1      VAL  14  -8.188  -4.054 -17.526
  107   3HG1  VAL  14          3HG1      VAL  14  -9.236  -5.289 -16.849
  108   1HG2  VAL  14          1HG2      VAL  14  -5.397  -4.550 -15.116
  109   2HG2  VAL  14          2HG2      VAL  14  -5.780  -3.884 -16.692
  110   3HG2  VAL  14          3HG2      VAL  14  -6.593  -3.274 -15.259
  111    H    GLY  15           H        GLY  15 -10.015  -5.984 -13.542
  112   1HA   GLY  15          1HA       GLY  15 -11.891  -7.145 -14.510
  113   2HA   GLY  15          2HA       GLY  15 -10.796  -8.352 -15.157
  114    H    LYS  16           H        LYS  16  -9.447  -7.886 -12.289
  115    HA   LYS  16           HA       LYS  16 -10.958 -10.070 -11.075
  116   1HB   LYS  16          1HB       LYS  16  -8.375  -9.966 -11.370
  117   2HB   LYS  16          2HB       LYS  16  -8.401  -8.897  -9.993
  118   1HG   LYS  16          1HG       LYS  16  -9.569 -10.648  -8.704
  119   2HG   LYS  16          2HG       LYS  16  -7.948 -11.094  -9.206
  120   1HD   LYS  16          1HD       LYS  16 -10.229 -11.871 -10.989
  121   2HD   LYS  16          2HD       LYS  16 -10.038 -12.719  -9.466
  122   1HE   LYS  16          1HE       LYS  16  -8.894 -13.833 -11.328
  123   2HE   LYS  16          2HE       LYS  16  -7.793 -13.357 -10.038
  124   1HZ   LYS  16          1HZ       LYS  16  -8.218 -11.738 -12.494
  125   2HZ   LYS  16          2HZ       LYS  16  -7.010 -11.543 -11.319
  126   3HZ   LYS  16          3HZ       LYS  16  -6.996 -12.891 -12.327
  127    H    SER  17           H        SER  17 -11.497 -10.027  -8.803
  128    HA   SER  17           HA       SER  17 -12.951  -7.775  -8.059
  129   1HB   SER  17          1HB       SER  17 -13.401  -8.868  -6.035
  130   2HB   SER  17          2HB       SER  17 -13.097 -10.190  -7.158
  131    HG   SER  17           HG       SER  17 -11.604 -10.777  -5.815
  132    H    GLY  18           H        GLY  18 -12.579  -6.026  -6.720
  133   1HA   GLY  18          1HA       GLY  18 -10.087  -4.849  -6.619
  134   2HA   GLY  18          2HA       GLY  18 -11.395  -4.474  -5.522
  135    H    ASN  19           H        ASN  19 -11.466  -7.173  -4.384
  136    HA   ASN  19           HA       ASN  19  -9.497  -6.796  -2.349
  137   1HB   ASN  19          1HB       ASN  19 -10.372  -9.013  -1.492
  138   2HB   ASN  19          2HB       ASN  19 -11.572  -7.741  -1.691
  139   2HD2  ASN  19          2HD2      ASN  19 -10.488 -10.840  -2.777
  140   1HD2  ASN  19          1HD2      ASN  19 -11.840 -11.163  -3.796
  141    H    MET  20           H        MET  20  -9.915  -9.160  -4.973
  142    HA   MET  20           HA       MET  20  -7.644 -10.686  -4.346
  143   1HB   MET  20          1HB       MET  20  -9.673 -10.866  -6.226
  144   2HB   MET  20          2HB       MET  20  -8.274 -10.536  -7.189
  145   1HG   MET  20          1HG       MET  20  -8.681 -12.903  -7.003
  146   2HG   MET  20          2HG       MET  20  -8.591 -12.796  -5.250
  147   1HE   MET  20          1HE       MET  20  -6.855 -12.469  -3.919
  148   2HE   MET  20          2HE       MET  20  -5.797 -13.814  -4.314
  149   3HE   MET  20          3HE       MET  20  -5.166 -12.172  -4.315
  150    H    ALA  21           H        ALA  21  -8.145  -7.898  -6.444
  151    HA   ALA  21           HA       ALA  21  -5.573  -7.798  -7.547
  152   1HB   ALA  21          1HB       ALA  21  -7.725  -5.768  -7.164
  153   2HB   ALA  21          2HB       ALA  21  -6.172  -5.299  -7.849
  154   3HB   ALA  21          3HB       ALA  21  -7.156  -6.518  -8.654
  155    H    ALA  22           H        ALA  22  -6.941  -5.916  -4.856
  156    HA   ALA  22           HA       ALA  22  -4.637  -4.586  -4.101
  157   1HB   ALA  22          1HB       ALA  22  -6.795  -5.599  -2.252
  158   2HB   ALA  22          2HB       ALA  22  -6.874  -4.113  -3.194
  159   3HB   ALA  22          3HB       ALA  22  -5.665  -4.284  -1.923
