NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
1294 1ag7 cing 1-original 5 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1H        ALA   1   7.514   9.464   0.497
    2   2H    ALA   1          3H        ALA   1   6.157   9.541   1.520
    3   3H    ALA   1          2H        ALA   1   7.661  10.125   2.055
    4    HA   ALA   1           HA       ALA   1   7.745   8.130   3.065
    5   1HB   ALA   1          3HB       ALA   1   6.001   7.164   0.761
    6   2HB   ALA   1          2HB       ALA   1   6.671   6.061   1.952
    7   3HB   ALA   1          1HB       ALA   1   5.548   7.313   2.450
    8    H    CYS   2           H        CYS   2   9.446   6.794   2.979
    9    HA   CYS   2           HA       CYS   2  11.560   7.132   1.177
   10   1HB   CYS   2          2HB       CYS   2  12.405   4.979   2.264
   11   2HB   CYS   2          1HB       CYS   2  12.044   6.268   3.360
   12    H    SER   3           H        SER   3  12.697   5.125   0.207
   13    HA   SER   3           HA       SER   3  10.936   4.032  -1.924
   14   1HB   SER   3          2HB       SER   3  12.781   4.897  -3.069
   15   2HB   SER   3          1HB       SER   3  13.866   4.725  -1.688
   16    HG   SER   3           HG       SER   3  12.913   2.673  -3.356
   17    H    GLY   4           H        GLY   4  11.232   1.782  -2.554
   18   1HA   GLY   4          2HA       GLY   4  11.810  -0.030  -0.238
   19   2HA   GLY   4          1HA       GLY   4  10.567  -0.326  -1.462
   20    H    ARG   5           H        ARG   5  12.328  -2.298  -1.134
   21    HA   ARG   5           HA       ARG   5  14.686  -2.041  -2.752
   22   1HB   ARG   5          2HB       ARG   5  14.163  -3.785  -0.882
   23   2HB   ARG   5          1HB       ARG   5  13.260  -4.663  -2.094
   24   1HG   ARG   5          2HG       ARG   5  15.648  -4.221  -3.444
   25   2HG   ARG   5          1HG       ARG   5  16.217  -4.307  -1.789
   26   1HD   ARG   5          2HD       ARG   5  14.495  -6.428  -3.129
   27   2HD   ARG   5          1HD       ARG   5  16.232  -6.545  -2.860
   28    HE   ARG   5           HE       ARG   5  15.410  -6.096  -0.336
   29   1HH1  ARG   5          2HH1      ARG   5  12.630  -6.851  -1.098
   30   2HH1  ARG   5          1HH1      ARG   5  12.605  -8.554  -0.777
   31   1HH2  ARG   5          1HH2      ARG   5  16.098  -8.753  -0.682
   32   2HH2  ARG   5          2HH2      ARG   5  14.640  -9.685  -0.538
   33    H    GLY   6           H        GLY   6  13.867  -1.102  -4.621
   34   1HA   GLY   6          2HA       GLY   6  13.662  -2.512  -6.937
   35   2HA   GLY   6          1HA       GLY   6  11.997  -2.490  -6.401
   36    H    SER   7           H        SER   7  13.137   0.258  -5.143
   37    HA   SER   7           HA       SER   7  12.689   1.899  -7.614
   38   1HB   SER   7          2HB       SER   7  11.704   3.566  -5.663
   39   2HB   SER   7          1HB       SER   7  10.660   2.400  -6.481
   40    HG   SER   7           HG       SER   7  11.997   2.159  -4.031
   41    H    ARG   8           H        ARG   8  13.940   3.789  -7.723
   42    HA   ARG   8           HA       ARG   8  16.443   3.667  -6.237
   43   1HB   ARG   8          2HB       ARG   8  17.074   5.591  -7.723
   44   2HB   ARG   8          1HB       ARG   8  16.489   4.197  -8.578
   45   1HG   ARG   8          2HG       ARG   8  14.270   6.010  -7.903
   46   2HG   ARG   8          1HG       ARG   8  15.517   6.849  -8.784
   47   1HD   ARG   8          2HD       ARG   8  14.090   4.320  -9.708
   48   2HD   ARG   8          1HD       ARG   8  13.938   5.925 -10.410
   49    HE   ARG   8           HE       ARG   8  16.451   4.297 -10.486
   50   1HH1  ARG   8          2HH1      ARG   8  15.416   7.365 -11.213
   51   2HH1  ARG   8          1HH1      ARG   8  15.872   7.322 -12.884
   52   1HH2  ARG   8          1HH2      ARG   8  16.562   3.894 -12.816
   53   2HH2  ARG   8          2HH2      ARG   8  16.535   5.306 -13.818
   54    H    CYS   9           H        CYS   9  17.237   6.177  -5.933
   55    HA   CYS   9           HA       CYS   9  15.399   7.357  -3.964
   56   1HB   CYS   9          2HB       CYS   9  17.180   7.778  -2.475
   57   2HB   CYS   9          1HB       CYS   9  17.375   6.135  -2.998
   58    HA   HYP  10           HA       HYP  10  15.239   9.006  -2.800
   59   1HB   HYP  10          1HB       HYP  10  15.051  11.066  -1.930
   60   2HB   HYP  10          2HB       HYP  10  13.644  11.335  -2.930
   61   1HD   HYP  10          1HD1      HYP  10  17.311  11.401  -4.924
   62   2HD   HYP  10          2HD1      HYP  10  15.851  11.417  -5.920
   63    HOD  HYP  10           HD2      HYP  10  16.824  13.398  -3.359
   64    HG   HYP  10           HG       HYP  10  14.949  12.858  -4.277
   65    HA   HYP  11           HA       HYP  11  12.679   9.944  -1.668
   66   1HB   HYP  11          1HB       HYP  11  10.621   9.212  -1.144
   67   2HB   HYP  11          2HB       HYP  11  11.330   7.658  -0.743
   68   1HD   HYP  11          1HD1      HYP  11  10.764   9.061  -4.495
   69   2HD   HYP  11          2HD1      HYP  11  11.530   7.474  -4.700
   70    HOD  HYP  11           HD2      HYP  11   8.952   8.126  -1.888
   71    HG   HYP  11           HG       HYP  11  10.576   6.656  -2.707
   72    H    GLN  12           H        GLN  12  14.126   9.568  -0.078
   73    HA   GLN  12           HA       GLN  12  16.351   7.921  -0.381
   74   1HB   GLN  12          2HB       GLN  12  15.056   8.836   2.230
   75   2HB   GLN  12          1HB       GLN  12  16.705   8.248   2.087
   76   1HG   GLN  12          2HG       GLN  12  17.226  10.116   0.499
   77   2HG   GLN  12          1HG       GLN  12  15.586  10.724   0.681
   78   1HE2  GLN  12          2HE2      GLN  12  16.149  12.106   3.898
   79   2HE2  GLN  12          1HE2      GLN  12  14.969  11.622   2.778
   80    H    CYS  13           H        CYS  13  16.680   5.744  -0.154
   81    HA   CYS  13           HA       CYS  13  14.545   3.929   0.093
   82   1HB   CYS  13          2HB       CYS  13  17.179   2.976   1.072
   83   2HB   CYS  13          1HB       CYS  13  16.064   2.295  -0.065
   84    H    CYS  14           H        CYS  14  13.599   2.890   1.625
   85    HA   CYS  14           HA       CYS  14  13.321   3.878   4.223
   86   1HB   CYS  14          2HB       CYS  14  12.720   1.121   3.136
   87   2HB   CYS  14          1HB       CYS  14  12.089   1.728   4.634
   88    H    MET  15           H        MET  15  13.508   2.438   6.204
   89    HA   MET  15           HA       MET  15  16.197   2.141   6.925
   90   1HB   MET  15          2HB       MET  15  14.212   2.381   8.489
   91   2HB   MET  15          1HB       MET  15  13.803   0.710   8.172
   92   1HG   MET  15          2HG       MET  15  15.217   0.076   9.793
   93   2HG   MET  15          1HG       MET  15  16.561   0.710   8.898
   94   1HE   MET  15          3HE       MET  15  18.118   2.345   9.697
   95   2HE   MET  15          2HE       MET  15  16.986   3.544   9.026
   96   3HE   MET  15          1HE       MET  15  17.683   3.767  10.622
   97    H    GLY  16           H        GLY  16  17.643   0.647   6.616
   98   1HA   GLY  16          2HA       GLY  16  18.441  -1.615   6.578
   99   2HA   GLY  16          1HA       GLY  16  16.882  -2.121   5.951
  100    H    LEU  17           H        LEU  17  16.874   0.176   4.008
  101    HA   LEU  17           HA       LEU  17  18.525  -1.148   1.988
  102   1HB   LEU  17          2HB       LEU  17  16.237   0.809   1.831
  103   2HB   LEU  17          1HB       LEU  17  17.273   0.569   0.447
  104    HG   LEU  17           HG       LEU  17  16.644  -2.056   1.307
  105   1HD1  LEU  17          1HD1      LEU  17  14.191  -0.277   1.139
  106   2HD1  LEU  17          3HD1      LEU  17  14.168  -2.034   1.113
  107   3HD1  LEU  17          2HD1      LEU  17  14.716  -1.186   2.557
  108   1HD2  LEU  17          1HD2      LEU  17  16.896  -0.838  -1.060
  109   2HD2  LEU  17          3HD2      LEU  17  16.017  -2.334  -0.875
  110   3HD2  LEU  17          2HD2      LEU  17  15.152  -0.806  -0.962
  111    H    ARG  18           H        ARG  18  19.460   0.088   0.357
  112    HA   ARG  18           HA       ARG  18  20.692   2.697   0.984
  113   1HB   ARG  18          2HB       ARG  18  22.816   1.537  -0.118
  114   2HB   ARG  18          1HB       ARG  18  22.538   1.418   1.604
  115   1HG   ARG  18          2HG       ARG  18  21.719  -0.811   1.401
  116   2HG   ARG  18          1HG       ARG  18  21.447  -0.660  -0.319
  117   1HD   ARG  18          2HD       ARG  18  23.986  -0.410  -0.607
  118   2HD   ARG  18          1HD       ARG  18  24.140  -0.881   1.086
  119    HE   ARG  18           HE       ARG  18  22.502  -2.794  -0.273
  120   1HH1  ARG  18          1HH2      ARG  18  25.199  -1.824  -1.760
  121   2HH1  ARG  18          2HH2      ARG  18  26.155  -3.238  -1.463
  122   1HH2  ARG  18          2HH1      ARG  18  23.886  -4.524   0.867
  123   2HH2  ARG  18          1HH1      ARG  18  25.405  -4.802   0.079
  124    H    CYS  19           H        CYS  19  21.244   3.773  -0.859
  125    HA   CYS  19           HA       CYS  19  19.629   3.201  -3.211
  126   1HB   CYS  19          2HB       CYS  19  20.290   5.472  -2.174
  127   2HB   CYS  19          1HB       CYS  19  21.776   5.323  -3.062
  128    H    GLY  20           H        GLY  20  20.301   1.400  -4.351
  129   1HA   GLY  20          2HA       GLY  20  23.081   0.890  -5.019
  130   2HA   GLY  20          1HA       GLY  20  21.675   0.027  -5.638
  131    H    ARG  21           H        ARG  21  24.069   2.230  -6.414
  132    HA   ARG  21           HA       ARG  21  22.794   3.814  -8.388
  133   1HB   ARG  21          2HB       ARG  21  25.173   4.158  -9.208
  134   2HB   ARG  21          1HB       ARG  21  24.911   4.529  -7.520
  135   1HG   ARG  21          2HG       ARG  21  26.200   2.779  -6.759
  136   2HG   ARG  21          1HG       ARG  21  25.739   1.698  -8.054
  137   1HD   ARG  21          2HD       ARG  21  27.394   4.047  -8.918
  138   2HD   ARG  21          1HD       ARG  21  28.203   2.892  -7.874
  139    HE   ARG  21           HE       ARG  21  28.337   1.509  -9.741
  140   1HH1  ARG  21          2HH1      ARG  21  26.228   0.132 -10.320
  141   2HH1  ARG  21          1HH1      ARG  21  25.360   0.875 -11.620
  142   1HH2  ARG  21          1HH2      ARG  21  26.960   3.961 -11.192
  143   2HH2  ARG  21          2HH2      ARG  21  25.783   3.102 -12.127
  144    H    GLY  22           H        GLY  22  23.218   3.726 -10.691
  145   1HA   GLY  22          2HA       GLY  22  24.112   2.099 -12.520
  146   2HA   GLY  22          1HA       GLY  22  22.988   0.953 -11.783
  147    H    ASN  23           H        ASN  23  22.308   1.164 -14.192
  148    HA   ASN  23           HA       ASN  23  20.103   3.155 -14.328
  149   1HB   ASN  23          2HB       ASN  23  20.661   2.954 -16.927
  150   2HB   ASN  23          1HB       ASN  23  21.515   4.111 -15.921
  151   1HD2  ASN  23          2HD2      ASN  23  24.617   2.369 -16.108
  152   2HD2  ASN  23          1HD2      ASN  23  23.727   3.515 -15.228
  153    HA   PRO  24           HA       PRO  24  18.119   3.166 -14.306
  154   1HB   PRO  24          2HB       PRO  24  15.923   1.926 -13.161
  155   2HB   PRO  24          1HB       PRO  24  15.976   2.695 -14.738
  156   1HG   PRO  24          2HG       PRO  24  15.867  -0.186 -14.114
  157   2HG   PRO  24          1HG       PRO  24  15.573   0.617 -15.650
  158   1HD   PRO  24          2HD       PRO  24  17.946  -0.840 -14.869
  159   2HD   PRO  24          1HD       PRO  24  17.677   0.030 -16.388
  160    H    GLN  25           H        GLN  25  18.401   3.984 -12.273
  161    HA   GLN  25           HA       GLN  25  19.927   2.579 -10.312
  162   1HB   GLN  25          2HB       GLN  25  18.220   5.101 -10.101
  163   2HB   GLN  25          1HB       GLN  25  19.170   4.502  -8.756
  164   1HG   GLN  25          2HG       GLN  25  21.216   4.625 -10.264
  165   2HG   GLN  25          1HG       GLN  25  20.203   5.445 -11.453
  166   1HE2  GLN  25          2HE2      GLN  25  21.658   7.503  -8.317
  167   2HE2  GLN  25          1HE2      GLN  25  22.095   5.892  -8.626
  168    H    LYS  26           H        LYS  26  19.310   1.736  -8.252
  169    HA   LYS  26           HA       LYS  26  16.501   1.524  -7.512
  170   1HB   LYS  26          2HB       LYS  26  16.709  -0.224  -9.297
  171   2HB   LYS  26          1HB       LYS  26  17.985  -0.994  -8.373
  172   1HG   LYS  26          2HG       LYS  26  16.015  -0.917  -6.467
  173   2HG   LYS  26          1HG       LYS  26  15.048  -0.890  -7.921
  174   1HD   LYS  26          2HD       LYS  26  17.288  -2.924  -7.582
  175   2HD   LYS  26          1HD       LYS  26  15.716  -3.219  -6.880
  176   1HE   LYS  26          2HE       LYS  26  14.633  -3.096  -9.071
  177   2HE   LYS  26          1HE       LYS  26  16.125  -2.566  -9.832
  178   1HZ   LYS  26          3HZ       LYS  26  15.716  -5.177  -8.502
  179   2HZ   LYS  26          2HZ       LYS  26  15.722  -4.905 -10.180
  180   3HZ   LYS  26          1HZ       LYS  26  17.138  -4.659  -9.274
  181    H    CYS  27           H        CYS  27  16.284   1.238  -5.311
  182    HA   CYS  27           HA       CYS  27  18.662   1.092  -3.722
  183   1HB   CYS  27          2HB       CYS  27  15.761   0.836  -2.810
  184   2HB   CYS  27          1HB       CYS  27  17.159   1.083  -1.829
  185    H    ILE  28           H        ILE  28  19.256  -0.585  -2.376
  186    HA   ILE  28           HA       ILE  28  17.944  -3.239  -2.660
  187    HB   ILE  28           HB       ILE  28  20.178  -4.266  -2.841
  188   1HG1  ILE  28          2HG1      ILE  28  21.281  -2.294  -1.545
  189   2HG1  ILE  28          1HG1      ILE  28  22.172  -3.120  -2.756
  190   1HG2  ILE  28          3HG2      ILE  28  19.692  -2.154  -4.983
  191   2HG2  ILE  28          2HG2      ILE  28  20.846  -3.467  -5.129
  192   3HG2  ILE  28          1HG2      ILE  28  19.137  -3.816  -4.974
  193   1HD1  ILE  28          3HD1      ILE  28  20.726  -0.714  -3.703
  194   2HD1  ILE  28          2HD1      ILE  28  22.075  -0.466  -2.608
  195   3HD1  ILE  28          1HD1      ILE  28  22.319  -1.336  -4.110
  196    H    GLY  29           H        GLY  29  19.398  -4.603  -0.867
  197   1HA   GLY  29          2HA       GLY  29  18.986  -3.045   1.595
  198   2HA   GLY  29          1HA       GLY  29  19.019  -4.767   1.518
  199    H    ALA  30           H        ALA  30  20.509  -2.620   3.013
  200    HA   ALA  30           HA       ALA  30  23.329  -2.867   2.260
  201   1HB   ALA  30          1HB       ALA  30  21.723  -1.278   4.154
  202   2HB   ALA  30          3HB       ALA  30  23.190  -1.879   4.907
  203   3HB   ALA  30          2HB       ALA  30  23.287  -0.907   3.452
  204    H    HIS  31           H        HIS  31  21.158  -4.010   4.729
  205    HA   HIS  31           HA       HIS  31  23.152  -5.877   5.846
  206   1HB   HIS  31          2HB       HIS  31  21.341  -4.479   7.184
  207   2HB   HIS  31          1HB       HIS  31  20.219  -5.736   6.684
  208    HD1  HIS  31           HD1      HIS  31  23.330  -5.323   8.708
  209    HD2  HIS  31           HD2      HIS  31  20.495  -8.184   8.037
  210    HE1  HIS  31           HE1      HIS  31  23.739  -7.108  10.360
  211   1HN   CGU  32           HN       CGU  32  22.208  -6.097   3.179
  212    HA   CGU  32           HA       CGU  32  21.095  -8.872   3.132
  213   1HB   CGU  32          1HB       CGU  32  20.666  -6.491   1.267
  214   2HB   CGU  32          2HB       CGU  32  19.422  -7.342   2.145
  215    HG   CGU  32           HG       CGU  32  21.066  -8.423  -0.177
  216    H    ASP  33           H        ASP  33  23.184  -9.504   3.405
  217    HA   ASP  33           HA       ASP  33  25.179  -8.898   1.296
  218   1HB   ASP  33          2HB       ASP  33  25.535 -10.270   3.995
  219   2HB   ASP  33          1HB       ASP  33  26.803  -9.640   2.960
  220    H    VAL  34           H        VAL  34  22.994 -10.542   0.753
  221    HA   VAL  34           HA       VAL  34  24.358 -13.105   0.084
  222    HB   VAL  34           HB       VAL  34  21.381 -13.023   0.738
  223   1HG1  VAL  34          1HG1      VAL  34  22.313 -14.995  -0.455
  224   2HG1  VAL  34          3HG1      VAL  34  23.469 -15.239   0.845
  225   3HG1  VAL  34          2HG1      VAL  34  21.748 -15.429   1.148
  226   1HG2  VAL  34          3HG2      VAL  34  23.662 -13.404   2.726
  227   2HG2  VAL  34          2HG2      VAL  34  22.404 -12.179   2.787
  228   3HG2  VAL  34          1HG2      VAL  34  21.998 -13.865   3.050
   
  No H/Q in entry =         228
  Start of MODEL    2
    1   1H    ALA   1          1H        ALA   1   7.315   9.372   0.527
    2   2H    ALA   1          3H        ALA   1   5.958   9.395   1.555
    3   3H    ALA   1          2H        ALA   1   7.415  10.118   2.051
    4    HA   ALA   1           HA       ALA   1   7.706   8.203   3.142
    5   1HB   ALA   1          1HB       ALA   1   6.044   6.846   0.966
    6   2HB   ALA   1          3HB       ALA   1   6.640   6.052   2.415
    7   3HB   ALA   1          2HB       ALA   1   5.448   7.334   2.544
    8    H    CYS   2           H        CYS   2   9.335   6.715   3.014
    9    HA   CYS   2           HA       CYS   2  11.434   7.103   1.179
   10   1HB   CYS   2          2HB       CYS   2  12.349   4.997   2.244
   11   2HB   CYS   2          1HB       CYS   2  11.886   6.197   3.401
   12    H    SER   3           H        SER   3  12.530   5.085   0.188
   13    HA   SER   3           HA       SER   3  10.672   3.947  -1.859
   14   1HB   SER   3          2HB       SER   3  13.626   4.647  -1.869
   15   2HB   SER   3          1HB       SER   3  12.989   3.507  -3.054
   16    HG   SER   3           HG       SER   3  12.842   5.594  -3.770
   17    H    GLY   4           H        GLY   4  10.773   1.754  -2.369
   18   1HA   GLY   4          2HA       GLY   4  11.824  -0.005  -0.193
   19   2HA   GLY   4          1HA       GLY   4  10.552  -0.424  -1.337
   20    H    ARG   5           H        ARG   5  12.454  -2.263  -1.121
   21    HA   ARG   5           HA       ARG   5  14.742  -1.898  -2.825
   22   1HB   ARG   5          2HB       ARG   5  14.574  -3.687  -1.088
   23   2HB   ARG   5          1HB       ARG   5  13.309  -4.470  -2.012
   24   1HG   ARG   5          2HG       ARG   5  14.769  -5.162  -3.718
   25   2HG   ARG   5          1HG       ARG   5  15.919  -3.883  -3.419
   26   1HD   ARG   5          2HD       ARG   5  16.861  -6.030  -2.643
   27   2HD   ARG   5          1HD       ARG   5  16.558  -4.999  -1.247
   28    HE   ARG   5           HE       ARG   5  14.813  -6.444  -0.584
   29   1HH1  ARG   5          2HH1      ARG   5  13.475  -6.664  -3.254
   30   2HH1  ARG   5          1HH1      ARG   5  13.684  -8.340  -3.633
   31   1HH2  ARG   5          1HH2      ARG   5  16.194  -8.773  -1.238
   32   2HH2  ARG   5          2HH2      ARG   5  15.268  -9.572  -2.466
   33    H    GLY   6           H        GLY   6  14.069  -1.001  -4.698
   34   1HA   GLY   6          2HA       GLY   6  13.709  -2.305  -7.012
   35   2HA   GLY   6          1HA       GLY   6  12.057  -2.291  -6.430
   36    H    SER   7           H        SER   7  13.088   0.363  -5.067
   37    HA   SER   7           HA       SER   7  12.570   2.151  -7.411
   38   1HB   SER   7          2HB       SER   7  11.660   2.375  -4.490
   39   2HB   SER   7          1HB       SER   7  11.524   3.706  -5.656
   40    HG   SER   7           HG       SER   7  10.523   1.074  -5.990
   41    H    ARG   8           H        ARG   8  13.832   3.971  -7.549