  160    H    ALA  23           H        ALA  23  -5.759  -7.807  -3.153
  161    HA   ALA  23           HA       ALA  23  -3.732  -8.350  -1.271
  162   1HB   ALA  23          1HB       ALA  23  -5.317 -10.248  -3.000
  163   2HB   ALA  23          2HB       ALA  23  -4.343 -10.714  -1.603
  164   3HB   ALA  23          3HB       ALA  23  -5.752  -9.677  -1.391
  165    H    THR  24           H        THR  24  -3.953  -9.011  -4.763
  166    HA   THR  24           HA       THR  24  -1.552 -10.423  -5.038
  167    HB   THR  24           HB       THR  24  -2.854  -8.578  -7.038
  168    HG1  THR  24           HG1      THR  24  -3.723 -10.721  -7.759
  169   1HG2  THR  24          1HG2      THR  24  -0.939 -10.865  -7.429
  170   2HG2  THR  24          2HG2      THR  24  -1.871 -10.107  -8.719
  171   3HG2  THR  24          3HG2      THR  24  -0.673  -9.169  -7.833
  172    H    VAL  25           H        VAL  25  -2.196  -6.948  -5.141
  173    HA   VAL  25           HA       VAL  25   0.443  -6.178  -5.859
  174    HB   VAL  25           HB       VAL  25  -1.582  -4.517  -4.342
  175   1HG1  VAL  25          1HG1      VAL  25   1.061  -3.980  -5.240
  176   2HG1  VAL  25          2HG1      VAL  25  -0.052  -3.051  -6.223
  177   3HG1  VAL  25          3HG1      VAL  25  -0.097  -2.898  -4.486
  178   1HG2  VAL  25          1HG2      VAL  25  -1.367  -5.173  -7.269
  179   2HG2  VAL  25          2HG2      VAL  25  -2.765  -5.228  -6.214
  180   3HG2  VAL  25          3HG2      VAL  25  -2.120  -3.683  -6.708
  181    H    GLU  26           H        GLU  26  -1.237  -5.977  -2.693
  182    HA   GLU  26           HA       GLU  26   1.062  -5.242  -1.239
  183   1HB   GLU  26          1HB       GLU  26  -1.498  -6.603  -0.407
  184   2HB   GLU  26          2HB       GLU  26  -0.270  -6.101   0.752
  185   1HG   GLU  26          1HG       GLU  26  -0.725  -3.905   0.524
  186   2HG   GLU  26          2HG       GLU  26  -1.221  -4.043  -1.162
  187    H    ARG  27           H        ARG  27  -0.001  -8.356  -2.405
  188    HA   ARG  27           HA       ARG  27   1.719  -9.837  -0.602
  189   1HB   ARG  27          1HB       ARG  27  -0.517 -10.592  -1.659
  190   2HB   ARG  27          2HB       ARG  27   0.432 -10.982  -3.084
  191   1HG   ARG  27          1HG       ARG  27   1.558 -12.685  -2.000
  192   2HG   ARG  27          2HG       ARG  27   1.246 -12.024  -0.393
  193   1HD   ARG  27          1HD       ARG  27  -1.108 -12.575  -0.626
  194   2HD   ARG  27          2HD       ARG  27  -0.087 -14.001  -0.755
  195    HE   ARG  27           HE       ARG  27  -0.345 -13.668  -3.266
  196   1HH1  ARG  27          1HH1      ARG  27  -2.874 -12.856  -0.947
  197   2HH1  ARG  27          2HH1      ARG  27  -4.132 -13.072  -2.096
  198   1HH2  ARG  27          1HH2      ARG  27  -2.044 -13.937  -4.752
  199   2HH2  ARG  27          2HH2      ARG  27  -3.667 -13.730  -4.231
  200    H    GLU  28           H        GLU  28   1.575  -9.437  -4.157
  201    HA   GLU  28           HA       GLU  28   4.108 -10.582  -4.647
  202   1HB   GLU  28          1HB       GLU  28   2.539  -8.578  -6.281
  203   2HB   GLU  28          2HB       GLU  28   3.962  -9.440  -6.855
  204   1HG   GLU  28          1HG       GLU  28   2.671 -11.576  -6.325
  205   2HG   GLU  28          2HG       GLU  28   1.250 -10.554  -6.203
  206    H    ASN  29           H        ASN  29   3.105  -7.366  -3.708
  207    HA   ASN  29           HA       ASN  29   5.944  -6.570  -3.574
  208   1HB   ASN  29          1HB       ASN  29   4.805  -5.501  -5.498
  209   2HB   ASN  29          2HB       ASN  29   3.636  -4.780  -4.394
  210   2HD2  ASN  29          2HD2      ASN  29   5.552  -3.491  -6.195
  211   1HD2  ASN  29          1HD2      ASN  29   6.545  -2.503  -5.181
  212    H    ARG  30           H        ARG  30   5.892  -7.185  -1.382
  213    HA   ARG  30           HA       ARG  30   4.021  -6.238   0.500
  214   1HB   ARG  30          1HB       ARG  30   6.267  -7.912   0.532
  215   2HB   ARG  30          2HB       ARG  30   6.688  -6.605   1.615
  216   1HG   ARG  30          1HG       ARG  30   4.523  -7.005   2.805
  217   2HG   ARG  30          2HG       ARG  30   4.294  -8.417   1.774
  218   1HD   ARG  30          1HD       ARG  30   5.525  -9.628   3.142
  219   2HD   ARG  30          2HD       ARG  30   6.922  -8.600   2.860
  220    HE   ARG  30           HE       ARG  30   5.141  -8.602   5.142
  221   1HH1  ARG  30          1HH1      ARG  30   7.556  -6.763   3.366
  222   2HH1  ARG  30          2HH1      ARG  30   7.945  -5.773   4.707
  223   1HH2  ARG  30          1HH2      ARG  30   5.693  -7.265   6.910
  224   2HH2  ARG  30          2HH2      ARG  30   6.915  -6.052   6.719
  225    H    ASN  31           H        ASN  31   6.309  -4.426  -1.224
  226    HA   ASN  31           HA       ASN  31   6.820  -2.536   0.915
  227   1HB   ASN  31          1HB       ASN  31   8.567  -3.084  -0.735
  228   2HB   ASN  31          2HB       ASN  31   7.574  -2.402  -2.014
  229   2HD2  ASN  31          2HD2      ASN  31   9.001  -1.570   1.132
  230   1HD2  ASN  31          1HD2      ASN  31   9.343   0.070   0.710
  231    H    VAL  32           H        VAL  32   4.300  -3.033  -1.313
  232    HA   VAL  32           HA       VAL  32   3.567  -0.173  -1.195
  233    HB   VAL  32           HB       VAL  32   2.287  -0.439  -3.182
  234   1HG1  VAL  32          1HG1      VAL  32   5.083  -0.723  -3.134
  235   2HG1  VAL  32          2HG1      VAL  32   4.474  -1.827  -4.342
  236   3HG1  VAL  32          3HG1      VAL  32   4.048  -0.165  -4.442
  237   1HG2  VAL  32          1HG2      VAL  32   2.884  -3.359  -2.889
  238   2HG2  VAL  32          2HG2      VAL  32   1.327  -2.572  -3.029
  239   3HG2  VAL  32          3HG2      VAL  32   2.402  -2.665  -4.414
  240    H    HIS  33           H        HIS  33   1.147   0.102  -1.504
  241    HA   HIS  33           HA       HIS  33  -0.427  -1.887  -0.059
  242   1HB   HIS  33          1HB       HIS  33  -0.860  -0.666   1.774
  243   2HB   HIS  33          2HB       HIS  33   0.627   0.178   1.382
  244    HD1  HIS  33           HD1      HIS  33  -2.893   0.720   1.999
  245    HD2  HIS  33           HD2      HIS  33   0.106   2.690  -0.071
  246    HE1  HIS  33           HE1      HIS  33  -3.699   3.079   1.717
  247    HE2  HIS  33           HE2      HIS  33  -1.825   4.265   0.534
  248    H    ALA  34           H        ALA  34  -2.308  -2.180  -1.081
  249    HA   ALA  34           HA       ALA  34  -3.065  -0.264  -3.142
  250   1HB   ALA  34          1HB       ALA  34  -4.595  -2.121  -3.879
  251   2HB   ALA  34          2HB       ALA  34  -2.868  -2.433  -3.987
  252   3HB   ALA  34          3HB       ALA  34  -3.807  -3.122  -2.667
  253    H    ILE  35           H        ILE  35  -4.785   1.007  -3.012
  254    HA   ILE  35           HA       ILE  35  -6.648   0.639  -0.747
  255    HB   ILE  35           HB       ILE  35  -6.260   3.129  -2.398
  256   1HG1  ILE  35          1HG1      ILE  35  -5.093   2.563   0.313
  257   2HG1  ILE  35          2HG1      ILE  35  -4.156   2.416  -1.168
  258   1HG2  ILE  35          1HG2      ILE  35  -8.400   2.928  -1.195
  259   2HG2  ILE  35          2HG2      ILE  35  -7.513   2.692   0.311
  260   3HG2  ILE  35          3HG2      ILE  35  -7.406   4.223  -0.553
  261   1HD1  ILE  35          1HD1      ILE  35  -5.525   4.991  -0.492
  262   2HD1  ILE  35          2HD1      ILE  35  -3.966   4.587   0.173
  263   3HD1  ILE  35          3HD1      ILE  35  -4.168   4.670  -1.554
  264    H    VAL  36           H        VAL  36  -8.591  -0.159  -1.272
  265    HA   VAL  36           HA       VAL  36  -9.408  -0.316  -4.023