   42    HA   ARG   8           HA       ARG   8  16.435   3.848  -6.202
   43   1HB   ARG   8          2HB       ARG   8  16.974   5.782  -7.737
   44   2HB   ARG   8          1HB       ARG   8  16.419   4.354  -8.563
   45   1HG   ARG   8          2HG       ARG   8  14.233   6.195  -7.803
   46   2HG   ARG   8          1HG       ARG   8  15.408   6.895  -8.886
   47   1HD   ARG   8          2HD       ARG   8  14.930   5.390 -10.630
   48   2HD   ARG   8          1HD       ARG   8  14.424   4.113  -9.528
   49    HE   ARG   8           HE       ARG   8  12.283   5.138  -9.325
   50   1HH1  ARG   8          2HH1      ARG   8  12.847   7.975  -9.354
   51   2HH1  ARG   8          1HH1      ARG   8  12.383   8.491 -10.943
   52   1HH2  ARG   8          1HH2      ARG   8  12.391   5.229 -12.223
   53   2HH2  ARG   8          2HH2      ARG   8  12.112   6.894 -12.609
   54    H    CYS   9           H        CYS   9  17.265   6.273  -5.910
   55    HA   CYS   9           HA       CYS   9  15.529   7.458  -3.850
   56   1HB   CYS   9          2HB       CYS   9  17.625   8.249  -2.781
   57   2HB   CYS   9          1HB       CYS   9  17.476   6.515  -2.863
   58    HA   HYP  10           HA       HYP  10  15.061   9.101  -2.884
   59   1HB   HYP  10          1HB       HYP  10  14.638  11.123  -2.112
   60   2HB   HYP  10          2HB       HYP  10  13.232  11.208  -3.145
   61   1HD   HYP  10          1HD1      HYP  10  16.869  11.592  -5.171
   62   2HD   HYP  10          2HD1      HYP  10  15.385  11.393  -6.114
   63    HOD  HYP  10           HD2      HYP  10  16.553  13.282  -3.796
   64    HG   HYP  10           HG       HYP  10  14.413  12.843  -4.507
   65    HA   HYP  11           HA       HYP  11  12.537   9.819  -1.734
   66   1HB   HYP  11          1HB       HYP  11  10.618   8.994  -0.968
   67   2HB   HYP  11          2HB       HYP  11  11.314   7.384  -0.882
   68   1HD   HYP  11          1HD1      HYP  11  10.597   9.013  -4.550
   69   2HD   HYP  11          2HD1      HYP  11  11.254   7.376  -4.701
   70    HOD  HYP  11           HD2      HYP  11   8.844   8.396  -1.796
   71    HG   HYP  11           HG       HYP  11  10.106   6.708  -2.754
   72    H    GLN  12           H        GLN  12  13.928   9.441  -0.089
   73    HA   GLN  12           HA       GLN  12  16.242   7.925  -0.485
   74   1HB   GLN  12          2HB       GLN  12  16.588   8.161   2.012
   75   2HB   GLN  12          1HB       GLN  12  16.160   9.670   1.232
   76   1HG   GLN  12          2HG       GLN  12  13.639   8.837   1.918
   77   2HG   GLN  12          1HG       GLN  12  14.550   7.977   3.146
   78   1HE2  GLN  12          2HE2      GLN  12  15.239  10.873   5.018
   79   2HE2  GLN  12          1HE2      GLN  12  15.426   9.191   4.872
   80    H    CYS  13           H        CYS  13  16.743   5.761  -0.149
   81    HA   CYS  13           HA       CYS  13  14.630   3.878  -0.003
   82   1HB   CYS  13          2HB       CYS  13  17.307   3.055   1.010
   83   2HB   CYS  13          1HB       CYS  13  16.202   2.263  -0.065
   84    H    CYS  14           H        CYS  14  13.673   2.868   1.537
   85    HA   CYS  14           HA       CYS  14  13.357   3.868   4.124
   86   1HB   CYS  14          2HB       CYS  14  12.806   1.053   3.138
   87   2HB   CYS  14          1HB       CYS  14  12.110   1.781   4.560
   88    H    MET  15           H        MET  15  13.560   2.470   6.124
   89    HA   MET  15           HA       MET  15  16.236   2.234   6.881
   90   1HB   MET  15          2HB       MET  15  14.271   2.450   8.428
   91   2HB   MET  15          1HB       MET  15  13.844   0.784   8.097
   92   1HG   MET  15          2HG       MET  15  15.918  -0.008   9.072
   93   2HG   MET  15          1HG       MET  15  16.549   1.611   9.196
   94   1HE   MET  15          1HE       MET  15  15.074   3.483  10.634
   95   2HE   MET  15          3HE       MET  15  15.199   3.060  12.330
   96   3HE   MET  15          2HE       MET  15  16.618   2.904  11.307
   97    H    GLY  16           H        GLY  16  17.733   0.746   6.701
   98   1HA   GLY  16          2HA       GLY  16  18.647  -1.444   6.652
   99   2HA   GLY  16          1HA       GLY  16  17.092  -2.057   6.110
  100    H    LEU  17           H        LEU  17  16.933   0.169   4.091
  101    HA   LEU  17           HA       LEU  17  18.454  -1.188   2.016
  102   1HB   LEU  17          2HB       LEU  17  16.480   1.111   1.833
  103   2HB   LEU  17          1HB       LEU  17  17.201   0.342   0.451
  104    HG   LEU  17           HG       LEU  17  15.162  -0.785   2.378
  105   1HD1  LEU  17          1HD1      LEU  17  14.335   0.656   0.603
  106   2HD1  LEU  17          3HD1      LEU  17  15.091  -0.367  -0.610
  107   3HD1  LEU  17          2HD1      LEU  17  13.793  -0.998   0.393
  108   1HD2  LEU  17          2HD2      LEU  17  16.853  -2.613   1.777
  109   2HD2  LEU  17          1HD2      LEU  17  15.229  -2.920   1.203
  110   3HD2  LEU  17          3HD2      LEU  17  16.442  -2.333   0.088
  111    H    ARG  18           H        ARG  18  19.409   0.021   0.343
  112    HA   ARG  18           HA       ARG  18  20.672   2.623   0.895
  113   1HB   ARG  18          2HB       ARG  18  22.803   1.454  -0.118
  114   2HB   ARG  18          1HB       ARG  18  22.498   1.360   1.601
  115   1HG   ARG  18          2HG       ARG  18  21.701  -0.888   1.409
  116   2HG   ARG  18          1HG       ARG  18  21.443  -0.747  -0.309
  117   1HD   ARG  18          2HD       ARG  18  24.037  -0.402  -0.483
  118   2HD   ARG  18          1HD       ARG  18  24.079  -1.126   1.123
  119    HE   ARG  18           HE       ARG  18  22.434  -2.750  -0.524
  120   1HH1  ARG  18          2HH1      ARG  18  25.296  -1.541  -1.639
  121   2HH1  ARG  18          1HH1      ARG  18  26.143  -3.051  -1.704
  122   1HH2  ARG  18          1HH2      ARG  18  23.621  -4.740   0.037
  123   2HH2  ARG  18          2HH2      ARG  18  25.172  -4.932  -0.719
  124    H    CYS  19           H        CYS  19  21.197   3.615  -0.991
  125    HA   CYS  19           HA       CYS  19  19.669   2.784  -3.354
  126   1HB   CYS  19          2HB       CYS  19  20.154   5.178  -2.338
  127   2HB   CYS  19          1HB       CYS  19  21.546   5.124  -3.379
  128    H    GLY  20           H        GLY  20  20.465   1.294  -4.712
  129   1HA   GLY  20          2HA       GLY  20  23.393   1.093  -5.196
  130   2HA   GLY  20          1HA       GLY  20  22.214  -0.126  -5.559
  131    H    ARG  21           H        ARG  21  24.153   0.775  -7.291
  132    HA   ARG  21           HA       ARG  21  24.454   1.070  -9.540
  133   1HB   ARG  21          2HB       ARG  21  22.109  -0.148  -9.417
  134   2HB   ARG  21          1HB       ARG  21  21.477   1.406  -9.857
  135   1HG   ARG  21          2HG       ARG  21  23.733   0.686 -11.606
  136   2HG   ARG  21          1HG       ARG  21  22.608  -0.646 -11.541
  137   1HD   ARG  21          2HD       ARG  21  21.358   2.055 -11.946
  138   2HD   ARG  21          1HD       ARG  21  22.354   1.467 -13.265
  139    HE   ARG  21           HE       ARG  21  19.772   0.409 -12.444
  140   1HH1  ARG  21          2HH1      ARG  21  20.261  -2.101 -12.418
  141   2HH1  ARG  21          1HH1      ARG  21  20.759  -2.655 -13.982
  142   1HH2  ARG  21          1HH2      ARG  21  21.515   0.568 -15.108
  143   2HH2  ARG  21          2HH2      ARG  21  21.491  -1.110 -15.542
  144    H    GLY  22           H        GLY  22  23.168   2.667 -11.391
  145   1HA   GLY  22          2HA       GLY  22  23.371   5.436 -10.282
  146   2HA   GLY  22          1HA       GLY  22  24.279   4.970 -11.711
  147    H    ASN  23           H        ASN  23  22.521   3.531 -13.145
  148    HA   ASN  23           HA       ASN  23  19.961   4.889 -13.345
  149   1HB   ASN  23          2HB       ASN  23  22.031   6.193 -14.623
  150   2HB   ASN  23          1HB       ASN  23  21.418   5.191 -15.926
  151   1HD2  ASN  23          2HD2      ASN  23  18.106   6.728 -15.750
  152   2HD2  ASN  23          1HD2      ASN  23  18.786   5.173 -15.842
  153    HA   PRO  24           HA       PRO  24  18.080   4.453 -13.740
  154   1HB   PRO  24          2HB       PRO  24  16.121   2.490 -13.577
  155   2HB   PRO  24          1HB       PRO  24  16.241   3.738 -14.803
  156   1HG   PRO  24          2HG       PRO  24  16.792   0.852 -15.086
  157   2HG   PRO  24          1HG       PRO  24  16.573   2.057 -16.347
  158   1HD   PRO  24          2HD       PRO  24  19.066   0.909 -15.462
  159   2HD   PRO  24          1HD       PRO  24  18.851   2.190 -16.664
  160    H    GLN  25           H        GLN  25  18.903   4.620 -11.718
  161    HA   GLN  25           HA       GLN  25  19.948   2.666 -10.105
  162   1HB   GLN  25          2HB       GLN  25  19.102   5.456  -9.853
  163   2HB   GLN  25          1HB       GLN  25  18.746   4.603  -8.367
  164   1HG   GLN  25          2HG       GLN  25  21.245   3.653  -8.938
  165   2HG   GLN  25          1HG       GLN  25  21.393   5.267  -9.549
  166   1HE2  GLN  25          2HE2      GLN  25  21.887   4.880  -5.704
  167   2HE2  GLN  25          1HE2      GLN  25  22.239   3.732  -6.903
  168    H    LYS  26           H        LYS  26  19.322   1.808  -8.108
  169    HA   LYS  26           HA       LYS  26  16.503   1.496  -7.460
  170   1HB   LYS  26          2HB       LYS  26  17.327  -0.213  -9.440
  171   2HB   LYS  26          1HB       LYS  26  17.769  -1.172  -8.038
  172   1HG   LYS  26          2HG       LYS  26  15.474  -0.912  -7.162
  173   2HG   LYS  26          1HG       LYS  26  15.047   0.031  -8.578
  174   1HD   LYS  26          2HD       LYS  26  14.324  -2.161  -9.162
  175   2HD   LYS  26          1HD       LYS  26  15.863  -2.019  -9.979
  176   1HE   LYS  26          2HE       LYS  26  16.960  -3.465  -8.472
  177   2HE   LYS  26          1HE       LYS  26  15.835  -3.140  -7.164
  178   1HZ   LYS  26          3HZ       LYS  26  15.009  -4.531  -9.629
  179   2HZ   LYS  26          2HZ       LYS  26  15.658  -5.353  -8.292
  180   3HZ   LYS  26          1HZ       LYS  26  14.215  -4.475  -8.128
  181    H    CYS  27           H        CYS  27  16.314   1.270  -5.287
  182    HA   CYS  27           HA       CYS  27  18.641   0.896  -3.682
  183   1HB   CYS  27          2HB       CYS  27  15.734   0.729  -2.720
  184   2HB   CYS  27          1HB       CYS  27  17.162   0.983  -1.793
  185    H    ILE  28           H        ILE  28  19.128  -0.743  -2.330
  186    HA   ILE  28           HA       ILE  28  17.782  -3.381  -2.530
  187    HB   ILE  28           HB       ILE  28  20.104  -4.402  -2.621
  188   1HG1  ILE  28          2HG1      ILE  28  21.048  -1.991  -1.827
  189   2HG1  ILE  28          1HG1      ILE  28  22.027  -3.120  -2.695
  190   1HG2  ILE  28          3HG2      ILE  28  19.311  -2.683  -5.004
  191   2HG2  ILE  28          2HG2      ILE  28  20.467  -4.006  -5.053
  192   3HG2  ILE  28          1HG2      ILE  28  18.787  -4.322  -4.663
  193   1HD1  ILE  28          3HD1      ILE  28  20.462  -0.924  -4.011
  194   2HD1  ILE  28          2HD1      ILE  28  22.127  -0.794  -3.468
  195   3HD1  ILE  28          1HD1      ILE  28  21.700  -1.956  -4.723
  196    H    GLY  29           H        GLY  29  19.425  -4.695  -0.784
  197   1HA   GLY  29          2HA       GLY  29  19.052  -3.103   1.674
  198   2HA   GLY  29          1HA       GLY  29  19.077  -4.829   1.629
  199    H    ALA  30           H        ALA  30  20.610  -2.632   3.017
  200    HA   ALA  30           HA       ALA  30  23.404  -2.961   2.215
  201   1HB   ALA  30          3HB       ALA  30  22.009  -1.623   4.572
  202   2HB   ALA  30          2HB       ALA  30  23.760  -1.692   4.452
  203   3HB   ALA  30          1HB       ALA  30  22.832  -0.829   3.241
  204    H    HIS  31           H        HIS  31  21.246  -3.979   4.729
  205    HA   HIS  31           HA       HIS  31  23.207  -5.837   5.921
  206   1HB   HIS  31          2HB       HIS  31  20.999  -4.330   6.917
  207   2HB   HIS  31          1HB       HIS  31  20.444  -5.989   6.996
  208    HD1  HIS  31           HD1      HIS  31  23.243  -3.866   8.245
  209    HD2  HIS  31           HD2      HIS  31  21.635  -7.540   8.990
  210    HE1  HIS  31           HE1      HIS  31  24.345  -4.704  10.286
  211   1HN   CGU  32           HN       CGU  32  22.344  -6.208   3.277
  212    HA   CGU  32           HA       CGU  32  21.255  -8.976   3.395
  213   1HB   CGU  32          1HB       CGU  32  20.550  -6.828   1.321
  214   2HB   CGU  32          2HB       CGU  32  19.485  -7.381   2.587
  215    HG   CGU  32           HG       CGU  32  20.263  -9.780   1.442
  216    H    ASP  33           H        ASP  33  23.281  -9.682   3.326
  217    HA   ASP  33           HA       ASP  33  24.999  -9.064   0.970
  218   1HB   ASP  33          2HB       ASP  33  25.620 -10.298   3.696
  219   2HB   ASP  33          1HB       ASP  33  26.803 -10.007   2.438
  220    H    VAL  34           H        VAL  34  22.816 -10.543   0.444
  221    HA   VAL  34           HA       VAL  34  23.653 -13.396   0.420
  222    HB   VAL  34           HB       VAL  34  20.940 -12.196  -0.316
  223   1HG1  VAL  34          1HG1      VAL  34  21.814 -15.037   0.374
  224   2HG1  VAL  34          3HG1      VAL  34  20.156 -14.540   0.084
  225   3HG1  VAL  34          2HG1      VAL  34  21.329 -14.470  -1.215
  226   1HG2  VAL  34          2HG2      VAL  34  21.905 -13.329   2.350
  227   2HG2  VAL  34          1HG2      VAL  34  21.415 -11.669   2.048
  228   3HG2  VAL  34          3HG2      VAL  34  20.228 -12.957   1.977
   
  No H/Q in entry =         228
  Start of MODEL    3
    1   1H    ALA   1          1H        ALA   1   8.909   9.553   3.212
    2   2H    ALA   1          3H        ALA   1   7.430   9.367   4.025
    3   3H    ALA   1          2H        ALA   1   8.611   8.149   4.120
    4    HA   ALA   1           HA       ALA   1   6.966   7.400   2.616
    5   1HB   ALA   1          1HB       ALA   1   6.038   9.696   2.143
    6   2HB   ALA   1          3HB       ALA   1   7.438  10.039   1.136
    7   3HB   ALA   1          2HB       ALA   1   6.297   8.784   0.665
    8    H    CYS   2           H        CYS   2   9.438   6.784   3.078
    9    HA   CYS   2           HA       CYS   2  11.486   7.019   1.193
   10   1HB   CYS   2          2HB       CYS   2  12.337   4.927   2.213
   11   2HB   CYS   2          1HB       CYS   2  11.839   6.061   3.424
   12    H    SER   3           H        SER   3  12.448   4.964   0.171
   13    HA   SER   3           HA       SER   3  10.489   3.867  -1.817
   14   1HB   SER   3          2HB       SER   3  13.343   4.799  -2.033
   15   2HB   SER   3          1HB       SER   3  12.923   3.375  -2.978
   16    HG   SER   3           HG       SER   3  11.483   4.457  -4.065
   17    H    GLY   4           H        GLY   4  10.482   1.665  -2.193
   18   1HA   GLY   4          2HA       GLY   4  11.709  -0.007  -0.060
   19   2HA   GLY   4          1HA       GLY   4  10.420  -0.505  -1.152
   20    H    ARG   5           H        ARG   5  12.352  -2.278  -0.934
   21    HA   ARG   5           HA       ARG   5  14.601  -1.899  -2.686
   22   1HB   ARG   5          2HB       ARG   5  14.190  -3.703  -0.812
   23   2HB   ARG   5          1HB       ARG   5  13.387  -4.627  -2.058
   24   1HG   ARG   5          2HG       ARG   5  16.123  -3.436  -2.612
   25   2HG   ARG   5          1HG       ARG   5  16.023  -4.865  -1.624
   26   1HD   ARG   5          2HD       ARG   5  14.933  -4.622  -4.468
   27   2HD   ARG   5          1HD       ARG   5  16.388  -5.485  -3.988
   28    HE   ARG   5           HE       ARG   5  14.477  -6.668  -2.420
   29   1HH1  ARG   5          1HH2      ARG   5  12.631  -5.693  -4.642
   30   2HH1  ARG   5          2HH2      ARG   5  12.547  -7.094  -5.656
   31   1HH2  ARG   5          2HH1      ARG   5  15.358  -8.568  -4.164
   32   2HH2  ARG   5          1HH1      ARG   5  14.141  -8.757  -5.383
   33    H    GLY   6           H        GLY   6  13.997  -1.164  -4.573
   34   1HA   GLY   6          2HA       GLY   6  13.602  -2.508  -6.854
   35   2HA   GLY   6          1HA       GLY   6  11.940  -2.472  -6.262
   36    H    SER   7           H        SER   7  13.087   0.231  -5.018
   37    HA   SER   7           HA       SER   7  12.639   1.941  -7.429
   38   1HB   SER   7          2HB       SER   7  11.555   2.274  -4.579
   39   2HB   SER   7          1HB       SER   7  11.475   3.544  -5.815
   40    HG   SER   7           HG       SER   7  10.508   1.903  -7.183
   41    H    ARG   8           H        ARG   8  14.060   3.611  -7.630
   42    HA   ARG   8           HA       ARG   8  16.504   3.526  -6.064
   43   1HB   ARG   8          2HB       ARG   8  17.158   5.462  -7.567
   44   2HB   ARG   8          1HB       ARG   8  16.639   4.048  -8.432
   45   1HG   ARG   8          2HG       ARG   8  14.409   5.917  -7.753
   46   2HG   ARG   8          1HG       ARG   8  15.627   6.617  -8.787
   47   1HD   ARG   8          2HD       ARG   8  14.905   3.901  -9.685
   48   2HD   ARG   8          1HD       ARG   8  13.507   4.957  -9.606
   49    HE   ARG   8           HE       ARG   8  15.945   5.442 -11.253
   50   1HH1  ARG   8          1HH2      ARG   8  14.033   7.649  -9.977
   51   2HH1  ARG   8          2HH2      ARG   8  13.158   8.096 -11.402
   52   1HH2  ARG   8          2HH1      ARG   8  14.293   5.326 -13.219
   53   2HH2  ARG   8          1HH1      ARG   8  13.304   6.748 -13.282
   54    H    CYS   9           H        CYS   9  17.298   6.066  -5.765
   55    HA   CYS   9           HA       CYS   9  15.361   7.243  -3.889
   56   1HB   CYS   9          2HB       CYS   9  16.972   7.556  -2.270
   57   2HB   CYS   9          1HB       CYS   9  17.417   6.024  -2.939
   58    HA   HYP  10           HA       HYP  10  15.188   8.851  -2.707
   59   1HB   HYP  10          1HB       HYP  10  14.996  10.862  -1.746
   60   2HB   HYP  10          2HB       HYP  10  13.669  11.254  -2.815
   61   1HD   HYP  10          1HD1      HYP  10  17.345  11.260  -4.783
   62   2HD   HYP  10          2HD1      HYP  10  15.825  11.380  -5.684
   63    HOD  HYP  10           HD2      HYP  10  17.164  11.305  -2.511
   64    HG   HYP  10           HG       HYP  10  15.190  12.826  -3.877
   65    HA   HYP  11           HA       HYP  11  12.572   9.960  -1.574
   66   1HB   HYP  11          1HB       HYP  11  10.554   9.206  -0.955
   67   2HB   HYP  11          2HB       HYP  11  11.216   7.591  -0.757
   68   1HD   HYP  11          1HD1      HYP  11  10.699   9.298  -4.396
   69   2HD   HYP  11          2HD1      HYP  11  11.321   7.661  -4.673
   70    HOD  HYP  11           HD2      HYP  11   8.825   8.430  -1.792
   71    HG   HYP  11           HG       HYP  11  10.249   6.844  -2.732
   72    H    GLN  12           H        GLN  12  14.059   9.583  -0.038
   73    HA   GLN  12           HA       GLN  12  16.255   7.946  -0.350
   74   1HB   GLN  12          2HB       GLN  12  14.910   8.882   2.218
   75   2HB   GLN  12          1HB       GLN  12  16.489   8.123   2.207
   76   1HG   GLN  12          2HG       GLN  12  15.816  10.604   0.547
   77   2HG   GLN  12          1HG       GLN  12  16.575  10.663   2.134
   78   1HE2  GLN  12          2HE2      GLN  12  18.958  10.078  -0.990
   79   2HE2  GLN  12          1HE2      GLN  12  17.424  10.761  -1.133
   80    H    CYS  13           H        CYS  13  16.666   5.811  -0.188
   81    HA   CYS  13           HA       CYS  13  14.579   3.922  -0.029
   82   1HB   CYS  13          2HB       CYS  13  17.295   3.093   0.905
   83   2HB   CYS  13          1HB       CYS  13  16.166   2.308  -0.147
   84    H    CYS  14           H        CYS  14  13.672   2.831   1.491
   85    HA   CYS  14           HA       CYS  14  13.392   3.784   4.108
   86   1HB   CYS  14          2HB       CYS  14  12.875   0.963   3.142
   87   2HB   CYS  14          1HB       CYS  14  12.142   1.728   4.524
   88    H    MET  15           H        MET  15  13.763   2.547   6.118
   89    HA   MET  15           HA       MET  15  16.474   2.244   6.691
   90   1HB   MET  15          2HB       MET  15  14.550   2.550   8.343
   91   2HB   MET  15          1HB       MET  15  14.200   0.842   8.165
   92   1HG   MET  15          2HG       MET  15  16.258   0.196   9.148
   93   2HG   MET  15          1HG       MET  15  16.984   1.756   8.886
   94   1HE   MET  15          1HE       MET  15  13.916   0.159  10.669
   95   2HE   MET  15          3HE       MET  15  15.372  -0.602  11.357
   96   3HE   MET  15          2HE       MET  15  14.351   0.435  12.343
   97    H    GLY  16           H        GLY  16  17.908   0.721   6.448
   98   1HA   GLY  16          2HA       GLY  16  18.697  -1.550   6.498
   99   2HA   GLY  16          1HA       GLY  16  17.121  -2.072   5.913
  100    H    LEU  17           H        LEU  17  16.982   0.080   3.922
  101    HA   LEU  17           HA       LEU  17  18.509  -1.241   1.842
  102   1HB   LEU  17          2HB       LEU  17  16.636   1.140   1.698
  103   2HB   LEU  17          1HB       LEU  17  17.310   0.354   0.298
  104    HG   LEU  17           HG       LEU  17  15.239  -0.680   2.258
  105   1HD1  LEU  17          3HD1      LEU  17  14.582   0.802   0.344
  106   2HD1  LEU  17          2HD1      LEU  17  15.104  -0.469  -0.752
  107   3HD1  LEU  17          1HD1      LEU  17  13.789  -0.761   0.382
  108   1HD2  LEU  17          1HD2      LEU  17  16.858  -2.583   1.684
  109   2HD2  LEU  17          3HD2      LEU  17  15.217  -2.844   1.141
  110   3HD2  LEU  17          2HD2      LEU  17  16.441  -2.339  -0.005
  111    H    ARG  18           H        ARG  18  19.538  -0.007   0.190
  112    HA   ARG  18           HA       ARG  18  20.960   2.463   0.981
  113   1HB   ARG  18          2HB       ARG  18  22.910   1.076  -0.410
  114   2HB   ARG  18          1HB       ARG  18  22.814   1.211   1.327
  115   1HG   ARG  18          2HG       ARG  18  21.922  -0.889   1.588
  116   2HG   ARG  18          1HG       ARG  18  21.363  -1.039  -0.051
  117   1HD   ARG  18          2HD       ARG  18  23.988  -0.805  -0.639
  118   2HD   ARG  18          1HD       ARG  18  24.173  -1.385   1.013
  119    HE   ARG  18           HE       ARG  18  22.309  -3.041  -0.426
  120   1HH1  ARG  18          2HH1      ARG  18  25.054  -3.337   1.242
  121   2HH1  ARG  18          1HH1      ARG  18  25.880  -4.405   0.157
  122   1HH2  ARG  18          1HH2      ARG  18  23.590  -3.917  -2.432
  123   2HH2  ARG  18          2HH2      ARG  18  25.042  -4.733  -1.957
  124    H    CYS  19           H        CYS  19  21.256   3.744  -0.672
  125    HA   CYS  19           HA       CYS  19  19.675   3.399  -3.078
  126   1HB   CYS  19          2HB       CYS  19  20.099   5.550  -1.851
  127   2HB   CYS  19          1HB       CYS  19  21.715   5.559  -2.491
  128    H    GLY  20           H        GLY  20  20.397   1.815  -4.443
  129   1HA   GLY  20          2HA       GLY  20  23.215   1.624  -5.241
  130   2HA   GLY  20          1HA       GLY  20  21.882   0.640  -5.844
  131    H    ARG  21           H        ARG  21  23.464   3.735  -6.114
  132    HA   ARG  21           HA       ARG  21  21.936   4.911  -8.157
  133   1HB   ARG  21          2HB       ARG  21  24.844   5.169  -7.344
  134   2HB   ARG  21          1HB       ARG  21  24.161   6.159  -8.611
  135   1HG   ARG  21          2HG       ARG  21  22.328   6.277  -6.373
  136   2HG   ARG  21          1HG       ARG  21  23.943   6.478  -5.726
  137   1HD   ARG  21          2HD       ARG  21  22.959   8.665  -6.350
  138   2HD   ARG  21          1HD       ARG  21  24.367   8.326  -7.355
  139    HE   ARG  21           HE       ARG  21  22.067   7.318  -8.697
  140   1HH1  ARG  21          2HH1      ARG  21  21.565  10.129  -7.298
  141   2HH1  ARG  21          1HH1      ARG  21  21.705  11.152  -8.689
  142   1HH2  ARG  21          1HH2      ARG  21  23.102   8.616 -10.661
  143   2HH2  ARG  21          2HH2      ARG  21  22.599  10.274 -10.639
  144    H    GLY  22           H        GLY  22  24.232   2.362  -8.300
  145   1HA   GLY  22          2HA       GLY  22  25.079   2.518 -11.017
  146   2HA   GLY  22          1HA       GLY  22  25.018   1.035 -10.058
  147    H    ASN  23           H        ASN  23  24.295   1.331 -12.854
  148    HA   ASN  23           HA       ASN  23  21.398   1.314 -13.009
  149   1HB   ASN  23          2HB       ASN  23  23.350   1.817 -14.857
  150   2HB   ASN  23          1HB       ASN  23  22.948   0.165 -15.294
  151   1HD2  ASN  23          2HD2      ASN  23  19.750   0.988 -16.556
  152   2HD2  ASN  23          1HD2      ASN  23  20.813  -0.262 -16.125
  153    HA   PRO  24           HA       PRO  24  19.580   0.339 -13.777
  154   1HB   PRO  24          2HB       PRO  24  17.607  -1.013 -12.361
  155   2HB   PRO  24          1HB       PRO  24  17.988  -1.232 -14.062
  156   1HG   PRO  24          2HG       PRO  24  18.592  -3.035 -11.794
  157   2HG   PRO  24          1HG       PRO  24  18.578  -3.399 -13.515
  158   1HD   PRO  24          2HD       PRO  24  20.896  -2.993 -11.866
  159   2HD   PRO  24          1HD       PRO  24  20.876  -3.189 -13.625
  160    H    GLN  25           H        GLN  25  19.179   2.155 -12.694
  161    HA   GLN  25           HA       GLN  25  20.124   2.692 -10.067
  162   1HB   GLN  25          2HB       GLN  25  17.964   4.158 -11.648
  163   2HB   GLN  25          1HB       GLN  25  18.818   4.811 -10.260
  164   1HG   GLN  25          2HG       GLN  25  20.865   4.999 -11.433
  165   2HG   GLN  25          1HG       GLN  25  20.394   3.852 -12.678
  166   1HE2  GLN  25          2HE2      GLN  25  18.970   7.704 -12.861
  167   2HE2  GLN  25          1HE2      GLN  25  19.484   7.074 -11.372
  168    H    LYS  26           H        LYS  26  19.388   1.535  -8.433
  169    HA   LYS  26           HA       LYS  26  16.648   1.845  -7.529
  170   1HB   LYS  26          2HB       LYS  26  17.492  -0.589  -8.984
  171   2HB   LYS  26          1HB       LYS  26  16.850  -0.972  -7.408
  172   1HG   LYS  26          2HG       LYS  26  14.820  -0.746  -8.162
  173   2HG   LYS  26          1HG       LYS  26  15.042   0.961  -8.459
  174   1HD   LYS  26          2HD       LYS  26  16.161   0.125 -10.727
  175   2HD   LYS  26          1HD       LYS  26  15.337  -1.378 -10.369
  176   1HE   LYS  26          2HE       LYS  26  13.974   0.108 -11.848
  177   2HE   LYS  26          1HE       LYS  26  13.153  -0.201 -10.327
  178   1HZ   LYS  26          3HZ       LYS  26  14.915   2.089 -10.396
  179   2HZ   LYS  26          2HZ       LYS  26  13.494   2.219 -11.326
  180   3HZ   LYS  26          1HZ       LYS  26  13.398   1.906  -9.657
  181    H    CYS  27           H        CYS  27  16.240   1.103  -5.372
  182    HA   CYS  27           HA       CYS  27  18.641   1.127  -3.756
  183   1HB   CYS  27          2HB       CYS  27  15.759   0.713  -2.797
  184   2HB   CYS  27          1HB       CYS  27  17.162   1.063  -1.867
  185    H    ILE  28           H        ILE  28  19.344  -0.531  -2.537
  186    HA   ILE  28           HA       ILE  28  18.204  -3.274  -2.915
  187    HB   ILE  28           HB       ILE  28  20.640  -4.041  -2.812
  188   1HG1  ILE  28          2HG1      ILE  28  21.211  -1.558  -1.930
  189   2HG1  ILE  28          1HG1      ILE  28  22.387  -2.554  -2.718
  190   1HG2  ILE  28          1HG2      ILE  28  19.697  -2.410  -5.196
  191   2HG2  ILE  28          3HG2      ILE  28  21.136  -3.416  -5.221
  192   3HG2  ILE  28          2HG2      ILE  28  19.563  -4.141  -4.944
  193   1HD1  ILE  28          1HD1      ILE  28  20.677  -0.587  -4.233
  194   2HD1  ILE  28          3HD1      ILE  28  22.194  -0.147  -3.464
  195   3HD1  ILE  28          2HD1      ILE  28  22.178  -1.354  -4.745
  196    H    GLY  29           H        GLY  29  19.863  -4.521  -1.081
  197   1HA   GLY  29          2HA       GLY  29  19.225  -3.056   1.414
  198   2HA   GLY  29          1HA       GLY  29  19.139  -4.777   1.284
  199    H    ALA  30           H        ALA  30  20.723  -2.618   2.827
  200    HA   ALA  30           HA       ALA  30  23.531  -3.241   2.303
  201   1HB   ALA  30          1HB       ALA  30  22.030  -1.570   4.337
  202   2HB   ALA  30          3HB       ALA  30  23.704  -1.998   4.655
  203   3HB   ALA  30          2HB       ALA  30  23.297  -1.067   3.229
  204    H    HIS  31           H        HIS  31  21.083  -3.815   4.693
  205    HA   HIS  31           HA       HIS  31  22.595  -5.958   6.080
  206   1HB   HIS  31          2HB       HIS  31  20.006  -4.422   6.600
  207   2HB   HIS  31          1HB       HIS  31  20.400  -5.857   7.533
  208    HD1  HIS  31           HD1      HIS  31  21.568  -5.198   9.620
  209    HD2  HIS  31           HD2      HIS  31  22.517  -2.572   6.640
  210    HE1  HIS  31           HE1      HIS  31  23.101  -3.542  10.615
  211   1HN   CGU  32           HN       CGU  32  22.368  -6.756   3.704
  212    HA   CGU  32           HA       CGU  32  20.111  -8.687   3.533
  213   1HB   CGU  32          1HB       CGU  32  21.382  -7.232   1.206
  214   2HB   CGU  32          2HB       CGU  32  20.037  -6.535   2.064
  215    HG   CGU  32           HG       CGU  32  19.659  -9.362   1.213
  216    H    ASP  33           H        ASP  33  21.630  -9.140   0.963
  217    HA   ASP  33           HA       ASP  33  24.121 -10.457   1.742
  218   1HB   ASP  33          2HB       ASP  33  22.016 -12.022   2.308
  219   2HB   ASP  33          1HB       ASP  33  22.003 -12.315   0.584
  220    H    VAL  34           H        VAL  34  23.892  -8.461   0.089
  221    HA   VAL  34           HA       VAL  34  23.540  -9.280  -2.697
  222    HB   VAL  34           HB       VAL  34  24.725  -6.733  -1.490
  223   1HG1  VAL  34          3HG1      VAL  34  23.924  -7.467  -4.342
  224   2HG1  VAL  34          2HG1      VAL  34  24.164  -5.807  -3.822
  225   3HG1  VAL  34          1HG1      VAL  34  25.504  -6.936  -3.789
  226   1HG2  VAL  34          3HG2      VAL  34  21.939  -7.432  -2.475
  227   2HG2  VAL  34          2HG2      VAL  34  22.405  -6.919  -0.856
  228   3HG2  VAL  34          1HG2      VAL  34  22.466  -5.784  -2.191
   
  No H/Q in entry =         228
  Start of MODEL    4
    1   1H    ALA   1          3H        ALA   1   9.078  10.914   2.474
    2   2H    ALA   1          2H        ALA   1   7.732  10.659   3.477
    3   3H    ALA   1          1H        ALA   1   9.284  10.220   4.010
    4    HA   ALA   1           HA       ALA   1   8.087   8.268   3.357
    5   1HB   ALA   1          1HB       ALA   1   6.540   9.405   1.755
    6   2HB   ALA   1          3HB       ALA   1   7.876   9.633   0.639
    7   3HB   ALA   1          2HB       ALA   1   7.314   8.011   1.015
    8    H    CYS   2           H        CYS   2   9.131   6.519   2.339
    9    HA   CYS   2           HA       CYS   2  11.856   7.091   1.285
   10   1HB   CYS   2          2HB       CYS   2  12.458   4.930   2.343
   11   2HB   CYS   2          1HB       CYS   2  12.034   6.120   3.522
   12    H    SER   3           H        SER   3  12.725   5.038   0.216
   13    HA   SER   3           HA       SER   3  10.731   4.089  -1.813
   14   1HB   SER   3          2HB       SER   3  12.637   5.385  -2.754
   15   2HB   SER   3          1HB       SER   3  13.793   4.260  -2.018
   16    HG   SER   3           HG       SER   3  12.894   2.617  -3.259
   17    H    GLY   4           H        GLY   4  10.809   1.872  -2.440
   18   1HA   GLY   4          2HA       GLY   4  11.666   0.052  -0.242
   19   2HA   GLY   4          1HA       GLY   4  10.481  -0.314  -1.492
   20    H    ARG   5           H        ARG   5  12.147  -2.220  -1.154
   21    HA   ARG   5           HA       ARG   5  14.606  -2.013  -2.679
   22   1HB   ARG   5          2HB       ARG   5  14.212  -3.611  -0.740
   23   2HB   ARG   5          1HB       ARG   5  13.137  -4.530  -1.776
   24   1HG   ARG   5          2HG       ARG   5  14.951  -5.041  -3.333
   25   2HG   ARG   5          1HG       ARG   5  16.021  -3.902  -2.546
   26   1HD   ARG   5          2HD       ARG   5  16.504  -6.280  -1.885
   27   2HD   ARG   5          1HD       ARG   5  16.052  -5.287  -0.505
   28    HE   ARG   5           HE       ARG   5  13.988  -6.457  -0.365
   29   1HH1  ARG   5          1HH2      ARG   5  13.275  -6.494  -3.259
   30   2HH1  ARG   5          2HH2      ARG   5  13.400  -8.176  -3.646
   31   1HH2  ARG   5          2HH1      ARG   5  15.272  -8.927  -0.787
   32   2HH2  ARG   5          1HH1      ARG   5  14.563  -9.586  -2.223
   33    H    GLY   6           H        GLY   6  13.635  -1.124  -4.543
   34   1HA   GLY   6          2HA       GLY   6  13.482  -2.721  -6.800
   35   2HA   GLY   6          1HA       GLY   6  11.806  -2.567  -6.266
   36    H    SER   7           H        SER   7  13.338   0.125  -5.217
   37    HA   SER   7           HA       SER   7  13.148   1.701  -7.710
   38   1HB   SER   7          2HB       SER   7  11.784   3.430  -6.138
   39   2HB   SER   7          1HB       SER   7  10.916   2.138  -6.973
   40    HG   SER   7           HG       SER   7  11.258   0.840  -5.104
   41    H    ARG   8           H        ARG   8  14.456   3.434  -7.718
   42    HA   ARG   8           HA       ARG   8  16.661   3.529  -5.886
   43   1HB   ARG   8          2HB       ARG   8  17.515   5.230  -7.373
   44   2HB   ARG   8          1HB       ARG   8  16.734   4.022  -8.350
   45   1HG   ARG   8          2HG       ARG   8  15.342   6.615  -7.520
   46   2HG   ARG   8          1HG       ARG   8  16.246   6.394  -8.992
   47   1HD   ARG   8          2HD       ARG   8  14.128   5.915  -9.809
   48   2HD   ARG   8          1HD       ARG   8  14.636   4.300  -9.361
   49    HE   ARG   8           HE       ARG   8  13.034   4.324  -7.621
   50   1HH1  ARG   8          1HH2      ARG   8  12.520   7.001  -9.517
   51   2HH1  ARG   8          2HH2      ARG   8  11.712   7.932  -8.301
   52   1HH2  ARG   8          2HH1      ARG   8  12.501   5.667  -5.747
   53   2HH2  ARG   8          1HH1      ARG   8  11.714   7.163  -6.110
   54    H    CYS   9           H        CYS   9  17.322   6.067  -5.617
   55    HA   CYS   9           HA       CYS   9  15.297   7.232  -3.825
   56   1HB   CYS   9          2HB       CYS   9  16.970   7.776  -2.258
   57   2HB   CYS   9          1HB       CYS   9  17.318   6.143  -2.735
   58    HA   HYP  10           HA       HYP  10  15.147   8.996  -2.685
   59   1HB   HYP  10          1HB       HYP  10  14.977  11.129  -1.985
   60   2HB   HYP  10          2HB       HYP  10  13.533  11.299  -2.957
   61   1HD   HYP  10          1HD1      HYP  10  17.119  11.262  -5.083
   62   2HD   HYP  10          2HD1      HYP  10  15.613  11.163  -6.005
   63    HOD  HYP  10           HD2      HYP  10  16.565  13.422  -3.552
   64    HG   HYP  10           HG       HYP  10  14.771  12.728  -4.455
   65    HA   HYP  11           HA       HYP  11  12.714   9.998  -1.570
   66   1HB   HYP  11          1HB       HYP  11  10.621   9.461  -0.898
   67   2HB   HYP  11          2HB       HYP  11  11.201   7.868  -0.461
   68   1HD   HYP  11          1HD1      HYP  11  10.769   8.723  -4.463
   69   2HD   HYP  11          2HD1      HYP  11  11.453   7.123  -4.141
   70    HOD  HYP  11           HD2      HYP  11   8.518   8.203  -2.975
   71    HG   HYP  11           HG       HYP  11  10.067   6.917  -2.265
   72    H    GLN  12           H        GLN  12  14.189   9.611   0.027
   73    HA   GLN  12           HA       GLN  12  16.355   7.955  -0.195
   74   1HB   GLN  12          2HB       GLN  12  16.623   8.128   2.295
   75   2HB   GLN  12          1HB       GLN  12  16.230   9.658   1.547
   76   1HG   GLN  12          2HG       GLN  12  14.504   9.864   2.997
   77   2HG   GLN  12          1HG       GLN  12  13.687   8.549   2.178
   78   1HE2  GLN  12          2HE2      GLN  12  15.204   7.979   5.877
   79   2HE2  GLN  12          1HE2      GLN  12  15.284   9.484   5.098
   80    H    CYS  13           H        CYS  13  16.738   5.768  -0.074
   81    HA   CYS  13           HA       CYS  13  14.608   3.919   0.057
   82   1HB   CYS  13          2HB       CYS  13  17.257   2.962   1.024
   83   2HB   CYS  13          1HB       CYS  13  16.135   2.284  -0.105
   84    H    CYS  14           H        CYS  14  13.660   2.825   1.569
   85    HA   CYS  14           HA       CYS  14  13.395   3.770   4.197
   86   1HB   CYS  14          2HB       CYS  14  12.757   1.001   3.147
   87   2HB   CYS  14          1HB       CYS  14  12.063   1.734   4.564
   88    H    MET  15           H        MET  15  13.628   2.360   6.161
   89    HA   MET  15           HA       MET  15  16.310   2.023   6.829
   90   1HB   MET  15          2HB       MET  15  14.330   2.225   8.409
   91   2HB   MET  15          1HB       MET  15  13.964   0.540   8.101
   92   1HG   MET  15          2HG       MET  15  15.271   0.812  10.167
   93   2HG   MET  15          1HG       MET  15  16.134  -0.138   8.995
   94   1HE   MET  15          2HE       MET  15  15.704   3.572  10.218
   95   2HE   MET  15          1HE       MET  15  16.301   2.551  11.547
   96   3HE   MET  15          3HE       MET  15  17.316   3.810  10.867
   97    H    GLY  16           H        GLY  16  17.759   0.507   6.595
   98   1HA   GLY  16          2HA       GLY  16  18.588  -1.731   6.491
   99   2HA   GLY  16          1HA       GLY  16  17.030  -2.250   5.866
  100    H    LEU  17           H        LEU  17  16.940   0.034   3.968
  101    HA   LEU  17           HA       LEU  17  18.563  -1.209   1.885
  102   1HB   LEU  17          2HB       LEU  17  16.298   0.791   1.828
  103   2HB   LEU  17          1HB       LEU  17  17.300   0.556   0.420
  104    HG   LEU  17           HG       LEU  17  16.634  -2.070   1.258
  105   1HD1  LEU  17          1HD1      LEU  17  14.200  -0.253   1.118
  106   2HD1  LEU  17          3HD1      LEU  17  14.163  -2.010   1.159
  107   3HD1  LEU  17          2HD1      LEU  17  14.751  -1.115   2.553
  108   1HD2  LEU  17          2HD2      LEU  17  16.860  -0.778  -1.101
  109   2HD2  LEU  17          1HD2      LEU  17  16.049  -2.311  -0.925
  110   3HD2  LEU  17          3HD2      LEU  17  15.119  -0.817  -0.979
  111    H    ARG  18           H        ARG  18  19.465   0.091   0.276
  112    HA   ARG  18           HA       ARG  18  20.736   2.660   0.993
  113   1HB   ARG  18          2HB       ARG  18  22.832   1.544  -0.180
  114   2HB   ARG  18          1HB       ARG  18  22.563   1.296   1.528
  115   1HG   ARG  18          2HG       ARG  18  21.727  -0.908   1.141
  116   2HG   ARG  18          1HG       ARG  18  21.399  -0.590  -0.541
  117   1HD   ARG  18          2HD       ARG  18  23.825  -0.473  -1.042
  118   2HD   ARG  18          1HD       ARG  18  24.196  -0.779   0.656
  119    HE   ARG  18           HE       ARG  18  22.508  -2.863  -0.147
  120   1HH1  ARG  18          2HH1      ARG  18  25.763  -1.945  -0.093
  121   2HH1  ARG  18          1HH1      ARG  18  26.323  -3.286  -1.034
  122   1HH2  ARG  18          1HH2      ARG  18  23.086  -4.409  -1.742
  123   2HH2  ARG  18          2HH2      ARG  18  24.774  -4.713  -1.991
  124    H    CYS  19           H        CYS  19  21.280   3.804  -0.804
  125    HA   CYS  19           HA       CYS  19  19.606   3.364  -3.155
  126   1HB   CYS  19          2HB       CYS  19  20.281   5.579  -1.999
  127   2HB   CYS  19          1HB       CYS  19  21.754   5.480  -2.913