  266    HB   VAL  36           HB       VAL  36  -9.800  -2.127  -2.366
  267   1HG1  VAL  36          1HG1      VAL  36 -10.497  -0.648  -0.482
  268   2HG1  VAL  36          2HG1      VAL  36 -12.030  -0.379  -1.314
  269   3HG1  VAL  36          3HG1      VAL  36 -11.585  -1.994  -0.786
  270   1HG2  VAL  36          1HG2      VAL  36 -12.232  -1.030  -3.781
  271   2HG2  VAL  36          2HG2      VAL  36 -11.007  -2.103  -4.454
  272   3HG2  VAL  36          3HG2      VAL  36 -12.064  -2.675  -3.171
  273    H    LEU  37           H        LEU  37 -10.797   0.900  -5.095
  274    HA   LEU  37           HA       LEU  37 -12.743   2.590  -3.767
  275   1HB   LEU  37          1HB       LEU  37 -11.768   4.584  -5.162
  276   2HB   LEU  37          2HB       LEU  37 -11.170   4.209  -3.568
  277    HG   LEU  37           HG       LEU  37  -9.387   2.768  -4.952
  278   1HD1  LEU  37          1HD1      LEU  37 -10.263   4.900  -6.890
  279   2HD1  LEU  37          2HD1      LEU  37  -8.767   3.974  -7.011
  280   3HD1  LEU  37          3HD1      LEU  37 -10.316   3.161  -7.119
  281   1HD2  LEU  37          1HD2      LEU  37  -9.459   5.547  -4.002
  282   2HD2  LEU  37          2HD2      LEU  37  -8.321   4.241  -3.682
  283   3HD2  LEU  37          3HD2      LEU  37  -8.199   5.180  -5.170
  284    H    LYS  38           H        LYS  38 -14.327   3.407  -5.231
  285    HA   LYS  38           HA       LYS  38 -14.479   1.837  -7.685
  286   1HB   LYS  38          1HB       LYS  38 -16.772   2.558  -7.813
  287   2HB   LYS  38          2HB       LYS  38 -16.524   3.711  -6.502
  288   1HG   LYS  38          1HG       LYS  38 -16.130   0.767  -6.130
  289   2HG   LYS  38          2HG       LYS  38 -16.269   2.009  -4.905
  290   1HD   LYS  38          1HD       LYS  38 -18.599   2.061  -6.607
  291   2HD   LYS  38          2HD       LYS  38 -18.302   0.408  -6.074
  292   1HE   LYS  38          1HE       LYS  38 -17.953   2.107  -3.807
  293   2HE   LYS  38          2HE       LYS  38 -19.425   2.601  -4.634
  294   1HZ   LYS  38          1HZ       LYS  38 -20.195   0.302  -4.545
  295   2HZ   LYS  38          2HZ       LYS  38 -18.780  -0.152  -3.729
  296   3HZ   LYS  38          3HZ       LYS  38 -19.875   0.910  -2.999
  297    H    GLU  39           H        GLU  39 -14.959   2.725  -9.729
  298    HA   GLU  39           HA       GLU  39 -13.348   4.773 -10.617
  299   1HB   GLU  39          1HB       GLU  39 -14.798   4.863 -12.631
  300   2HB   GLU  39          2HB       GLU  39 -14.350   3.229 -12.156
  301   1HG   GLU  39          1HG       GLU  39 -16.553   2.967 -11.070
  302   2HG   GLU  39          2HG       GLU  39 -16.994   4.573 -11.636
  303    H    GLY  40           H        GLY  40 -13.279   6.848 -10.087
  304   1HA   GLY  40          1HA       GLY  40 -14.364   8.990 -10.377
  305   2HA   GLY  40          2HA       GLY  40 -15.854   8.297  -9.770
  306    H    SER  41           H        SER  41 -13.448   6.981  -7.910
  307    HA   SER  41           HA       SER  41 -14.156   8.545  -5.642
  308   1HB   SER  41          1HB       SER  41 -13.571   6.225  -5.342
  309   2HB   SER  41          2HB       SER  41 -11.990   6.483  -6.087
  310    HG   SER  41           HG       SER  41 -11.274   7.086  -4.202
  311    H    ALA  42           H        ALA  42 -12.062   9.159  -4.193
  312    HA   ALA  42           HA       ALA  42 -10.779  11.332  -5.674
  313   1HB   ALA  42          1HB       ALA  42  -9.953  11.932  -3.330
  314   2HB   ALA  42          2HB       ALA  42 -11.059  10.681  -2.755
  315   3HB   ALA  42          3HB       ALA  42 -11.682  12.065  -3.648
  316    H    MET  43           H        MET  43  -9.047  10.647  -6.770
  317    HA   MET  43           HA       MET  43  -7.066   8.994  -5.326
  318   1HB   MET  43          1HB       MET  43  -6.463   8.267  -7.756