  128    H    GLY  20           H        GLY  20  20.287   1.588  -4.333
  129   1HA   GLY  20          2HA       GLY  20  23.036   1.084  -5.062
  130   2HA   GLY  20          1HA       GLY  20  21.615   0.297  -5.747
  131    H    ARG  21           H        ARG  21  23.797   2.941  -6.017
  132    HA   ARG  21           HA       ARG  21  22.636   4.460  -8.070
  133   1HB   ARG  21          2HB       ARG  21  25.097   5.114  -8.520
  134   2HB   ARG  21          1HB       ARG  21  24.457   5.437  -6.926
  135   1HG   ARG  21          2HG       ARG  21  25.658   3.677  -5.919
  136   2HG   ARG  21          1HG       ARG  21  25.846   2.788  -7.417
  137   1HD   ARG  21          2HD       ARG  21  27.144   5.512  -7.151
  138   2HD   ARG  21          1HD       ARG  21  27.908   4.096  -6.433
  139    HE   ARG  21           HE       ARG  21  27.088   3.847  -9.265
  140   1HH1  ARG  21          1HH2      ARG  21  29.131   2.174  -7.784
  141   2HH1  ARG  21          2HH2      ARG  21  30.618   2.781  -8.435
  142   1HH2  ARG  21          2HH1      ARG  21  29.103   5.655  -9.743
  143   2HH2  ARG  21          1HH1      ARG  21  30.601   4.802  -9.571
  144    H    GLY  22           H        GLY  22  24.113   1.376  -8.260
  145   1HA   GLY  22          2HA       GLY  22  25.096   1.348 -10.927
  146   2HA   GLY  22          1HA       GLY  22  24.512  -0.071 -10.056
  147    H    ASN  23           H        ASN  23  24.117   1.037 -12.883
  148    HA   ASN  23           HA       ASN  23  21.280   1.591 -13.065
  149   1HB   ASN  23          2HB       ASN  23  23.528   1.263 -15.034
  150   2HB   ASN  23          1HB       ASN  23  21.871   1.253 -15.614
  151   1HD2  ASN  23          2HD2      ASN  23  21.547   4.734 -15.340
  152   2HD2  ASN  23          1HD2      ASN  23  20.969   3.276 -15.988
  153    HA   PRO  24           HA       PRO  24  19.376   1.200 -14.147
  154   1HB   PRO  24          2HB       PRO  24  17.104  -0.035 -13.114
  155   2HB   PRO  24          1HB       PRO  24  17.532   0.077 -14.813
  156   1HG   PRO  24          2HG       PRO  24  17.675  -2.286 -13.037
  157   2HG   PRO  24          1HG       PRO  24  17.668  -2.226 -14.794
  158   1HD   PRO  24          2HD       PRO  24  19.949  -2.690 -13.117
  159   2HD   PRO  24          1HD       PRO  24  19.975  -2.412 -14.866
  160    H    GLN  25           H        GLN  25  19.315   2.743 -12.681
  161    HA   GLN  25           HA       GLN  25  20.214   2.538 -10.028
  162   1HB   GLN  25          2HB       GLN  25  18.405   4.597 -11.350
  163   2HB   GLN  25          1HB       GLN  25  19.093   4.814  -9.748
  164   1HG   GLN  25          2HG       GLN  25  21.362   4.733 -10.623
  165   2HG   GLN  25          1HG       GLN  25  20.799   4.267 -12.223
  166   1HE2  GLN  25          2HE2      GLN  25  19.698   7.550 -13.092
  167   2HE2  GLN  25          1HE2      GLN  25  19.465   5.901 -13.415
  168    H    LYS  26           H        LYS  26  19.369   1.600  -8.379
  169    HA   LYS  26           HA       LYS  26  16.579   1.875  -7.602
  170   1HB   LYS  26          2HB       LYS  26  17.541  -0.547  -9.016
  171   2HB   LYS  26          1HB       LYS  26  16.757  -0.923  -7.500
  172   1HG   LYS  26          2HG       LYS  26  14.710  -0.242  -8.186
  173   2HG   LYS  26          1HG       LYS  26  15.292   1.083  -9.152
  174   1HD   LYS  26          2HD       LYS  26  14.407  -0.458 -10.721
  175   2HD   LYS  26          1HD       LYS  26  16.143  -0.675 -10.829
  176   1HE   LYS  26          2HE       LYS  26  15.827  -2.599  -9.097
  177   2HE   LYS  26          1HE       LYS  26  14.108  -2.460  -9.445
  178   1HZ   LYS  26          2HZ       LYS  26  16.199  -2.882 -11.495
  179   2HZ   LYS  26          1HZ       LYS  26  15.261  -4.120 -10.806
  180   3HZ   LYS  26          3HZ       LYS  26  14.517  -2.904 -11.733
  181    H    CYS  27           H        CYS  27  16.175   1.199  -5.386
  182    HA   CYS  27           HA       CYS  27  18.610   1.175  -3.813
  183   1HB   CYS  27          2HB       CYS  27  15.735   0.883  -2.818
  184   2HB   CYS  27          1HB       CYS  27  17.161   1.128  -1.898
  185    H    ILE  28           H        ILE  28  19.224  -0.506  -2.480
  186    HA   ILE  28           HA       ILE  28  17.910  -3.151  -2.824
  187    HB   ILE  28           HB       ILE  28  20.143  -4.171  -3.052
  188   1HG1  ILE  28          2HG1      ILE  28  21.276  -2.246  -1.728
  189   2HG1  ILE  28          1HG1      ILE  28  22.127  -3.024  -2.998
  190   1HG2  ILE  28          1HG2      ILE  28  19.604  -2.012  -5.135
  191   2HG2  ILE  28          3HG2      ILE  28  20.769  -3.308  -5.334
  192   3HG2  ILE  28          2HG2      ILE  28  19.064  -3.678  -5.156
  193   1HD1  ILE  28          3HD1      ILE  28  20.663  -0.615  -3.876
  194   2HD1  ILE  28          2HD1      ILE  28  21.986  -0.350  -2.758
  195   3HD1  ILE  28          1HD1      ILE  28  22.272  -1.191  -4.272
  196    H    GLY  29           H        GLY  29  19.347  -4.570  -1.123
  197   1HA   GLY  29          2HA       GLY  29  18.986  -3.110   1.414
  198   2HA   GLY  29          1HA       GLY  29  18.987  -4.823   1.276
  199    H    ALA  30           H        ALA  30  20.561  -2.642   2.735
  200    HA   ALA  30           HA       ALA  30  23.361  -3.049   1.955
  201   1HB   ALA  30          2HB       ALA  30  21.862  -1.352   3.926
  202   2HB   ALA  30          1HB       ALA  30  23.521  -1.749   4.334
  203   3HB   ALA  30          3HB       ALA  30  23.167  -0.897   2.845
  204    H    HIS  31           H        HIS  31  21.192  -3.765   4.564
  205    HA   HIS  31           HA       HIS  31  22.964  -5.976   5.555
  206   1HB   HIS  31          2HB       HIS  31  22.591  -3.973   7.123
  207   2HB   HIS  31          1HB       HIS  31  20.888  -4.407   7.176
  208    HD1  HIS  31           HD1      HIS  31  24.189  -6.080   7.860
  209    HD2  HIS  31           HD2      HIS  31  20.304  -6.302   9.088
  210    HE1  HIS  31           HE1      HIS  31  24.135  -7.735   9.687
  211   1HN   CGU  32           HN       CGU  32  21.800  -6.929   3.649
  212    HA   CGU  32           HA       CGU  32  19.157  -8.089   4.412
  213   1HB   CGU  32          1HB       CGU  32  20.216  -7.996   1.568
  214   2HB   CGU  32          2HB       CGU  32  19.657  -6.517   2.277
  215    HG   CGU  32           HG       CGU  32  17.982  -7.827   0.922
  216    H    ASP  33           H        ASP  33  20.024  -9.702   1.978
  217    HA   ASP  33           HA       ASP  33  22.104 -11.499   2.892
  218   1HB   ASP  33          2HB       ASP  33  19.806 -12.037   4.193
  219   2HB   ASP  33          1HB       ASP  33  19.356 -12.805   2.687
  220    H    VAL  34           H        VAL  34  21.528  -9.937   0.649
  221    HA   VAL  34           HA       VAL  34  20.847 -11.819  -1.537
  222    HB   VAL  34           HB       VAL  34  21.595  -8.857  -1.696
  223   1HG1  VAL  34          2HG1      VAL  34  20.298 -10.771  -3.693
  224   2HG1  VAL  34          1HG1      VAL  34  20.415  -9.035  -3.928
  225   3HG1  VAL  34          3HG1      VAL  34  21.872 -10.008  -3.854
  226   1HG2  VAL  34          2HG2      VAL  34  18.904 -10.251  -1.389
  227   2HG2  VAL  34          1HG2      VAL  34  19.575  -8.958  -0.409
  228   3HG2  VAL  34          3HG2      VAL  34  19.041  -8.627  -2.044
   
  No H/Q in entry =         228
  Start of MODEL    5
    1   1H    ALA   1          2H        ALA   1   8.377   9.038   3.493
    2   2H    ALA   1          1H        ALA   1   7.858   9.917   2.134
    3   3H    ALA   1          3H        ALA   1   6.731   9.416   3.304
    4    HA   ALA   1           HA       ALA   1   7.149   7.112   2.765
    5   1HB   ALA   1          2HB       ALA   1   6.457   8.919   0.401
    6   2HB   ALA   1          1HB       ALA   1   6.175   7.185   0.421
    7   3HB   ALA   1          3HB       ALA   1   5.328   8.228   1.553
    8    H    CYS   2           H        CYS   2   9.226   6.424   2.906
    9    HA   CYS   2           HA       CYS   2  11.391   7.107   1.136
   10   1HB   CYS   2          2HB       CYS   2  12.385   4.991   2.185
   11   2HB   CYS   2          1HB       CYS   2  11.961   6.231   3.314
   12    H    SER   3           H        SER   3  12.563   4.983   0.202
   13    HA   SER   3           HA       SER   3  10.701   3.865  -1.855
   14   1HB   SER   3          2HB       SER   3  13.652   4.558  -1.857
   15   2HB   SER   3          1HB       SER   3  13.037   3.369  -3.006
   16    HG   SER   3           HG       SER   3  12.883   5.403  -3.803
   17    H    GLY   4           H        GLY   4  10.786   1.662  -2.348
   18   1HA   GLY   4          2HA       GLY   4  11.813  -0.085  -0.151
   19   2HA   GLY   4          1HA       GLY   4  10.496  -0.489  -1.244
   20    H    ARG   5           H        ARG   5  12.332  -2.384  -1.054
   21    HA   ARG   5           HA       ARG   5  14.607  -2.142  -2.767
   22   1HB   ARG   5          2HB       ARG   5  13.302  -4.247  -1.223
   23   2HB   ARG   5          1HB       ARG   5  13.644  -4.896  -2.807
   24   1HG   ARG   5          2HG       ARG   5  15.937  -3.354  -1.798
   25   2HG   ARG   5          1HG       ARG   5  15.452  -4.554  -0.644
   26   1HD   ARG   5          2HD       ARG   5  15.868  -5.260  -3.580
   27   2HD   ARG   5          1HD       ARG   5  17.191  -5.290  -2.419
   28    HE   ARG   5           HE       ARG   5  15.163  -6.825  -1.256
   29   1HH1  ARG   5          1HH2      ARG   5  17.916  -7.764  -1.998
   30   2HH1  ARG   5          2HH2      ARG   5  17.586  -9.026  -3.132
   31   1HH2  ARG   5          2HH1      ARG   5  14.280  -7.952  -3.630
   32   2HH2  ARG   5          1HH1      ARG   5  15.459  -9.134  -4.089
   33    H    GLY   6           H        GLY   6  14.422  -1.489  -4.689
   34   1HA   GLY   6          2HA       GLY   6  13.997  -2.446  -7.034
   35   2HA   GLY   6          1HA       GLY   6  12.328  -2.567  -6.554
   36    H    SER   7           H        SER   7  13.083   0.125  -5.042
   37    HA   SER   7           HA       SER   7  12.440   1.910  -7.356
   38   1HB   SER   7          2HB       SER   7  11.755   2.093  -4.377
   39   2HB   SER   7          1HB       SER   7  11.480   3.423  -5.520
   40    HG   SER   7           HG       SER   7  10.265   2.001  -6.783
   41    H    ARG   8           H        ARG   8  13.727   3.698  -7.673
   42    HA   ARG   8           HA       ARG   8  16.390   3.651  -6.520
   43   1HB   ARG   8          2HB       ARG   8  16.871   5.416  -8.084
   44   2HB   ARG   8          1HB       ARG   8  15.809   4.294  -8.912
   45   1HG   ARG   8          2HG       ARG   8  13.903   5.860  -8.010
   46   2HG   ARG   8          1HG       ARG   8  15.174   7.025  -7.807
   47   1HD   ARG   8          2HD       ARG   8  15.109   5.637 -10.487
   48   2HD   ARG   8          1HD       ARG   8  13.830   6.793 -10.158
   49    HE   ARG   8           HE       ARG   8  15.411   8.484 -10.451
   50   1HH1  ARG   8          1HH2      ARG   8  17.065   8.220  -8.196
   51   2HH1  ARG   8          2HH2      ARG   8  18.609   7.717  -8.802
   52   1HH2  ARG   8          2HH1      ARG   8  17.257   6.655 -11.862
   53   2HH2  ARG   8          1HH1      ARG   8  18.719   6.800 -10.944
   54    H    CYS   9           H        CYS   9  17.144   6.151  -6.215
   55    HA   CYS   9           HA       CYS   9  15.463   7.250  -4.067
   56   1HB   CYS   9          2HB       CYS   9  17.263   7.531  -2.609
   57   2HB   CYS   9          1HB       CYS   9  17.477   5.943  -3.265
   58    HA   HYP  10           HA       HYP  10  15.282   8.794  -2.864
   59   1HB   HYP  10          1HB       HYP  10  15.138  10.765  -1.848
   60   2HB   HYP  10          2HB       HYP  10  13.786  11.211  -2.862
   61   1HD   HYP  10          1HD1      HYP  10  17.419  11.272  -4.897
   62   2HD   HYP  10          2HD1      HYP  10  15.890  11.425  -5.778
   63    HOD  HYP  10           HD2      HYP  10  16.921  13.076  -2.697
   64    HG   HYP  10           HG       HYP  10  15.258  12.800  -3.937
   65    HA   HYP  11           HA       HYP  11  12.649   9.979  -1.721
   66   1HB   HYP  11          1HB       HYP  11  10.637   9.265  -1.044
   67   2HB   HYP  11          2HB       HYP  11  11.195   7.600  -0.979
   68   1HD   HYP  11          1HD1      HYP  11  10.896   9.209  -4.741
   69   2HD   HYP  11          2HD1      HYP  11  11.432   7.523  -4.692
   70    HOD  HYP  11           HD2      HYP  11   9.713   9.968  -3.062
   71    HG   HYP  11           HG       HYP  11   9.944   7.136  -2.900
   72    H    GLN  12           H        GLN  12  14.248   9.645  -0.321
   73    HA   GLN  12           HA       GLN  12  16.343   7.888  -0.556
   74   1HB   GLN  12          2HB       GLN  12  15.099   9.038   1.972
   75   2HB   GLN  12          1HB       GLN  12  16.637   8.204   1.974
   76   1HG   GLN  12          2HG       GLN  12  17.605  10.216   1.490
   77   2HG   GLN  12          1HG       GLN  12  16.983  10.024  -0.138
   78   1HE2  GLN  12          2HE2      GLN  12  15.051  12.947   0.273
   79   2HE2  GLN  12          1HE2      GLN  12  16.046  12.041  -0.746
   80    H    CYS  13           H        CYS  13  16.657   5.760  -0.304
   81    HA   CYS  13           HA       CYS  13  14.562   3.932   0.012
   82   1HB   CYS  13          2HB       CYS  13  17.262   3.105   0.967
   83   2HB   CYS  13          1HB       CYS  13  16.126   2.299  -0.066
   84    H    CYS  14           H        CYS  14  13.684   2.855   1.572
   85    HA   CYS  14           HA       CYS  14  13.365   3.912   4.141
   86   1HB   CYS  14          2HB       CYS  14  12.859   1.093   3.166
   87   2HB   CYS  14          1HB       CYS  14  12.182   1.775   4.614
   88    H    MET  15           H        MET  15  13.552   2.504   6.143
   89    HA   MET  15           HA       MET  15  16.240   2.336   6.919
   90   1HB   MET  15          2HB       MET  15  14.207   2.545   8.440
   91   2HB   MET  15          1HB       MET  15  13.894   0.841   8.183
   92   1HG   MET  15          2HG       MET  15  15.418   0.271   9.732
   93   2HG   MET  15          1HG       MET  15  16.673   1.182   8.947
   94   1HE   MET  15          2HE       MET  15  17.812   3.126   9.821
   95   2HE   MET  15          1HE       MET  15  16.428   4.065   9.209
   96   3HE   MET  15          3HE       MET  15  17.062   4.354  10.821
   97    H    GLY  16           H        GLY  16  17.740   0.869   6.669
   98   1HA   GLY  16          2HA       GLY  16  18.641  -1.339   6.659
   99   2HA   GLY  16          1HA       GLY  16  17.081  -1.948   6.129
  100    H    LEU  17           H        LEU  17  16.872   0.252   4.102
  101    HA   LEU  17           HA       LEU  17  18.421  -1.094   2.034
  102   1HB   LEU  17          2HB       LEU  17  16.396   1.166   1.822
  103   2HB   LEU  17          1HB       LEU  17  17.152   0.398   0.450
  104    HG   LEU  17           HG       LEU  17  15.068  -0.717   2.333
  105   1HD1  LEU  17          2HD1      LEU  17  14.448   0.660   0.323
  106   2HD1  LEU  17          1HD1      LEU  17  15.101  -0.624  -0.682
  107   3HD1  LEU  17          3HD1      LEU  17  13.747  -0.948   0.389
  108   1HD2  LEU  17          1HD2      LEU  17  16.819  -2.537   1.915
  109   2HD2  LEU  17          3HD2      LEU  17  15.231  -2.897   1.265
  110   3HD2  LEU  17          2HD2      LEU  17  16.496  -2.343   0.193
  111    H    ARG  18           H        ARG  18  19.386   0.108   0.362
  112    HA   ARG  18           HA       ARG  18  20.622   2.717   0.966
  113   1HB   ARG  18          2HB       ARG  18  22.771   1.542  -0.040
  114   2HB   ARG  18          1HB       ARG  18  22.436   1.439   1.675
  115   1HG   ARG  18          2HG       ARG  18  21.717  -0.790   1.517
  116   2HG   ARG  18          1HG       ARG  18  21.301  -0.671  -0.173
  117   1HD   ARG  18          2HD       ARG  18  24.168  -0.610   0.850
  118   2HD   ARG  18          1HD       ARG  18  23.369  -2.040   0.194
  119    HE   ARG  18           HE       ARG  18  23.092   0.126  -1.651
  120   1HH1  ARG  18          1HH2      ARG  18  26.013  -0.030  -0.534
  121   2HH1  ARG  18          2HH2      ARG  18  26.771  -0.926  -1.806
  122   1HH2  ARG  18          2HH1      ARG  18  23.716  -1.913  -3.205
  123   2HH2  ARG  18          1HH1      ARG  18  25.436  -2.019  -3.358
  124    H    CYS  19           H        CYS  19  21.249   3.741  -0.869
  125    HA   CYS  19           HA       CYS  19  19.705   3.156  -3.264
  126   1HB   CYS  19          2HB       CYS  19  20.330   5.438  -2.252
  127   2HB   CYS  19          1HB       CYS  19  21.854   5.268  -3.068
  128    H    GLY  20           H        GLY  20  20.353   1.457  -4.499
  129   1HA   GLY  20          2HA       GLY  20  23.177   0.920  -5.082
  130   2HA   GLY  20          1HA       GLY  20  21.780   0.048  -5.728
  131    H    ARG  21           H        ARG  21  24.236   1.961  -6.638
  132    HA   ARG  21           HA       ARG  21  23.163   3.866  -8.382
  133   1HB   ARG  21          2HB       ARG  21  25.366   4.062  -9.240
  134   2HB   ARG  21          1HB       ARG  21  25.601   3.498  -7.606
  135   1HG   ARG  21          2HG       ARG  21  25.671   1.707 -10.084
  136   2HG   ARG  21          1HG       ARG  21  27.069   2.325  -9.239
  137   1HD   ARG  21          2HD       ARG  21  26.369   1.119  -7.162
  138   2HD   ARG  21          1HD       ARG  21  24.987   0.452  -8.027
  139    HE   ARG  21           HE       ARG  21  27.809  -0.302  -8.430
  140   1HH1  ARG  21          1HH1      ARG  21  26.033  -1.645 -11.386
  141   2HH1  ARG  21          2HH1      ARG  21  26.858  -0.145 -11.118
  142   1HH2  ARG  21          1HH2      ARG  21  25.757  -2.326  -7.958
  143   2HH2  ARG  21          2HH2      ARG  21  25.391  -2.915  -9.546
  144    H    GLY  22           H        GLY  22  23.058   3.907 -10.672
  145   1HA   GLY  22          2HA       GLY  22  23.248   2.044 -12.630
  146   2HA   GLY  22          1HA       GLY  22  21.757   1.535 -11.827
  147    H    ASN  23           H        ASN  23  20.782   2.065 -13.942
  148    HA   ASN  23           HA       ASN  23  19.650   4.739 -13.867
  149   1HB   ASN  23          2HB       ASN  23  22.010   4.448 -15.373
  150   2HB   ASN  23          1HB       ASN  23  20.758   4.341 -16.599
  151   1HD2  ASN  23          2HD2      ASN  23  20.293   7.807 -16.578
  152   2HD2  ASN  23          1HD2      ASN  23  20.255   6.341 -17.432
  153    HA   PRO  24           HA       PRO  24  17.722   5.077 -13.446
  154   1HB   PRO  24          2HB       PRO  24  15.443   3.837 -12.426
  155   2HB   PRO  24          1HB       PRO  24  15.482   5.178 -13.556
  156   1HG   PRO  24          2HG       PRO  24  14.809   2.360 -14.089
  157   2HG   PRO  24          1HG       PRO  24  14.512   3.768 -15.098
  158   1HD   PRO  24          2HD       PRO  24  16.538   1.775 -15.501
  159   2HD   PRO  24          1HD       PRO  24  16.360   3.291 -16.400
  160    H    GLN  25           H        GLN  25  18.406   4.980 -11.388
  161    HA   GLN  25           HA       GLN  25  19.851   2.763 -10.380
  162   1HB   GLN  25          2HB       GLN  25  18.667   5.156  -8.910
  163   2HB   GLN  25          1HB       GLN  25  19.871   4.084  -8.219
  164   1HG   GLN  25          2HG       GLN  25  21.537   4.797  -9.784
  165   2HG   GLN  25          1HG       GLN  25  20.334   5.475 -10.871
  166   1HE2  GLN  25          2HE2      GLN  25  21.225   8.590  -9.582
  167   2HE2  GLN  25          1HE2      GLN  25  21.241   7.532 -10.913
  168    H    LYS  26           H        LYS  26  19.347   1.893  -8.049
  169    HA   LYS  26           HA       LYS  26  16.525   1.397  -7.475
  170   1HB   LYS  26          2HB       LYS  26  17.104  -0.173  -9.398
  171   2HB   LYS  26          1HB       LYS  26  18.246  -0.967  -8.329
  172   1HG   LYS  26          2HG       LYS  26  16.258  -1.346  -6.739
  173   2HG   LYS  26          1HG       LYS  26  15.250  -0.785  -8.060
  174   1HD   LYS  26          2HD       LYS  26  17.272  -3.023  -8.478
  175   2HD   LYS  26          1HD       LYS  26  15.681  -3.369  -7.853
  176   1HE   LYS  26          2HE       LYS  26  15.194  -3.591 -10.108
  177   2HE   LYS  26          1HE       LYS  26  14.933  -1.860  -9.996
  178   1HZ   LYS  26          3HZ       LYS  26  17.654  -2.785 -10.492
  179   2HZ   LYS  26          2HZ       LYS  26  16.531  -2.936 -11.755
  180   3HZ   LYS  26          1HZ       LYS  26  16.853  -1.411 -11.083
  181    H    CYS  27           H        CYS  27  16.303   1.213  -5.309
  182    HA   CYS  27           HA       CYS  27  18.600   0.971  -3.633
  183   1HB   CYS  27          2HB       CYS  27  15.684   0.701  -2.729
  184   2HB   CYS  27          1HB       CYS  27  17.087   1.027  -1.791
  185    H    ILE  28           H        ILE  28  19.177  -0.651  -2.345
  186    HA   ILE  28           HA       ILE  28  17.876  -3.317  -2.561
  187    HB   ILE  28           HB       ILE  28  20.194  -4.302  -2.606
  188   1HG1  ILE  28          2HG1      ILE  28  21.183  -2.096  -1.623
  189   2HG1  ILE  28          1HG1      ILE  28  22.118  -3.033  -2.720
  190   1HG2  ILE  28          1HG2      ILE  28  19.212  -2.639  -4.920
  191   2HG2  ILE  28          3HG2      ILE  28  20.743  -3.486  -5.051
  192   3HG2  ILE  28          2HG2      ILE  28  19.269  -4.381  -4.736
  193   1HD1  ILE  28          2HD1      ILE  28  20.482  -0.959  -4.045
  194   2HD1  ILE  28          1HD1      ILE  28  21.747  -0.378  -2.978
  195   3HD1  ILE  28          3HD1      ILE  28  22.144  -1.457  -4.309
  196    H    GLY  29           H        GLY  29  19.498  -4.580  -0.750
  197   1HA   GLY  29          2HA       GLY  29  19.082  -2.924   1.668
  198   2HA   GLY  29          1HA       GLY  29  19.048  -4.654   1.668
  199    H    ALA  30           H        ALA  30  20.618  -2.591   3.125
  200    HA   ALA  30           HA       ALA  30  23.406  -2.849   2.316
  201   1HB   ALA  30          2HB       ALA  30  22.095  -1.919   4.916
  202   2HB   ALA  30          1HB       ALA  30  23.825  -1.832   4.610
  203   3HB   ALA  30          3HB       ALA  30  22.713  -0.889   3.634
  204    H    HIS  31           H        HIS  31  21.248  -4.231   4.649
  205    HA   HIS  31           HA       HIS  31  23.197  -6.336   5.447
  206   1HB   HIS  31          2HB       HIS  31  21.648  -4.848   7.072
  207   2HB   HIS  31          1HB       HIS  31  20.429  -6.049   6.671
  208    HD1  HIS  31           HD1      HIS  31  23.656  -5.725   8.444
  209    HD2  HIS  31           HD2      HIS  31  20.935  -8.669   7.673
  210    HE1  HIS  31           HE1      HIS  31  24.261  -7.626   9.896
  211   1HN   CGU  32           HN       CGU  32  22.057  -6.224   2.906
  212    HA   CGU  32           HA       CGU  32  20.503  -8.769   2.753
  213   1HB   CGU  32          1HB       CGU  32  20.330  -6.262   1.030
  214   2HB   CGU  32          2HB       CGU  32  19.139  -6.813   2.181
  215    HG   CGU  32           HG       CGU  32  19.290  -9.020   0.637
  216    H    ASP  33           H        ASP  33  22.250  -9.865   2.640
  217    HA   ASP  33           HA       ASP  33  24.160  -9.529   0.379
  218   1HB   ASP  33          2HB       ASP  33  24.551 -11.036   3.008
  219   2HB   ASP  33          1HB       ASP  33  25.787 -10.572   1.858
  220    H    VAL  34           H        VAL  34  21.786 -10.521  -0.265
  221    HA   VAL  34           HA       VAL  34  22.300 -13.443  -0.606
  222    HB   VAL  34           HB       VAL  34  20.527 -12.881   1.149
  223   1HG1  VAL  34          3HG1      VAL  34  19.587 -10.948  -0.382
  224   2HG1  VAL  34          2HG1      VAL  34  18.647 -12.226  -1.129
  225   3HG1  VAL  34          1HG1      VAL  34  18.470 -11.888   0.586
  226   1HG2  VAL  34          2HG2      VAL  34  20.649 -15.079  -0.157
  227   2HG2  VAL  34          1HG2      VAL  34  19.083 -14.686   0.521
  228   3HG2  VAL  34          3HG2      VAL  34  19.379 -14.449  -1.192
   
  No H/Q in entry =         228
  Start of MODEL    6
    1   1H    ALA   1          1H        ALA   1   9.233   9.828   4.165
    2   2H    ALA   1          3H        ALA   1   7.558   9.595   4.314
    3   3H    ALA   1          2H        ALA   1   8.622   8.302   4.594
    4    HA   ALA   1           HA       ALA   1   7.645   7.994   2.469
    5   1HB   ALA   1          1HB       ALA   1   8.597  10.853   1.995
    6   2HB   ALA   1          3HB       ALA   1   8.072   9.793   0.695
    7   3HB   ALA   1          2HB       ALA   1   6.942  10.265   1.956
    8    H    CYS   2           H        CYS   2   9.070   6.398   2.205
    9    HA   CYS   2           HA       CYS   2  11.822   7.051   1.273
   10   1HB   CYS   2          2HB       CYS   2  12.459   4.910   2.330
   11   2HB   CYS   2          1HB       CYS   2  11.987   6.080   3.511
   12    H    SER   3           H        SER   3  12.743   4.978   0.236
   13    HA   SER   3           HA       SER   3  10.777   4.020  -1.814
   14   1HB   SER   3          2HB       SER   3  13.749   4.626  -1.897
   15   2HB   SER   3          1HB       SER   3  13.070   3.466  -3.043
   16    HG   SER   3           HG       SER   3  12.929   5.485  -3.837
   17    H    GLY   4           H        GLY   4  10.645   1.834  -2.253
   18   1HA   GLY   4          2HA       GLY   4  11.668   0.022  -0.125
   19   2HA   GLY   4          1HA       GLY   4  10.386  -0.344  -1.277
   20    H    ARG   5           H        ARG   5  12.247  -2.243  -0.978
   21    HA   ARG   5           HA       ARG   5  14.520  -1.963  -2.720
   22   1HB   ARG   5          2HB       ARG   5  14.214  -3.703  -0.851
   23   2HB   ARG   5          1HB       ARG   5  13.173  -4.594  -1.942
   24   1HG   ARG   5          2HG       ARG   5  14.922  -5.091  -3.445
   25   2HG   ARG   5          1HG       ARG   5  15.885  -3.710  -2.966
   26   1HD   ARG   5          2HD       ARG   5  17.012  -5.610  -2.052
   27   2HD   ARG   5          1HD       ARG   5  16.184  -4.884  -0.679
   28    HE   ARG   5           HE       ARG   5  14.512  -6.640  -0.800
   29   1HH1  ARG   5          1HH2      ARG   5  15.320  -6.972  -3.845
   30   2HH1  ARG   5          2HH2      ARG   5  15.869  -8.615  -3.807
   31   1HH2  ARG   5          2HH1      ARG   5  15.992  -8.716  -0.317
   32   2HH2  ARG   5          1HH1      ARG   5  16.265  -9.622  -1.767
   33    H    GLY   6           H        GLY   6  13.804  -1.161  -4.616
   34   1HA   GLY   6          2HA       GLY   6  13.335  -2.638  -6.849
   35   2HA   GLY   6          1HA       GLY   6  11.698  -2.423  -6.223
   36    H    SER   7           H        SER   7  13.134   0.223  -5.141
   37    HA   SER   7           HA       SER   7  12.920   1.847  -7.637
   38   1HB   SER   7          2HB       SER   7  11.545   2.408  -4.952
   39   2HB   SER   7          1HB       SER   7  11.622   3.564  -6.294
   40    HG   SER   7           HG       SER   7  10.651   0.907  -6.480
   41    H    ARG   8           H        ARG   8  14.360   3.559  -7.715
   42    HA   ARG   8           HA       ARG   8  16.622   3.446  -5.886
   43   1HB   ARG   8          2HB       ARG   8  17.622   5.076  -7.416
   44   2HB   ARG   8          1HB       ARG   8  16.818   3.835  -8.343
   45   1HG   ARG   8          2HG       ARG   8  14.764   5.657  -8.016
   46   2HG   ARG   8          1HG       ARG   8  16.145   6.710  -8.049
   47   1HD   ARG   8          2HD       ARG   8  16.564   4.864 -10.203
   48   2HD   ARG   8          1HD       ARG   8  14.870   5.331 -10.273
   49    HE   ARG   8           HE       ARG   8  15.777   7.745 -10.138
   50   1HH1  ARG   8          2HH1      ARG   8  18.301   8.204 -10.272
   51   2HH1  ARG   8          1HH1      ARG   8  18.915   7.814 -11.844
   52   1HH2  ARG   8          1HH2      ARG   8  16.140   5.844 -12.664
   53   2HH2  ARG   8          2HH2      ARG   8  17.660   6.447 -13.233
   54    H    CYS   9           H        CYS   9  17.454   5.981  -5.622
   55    HA   CYS   9           HA       CYS   9  15.421   7.189  -3.861
   56   1HB   CYS   9          2HB       CYS   9  17.101   7.808  -2.351
   57   2HB   CYS   9          1HB       CYS   9  17.496   6.185  -2.817
   58    HA   HYP  10           HA       HYP  10  15.207   8.909  -2.719
   59   1HB   HYP  10          1HB       HYP  10  15.015  11.004  -1.954
   60   2HB   HYP  10          2HB       HYP  10  13.580  11.214  -2.940
   61   1HD   HYP  10          1HD1      HYP  10  17.096  11.242  -5.164
   62   2HD   HYP  10          2HD1      HYP  10  15.528  11.171  -5.981
   63    HOD  HYP  10           HD2      HYP  10  17.046  11.611  -2.898
   64    HG   HYP  10           HG       HYP  10  14.850  12.724  -4.318
   65    HA   HYP  11           HA       HYP  11  12.722  10.032  -1.536
   66   1HB   HYP  11          1HB       HYP  11  10.685   9.494  -0.743
   67   2HB   HYP  11          2HB       HYP  11  11.172   7.824  -0.535
   68   1HD   HYP  11          1HD1      HYP  11  10.747   9.133  -4.392
   69   2HD   HYP  11          2HD1      HYP  11  11.225   7.434  -4.266
   70    HOD  HYP  11           HD2      HYP  11   9.650  10.036  -2.642
   71    HG   HYP  11           HG       HYP  11   9.860   7.210  -2.358
   72    H    GLN  12           H        GLN  12  14.279   9.654  -0.066
   73    HA   GLN  12           HA       GLN  12  16.373   7.912  -0.294
   74   1HB   GLN  12          2HB       GLN  12  16.201   9.776   1.371
   75   2HB   GLN  12          1HB       GLN  12  15.139   8.786   2.354
   76   1HG   GLN  12          2HG       GLN  12  16.951   7.109   2.665
   77   2HG   GLN  12          1HG       GLN  12  18.011   8.034   1.606
   78   1HE2  GLN  12          2HE2      GLN  12  18.498  10.662   4.038
   79   2HE2  GLN  12          1HE2      GLN  12  18.344  10.420   2.364
   80    H    CYS  13           H        CYS  13  16.612   5.741  -0.229
   81    HA   CYS  13           HA       CYS  13  14.529   3.931   0.091
   82   1HB   CYS  13          2HB       CYS  13  17.193   2.964   1.019
   83   2HB   CYS  13          1HB       CYS  13  16.049   2.282  -0.086
   84    H    CYS  14           H        CYS  14  13.668   2.793   1.596
   85    HA   CYS  14           HA       CYS  14  13.360   3.746   4.216
   86   1HB   CYS  14          2HB       CYS  14  12.808   0.967   3.159
   87   2HB   CYS  14          1HB       CYS  14  12.069   1.677   4.562
   88    H    MET  15           H        MET  15  13.589   2.358   6.180
   89    HA   MET  15           HA       MET  15  16.282   2.054   6.869
   90   1HB   MET  15          2HB       MET  15  14.349   2.318   8.475
   91   2HB   MET  15          1HB       MET  15  13.885   0.660   8.153
   92   1HG   MET  15          2HG       MET  15  15.784  -0.218   9.209
   93   2HG   MET  15          1HG       MET  15  16.704   1.250   9.046
   94   1HE   MET  15          3HE       MET  15  15.896   3.477  10.212
   95   2HE   MET  15          2HE       MET  15  15.868   3.394  11.957
   96   3HE   MET  15          1HE       MET  15  17.256   2.740  11.091
   97    H    GLY  16           H        GLY  16  17.719   0.555   6.534
   98   1HA   GLY  16          2HA       GLY  16  18.494  -1.723   6.508
   99   2HA   GLY  16          1HA       GLY  16  16.931  -2.214   5.878
  100    H    LEU  17           H        LEU  17  16.936   0.097   3.951
  101    HA   LEU  17           HA       LEU  17  18.588  -1.205   1.912
  102   1HB   LEU  17          2HB       LEU  17  16.292   0.761   1.776
  103   2HB   LEU  17          1HB       LEU  17  17.320   0.521   0.387
  104    HG   LEU  17           HG       LEU  17  16.694  -2.102   1.237
  105   1HD1  LEU  17          2HD1      LEU  17  14.800  -1.086   2.532
  106   2HD1  LEU  17          1HD1      LEU  17  14.198  -0.385   1.030
  107   3HD1  LEU  17          3HD1      LEU  17  14.254  -2.132   1.225
  108   1HD2  LEU  17          3HD2      LEU  17  16.891  -0.857  -1.137
  109   2HD2  LEU  17          2HD2      LEU  17  16.057  -2.376  -0.940
  110   3HD2  LEU  17          1HD2      LEU  17  15.151  -0.867  -0.999
  111    H    ARG  18           H        ARG  18  19.491   0.115   0.282
  112    HA   ARG  18           HA       ARG  18  20.715   2.694   1.034
  113   1HB   ARG  18          2HB       ARG  18  22.829   1.558  -0.177
  114   2HB   ARG  18          1HB       ARG  18  22.586   1.428   1.552
  115   1HG   ARG  18          2HG       ARG  18  21.790  -0.781   1.386
  116   2HG   ARG  18          1HG       ARG  18  21.392  -0.630  -0.305
  117   1HD   ARG  18          2HD       ARG  18  23.410  -2.028  -0.068
  118   2HD   ARG  18          1HD       ARG  18  23.822  -0.522  -0.887
  119    HE   ARG  18           HE       ARG  18  24.194  -0.035   1.845
  120   1HH1  ARG  18          1HH2      ARG  18  25.187  -2.589   2.425
  121   2HH1  ARG  18          2HH2      ARG  18  26.813  -2.616   1.832
  122   1HH2  ARG  18          1HH1      ARG  18  27.481  -1.024   0.296
  123   2HH2  ARG  18          2HH1      ARG  18  26.337   0.164  -0.236
  124    H    CYS  19           H        CYS  19  21.251   3.871  -0.735
  125    HA   CYS  19           HA       CYS  19  19.619   3.459  -3.100
  126   1HB   CYS  19          2HB       CYS  19  20.218   5.657  -1.980
  127   2HB   CYS  19          1HB       CYS  19  21.777   5.551  -2.741
  128    H    GLY  20           H        GLY  20  20.292   1.689  -4.314
  129   1HA   GLY  20          2HA       GLY  20  23.073   1.331  -5.130
  130   2HA   GLY  20          1HA       GLY  20  21.683   0.397  -5.692
  131    H    ARG  21           H        ARG  21  23.259   3.517  -6.038
  132    HA   ARG  21           HA       ARG  21  21.726   4.380  -8.293
  133   1HB   ARG  21          2HB       ARG  21  23.511   6.197  -8.359
  134   2HB   ARG  21          1HB       ARG  21  22.660   6.030  -6.845
  135   1HG   ARG  21          2HG       ARG  21  24.518   5.362  -5.689
  136   2HG   ARG  21          1HG       ARG  21  25.090   4.320  -6.977
  137   1HD   ARG  21          2HD       ARG  21  26.689   6.140  -6.681
  138   2HD   ARG  21          1HD       ARG  21  25.875   6.370  -8.227
  139    HE   ARG  21           HE       ARG  21  24.620   7.761  -5.961
  140   1HH1  ARG  21          2HH1      ARG  21  24.063   9.021  -8.362
  141   2HH1  ARG  21          1HH1      ARG  21  25.297  10.216  -8.590
  142   1HH2  ARG  21          1HH2      ARG  21  27.458   8.713  -6.279
  143   2HH2  ARG  21          2HH2      ARG  21  27.273  10.033  -7.384
  144    H    GLY  22           H        GLY  22  23.289   1.784  -8.533
  145   1HA   GLY  22          2HA       GLY  22  25.308   2.238 -10.590
  146   2HA   GLY  22          1HA       GLY  22  24.671   0.679 -10.069
  147    H    ASN  23           H        ASN  23  23.590  -0.357 -11.595
  148    HA   ASN  23           HA       ASN  23  21.591   0.969 -13.253
  149   1HB   ASN  23          2HB       ASN  23  23.644   1.464 -14.544
  150   2HB   ASN  23          1HB       ASN  23  24.050  -0.248 -14.583
  151   1HD2  ASN  23          2HD2      ASN  23  21.620  -1.042 -17.061
  152   2HD2  ASN  23          1HD2      ASN  23  22.624  -1.676 -15.847
  153    HA   PRO  24           HA       PRO  24  19.703   0.460 -13.998
  154   1HB   PRO  24          2HB       PRO  24  17.417  -0.563 -12.764
  155   2HB   PRO  24          1HB       PRO  24  17.803  -0.644 -14.474
  156   1HG   PRO  24          2HG       PRO  24  17.890  -2.813 -12.476
  157   2HG   PRO  24          1HG       PRO  24  17.912  -2.934 -14.231
  158   1HD   PRO  24          2HD       PRO  24  20.151  -3.271 -12.461
  159   2HD   PRO  24          1HD       PRO  24  20.208  -3.214 -14.231
  160    H    GLN  25           H        GLN  25  19.240   2.202 -12.735
  161    HA   GLN  25           HA       GLN  25  20.316   2.345 -10.077
  162   1HB   GLN  25          2HB       GLN  25  18.458   4.221 -11.613
  163   2HB   GLN  25          1HB       GLN  25  19.206   4.637 -10.077
  164   1HG   GLN  25          2HG       GLN  25  21.456   4.342 -11.056
  165   2HG   GLN  25          1HG       GLN  25  20.755   3.823 -12.584
  166   1HE2  GLN  25          2HE2      GLN  25  19.746   7.113 -13.546
  167   2HE2  GLN  25          1HE2      GLN  25  19.368   5.468 -13.732
  168    H    LYS  26           H        LYS  26  19.442   1.425  -8.393
  169    HA   LYS  26           HA       LYS  26  16.670   1.819  -7.617
  170   1HB   LYS  26          2HB       LYS  26  17.520  -0.674  -8.970
  171   2HB   LYS  26          1HB       LYS  26  16.768  -0.986  -7.423
  172   1HG   LYS  26          2HG       LYS  26  14.734  -0.247  -8.062
  173   2HG   LYS  26          1HG       LYS  26  15.329   1.044  -9.067
  174   1HD   LYS  26          2HD       LYS  26  16.132  -1.069 -10.594
  175   2HD   LYS  26          1HD       LYS  26  14.781  -1.820  -9.764
  176   1HE   LYS  26          2HE       LYS  26  13.788  -0.865 -11.699
  177   2HE   LYS  26          1HE       LYS  26  13.434   0.319 -10.451
  178   1HZ   LYS  26          1HZ       LYS  26  15.599   1.409 -11.188
  179   2HZ   LYS  26          3HZ       LYS  26  15.474   0.436 -12.570
  180   3HZ   LYS  26          2HZ       LYS  26  14.252   1.554 -12.204
  181    H    CYS  27           H        CYS  27  16.220   1.142  -5.408
  182    HA   CYS  27           HA       CYS  27  18.622   1.195  -3.791
  183   1HB   CYS  27          2HB       CYS  27  15.736   0.806  -2.845
  184   2HB   CYS  27          1HB       CYS  27  17.139   1.097  -1.898
  185    H    ILE  28           H        ILE  28  19.302  -0.476  -2.487
  186    HA   ILE  28           HA       ILE  28  18.069  -3.167  -2.826
  187    HB   ILE  28           HB       ILE  28  20.360  -4.101  -2.980
  188   1HG1  ILE  28          2HG1      ILE  28  21.391  -2.073  -1.710
  189   2HG1  ILE  28          1HG1      ILE  28  22.299  -2.847  -2.943
  190   1HG2  ILE  28          3HG2      ILE  28  19.671  -2.055  -5.123
  191   2HG2  ILE  28          2HG2      ILE  28  20.977  -3.218  -5.282
  192   3HG2  ILE  28          1HG2      ILE  28  19.322  -3.773  -5.106
  193   1HD1  ILE  28          1HD1      ILE  28  20.715  -0.564  -3.928
  194   2HD1  ILE  28          3HD1      ILE  28  21.958  -0.175  -2.752
  195   3HD1  ILE  28          2HD1      ILE  28  22.386  -1.024  -4.228
  196    H    GLY  29           H        GLY  29  19.579  -4.530  -1.092
  197   1HA   GLY  29          2HA       GLY  29  19.070  -3.071   1.415
  198   2HA   GLY  29          1HA       GLY  29  19.179  -4.780   1.294
  199    H    ALA  30           H        ALA  30  20.520  -2.664   2.902
  200    HA   ALA  30           HA       ALA  30  23.381  -2.840   2.234
  201   1HB   ALA  30          1HB       ALA  30  21.735  -1.006   3.711
  202   2HB   ALA  30          3HB       ALA  30  22.787  -1.748   4.900
  203   3HB   ALA  30          2HB       ALA  30  23.475  -0.919   3.517
  204    H    HIS  31           H        HIS  31  21.007  -3.815   4.546
  205    HA   HIS  31           HA       HIS  31  22.791  -5.776   5.901
  206   1HB   HIS  31          2HB       HIS  31  20.130  -4.439   6.494
  207   2HB   HIS  31          1HB       HIS  31  20.339  -6.060   7.140
  208    HD1  HIS  31           HD1      HIS  31  21.398  -2.642   7.743
  209    HD2  HIS  31           HD2      HIS  31  22.634  -6.352   8.911
  210    HE1  HIS  31           HE1      HIS  31  22.888  -2.301   9.681
  211   1HN   CGU  32           HN       CGU  32  22.759  -6.428   3.511
  212    HA   CGU  32           HA       CGU  32  21.121  -8.840   3.240