  319   2HB   MET  43          2HB       MET  43  -7.771   7.496  -6.864
  320   1HG   MET  43          1HG       MET  43  -9.283   9.235  -8.081
  321   2HG   MET  43          2HG       MET  43  -7.904   9.415  -9.155
  322   1HE   MET  43          1HE       MET  43  -6.782   6.619  -8.661
  323   2HE   MET  43          2HE       MET  43  -7.191   5.950 -10.204
  324   3HE   MET  43          3HE       MET  43  -7.880   5.278  -8.732
  325    H    THR  44           H        THR  44  -5.520  10.358  -4.770
  326    HA   THR  44           HA       THR  44  -4.849  12.723  -6.071
  327    HB   THR  44           HB       THR  44  -2.531  12.298  -4.910
  328    HG1  THR  44           HG1      THR  44  -3.932  10.447  -3.343
  329   1HG2  THR  44          1HG2      THR  44  -4.260  13.788  -3.998
  330   2HG2  THR  44          2HG2      THR  44  -4.992  12.402  -3.185
  331   3HG2  THR  44          3HG2      THR  44  -3.361  12.916  -2.757
  332    H    LYS  45           H        LYS  45  -3.200  13.280  -7.498
  333    HA   LYS  45           HA       LYS  45  -2.583  11.210  -9.452
  334   1HB   LYS  45          1HB       LYS  45  -2.393  14.191  -9.340
  335   2HB   LYS  45          2HB       LYS  45  -1.385  13.343 -10.500
  336   1HG   LYS  45          1HG       LYS  45  -4.347  12.838 -10.341
  337   2HG   LYS  45          2HG       LYS  45  -3.681  14.202 -11.225
  338   1HD   LYS  45          1HD       LYS  45  -3.390  12.873 -12.971
  339   2HD   LYS  45          2HD       LYS  45  -2.122  12.041 -12.076
  340   1HE   LYS  45          1HE       LYS  45  -3.638  10.390 -12.830
  341   2HE   LYS  45          2HE       LYS  45  -3.918  10.570 -11.099
  342   1HZ   LYS  45          1HZ       LYS  45  -5.555  11.831 -13.241
  343   2HZ   LYS  45          2HZ       LYS  45  -5.981  10.450 -12.365
  344   3HZ   LYS  45          3HZ       LYS  45  -5.845  11.935 -11.578
  345    H    ASP  46           H        ASP  46  -0.992  12.933  -6.886
  346    HA   ASP  46           HA       ASP  46   1.643  12.847  -7.551
  347   1HB   ASP  46          1HB       ASP  46   0.128  12.657  -5.007
  348   2HB   ASP  46          2HB       ASP  46   1.782  12.065  -4.921
  349    H    PHE  47           H        PHE  47   3.258  11.378  -7.677
  350    HA   PHE  47           HA       PHE  47   2.468   8.597  -7.969
  351   1HB   PHE  47          1HB       PHE  47   3.872   9.416  -9.673
  352   2HB   PHE  47          2HB       PHE  47   4.982  10.160  -8.530
  353    HD1  PHE  47           HD1      PHE  47   6.806   8.953  -7.640
  354    HD2  PHE  47           HD2      PHE  47   3.803   6.923  -9.877
  355    HE1  PHE  47           HE1      PHE  47   8.210   6.940  -7.705
  356    HE2  PHE  47           HE2      PHE  47   5.233   4.935  -9.976
  357    HZ   PHE  47           HZ       PHE  47   7.426   4.936  -8.906
  358    H    ARG  48           H        ARG  48   2.821   7.001  -6.539
  359    HA   ARG  48           HA       ARG  48   4.854   7.316  -4.441
  360   1HB   ARG  48          1HB       ARG  48   1.916   6.881  -3.951
  361   2HB   ARG  48          2HB       ARG  48   3.125   6.471  -2.771
  362   1HG   ARG  48          1HG       ARG  48   3.430   8.550  -2.110
  363   2HG   ARG  48          2HG       ARG  48   3.446   9.199  -3.731
  364   1HD   ARG  48          1HD       ARG  48   1.505  10.110  -3.193
  365   2HD   ARG  48          2HD       ARG  48   0.830   8.535  -3.493
  366    HE   ARG  48           HE       ARG  48   0.981   8.060  -1.121
  367   1HH1  ARG  48          1HH1      ARG  48   1.232  11.448  -2.064
  368   2HH1  ARG  48          2HH1      ARG  48   0.724  12.017  -0.526
  369   1HH2  ARG  48          1HH2      ARG  48   0.320   8.863   0.909
  370   2HH2  ARG  48          2HH2      ARG  48   0.200  10.573   1.156
  371    H    CYS  49           H        CYS  49   6.079   5.579  -4.692
  372    HA   CYS  49           HA       CYS  49   5.269   3.184  -5.929