  213   1HB   CGU  32          1HB       CGU  32  21.075  -6.602   1.146
  214   2HB   CGU  32          2HB       CGU  32  19.789  -6.996   2.261
  215    HG   CGU  32           HG       CGU  32  19.966  -9.396   1.238
  216    H    ASP  33           H        ASP  33  22.856 -10.019   3.298
  217    HA   ASP  33           HA       ASP  33  24.923  -9.727   1.156
  218   1HB   ASP  33          2HB       ASP  33  25.630  -9.140   3.610
  219   2HB   ASP  33          1HB       ASP  33  25.472 -10.852   3.946
  220    H    VAL  34           H        VAL  34  22.695 -11.075   0.651
  221    HA   VAL  34           HA       VAL  34  23.532 -13.943   0.765
  222    HB   VAL  34           HB       VAL  34  21.661 -13.480   2.357
  223   1HG1  VAL  34          1HG1      VAL  34  20.596 -11.592   1.110
  224   2HG1  VAL  34          3HG1      VAL  34  20.021 -12.728  -0.106
  225   3HG1  VAL  34          2HG1      VAL  34  19.436 -12.835   1.545
  226   1HG2  VAL  34          2HG2      VAL  34  21.871 -15.703   1.117
  227   2HG2  VAL  34          1HG2      VAL  34  20.268 -15.336   1.725
  228   3HG2  VAL  34          3HG2      VAL  34  20.624 -15.132   0.021
   
  No H/Q in entry =         228
  Start of MODEL    7
    1   1H    ALA   1          3H        ALA   1   7.895  10.226   0.725
    2   2H    ALA   1          2H        ALA   1   6.785  10.320   2.009
    3   3H    ALA   1          1H        ALA   1   8.452  10.234   2.330
    4    HA   ALA   1           HA       ALA   1   7.611   8.098   2.750
    5   1HB   ALA   1          3HB       ALA   1   6.263   8.407   0.030
    6   2HB   ALA   1          2HB       ALA   1   6.312   6.893   0.920
    7   3HB   ALA   1          1HB       ALA   1   5.460   8.278   1.585
    8    H    CYS   2           H        CYS   2   9.421   7.025   2.695
    9    HA   CYS   2           HA       CYS   2  11.570   7.275   0.886
   10   1HB   CYS   2          2HB       CYS   2  12.365   5.156   2.023
   11   2HB   CYS   2          1HB       CYS   2  11.996   6.449   3.109
   12    H    SER   3           H        SER   3  12.593   5.116   0.050
   13    HA   SER   3           HA       SER   3  10.756   3.985  -2.018
   14   1HB   SER   3          2HB       SER   3  13.665   4.736  -1.952
   15   2HB   SER   3          1HB       SER   3  13.245   3.342  -2.939
   16    HG   SER   3           HG       SER   3  11.759   4.518  -4.006
   17    H    GLY   4           H        GLY   4  10.862   1.706  -2.475
   18   1HA   GLY   4          2HA       GLY   4  11.651   0.067  -0.113
   19   2HA   GLY   4          1HA       GLY   4  10.459  -0.380  -1.332
   20    H    ARG   5           H        ARG   5  12.258  -2.267  -0.882
   21    HA   ARG   5           HA       ARG   5  14.698  -2.060  -2.412
   22   1HB   ARG   5          2HB       ARG   5  14.204  -3.704  -0.527
   23   2HB   ARG   5          1HB       ARG   5  13.184  -4.588  -1.640
   24   1HG   ARG   5          2HG       ARG   5  15.285  -4.674  -3.202
   25   2HG   ARG   5          1HG       ARG   5  16.189  -4.090  -1.817
   26   1HD   ARG   5          2HD       ARG   5  16.316  -6.532  -1.894
   27   2HD   ARG   5          1HD       ARG   5  15.349  -6.065  -0.494
   28    HE   ARG   5           HE       ARG   5  13.395  -6.388  -2.323
   29   1HH1  ARG   5          2HH1      ARG   5  14.852  -7.922  -4.213
   30   2HH1  ARG   5          1HH1      ARG   5  14.762  -9.554  -3.638
   31   1HH2  ARG   5          1HH2      ARG   5  13.840  -8.565  -0.403
   32   2HH2  ARG   5          2HH2      ARG   5  14.173  -9.927  -1.422
   33    H    GLY   6           H        GLY   6  14.227  -1.309  -4.388
   34   1HA   GLY   6          2HA       GLY   6  14.172  -2.530  -6.672
   35   2HA   GLY   6          1HA       GLY   6  12.497  -2.885  -6.250
   36    H    SER   7           H        SER   7  12.921  -0.085  -4.805
   37    HA   SER   7           HA       SER   7  11.812   1.531  -7.033
   38   1HB   SER   7          2HB       SER   7  12.015   2.076  -4.025
   39   2HB   SER   7          1HB       SER   7  11.181   3.121  -5.187
   40    HG   SER   7           HG       SER   7  10.601   0.474  -4.420
   41    H    ARG   8           H        ARG   8  12.764   3.679  -7.343
   42    HA   ARG   8           HA       ARG   8  15.683   3.586  -7.274
   43   1HB   ARG   8          2HB       ARG   8  15.592   5.583  -8.638
   44   2HB   ARG   8          1HB       ARG   8  14.235   4.610  -9.162
   45   1HG   ARG   8          2HG       ARG   8  12.730   5.931  -7.667
   46   2HG   ARG   8          1HG       ARG   8  14.074   6.920  -7.175
   47   1HD   ARG   8          2HD       ARG   8  14.300   7.215  -9.889
   48   2HD   ARG   8          1HD       ARG   8  12.552   7.040  -9.714
   49    HE   ARG   8           HE       ARG   8  13.494   8.811  -7.699
   50   1HH1  ARG   8          2HH1      ARG   8  11.280   9.184  -9.808
   51   2HH1  ARG   8          1HH1      ARG   8  11.840  10.617 -10.602
   52   1HH2  ARG   8          1HH2      ARG   8  15.057  10.352  -9.232
   53   2HH2  ARG   8          2HH2      ARG   8  14.038  11.304 -10.260
   54    H    CYS   9           H        CYS   9  16.299   6.212  -6.868
   55    HA   CYS   9           HA       CYS   9  15.402   7.061  -4.267
   56   1HB   CYS   9          2HB       CYS   9  17.966   6.939  -3.489
   57   2HB   CYS   9          1HB       CYS   9  16.836   5.650  -3.220
   58    HA   HYP  10           HA       HYP  10  15.435   8.686  -3.111
   59   1HB   HYP  10          1HB       HYP  10  15.523  10.724  -2.234
   60   2HB   HYP  10          2HB       HYP  10  14.154  11.186  -3.216
   61   1HD   HYP  10          1HD1      HYP  10  17.798  10.825  -5.230
   62   2HD   HYP  10          2HD1      HYP  10  16.340  11.003  -6.213
   63    HOD  HYP  10           HD2      HYP  10  17.569  11.227  -2.955
   64    HG   HYP  10           HG       HYP  10  15.633  12.541  -4.567
   65    HA   HYP  11           HA       HYP  11  12.893  10.039  -2.024
   66   1HB   HYP  11          1HB       HYP  11  10.812   9.436  -1.456
   67   2HB   HYP  11          2HB       HYP  11  11.416   7.839  -1.040
   68   1HD   HYP  11          1HD1      HYP  11  10.992   9.201  -4.834
   69   2HD   HYP  11          2HD1      HYP  11  11.622   7.552  -4.981
   70    HOD  HYP  11           HD2      HYP  11   9.076   8.488  -2.211
   71    HG   HYP  11           HG       HYP  11  10.563   6.875  -2.978
   72    H    GLN  12           H        GLN  12  14.355   9.696  -0.465
   73    HA   GLN  12           HA       GLN  12  16.462   7.913  -0.628
   74   1HB   GLN  12          2HB       GLN  12  15.157   9.154   1.828
   75   2HB   GLN  12          1HB       GLN  12  16.677   8.279   1.910
   76   1HG   GLN  12          2HG       GLN  12  17.698   9.860   0.278
   77   2HG   GLN  12          1HG       GLN  12  16.173  10.727   0.146
   78   1HE2  GLN  12          2HE2      GLN  12  18.214  10.969   3.716
   79   2HE2  GLN  12          1HE2      GLN  12  18.306   9.541   2.803
   80    H    CYS  13           H        CYS  13  16.696   5.771  -0.308
   81    HA   CYS  13           HA       CYS  13  14.521   4.032  -0.010
   82   1HB   CYS  13          2HB       CYS  13  17.160   3.108   1.028
   83   2HB   CYS  13          1HB       CYS  13  16.021   2.338  -0.027
   84    H    CYS  14           H        CYS  14  13.580   2.992   1.554
   85    HA   CYS  14           HA       CYS  14  13.261   4.117   4.103
   86   1HB   CYS  14          2HB       CYS  14  12.680   1.292   3.181
   87   2HB   CYS  14          1HB       CYS  14  11.994   2.033   4.594
   88    H    MET  15           H        MET  15  13.512   2.850   6.179
   89    HA   MET  15           HA       MET  15  16.224   2.539   6.811
   90   1HB   MET  15          2HB       MET  15  14.161   2.944   8.346
   91   2HB   MET  15          1HB       MET  15  13.955   1.209   8.342
   92   1HG   MET  15          2HG       MET  15  16.737   1.848   8.906
   93   2HG   MET  15          1HG       MET  15  15.714   2.798   9.936
   94   1HE   MET  15          3HE       MET  15  17.365  -0.255   9.059
   95   2HE   MET  15          2HE       MET  15  16.980  -1.431  10.283
   96   3HE   MET  15          1HE       MET  15  15.907  -1.249   8.887
   97    H    GLY  16           H        GLY  16  17.602   0.902   6.669
   98   1HA   GLY  16          2HA       GLY  16  18.242  -1.414   6.795
   99   2HA   GLY  16          1HA       GLY  16  16.652  -1.853   6.188
  100    H    LEU  17           H        LEU  17  16.790   0.321   4.130
  101    HA   LEU  17           HA       LEU  17  18.342  -1.178   2.164
  102   1HB   LEU  17          2HB       LEU  17  16.459   1.184   1.847
  103   2HB   LEU  17          1HB       LEU  17  17.182   0.360   0.494
  104    HG   LEU  17           HG       LEU  17  15.103  -0.669   2.439
  105   1HD1  LEU  17          3HD1      LEU  17  14.335   0.823   0.668
  106   2HD1  LEU  17          2HD1      LEU  17  14.973  -0.278  -0.544
  107   3HD1  LEU  17          1HD1      LEU  17  13.669  -0.792   0.524
  108   1HD2  LEU  17          3HD2      LEU  17  16.738  -2.541   1.819
  109   2HD2  LEU  17          2HD2      LEU  17  15.088  -2.812   1.314
  110   3HD2  LEU  17          1HD2      LEU  17  16.278  -2.284   0.138
  111    H    ARG  18           H        ARG  18  19.401   0.049   0.499
  112    HA   ARG  18           HA       ARG  18  20.751   2.566   1.248
  113   1HB   ARG  18          2HB       ARG  18  22.791   1.165   0.040
  114   2HB   ARG  18          1HB       ARG  18  22.611   1.370   1.766
  115   1HG   ARG  18          2HG       ARG  18  21.774  -0.737   2.119
  116   2HG   ARG  18          1HG       ARG  18  21.253  -0.991   0.471
  117   1HD   ARG  18          2HD       ARG  18  24.172  -0.862   1.359
  118   2HD   ARG  18          1HD       ARG  18  23.304  -2.327   0.895
  119    HE   ARG  18           HE       ARG  18  23.030  -0.446  -1.195
  120   1HH1  ARG  18          1HH2      ARG  18  24.228  -3.372  -0.796
  121   2HH1  ARG  18          2HH2      ARG  18  25.721  -3.172  -1.652
  122   1HH2  ARG  18          2HH1      ARG  18  25.395   0.317  -1.784
  123   2HH2  ARG  18          1HH1      ARG  18  26.400  -1.021  -2.232
  124    H    CYS  19           H        CYS  19  21.255   3.708  -0.551
  125    HA   CYS  19           HA       CYS  19  19.709   3.081  -2.945
  126   1HB   CYS  19          2HB       CYS  19  19.822   5.343  -2.081
  127   2HB   CYS  19          1HB       CYS  19  21.542   5.400  -2.351
  128    H    GLY  20           H        GLY  20  20.414   1.611  -4.321
  129   1HA   GLY  20          2HA       GLY  20  23.259   1.296  -5.003
  130   2HA   GLY  20          1HA       GLY  20  21.903   0.364  -5.664
  131    H    ARG  21           H        ARG  21  23.908   3.107  -6.093
  132    HA   ARG  21           HA       ARG  21  22.331   4.607  -7.888
  133   1HB   ARG  21          2HB       ARG  21  24.749   4.998  -6.697
  134   2HB   ARG  21          1HB       ARG  21  25.306   4.589  -8.308
  135   1HG   ARG  21          2HG       ARG  21  23.790   6.345  -9.257
  136   2HG   ARG  21          1HG       ARG  21  23.247   6.730  -7.633
  137   1HD   ARG  21          2HD       ARG  21  25.847   7.080  -7.163
  138   2HD   ARG  21          1HD       ARG  21  25.917   7.288  -8.912
  139    HE   ARG  21           HE       ARG  21  23.796   8.898  -8.115
  140   1HH1  ARG  21          1HH2      ARG  21  25.348   9.152  -5.573
  141   2HH1  ARG  21          2HH2      ARG  21  26.362  10.520  -5.892
  142   1HH2  ARG  21          2HH1      ARG  21  25.825  10.357  -9.352
  143   2HH2  ARG  21          1HH1      ARG  21  26.639  11.221  -8.090
  144    H    GLY  22           H        GLY  22  22.469   4.869 -10.099
  145   1HA   GLY  22          2HA       GLY  22  23.806   3.554 -12.094
  146   2HA   GLY  22          1HA       GLY  22  22.553   2.389 -11.636
  147    H    ASN  23           H        ASN  23  21.401   2.598 -13.550
  148    HA   ASN  23           HA       ASN  23  19.578   4.870 -13.665
  149   1HB   ASN  23          2HB       ASN  23  21.699   5.586 -14.951
  150   2HB   ASN  23          1HB       ASN  23  21.275   4.378 -16.151
  151   1HD2  ASN  23          2HD2      ASN  23  18.195   6.176 -17.035
  152   2HD2  ASN  23          1HD2      ASN  23  18.669   4.587 -16.675
  153    HA   PRO  24           HA       PRO  24  17.589   4.850 -13.503
  154   1HB   PRO  24          2HB       PRO  24  15.513   3.264 -12.508
  155   2HB   PRO  24          1HB       PRO  24  15.407   4.458 -13.791
  156   1HG   PRO  24          2HG       PRO  24  15.342   1.528 -14.033
  157   2HG   PRO  24          1HG       PRO  24  14.929   2.738 -15.239
  158   1HD   PRO  24          2HD       PRO  24  17.325   1.145 -15.145
  159   2HD   PRO  24          1HD       PRO  24  16.969   2.461 -16.279
  160    H    GLN  25           H        GLN  25  18.052   5.170 -11.383
  161    HA   GLN  25           HA       GLN  25  19.776   3.403  -9.952
  162   1HB   GLN  25          2HB       GLN  25  18.025   5.636  -8.821
  163   2HB   GLN  25          1HB       GLN  25  19.424   4.938  -8.022
  164   1HG   GLN  25          2HG       GLN  25  20.913   5.764  -9.794
  165   2HG   GLN  25          1HG       GLN  25  19.547   6.368 -10.718
  166   1HE2  GLN  25          2HE2      GLN  25  21.214   8.838  -8.156
  167   2HE2  GLN  25          1HE2      GLN  25  21.968   7.514  -8.901
  168    H    LYS  26           H        LYS  26  19.352   2.121  -8.059
  169    HA   LYS  26           HA       LYS  26  16.551   1.575  -7.329
  170   1HB   LYS  26          2HB       LYS  26  18.321  -0.394  -8.790
  171   2HB   LYS  26          1HB       LYS  26  17.162  -0.991  -7.622
  172   1HG   LYS  26          2HG       LYS  26  15.322   0.207  -8.863
  173   2HG   LYS  26          1HG       LYS  26  16.502   0.719 -10.053
  174   1HD   LYS  26          2HD       LYS  26  15.578  -1.182 -11.052
  175   2HD   LYS  26          1HD       LYS  26  17.076  -1.786 -10.375
  176   1HE   LYS  26          2HE       LYS  26  14.502  -1.943  -8.779
  177   2HE   LYS  26          1HE       LYS  26  14.872  -3.153  -9.991
  178   1HZ   LYS  26          2HZ       LYS  26  17.179  -3.009  -8.645
  179   2HZ   LYS  26          1HZ       LYS  26  16.053  -2.726  -7.406
  180   3HZ   LYS  26          3HZ       LYS  26  15.949  -4.140  -8.343
  181    H    CYS  27           H        CYS  27  16.371   1.286  -5.247
  182    HA   CYS  27           HA       CYS  27  18.631   1.090  -3.514
  183   1HB   CYS  27          2HB       CYS  27  15.684   0.708  -2.733
  184   2HB   CYS  27          1HB       CYS  27  17.041   1.020  -1.720
  185    H    ILE  28           H        ILE  28  19.257  -0.543  -2.251
  186    HA   ILE  28           HA       ILE  28  18.152  -3.285  -2.641
  187    HB   ILE  28           HB       ILE  28  20.575  -4.049  -2.496
  188   1HG1  ILE  28          2HG1      ILE  28  21.160  -1.627  -1.498
  189   2HG1  ILE  28          1HG1      ILE  28  22.334  -2.623  -2.292
  190   1HG2  ILE  28          1HG2      ILE  28  19.790  -2.323  -4.868
  191   2HG2  ILE  28          3HG2      ILE  28  21.164  -3.421  -4.864
  192   3HG2  ILE  28          2HG2      ILE  28  19.537  -4.047  -4.667
  193   1HD1  ILE  28          1HD1      ILE  28  20.730  -0.583  -3.816
  194   2HD1  ILE  28          3HD1      ILE  28  22.201  -0.165  -2.956
  195   3HD1  ILE  28          2HD1      ILE  28  22.255  -1.344  -4.259
  196    H    GLY  29           H        GLY  29  19.737  -4.497  -0.746
  197   1HA   GLY  29          2HA       GLY  29  18.978  -3.021   1.706
  198   2HA   GLY  29          1HA       GLY  29  19.011  -4.749   1.601
  199    H    ALA  30           H        ALA  30  20.326  -2.808   3.378
  200    HA   ALA  30           HA       ALA  30  23.144  -2.662   2.912
  201   1HB   ALA  30          3HB       ALA  30  21.361  -2.423   5.329
  202   2HB   ALA  30          2HB       ALA  30  23.108  -2.452   5.541
  203   3HB   ALA  30          1HB       ALA  30  22.361  -1.202   4.562
  204    H    HIS  31           H        HIS  31  21.082  -5.126   4.135
  205    HA   HIS  31           HA       HIS  31  23.334  -6.844   5.004
  206   1HB   HIS  31          2HB       HIS  31  21.114  -6.581   6.327
  207   2HB   HIS  31          1HB       HIS  31  20.342  -7.496   5.038
  208    HD1  HIS  31           HD1      HIS  31  20.618  -9.988   5.231
  209    HD2  HIS  31           HD2      HIS  31  23.264  -8.080   7.684
  210    HE1  HIS  31           HE1      HIS  31  21.707 -11.745   6.576
  211   1HN   CGU  32           HN       CGU  32  22.994  -6.068   2.313
  212    HA   CGU  32           HA       CGU  32  23.407  -8.570   0.952
  213   1HB   CGU  32          1HB       CGU  32  20.850  -7.002   0.465
  214   2HB   CGU  32          2HB       CGU  32  20.976  -8.672   0.915
  215    HG   CGU  32           HG       CGU  32  22.496  -8.151  -1.574
  216    H    ASP  33           H        ASP  33  25.330  -7.571   0.452
  217    HA   ASP  33           HA       ASP  33  25.238  -5.096  -1.200
  218   1HB   ASP  33          2HB       ASP  33  27.385  -6.533   0.419
  219   2HB   ASP  33          1HB       ASP  33  27.815  -5.293  -0.752
  220    H    VAL  34           H        VAL  34  24.118  -7.076  -2.325
  221    HA   VAL  34           HA       VAL  34  25.942  -7.948  -4.506
  222    HB   VAL  34           HB       VAL  34  23.683  -9.739  -3.500
  223   1HG1  VAL  34          1HG1      VAL  34  26.185 -10.162  -5.186
  224   2HG1  VAL  34          3HG1      VAL  34  25.206 -11.492  -4.584
  225   3HG1  VAL  34          2HG1      VAL  34  24.509 -10.321  -5.692
  226   1HG2  VAL  34          1HG2      VAL  34  26.566  -9.738  -2.500
  227   2HG2  VAL  34          3HG2      VAL  34  25.116  -9.501  -1.535
  228   3HG2  VAL  34          2HG2      VAL  34  25.441 -11.065  -2.255
   
  No H/Q in entry =         228
  Start of MODEL    8
    1   1H    ALA   1          2H        ALA   1   7.228   9.356   0.510
    2   2H    ALA   1          1H        ALA   1   5.848   9.281   1.502
    3   3H    ALA   1          3H        ALA   1   7.228  10.126   2.024
    4    HA   ALA   1           HA       ALA   1   7.683   8.267   3.137
    5   1HB   ALA   1          3HB       ALA   1   5.441   7.292   2.525
    6   2HB   ALA   1          2HB       ALA   1   6.137   6.694   1.027
    7   3HB   ALA   1          1HB       ALA   1   6.698   6.066   2.571
    8    H    CYS   2           H        CYS   2   9.294   6.691   3.003
    9    HA   CYS   2           HA       CYS   2  11.421   7.150   1.201
   10   1HB   CYS   2          2HB       CYS   2  12.337   5.028   2.221
   11   2HB   CYS   2          1HB       CYS   2  11.881   6.219   3.390
   12    H    SER   3           H        SER   3  12.528   5.106   0.172
   13    HA   SER   3           HA       SER   3  10.633   4.021  -1.877
   14   1HB   SER   3          2HB       SER   3  13.602   4.687  -1.915
   15   2HB   SER   3          1HB       SER   3  12.950   3.519  -3.068
   16    HG   SER   3           HG       SER   3  11.729   6.027  -2.584
   17    H    GLY   4           H        GLY   4  10.763   1.814  -2.431
   18   1HA   GLY   4          2HA       GLY   4  11.745   0.058  -0.225
   19   2HA   GLY   4          1HA       GLY   4  10.481  -0.356  -1.373
   20    H    ARG   5           H        ARG   5  12.413  -2.155  -1.014
   21    HA   ARG   5           HA       ARG   5  14.681  -1.885  -2.757
   22   1HB   ARG   5          2HB       ARG   5  13.980  -3.640  -0.785
   23   2HB   ARG   5          1HB       ARG   5  13.576  -4.635  -2.167
   24   1HG   ARG   5          2HG       ARG   5  15.830  -4.491  -3.040
   25   2HG   ARG   5          1HG       ARG   5  16.241  -3.197  -1.927
   26   1HD   ARG   5          2HD       ARG   5  17.215  -5.178  -1.002