  373   1HB   CYS  49          1HB       CYS  49   7.631   3.831  -4.195
  374   2HB   CYS  49          2HB       CYS  49   7.420   2.264  -4.968
  375    H    ASP  50           H        ASP  50   4.676   4.285  -2.749
  376    HA   ASP  50           HA       ASP  50   4.417   1.559  -1.729
  377   1HB   ASP  50          1HB       ASP  50   5.579   3.206  -0.342
  378   2HB   ASP  50          2HB       ASP  50   4.131   2.588   0.446
  379    H    ARG  51           H        ARG  51   2.489   3.756  -3.370
  380    HA   ARG  51           HA       ARG  51   0.068   2.616  -2.146
  381   1HB   ARG  51          1HB       ARG  51   0.394   5.059  -1.723
  382   2HB   ARG  51          2HB       ARG  51   0.288   5.319  -3.459
  383   1HG   ARG  51          1HG       ARG  51  -1.997   4.295  -3.394
  384   2HG   ARG  51          2HG       ARG  51  -1.862   4.242  -1.643
  385   1HD   ARG  51          1HD       ARG  51  -3.048   6.215  -2.139
  386   2HD   ARG  51          2HD       ARG  51  -1.413   6.715  -1.728
  387    HE   ARG  51           HE       ARG  51  -1.983   6.307  -4.561
  388   1HH1  ARG  51          1HH1      ARG  51  -1.768   8.617  -1.911
  389   2HH1  ARG  51          2HH1      ARG  51  -1.563   9.959  -2.966
  390   1HH2  ARG  51          1HH2      ARG  51  -1.719   8.116  -5.920
  391   2HH2  ARG  51          2HH2      ARG  51  -1.519   9.685  -5.230
  392    H    VAL  52           H        VAL  52  -1.525   1.895  -3.445
  393    HA   VAL  52           HA       VAL  52  -1.189   2.139  -6.359
  394    HB   VAL  52           HB       VAL  52  -1.660  -0.506  -4.955
  395   1HG1  VAL  52          1HG1      VAL  52  -1.533   0.247  -7.868
  396   2HG1  VAL  52          2HG1      VAL  52  -1.409  -1.409  -7.291
  397   3HG1  VAL  52          3HG1      VAL  52  -2.875  -0.483  -7.004
  398   1HG2  VAL  52          1HG2      VAL  52   0.747   0.567  -6.399
  399   2HG2  VAL  52          2HG2      VAL  52   0.640   0.093  -4.716
  400   3HG2  VAL  52          3HG2      VAL  52   0.540  -1.111  -5.987
  401    H    TRP  53           H        TRP  53  -3.042   2.928  -7.126
  402    HA   TRP  53           HA       TRP  53  -5.449   2.856  -5.551
  403   1HB   TRP  53          1HB       TRP  53  -4.838   3.914  -8.313
  404   2HB   TRP  53          2HB       TRP  53  -6.447   3.999  -7.613
  405    HD1  TRP  53           HD1      TRP  53  -4.140   6.393  -8.386
  406    HE1  TRP  53           HE1      TRP  53  -3.961   8.300  -6.661
  407    HE3  TRP  53           HE3      TRP  53  -6.254   4.060  -4.385
  408    HZ2  TRP  53           HZ2      TRP  53  -4.613   8.713  -3.948
  409    HZ3  TRP  53           HZ3      TRP  53  -6.458   5.278  -2.278
  410    HH2  TRP  53           HH2      TRP  53  -5.633   7.562  -2.044
  411    H    VAL  54           H        VAL  54  -7.208   1.575  -5.777
  412    HA   VAL  54           HA       VAL  54  -7.161  -0.393  -7.996
  413    HB   VAL  54           HB       VAL  54  -7.931  -0.742  -5.103
  414   1HG1  VAL  54          1HG1      VAL  54  -8.708  -2.372  -7.486
  415   2HG1  VAL  54          2HG1      VAL  54  -8.438  -3.169  -5.937
  416   3HG1  VAL  54          3HG1      VAL  54  -9.663  -1.922  -6.083
  417   1HG2  VAL  54          1HG2      VAL  54  -5.950  -2.157  -6.868
  418   2HG2  VAL  54          2HG2      VAL  54  -5.583  -1.027  -5.565
  419   3HG2  VAL  54          3HG2      VAL  54  -6.313  -2.587  -5.195
  420    H    ILE  55           H        ILE  55  -8.458   0.891  -9.311
  421    HA   ILE  55           HA       ILE  55 -11.008   1.844  -8.366
  422    HB   ILE  55           HB       ILE  55  -9.927   1.781 -11.166
  423   1HG1  ILE  55          1HG1      ILE  55 -10.111   4.345  -9.676
  424   2HG1  ILE  55          2HG1      ILE  55  -8.901   3.231  -9.073
  425   1HG2  ILE  55          1HG2      ILE  55 -12.285   3.155  -9.944
  426   2HG2  ILE  55          2HG2      ILE  55 -11.630   3.611 -11.514
  427   3HG2  ILE  55          3HG2      ILE  55 -12.295   1.998 -11.267
  428   1HD1  ILE  55          1HD1      ILE  55  -8.683   3.362 -11.900
  429   2HD1  ILE  55          2HD1      ILE  55  -8.719   4.964 -11.248
  430   3HD1  ILE  55          3HD1      ILE  55  -7.520   3.807 -10.667
  431    H    VAL  56           H        VAL  56 -12.874   0.783  -8.401
  432    HA   VAL  56           HA       VAL  56 -13.084  -1.596 -10.107
  433    HB   VAL  56           HB       VAL  56 -14.492  -2.622  -8.382
  434   1HG1  VAL  56          1HG1      VAL  56 -11.718  -1.813  -7.541
  435   2HG1  VAL  56          2HG1      VAL  56 -12.673  -3.022  -6.686
  436   3HG1  VAL  56          3HG1      VAL  56 -12.214  -3.288  -8.360
  437   1HG2  VAL  56          1HG2      VAL  56 -13.798  -0.161  -6.788
  438   2HG2  VAL  56          2HG2      VAL  56 -15.392  -0.733  -7.268
  439   3HG2  VAL  56          3HG2      VAL  56 -14.458  -1.631  -6.083
  440    H    ASN  57           H        ASN  57 -15.330  -2.285 -10.522
  441    HA   ASN  57           HA       ASN  57 -16.890   0.044 -11.351
  442   1HB   ASN  57          1HB       ASN  57 -16.498  -1.780 -12.943
  443   2HB   ASN  57          2HB       ASN  57 -18.203  -1.556 -12.649
  444   2HD2  ASN  57          2HD2      ASN  57 -17.260  -3.879 -13.751
  445   1HD2  ASN  57          1HD2      ASN  57 -17.473  -5.157 -12.613
  446    H    ASP  58           H        ASP  58 -19.440  -0.743 -11.324
  447    HA   ASP  58           HA       ASP  58 -20.290  -0.214  -8.725
  448   1HB   ASP  58          1HB       ASP  58 -21.788  -1.483 -11.027
  449   2HB   ASP  58          2HB       ASP  58 -22.550  -0.864  -9.563
  450    H    HIS  59           H        HIS  59 -19.399  -3.250 -10.158
  451    HA   HIS  59           HA       HIS  59 -20.758  -4.774  -8.069
  452   1HB   HIS  59          1HB       HIS  59 -19.612  -5.376 -10.738
  453   2HB   HIS  59          2HB       HIS  59 -19.442  -6.647  -9.533
  454    HD1  HIS  59           HD1      HIS  59 -21.143  -8.260 -10.412
  455    HD2  HIS  59           HD2      HIS  59 -22.679  -4.438  -9.872
  456    HE1  HIS  59           HE1      HIS  59 -23.627  -8.486 -10.722
  457    HE2  HIS  59           HE2      HIS  59 -24.541  -6.163 -10.372
  458    H    GLY  60           H        GLY  60 -17.739  -3.293  -8.469
  459   1HA   GLY  60          1HA       GLY  60 -16.115  -3.301  -6.795
  460   2HA   GLY  60          2HA       GLY  60 -16.685  -4.858  -6.228
  461    H    VAL  61           H        VAL  61 -16.175  -4.376  -9.631
  462    HA   VAL  61           HA       VAL  61 -13.936  -6.265  -9.548
  463    HB   VAL  61           HB       VAL  61 -15.444  -5.256 -11.956
  464   1HG1  VAL  61          1HG1      VAL  61 -13.607  -7.597 -11.568
  465   2HG1  VAL  61          2HG1      VAL  61 -14.523  -7.255 -13.036
  466   3HG1  VAL  61          3HG1      VAL  61 -13.273  -6.140 -12.503
  467   1HG2  VAL  61          1HG2      VAL  61 -16.995  -6.399 -10.449
  468   2HG2  VAL  61          2HG2      VAL  61 -16.686  -7.366 -11.887
  469   3HG2  VAL  61          3HG2      VAL  61 -15.895  -7.775 -10.366
  470    H    VAL  62           H        VAL  62 -11.906  -5.739 -10.331
  471    HA   VAL  62           HA       VAL  62 -11.233  -2.964 -10.343
  472    HB   VAL  62           HB       VAL  62  -9.487  -5.287 -11.176
  473   1HG1  VAL  62          1HG1      VAL  62  -8.857  -2.446 -10.355
  474   2HG1  VAL  62          2HG1      VAL  62  -7.658  -3.733 -10.480
  475   3HG1  VAL  62          3HG1      VAL  62  -8.540  -3.217 -11.909
  476   1HG2  VAL  62          1HG2      VAL  62 -10.627  -5.018  -8.710
  477   2HG2  VAL  62          2HG2      VAL  62  -9.086  -5.770  -9.043
  478   3HG2  VAL  62          3HG2      VAL  62  -9.147  -4.108  -8.503