   27   2HD   ARG   5          1HD       ARG   5  15.797  -4.849  -0.011
   28    HE   ARG   5           HE       ARG   5  14.791  -6.530  -1.940
   29   1HH1  ARG   5          2HH1      ARG   5  17.629  -7.486  -2.217
   30   2HH1  ARG   5          1HH1      ARG   5  17.692  -8.759  -1.041
   31   1HH2  ARG   5          1HH2      ARG   5  14.757  -7.784   0.555
   32   2HH2  ARG   5          2HH2      ARG   5  16.044  -8.948   0.520
   33    H    GLY   6           H        GLY   6  14.094  -1.204  -4.690
   34   1HA   GLY   6          2HA       GLY   6  13.780  -2.620  -6.916
   35   2HA   GLY   6          1HA       GLY   6  12.105  -2.640  -6.357
   36    H    SER   7           H        SER   7  13.044   0.121  -5.133
   37    HA   SER   7           HA       SER   7  12.524   1.781  -7.563
   38   1HB   SER   7          2HB       SER   7  11.623   2.223  -4.659
   39   2HB   SER   7          1HB       SER   7  11.351   3.363  -5.986
   40    HG   SER   7           HG       SER   7   9.601   2.107  -6.065
   41    H    ARG   8           H        ARG   8  13.778   3.627  -7.734
   42    HA   ARG   8           HA       ARG   8  16.372   3.566  -6.416
   43   1HB   ARG   8          2HB       ARG   8  16.844   5.530  -7.885
   44   2HB   ARG   8          1HB       ARG   8  16.159   4.200  -8.777
   45   1HG   ARG   8          2HG       ARG   8  13.942   5.764  -7.819
   46   2HG   ARG   8          1HG       ARG   8  15.117   6.884  -8.444
   47   1HD   ARG   8          2HD       ARG   8  14.634   4.495 -10.192
   48   2HD   ARG   8          1HD       ARG   8  13.275   5.591 -10.012
   49    HE   ARG   8           HE       ARG   8  15.987   6.478 -10.925
   50   1HH1  ARG   8          1HH2      ARG   8  13.731   8.358  -9.978
   51   2HH1  ARG   8          2HH2      ARG   8  13.095   8.881 -11.502
   52   1HH2  ARG   8          2HH1      ARG   8  14.713   6.332 -13.281
   53   2HH2  ARG   8          1HH1      ARG   8  13.665   7.704 -13.421
   54    H    CYS   9           H        CYS   9  17.038   6.133  -6.101
   55    HA   CYS   9           HA       CYS   9  15.206   7.244  -4.093
   56   1HB   CYS   9          2HB       CYS   9  16.787   7.308  -2.415
   57   2HB   CYS   9          1HB       CYS   9  17.225   5.835  -3.208
   58    HA   HYP  10           HA       HYP  10  15.223   8.789  -2.777
   59   1HB   HYP  10          1HB       HYP  10  15.319  10.745  -1.691
   60   2HB   HYP  10          2HB       HYP  10  13.943  11.315  -2.605
   61   1HD   HYP  10          1HD1      HYP  10  17.522  11.145  -4.756
   62   2HD   HYP  10          2HD1      HYP  10  16.008  11.432  -5.624
   63    HOD  HYP  10           HD2      HYP  10  17.492  11.234  -2.589
   64    HG   HYP  10           HG       HYP  10  15.457  12.810  -3.765
   65    HA   HYP  11           HA       HYP  11  12.633  10.041  -1.500
   66   1HB   HYP  11          1HB       HYP  11  10.635   9.255  -0.865
   67   2HB   HYP  11          2HB       HYP  11  11.266   7.615  -0.835
   68   1HD   HYP  11          1HD1      HYP  11  10.737   9.635  -4.307
   69   2HD   HYP  11          2HD1      HYP  11  11.292   8.007  -4.728
   70    HOD  HYP  11           HD2      HYP  11   8.850   8.586  -1.761
   71    HG   HYP  11           HG       HYP  11  10.222   7.071  -2.836
   72    H    GLN  12           H        GLN  12  14.219   9.647  -0.105
   73    HA   GLN  12           HA       GLN  12  16.315   7.889  -0.493
   74   1HB   GLN  12          2HB       GLN  12  15.172   9.111   2.048
   75   2HB   GLN  12          1HB       GLN  12  16.609   8.109   2.113
   76   1HG   GLN  12          2HG       GLN  12  16.308  10.600   0.362
   77   2HG   GLN  12          1HG       GLN  12  17.172  10.546   1.890
   78   1HE2  GLN  12          2HE2      GLN  12  19.245   9.637  -1.328
   79   2HE2  GLN  12          1HE2      GLN  12  17.871  10.616  -1.322
   80    H    CYS  13           H        CYS  13  16.610   5.757  -0.290
   81    HA   CYS  13           HA       CYS  13  14.477   3.968   0.028
   82   1HB   CYS  13          2HB       CYS  13  17.181   3.050   0.894
   83   2HB   CYS  13          1HB       CYS  13  16.004   2.294  -0.128
   84    H    CYS  14           H        CYS  14  13.590   2.931   1.587
   85    HA   CYS  14           HA       CYS  14  13.363   3.923   4.184
   86   1HB   CYS  14          2HB       CYS  14  12.843   1.094   3.253
   87   2HB   CYS  14          1HB       CYS  14  12.133   1.842   4.651
   88    H    MET  15           H        MET  15  13.764   2.736   6.228
   89    HA   MET  15           HA       MET  15  16.506   2.401   6.719
   90   1HB   MET  15          2HB       MET  15  14.619   2.865   8.410
   91   2HB   MET  15          1HB       MET  15  14.270   1.149   8.376
   92   1HG   MET  15          2HG       MET  15  16.808   0.846   8.934
   93   2HG   MET  15          1HG       MET  15  16.783   2.544   9.311
   94   1HE   MET  15          3HE       MET  15  14.777  -0.752  10.056
   95   2HE   MET  15          2HE       MET  15  16.478  -0.943  10.548
   96   3HE   MET  15          1HE       MET  15  15.201  -0.923  11.750
   97    H    GLY  16           H        GLY  16  17.851   0.817   6.385
   98   1HA   GLY  16          2HA       GLY  16  18.487  -1.528   6.579
   99   2HA   GLY  16          1HA       GLY  16  16.890  -1.954   5.980
  100    H    LEU  17           H        LEU  17  16.932   0.194   3.955
  101    HA   LEU  17           HA       LEU  17  18.440  -1.244   1.929
  102   1HB   LEU  17          2HB       LEU  17  16.590   1.152   1.702
  103   2HB   LEU  17          1HB       LEU  17  17.248   0.313   0.323
  104    HG   LEU  17           HG       LEU  17  15.142  -0.593   2.305
  105   1HD1  LEU  17          1HD1      LEU  17  14.459   0.754   0.355
  106   2HD1  LEU  17          3HD1      LEU  17  15.111  -0.483  -0.710
  107   3HD1  LEU  17          2HD1      LEU  17  13.764  -0.854   0.358
  108   1HD2  LEU  17          1HD2      LEU  17  16.697  -2.558   1.924
  109   2HD2  LEU  17          3HD2      LEU  17  15.098  -2.811   1.249
  110   3HD2  LEU  17          2HD2      LEU  17  16.427  -2.373   0.194
  111    H    ARG  18           H        ARG  18  19.439  -0.005   0.221
  112    HA   ARG  18           HA       ARG  18  20.890   2.460   0.951
  113   1HB   ARG  18          2HB       ARG  18  22.805   0.970  -0.447
  114   2HB   ARG  18          1HB       ARG  18  22.778   1.271   1.277
  115   1HG   ARG  18          2HG       ARG  18  21.905  -0.779   1.799
  116   2HG   ARG  18          1HG       ARG  18  21.256  -1.098   0.218
  117   1HD   ARG  18          2HD       ARG  18  23.213  -2.491   0.333
  118   2HD   ARG  18          1HD       ARG  18  23.701  -1.118  -0.653
  119    HE   ARG  18           HE       ARG  18  24.307  -0.335   1.932
  120   1HH1  ARG  18          1HH2      ARG  18  26.016  -1.399  -0.541
  121   2HH1  ARG  18          2HH2      ARG  18  27.134  -2.409   0.318
  122   1HH2  ARG  18          2HH1      ARG  18  25.260  -2.308   3.277
  123   2HH2  ARG  18          1HH1      ARG  18  26.693  -2.936   2.532
  124    H    CYS  19           H        CYS  19  21.179   3.706  -0.742
  125    HA   CYS  19           HA       CYS  19  19.610   3.259  -3.142
  126   1HB   CYS  19          2HB       CYS  19  20.058   5.458  -1.956
  127   2HB   CYS  19          1HB       CYS  19  21.641   5.453  -2.671
  128    H    GLY  20           H        GLY  20  20.391   1.589  -4.407
  129   1HA   GLY  20          2HA       GLY  20  23.222   1.381  -5.124
  130   2HA   GLY  20          1HA       GLY  20  21.904   0.386  -5.743
  131    H    ARG  21           H        ARG  21  23.813   3.196  -6.293
  132    HA   ARG  21           HA       ARG  21  22.226   4.405  -8.328
  133   1HB   ARG  21          2HB       ARG  21  24.205   5.453  -7.068
  134   2HB   ARG  21          1HB       ARG  21  25.262   4.523  -8.109
  135   1HG   ARG  21          2HG       ARG  21  23.653   5.667 -10.015
  136   2HG   ARG  21          1HG       ARG  21  23.489   6.872  -8.758
  137   1HD   ARG  21          2HD       ARG  21  26.304   6.248  -8.950
  138   2HD   ARG  21          1HD       ARG  21  25.696   6.454 -10.585
  139    HE   ARG  21           HE       ARG  21  24.913   8.699  -9.949
  140   1HH1  ARG  21          2HH1      ARG  21  24.886   8.162  -6.981
  141   2HH1  ARG  21          1HH1      ARG  21  26.273   9.053  -6.446
  142   1HH2  ARG  21          1HH2      ARG  21  27.583   9.336  -9.684
  143   2HH2  ARG  21          2HH2      ARG  21  27.840   9.735  -8.018
  144    H    GLY  22           H        GLY  22  21.696   3.470 -10.159
  145   1HA   GLY  22          2HA       GLY  22  23.713   2.002 -11.777
  146   2HA   GLY  22          1HA       GLY  22  22.212   1.170 -11.367
  147    H    ASN  23           H        ASN  23  21.365   1.060 -13.401
  148    HA   ASN  23           HA       ASN  23  20.150   3.493 -14.449
  149   1HB   ASN  23          2HB       ASN  23  22.544   3.434 -15.389
  150   2HB   ASN  23          1HB       ASN  23  22.062   2.023 -16.314
  151   1HD2  ASN  23          2HD2      ASN  23  20.538   5.711 -17.261
  152   2HD2  ASN  23          1HD2      ASN  23  21.258   5.451 -15.744
  153    HA   PRO  24           HA       PRO  24  18.198   3.682 -14.198
  154   1HB   PRO  24          2HB       PRO  24  15.812   2.744 -13.188
  155   2HB   PRO  24          1HB       PRO  24  16.019   3.532 -14.746
  156   1HG   PRO  24          2HG       PRO  24  15.571   0.648 -14.178
  157   2HG   PRO  24          1HG       PRO  24  15.258   1.542 -15.659
  158   1HD   PRO  24          2HD       PRO  24  17.475  -0.203 -15.167
  159   2HD   PRO  24          1HD       PRO  24  17.298   0.886 -16.552
  160    H    GLN  25           H        GLN  25  18.773   4.210 -12.173
  161    HA   GLN  25           HA       GLN  25  20.022   2.482 -10.351
  162   1HB   GLN  25          2HB       GLN  25  18.494   4.866  -9.283
  163   2HB   GLN  25          1HB       GLN  25  20.052   4.260  -8.792
  164   1HG   GLN  25          2HG       GLN  25  21.059   5.781 -10.124
  165   2HG   GLN  25          1HG       GLN  25  20.366   5.024 -11.540
  166   1HE2  GLN  25          2HE2      GLN  25  19.271   8.668 -11.019
  167   2HE2  GLN  25          1HE2      GLN  25  20.785   7.950 -10.755
  168    H    LYS  26           H        LYS  26  19.390   1.735  -8.246
  169    HA   LYS  26           HA       LYS  26  16.578   1.574  -7.519
  170   1HB   LYS  26          2HB       LYS  26  17.853  -0.579  -9.088
  171   2HB   LYS  26          1HB       LYS  26  17.178  -1.187  -7.593
  172   1HG   LYS  26          2HG       LYS  26  15.012  -0.075  -8.139
  173   2HG   LYS  26          1HG       LYS  26  15.656   0.423  -9.684
  174   1HD   LYS  26          2HD       LYS  26  15.607  -2.496  -8.805
  175   2HD   LYS  26          1HD       LYS  26  14.291  -1.762  -9.696
  176   1HE   LYS  26          2HE       LYS  26  17.177  -2.028 -10.658
  177   2HE   LYS  26          1HE       LYS  26  15.776  -2.883 -11.282
  178   1HZ   LYS  26          1HZ       LYS  26  15.035  -0.305 -11.483
  179   2HZ   LYS  26          3HZ       LYS  26  16.690  -0.234 -11.849
  180   3HZ   LYS  26          2HZ       LYS  26  15.669  -1.256 -12.739
  181    H    CYS  27           H        CYS  27  16.263   1.097  -5.361
  182    HA   CYS  27           HA       CYS  27  18.595   1.030  -3.692
  183   1HB   CYS  27          2HB       CYS  27  15.689   0.605  -2.815
  184   2HB   CYS  27          1HB       CYS  27  17.066   0.975  -1.845
  185    H    ILE  28           H        ILE  28  19.315  -0.611  -2.475
  186    HA   ILE  28           HA       ILE  28  18.198  -3.366  -2.817
  187    HB   ILE  28           HB       ILE  28  20.604  -4.133  -2.699
  188   1HG1  ILE  28          2HG1      ILE  28  21.214  -1.707  -1.694
  189   2HG1  ILE  28          1HG1      ILE  28  22.388  -2.688  -2.506
  190   1HG2  ILE  28          2HG2      ILE  28  19.793  -2.387  -5.054
  191   2HG2  ILE  28          1HG2      ILE  28  21.194  -3.450  -5.068
  192   3HG2  ILE  28          3HG2      ILE  28  19.587  -4.119  -4.869
  193   1HD1  ILE  28          2HD1      ILE  28  20.762  -0.644  -3.997
  194   2HD1  ILE  28          1HD1      ILE  28  22.238  -0.230  -3.132
  195   3HD1  ILE  28          3HD1      ILE  28  22.291  -1.389  -4.453
  196    H    GLY  29           H        GLY  29  19.833  -4.565  -0.930
  197   1HA   GLY  29          2HA       GLY  29  19.118  -3.090   1.537
  198   2HA   GLY  29          1HA       GLY  29  19.123  -4.818   1.431
  199    H    ALA  30           H        ALA  30  20.554  -2.712   3.069
  200    HA   ALA  30           HA       ALA  30  23.399  -3.049   2.509
  201   1HB   ALA  30          3HB       ALA  30  21.743  -1.632   4.598
  202   2HB   ALA  30          2HB       ALA  30  23.408  -2.005   5.005
  203   3HB   ALA  30          1HB       ALA  30  23.054  -0.994   3.620
  204    H    HIS  31           H        HIS  31  21.011  -4.264   4.704
  205    HA   HIS  31           HA       HIS  31  22.882  -6.084   6.081
  206   1HB   HIS  31          2HB       HIS  31  19.974  -5.273   6.395
  207   2HB   HIS  31          1HB       HIS  31  20.517  -6.758   7.163
  208    HD1  HIS  31           HD1      HIS  31  21.424  -3.120   7.150
  209    HD2  HIS  31           HD2      HIS  31  21.919  -6.415   9.512
  210    HE1  HIS  31           HE1      HIS  31  22.454  -2.324   9.250
  211   1HN   CGU  32           HN       CGU  32  23.008  -6.605   3.530
  212    HA   CGU  32           HA       CGU  32  21.994  -9.341   3.293
  213   1HB   CGU  32          1HB       CGU  32  21.184  -7.108   1.385
  214   2HB   CGU  32          2HB       CGU  32  20.110  -8.109   2.326
  215    HG   CGU  32           HG       CGU  32  21.863  -9.774   0.650
  216    H    ASP  33           H        ASP  33  24.140  -9.844   3.410
  217    HA   ASP  33           HA       ASP  33  25.964  -8.910   1.248
  218   1HB   ASP  33          2HB       ASP  33  26.575  -8.981   3.815
  219   2HB   ASP  33          1HB       ASP  33  26.703 -10.717   3.604
  220    H    VAL  34           H        VAL  34  23.763 -10.471   0.689
  221    HA   VAL  34           HA       VAL  34  24.838 -13.169   0.021
  222    HB   VAL  34           HB       VAL  34  21.926 -12.241  -0.069
  223   1HG1  VAL  34          2HG1      VAL  34  23.197 -15.018   0.032
  224   2HG1  VAL  34          1HG1      VAL  34  21.473 -14.689   0.012
  225   3HG1  VAL  34          3HG1      VAL  34  22.456 -14.290  -1.384
  226   1HG2  VAL  34          3HG2      VAL  34  23.467 -13.565   2.210
  227   2HG2  VAL  34          2HG2      VAL  34  22.654 -12.006   2.256
  228   3HG2  VAL  34          1HG2      VAL  34  21.715 -13.483   2.140
   
  No H/Q in entry =         228
  Start of MODEL    9
    1   1H    ALA   1          3H        ALA   1   9.239  10.659   3.079
    2   2H    ALA   1          2H        ALA   1   7.697  10.308   3.701
    3   3H    ALA   1          1H        ALA   1   9.052   9.443   4.250
    4    HA   ALA   1           HA       ALA   1   7.807   8.088   2.741
    5   1HB   ALA   1          1HB       ALA   1   8.285  10.382   0.784
    6   2HB   ALA   1          3HB       ALA   1   7.598   8.824   0.346
    7   3HB   ALA   1          2HB       ALA   1   6.728   9.893   1.435
    8    H    CYS   2           H        CYS   2   9.084   6.484   2.104
    9    HA   CYS   2           HA       CYS   2  11.843   7.074   1.146
   10   1HB   CYS   2          2HB       CYS   2  12.448   4.955   2.259
   11   2HB   CYS   2          1HB       CYS   2  11.951   6.139   3.416
   12    H    SER   3           H        SER   3  12.748   4.977   0.157
   13    HA   SER   3           HA       SER   3  10.786   3.997  -1.889
   14   1HB   SER   3          2HB       SER   3  12.670   5.247  -2.875
   15   2HB   SER   3          1HB       SER   3  13.846   4.212  -2.047
   16    HG   SER   3           HG       SER   3  12.954   2.440  -3.181
   17    H    GLY   4           H        GLY   4  10.620   1.827  -2.279
   18   1HA   GLY   4          2HA       GLY   4  11.573   0.021  -0.131
   19   2HA   GLY   4          1HA       GLY   4  10.379  -0.366  -1.374
   20    H    ARG   5           H        ARG   5  12.114  -2.273  -1.061
   21    HA   ARG   5           HA       ARG   5  14.548  -1.963  -2.602
   22   1HB   ARG   5          2HB       ARG   5  14.201  -3.643  -0.712
   23   2HB   ARG   5          1HB       ARG   5  13.144  -4.555  -1.766
   24   1HG   ARG   5          2HG       ARG   5  14.893  -5.187  -3.220
   25   2HG   ARG   5          1HG       ARG   5  15.903  -3.832  -2.771
   26   1HD   ARG   5          2HD       ARG   5  16.968  -5.631  -1.682
   27   2HD   ARG   5          1HD       ARG   5  15.959  -5.007  -0.382
   28    HE   ARG   5           HE       ARG   5  14.292  -6.822  -1.571
   29   1HH1  ARG   5          2HH1      ARG   5  17.254  -7.754  -2.280
   30   2HH1  ARG   5          1HH1      ARG   5  17.394  -9.067  -1.158
   31   1HH2  ARG   5          1HH2      ARG   5  14.546  -8.106   0.639
   32   2HH2  ARG   5          2HH2      ARG   5  15.827  -9.269   0.535
   33    H    GLY   6           H        GLY   6  13.735  -1.097  -4.499
   34   1HA   GLY   6          2HA       GLY   6  13.572  -2.625  -6.763
   35   2HA   GLY   6          1HA       GLY   6  11.889  -2.546  -6.243
   36    H    SER   7           H        SER   7  13.230   0.203  -5.135
   37    HA   SER   7           HA       SER   7  12.919   1.778  -7.648
   38   1HB   SER   7          2HB       SER   7  11.360   2.061  -5.037
   39   2HB   SER   7          1HB       SER   7  11.605   3.469  -6.090
   40    HG   SER   7           HG       SER   7  10.609   0.933  -6.877
   41    H    ARG   8           H        ARG   8  14.116   3.736  -7.608
   42    HA   ARG   8           HA       ARG   8  16.468   3.626  -5.868
   43   1HB   ARG   8          2HB       ARG   8  17.318   5.374  -7.365
   44   2HB   ARG   8          1HB       ARG   8  16.683   4.018  -8.254
   45   1HG   ARG   8          2HG       ARG   8  14.560   5.999  -7.759
   46   2HG   ARG   8          1HG       ARG   8  15.939   6.744  -8.519
   47   1HD   ARG   8          2HD       ARG   8  15.836   4.758 -10.224
   48   2HD   ARG   8          1HD       ARG   8  14.225   4.480  -9.573
   49    HE   ARG   8           HE       ARG   8  15.126   6.943 -10.994
   50   1HH1  ARG   8          2HH1      ARG   8  12.966   7.308  -8.873
   51   2HH1  ARG   8          1HH1      ARG   8  11.536   7.177  -9.836
   52   1HH2  ARG   8          1HH2      ARG   8  13.212   5.756 -12.553
   53   2HH2  ARG   8          2HH2      ARG   8  11.672   6.283 -11.961
   54    H    CYS   9           H        CYS   9  17.314   6.053  -5.567
   55    HA   CYS   9           HA       CYS   9  15.398   7.330  -3.743
   56   1HB   CYS   9          2HB       CYS   9  17.251   8.040  -2.416
   57   2HB   CYS   9          1HB       CYS   9  17.419   6.337  -2.715
   58    HA   HYP  10           HA       HYP  10  15.097   9.086  -2.765
   59   1HB   HYP  10          1HB       HYP  10  14.776  11.224  -2.140
   60   2HB   HYP  10          2HB       HYP  10  13.356  11.283  -3.160
   61   1HD   HYP  10          1HD1      HYP  10  17.005  11.368  -5.177
   62   2HD   HYP  10          2HD1      HYP  10  15.534  11.179  -6.142
   63    HOD  HYP  10           HD2      HYP  10  16.709  11.970  -2.946
   64    HG   HYP  10           HG       HYP  10  14.572  12.740  -4.654
   65    HA   HYP  11           HA       HYP  11  12.639   9.955  -1.704
   66   1HB   HYP  11          1HB       HYP  11  10.527   9.401  -1.101
   67   2HB   HYP  11          2HB       HYP  11  11.128   7.838  -0.592
   68   1HD   HYP  11          1HD1      HYP  11  10.742   8.672  -4.595
   69   2HD   HYP  11          2HD1      HYP  11  11.452   7.074  -4.327