  479    H    THR  63           H        THR  63 -11.674  -1.656 -12.009
  480    HA   THR  63           HA       THR  63 -11.780  -2.747 -14.736
  481    HB   THR  63           HB       THR  63 -12.875  -0.700 -15.339
  482    HG1  THR  63           HG1      THR  63 -11.964   0.908 -14.226
  483   1HG2  THR  63          1HG2      THR  63 -14.185  -2.447 -14.014
  484   2HG2  THR  63          2HG2      THR  63 -14.046  -1.326 -12.659
  485   3HG2  THR  63          3HG2      THR  63 -14.857  -0.823 -14.140
  486    H    SER  64           H        SER  64  -9.904  -0.502 -12.762
  487    HA   SER  64           HA       SER  64  -8.302   0.228 -15.121
  488   1HB   SER  64          1HB       SER  64  -9.214   2.001 -13.580
  489   2HB   SER  64          2HB       SER  64  -8.110   1.397 -12.344
  490    HG   SER  64           HG       SER  64  -6.430   2.155 -13.457
  491    H    VAL  65           H        VAL  65  -6.117  -0.061 -15.203
  492    HA   VAL  65           HA       VAL  65  -5.063  -2.410 -14.095
  493    HB   VAL  65           HB       VAL  65  -3.443  -0.136 -15.208
  494   1HG1  VAL  65          1HG1      VAL  65  -2.887  -2.926 -14.469
  495   2HG1  VAL  65          2HG1      VAL  65  -2.256  -2.437 -16.043
  496   3HG1  VAL  65          3HG1      VAL  65  -1.824  -1.538 -14.597
  497   1HG2  VAL  65          1HG2      VAL  65  -5.456  -1.736 -16.531
  498   2HG2  VAL  65          2HG2      VAL  65  -4.507  -0.384 -17.116
  499   3HG2  VAL  65          3HG2      VAL  65  -3.878  -2.019 -17.239
  500   1HB   PRO  66          1HB       PRO  66  -3.324  -2.810  -8.890
  501   2HB   PRO  66          2HB       PRO  66  -4.994  -2.245  -8.919
  502   1HG   PRO  66          1HG       PRO  66  -3.638  -4.181 -10.733
  503   2HG   PRO  66          2HG       PRO  66  -5.251  -4.275 -10.001
  504   1HD   PRO  66          1HD       PRO  66  -4.912  -3.576 -12.546
  505   2HD   PRO  66          2HD       PRO  66  -6.137  -2.806 -11.544
  506    H    HIS  67           H        HIS  67  -2.429   0.763 -10.600
  507    HA   HIS  67           HA       HIS  67   0.185  -0.587 -10.550
  508   1HB   HIS  67          1HB       HIS  67   1.022   1.001 -12.193
  509   2HB   HIS  67          2HB       HIS  67  -0.364   0.136 -12.845
  510    HD1  HIS  67           HD1      HIS  67   0.223   2.670 -14.237
  511    HD2  HIS  67           HD2      HIS  67  -2.148   2.580 -10.830
  512    HE1  HIS  67           HE1      HIS  67  -1.159   4.769 -14.308
  513    HE2  HIS  67           HE2      HIS  67  -2.634   4.644 -12.271
  514    H    ILE  68           H        ILE  68   1.897   0.578  -9.679
  515    HA   ILE  68           HA       ILE  68   1.444   1.943  -7.344
  516    HB   ILE  68           HB       ILE  68   3.747   1.421  -9.083
  517   1HG1  ILE  68          1HG1      ILE  68   3.736   1.765  -6.084
  518   2HG1  ILE  68          2HG1      ILE  68   3.047   0.345  -6.848
  519   1HG2  ILE  68          1HG2      ILE  68   3.828   3.913  -7.386
  520   2HG2  ILE  68          2HG2      ILE  68   5.232   3.096  -8.073
  521   3HG2  ILE  68          3HG2      ILE  68   4.027   3.771  -9.131
  522   1HD1  ILE  68          1HD1      ILE  68   5.584   0.639  -8.006
  523   2HD1  ILE  68          2HD1      ILE  68   5.778   0.929  -6.280
  524   3HD1  ILE  68          3HD1      ILE  68   5.040  -0.566  -6.839
  525    H    THR  69           H        THR  69   0.490   3.833  -6.961
  526    HA   THR  69           HA       THR  69   1.251   6.211  -8.417
  527    HB   THR  69           HB       THR  69  -1.462   4.951  -8.799
  528    HG1  THR  69           HG1      THR  69  -0.967   5.513 -10.979
  529   1HG2  THR  69          1HG2      THR  69  -0.770   7.858  -9.150
  530   2HG2  THR  69          2HG2      THR  69  -2.136   7.061  -9.927
  531   3HG2  THR  69          3HG2      THR  69  -2.064   7.175  -8.181

  No H/Q in entry =         531