   70    HOD  HYP  11           HD2      HYP  11   8.498   8.253  -2.223
   71    HG   HYP  11           HG       HYP  11  10.113   6.786  -2.417
   72    H    GLN  12           H        GLN  12  14.214   9.636  -0.222
   73    HA   GLN  12           HA       GLN  12  16.330   7.918  -0.414
   74   1HB   GLN  12          2HB       GLN  12  16.165   9.801   1.216
   75   2HB   GLN  12          1HB       GLN  12  15.074   8.853   2.209
   76   1HG   GLN  12          2HG       GLN  12  16.832   7.194   2.659
   77   2HG   GLN  12          1HG       GLN  12  17.914   7.965   1.509
   78   1HE2  GLN  12          2HE2      GLN  12  19.055  10.351   3.824
   79   2HE2  GLN  12          1HE2      GLN  12  19.189   9.681   2.269
   80    H    CYS  13           H        CYS  13  16.596   5.755  -0.321
   81    HA   CYS  13           HA       CYS  13  14.557   3.909   0.020
   82   1HB   CYS  13          2HB       CYS  13  17.223   3.029   1.013
   83   2HB   CYS  13          1HB       CYS  13  16.117   2.297  -0.101
   84    H    CYS  14           H        CYS  14  13.671   2.809   1.548
   85    HA   CYS  14           HA       CYS  14  13.353   3.830   4.151
   86   1HB   CYS  14          2HB       CYS  14  12.774   1.019   3.195
   87   2HB   CYS  14          1HB       CYS  14  12.025   1.820   4.546
   88    H    MET  15           H        MET  15  13.525   2.418   6.131
   89    HA   MET  15           HA       MET  15  16.192   2.160   6.905
   90   1HB   MET  15          2HB       MET  15  14.100   2.327   8.385
   91   2HB   MET  15          1HB       MET  15  13.862   0.613   8.124
   92   1HG   MET  15          2HG       MET  15  16.558   0.806   8.893
   93   2HG   MET  15          1HG       MET  15  15.763   1.997   9.875
   94   1HE   MET  15          1HE       MET  15  13.403   1.322  11.110
   95   2HE   MET  15          3HE       MET  15  13.722   0.145  12.366
   96   3HE   MET  15          2HE       MET  15  14.836   1.488  12.156
   97    H    GLY  16           H        GLY  16  17.683   0.711   6.616
   98   1HA   GLY  16          2HA       GLY  16  18.575  -1.504   6.584
   99   2HA   GLY  16          1HA       GLY  16  17.031  -2.092   5.995
  100    H    LEU  17           H        LEU  17  16.965   0.218   4.012
  101    HA   LEU  17           HA       LEU  17  18.572  -1.134   1.976
  102   1HB   LEU  17          2HB       LEU  17  16.316   0.867   1.832
  103   2HB   LEU  17          1HB       LEU  17  17.329   0.581   0.441
  104    HG   LEU  17           HG       LEU  17  16.654  -2.014   1.353
  105   1HD1  LEU  17          3HD1      LEU  17  14.221  -0.204   1.154
  106   2HD1  LEU  17          2HD1      LEU  17  14.185  -1.958   1.250
  107   3HD1  LEU  17          1HD1      LEU  17  14.770  -1.015   2.619
  108   1HD2  LEU  17          2HD2      LEU  17  16.882  -0.813  -1.047
  109   2HD2  LEU  17          1HD2      LEU  17  16.036  -2.321  -0.824
  110   3HD2  LEU  17          3HD2      LEU  17  15.143  -0.805  -0.918
  111    H    ARG  18           H        ARG  18  19.494   0.087   0.326
  112    HA   ARG  18           HA       ARG  18  20.773   2.676   0.941
  113   1HB   ARG  18          2HB       ARG  18  22.858   1.473  -0.214
  114   2HB   ARG  18          1HB       ARG  18  22.618   1.385   1.515
  115   1HG   ARG  18          2HG       ARG  18  21.796  -0.834   1.379
  116   2HG   ARG  18          1HG       ARG  18  21.405  -0.700  -0.315
  117   1HD   ARG  18          2HD       ARG  18  23.401  -2.100  -0.108
  118   2HD   ARG  18          1HD       ARG  18  23.859  -0.578  -0.867
  119    HE   ARG  18           HE       ARG  18  24.210  -0.133   1.851
  120   1HH1  ARG  18          1HH2      ARG  18  26.308  -0.387  -0.413
  121   2HH1  ARG  18          2HH2      ARG  18  27.391  -1.544   0.288
  122   1HH2  ARG  18          2HH1      ARG  18  25.108  -2.492   2.767
  123   2HH2  ARG  18          1HH1      ARG  18  26.694  -2.765   2.127
  124    H    CYS  19           H        CYS  19  21.211   3.776  -0.860
  125    HA   CYS  19           HA       CYS  19  19.608   3.198  -3.219
  126   1HB   CYS  19          2HB       CYS  19  20.177   5.469  -2.140
  127   2HB   CYS  19          1HB       CYS  19  21.676   5.394  -3.014
  128    H    GLY  20           H        GLY  20  20.391   1.373  -4.274
  129   1HA   GLY  20          2HA       GLY  20  23.166   0.992  -4.993
  130   2HA   GLY  20          1HA       GLY  20  21.789   0.092  -5.629
  131    H    ARG  21           H        ARG  21  23.944   2.695  -6.216
  132    HA   ARG  21           HA       ARG  21  22.540   4.092  -8.220
  133   1HB   ARG  21          2HB       ARG  21  24.899   4.513  -7.011
  134   2HB   ARG  21          1HB       ARG  21  25.527   3.742  -8.453
  135   1HG   ARG  21          2HG       ARG  21  23.932   5.459  -9.725
  136   2HG   ARG  21          1HG       ARG  21  23.948   6.320  -8.199
  137   1HD   ARG  21          2HD       ARG  21  25.754   7.253  -9.480
  138   2HD   ARG  21          1HD       ARG  21  26.538   6.173  -8.330
  139    HE   ARG  21           HE       ARG  21  25.848   4.886 -10.867
  140   1HH1  ARG  21          1HH2      ARG  21  28.112   3.862  -9.486
  141   2HH1  ARG  21          2HH2      ARG  21  29.479   4.618 -10.236
  142   1HH2  ARG  21          2HH1      ARG  21  27.535   7.149 -11.681
  143   2HH2  ARG  21          1HH1      ARG  21  29.143   6.527 -11.512
  144    H    GLY  22           H        GLY  22  22.619   3.993 -10.453
  145   1HA   GLY  22          2HA       GLY  22  23.970   2.240 -12.147
  146   2HA   GLY  22          1HA       GLY  22  22.536   1.353 -11.616
  147    H    ASN  23           H        ASN  23  21.786   1.403 -13.792
  148    HA   ASN  23           HA       ASN  23  20.201   3.801 -14.384
  149   1HB   ASN  23          2HB       ASN  23  22.556   4.041 -15.458
  150   2HB   ASN  23          1HB       ASN  23  22.033   2.809 -16.592
  151   1HD2  ASN  23          2HD2      ASN  23  20.742   6.590 -17.033
  152   2HD2  ASN  23          1HD2      ASN  23  21.926   6.150 -15.897
  153    HA   PRO  24           HA       PRO  24  18.241   3.880 -14.197
  154   1HB   PRO  24          2HB       PRO  24  15.925   2.656 -13.297
  155   2HB   PRO  24          1HB       PRO  24  16.072   3.677 -14.718
  156   1HG   PRO  24          2HG       PRO  24  15.736   0.743 -14.599
  157   2HG   PRO  24          1HG       PRO  24  15.481   1.827 -15.960
  158   1HD   PRO  24          2HD       PRO  24  17.731   0.083 -15.552
  159   2HD   PRO  24          1HD       PRO  24  17.550   1.291 -16.834
  160    H    GLN  25           H        GLN  25  19.015   4.206 -12.196
  161    HA   GLN  25           HA       GLN  25  20.134   2.210 -10.541
  162   1HB   GLN  25          2HB       GLN  25  20.061   4.012  -8.729
  163   2HB   GLN  25          1HB       GLN  25  20.884   4.444 -10.214
  164   1HG   GLN  25          2HG       GLN  25  19.035   5.675 -11.034
  165   2HG   GLN  25          1HG       GLN  25  17.978   5.077  -9.768
  166   1HE2  GLN  25          2HE2      GLN  25  19.767   7.135  -7.244
  167   2HE2  GLN  25          1HE2      GLN  25  19.347   5.500  -7.431
  168    H    LYS  26           H        LYS  26  19.460   1.618  -8.319
  169    HA   LYS  26           HA       LYS  26  16.661   1.820  -7.549
  170   1HB   LYS  26          2HB       LYS  26  17.630  -0.516  -9.076
  171   2HB   LYS  26          1HB       LYS  26  16.943  -0.997  -7.541
  172   1HG   LYS  26          2HG       LYS  26  14.861   0.073  -8.002
  173   2HG   LYS  26          1HG       LYS  26  15.464   0.871  -9.431
  174   1HD   LYS  26          2HD       LYS  26  15.628  -2.151  -9.314
  175   2HD   LYS  26          1HD       LYS  26  14.066  -1.421  -9.603
  176   1HE   LYS  26          2HE       LYS  26  14.885  -1.688 -11.790
  177   2HE   LYS  26          1HE       LYS  26  15.317  -0.019 -11.465
  178   1HZ   LYS  26          2HZ       LYS  26  17.355  -1.739 -10.543
  179   2HZ   LYS  26          1HZ       LYS  26  16.990  -2.091 -12.165
  180   3HZ   LYS  26          3HZ       LYS  26  17.420  -0.512 -11.716
  181    H    CYS  27           H        CYS  27  16.284   1.174  -5.367
  182    HA   CYS  27           HA       CYS  27  18.683   1.057  -3.763
  183   1HB   CYS  27          2HB       CYS  27  15.800   0.814  -2.802
  184   2HB   CYS  27          1HB       CYS  27  17.220   1.095  -1.873
  185    H    ILE  28           H        ILE  28  19.249  -0.609  -2.419
  186    HA   ILE  28           HA       ILE  28  17.896  -3.243  -2.678
  187    HB   ILE  28           HB       ILE  28  20.120  -4.309  -2.843
  188   1HG1  ILE  28          2HG1      ILE  28  21.255  -2.275  -1.610
  189   2HG1  ILE  28          1HG1      ILE  28  22.124  -3.196  -2.765
  190   1HG2  ILE  28          1HG2      ILE  28  19.607  -2.249  -5.025
  191   2HG2  ILE  28          3HG2      ILE  28  20.789  -3.542  -5.154
  192   3HG2  ILE  28          2HG2      ILE  28  19.087  -3.923  -4.981
  193   1HD1  ILE  28          3HD1      ILE  28  20.715  -0.781  -3.791
  194   2HD1  ILE  28          2HD1      ILE  28  22.140  -0.562  -2.794
  195   3HD1  ILE  28          1HD1      ILE  28  22.243  -1.505  -4.274
  196    H    GLY  29           H        GLY  29  19.306  -4.624  -0.881
  197   1HA   GLY  29          2HA       GLY  29  18.969  -3.018   1.558
  198   2HA   GLY  29          1HA       GLY  29  18.973  -4.741   1.511
  199    H    ALA  30           H        ALA  30  20.528  -2.665   2.979
  200    HA   ALA  30           HA       ALA  30  23.319  -2.971   2.136
  201   1HB   ALA  30          3HB       ALA  30  21.950  -1.053   3.639
  202   2HB   ALA  30          2HB       ALA  30  22.782  -1.955   4.889
  203   3HB   ALA  30          1HB       ALA  30  23.696  -1.206   3.594
  204    H    HIS  31           H        HIS  31  21.163  -3.985   4.647
  205    HA   HIS  31           HA       HIS  31  23.069  -5.969   5.760
  206   1HB   HIS  31          2HB       HIS  31  21.202  -4.293   6.965
  207   2HB   HIS  31          1HB       HIS  31  20.285  -5.784   6.886
  208    HD1  HIS  31           HD1      HIS  31  22.495  -4.184   9.060
  209    HD2  HIS  31           HD2      HIS  31  22.124  -8.079   7.896
  210    HE1  HIS  31           HE1      HIS  31  23.640  -5.534  10.778
  211   1HN   CGU  32           HN       CGU  32  22.256  -6.333   3.169
  212    HA   CGU  32           HA       CGU  32  20.315  -8.581   3.116
  213   1HB   CGU  32          1HB       CGU  32  21.579  -7.123   0.787
  214   2HB   CGU  32          2HB       CGU  32  20.264  -6.405   1.669
  215    HG   CGU  32           HG       CGU  32  19.951  -9.217   0.677
  216    H    ASP  33           H        ASP  33  21.892  -8.975   0.565
  217    HA   ASP  33           HA       ASP  33  24.242 -10.491   1.583
  218   1HB   ASP  33          2HB       ASP  33  22.017 -11.906   1.206
  219   2HB   ASP  33          1HB       ASP  33  22.378 -11.723  -0.499
  220    H    VAL  34           H        VAL  34  23.926  -8.022   0.228
  221    HA   VAL  34           HA       VAL  34  24.849  -8.427  -2.538
  222    HB   VAL  34           HB       VAL  34  24.552  -5.853  -0.905
  223   1HG1  VAL  34          1HG1      VAL  34  24.962  -6.347  -3.890
  224   2HG1  VAL  34          3HG1      VAL  34  24.513  -4.792  -3.210
  225   3HG1  VAL  34          2HG1      VAL  34  26.062  -5.507  -2.809
  226   1HG2  VAL  34          3HG2      VAL  34  22.662  -7.227  -2.870
  227   2HG2  VAL  34          2HG2      VAL  34  22.383  -6.949  -1.161
  228   3HG2  VAL  34          1HG2      VAL  34  22.437  -5.593  -2.268
   
  No H/Q in entry =         228
  Start of MODEL   10
    1   1H    ALA   1          2H        ALA   1   8.529  10.554   1.137
    2   2H    ALA   1          1H        ALA   1   7.447  10.858   2.412
    3   3H    ALA   1          3H        ALA   1   9.121  11.031   2.657
    4    HA   ALA   1           HA       ALA   1   8.513   8.994   3.641
    5   1HB   ALA   1          3HB       ALA   1   6.345   8.829   2.287
    6   2HB   ALA   1          2HB       ALA   1   7.301   8.200   0.955
    7   3HB   ALA   1          1HB       ALA   1   7.200   7.306   2.465
    8    H    CYS   2           H        CYS   2   9.136   6.615   2.490
    9    HA   CYS   2           HA       CYS   2  11.777   7.103   1.200
   10   1HB   CYS   2          2HB       CYS   2  12.428   4.990   2.306
   11   2HB   CYS   2          1HB       CYS   2  12.007   6.185   3.484
   12    H    SER   3           H        SER   3  12.529   4.921   0.231
   13    HA   SER   3           HA       SER   3  10.391   3.902  -1.612
   14   1HB   SER   3          2HB       SER   3  13.046   5.042  -2.141
   15   2HB   SER   3          1HB       SER   3  12.896   3.452  -2.868
   16    HG   SER   3           HG       SER   3  11.137   5.658  -3.128
   17    H    GLY   4           H        GLY   4  10.395   1.726  -2.117
   18   1HA   GLY   4          2HA       GLY   4  11.627  -0.043  -0.079
   19   2HA   GLY   4          1HA       GLY   4  10.340  -0.480  -1.197
   20    H    ARG   5           H        ARG   5  12.253  -2.265  -0.955
   21    HA   ARG   5           HA       ARG   5  14.527  -1.955  -2.658
   22   1HB   ARG   5          2HB       ARG   5  14.193  -3.696  -0.802
   23   2HB   ARG   5          1HB       ARG   5  13.194  -4.596  -1.926
   24   1HG   ARG   5          2HG       ARG   5  15.047  -4.825  -3.503
   25   2HG   ARG   5          1HG       ARG   5  16.025  -3.698  -2.593
   26   1HD   ARG   5          2HD       ARG   5  16.759  -5.998  -2.093
   27   2HD   ARG   5          1HD       ARG   5  16.017  -5.316  -0.649
   28    HE   ARG   5           HE       ARG   5  14.119  -6.726  -0.980
   29   1HH1  ARG   5          2HH1      ARG   5  13.529  -6.701  -3.750
   30   2HH1  ARG   5          1HH1      ARG   5  14.125  -8.210  -4.358
   31   1HH2  ARG   5          1HH2      ARG   5  16.207  -8.724  -1.582
   32   2HH2  ARG   5          2HH2      ARG   5  15.675  -9.399  -3.084
   33    H    GLY   6           H        GLY   6  13.745  -1.080  -4.525
   34   1HA   GLY   6          2HA       GLY   6  13.523  -2.568  -6.812
   35   2HA   GLY   6          1HA       GLY   6  11.846  -2.421  -6.295
   36    H    SER   7           H        SER   7  13.118   0.251  -5.084
   37    HA   SER   7           HA       SER   7  12.967   1.890  -7.574
   38   1HB   SER   7          2HB       SER   7  11.594   3.560  -6.219
   39   2HB   SER   7          1HB       SER   7  10.751   2.020  -6.430
   40    HG   SER   7           HG       SER   7  12.087   1.535  -4.338
   41    H    ARG   8           H        ARG   8  14.382   3.555  -7.625
   42    HA   ARG   8           HA       ARG   8  16.623   3.517  -5.790
   43   1HB   ARG   8          2HB       ARG   8  17.504   5.296  -7.312
   44   2HB   ARG   8          1HB       ARG   8  16.929   3.896  -8.170
   45   1HG   ARG   8          2HG       ARG   8  14.704   5.760  -7.819
   46   2HG   ARG   8          1HG       ARG   8  16.071   6.607  -8.496
   47   1HD   ARG   8          2HD       ARG   8  16.237   4.898 -10.305
   48   2HD   ARG   8          1HD       ARG   8  14.848   4.052  -9.621
   49    HE   ARG   8           HE       ARG   8  13.806   6.522  -9.949
   50   1HH1  ARG   8          1HH2      ARG   8  15.783   7.391 -11.856
   51   2HH1  ARG   8          2HH2      ARG   8  15.196   6.812 -13.381
   52   1HH2  ARG   8          2HH1      ARG   8  13.012   4.515 -11.888
   53   2HH2  ARG   8          1HH1      ARG   8  13.586   5.142 -13.399
   54    H    CYS   9           H        CYS   9  17.409   6.075  -5.605
   55    HA   CYS   9           HA       CYS   9  15.431   7.307  -3.811
   56   1HB   CYS   9          2HB       CYS   9  17.205   8.008  -2.390
   57   2HB   CYS   9          1HB       CYS   9  17.451   6.322  -2.727
   58    HA   HYP  10           HA       HYP  10  15.148   9.051  -2.805
   59   1HB   HYP  10          1HB       HYP  10  14.865  11.157  -2.134
   60   2HB   HYP  10          2HB       HYP  10  13.431  11.255  -3.133
   61   1HD   HYP  10          1HD1      HYP  10  17.081  11.360  -5.159
   62   2HD   HYP  10          2HD1      HYP  10  15.621  11.194  -6.142
   63    HOD  HYP  10           HD2      HYP  10  15.943  13.525  -3.169
   64    HG   HYP  10           HG       HYP  10  14.636  12.720  -4.639
   65    HA   HYP  11           HA       HYP  11  12.623   9.954  -1.722
   66   1HB   HYP  11          1HB       HYP  11  10.627   9.246  -0.944
   67   2HB   HYP  11          2HB       HYP  11  11.243   7.614  -0.764
   68   1HD   HYP  11          1HD1      HYP  11  10.786   8.806  -4.663
   69   2HD   HYP  11          2HD1      HYP  11  11.415   7.175  -4.404
   70    HOD  HYP  11           HD2      HYP  11   9.695   9.779  -2.989
   71    HG   HYP  11           HG       HYP  11   9.911   6.974  -2.580
   72    H    GLN  12           H        GLN  12  14.048   9.579  -0.034
   73    HA   GLN  12           HA       GLN  12  16.297   7.983  -0.340
   74   1HB   GLN  12          2HB       GLN  12  15.987   9.798   1.380
   75   2HB   GLN  12          1HB       GLN  12  14.968   8.718   2.303
   76   1HG   GLN  12          2HG       GLN  12  17.358   7.222   1.838
   77   2HG   GLN  12          1HG       GLN  12  17.907   8.853   2.176
   78   1HE2  GLN  12          2HE2      GLN  12  17.058   8.711   5.591
   79   2HE2  GLN  12          1HE2      GLN  12  17.681   9.646   4.318
   80    H    CYS  13           H        CYS  13  16.651   5.771  -0.216
   81    HA   CYS  13           HA       CYS  13  14.540   3.940   0.004
   82   1HB   CYS  13          2HB       CYS  13  17.188   2.992   0.994
   83   2HB   CYS  13          1HB       CYS  13  16.074   2.298  -0.133
   84    H    CYS  14           H        CYS  14  13.632   2.816   1.540
   85    HA   CYS  14           HA       CYS  14  13.351   3.823   4.150
   86   1HB   CYS  14          2HB       CYS  14  12.740   1.047   3.117
   87   2HB   CYS  14          1HB       CYS  14  12.055   1.756   4.550
   88    H    MET  15           H        MET  15  13.586   2.474   6.137
   89    HA   MET  15           HA       MET  15  16.268   2.157   6.827
   90   1HB   MET  15          2HB       MET  15  14.264   2.396   8.396
   91   2HB   MET  15          1HB       MET  15  13.929   0.695   8.141
   92   1HG   MET  15          2HG       MET  15  16.209   0.145   8.980
   93   2HG   MET  15          1HG       MET  15  16.517   1.837   9.245
   94   1HE   MET  15          3HE       MET  15  14.781   3.278  10.754
   95   2HE   MET  15          2HE       MET  15  14.825   2.754  12.423
   96   3HE   MET  15          1HE       MET  15  16.336   2.907  11.536
   97    H    GLY  16           H        GLY  16  17.717   0.647   6.560
   98   1HA   GLY  16          2HA       GLY  16  18.516  -1.614   6.537
   99   2HA   GLY  16          1HA       GLY  16  16.955  -2.126   5.917
  100    H    LEU  17           H        LEU  17  16.920   0.145   3.971
  101    HA   LEU  17           HA       LEU  17  18.557  -1.161   1.930
  102   1HB   LEU  17          2HB       LEU  17  16.274   0.815   1.798
  103   2HB   LEU  17          1HB       LEU  17  17.295   0.557   0.408
  104    HG   LEU  17           HG       LEU  17  16.653  -2.055   1.291
  105   1HD1  LEU  17          3HD1      LEU  17  14.193  -0.278   1.117
  106   2HD1  LEU  17          2HD1      LEU  17  14.185  -2.034   1.198
  107   3HD1  LEU  17          1HD1      LEU  17  14.759  -1.095   2.573
  108   1HD2  LEU  17          1HD2      LEU  17  16.884  -0.844  -1.086
  109   2HD2  LEU  17          3HD2      LEU  17  16.014  -2.340  -0.880
  110   3HD2  LEU  17          2HD2      LEU  17  15.142  -0.812  -0.967
  111    H    ARG  18           H        ARG  18  19.473   0.101   0.299
  112    HA   ARG  18           HA       ARG  18  20.706   2.701   0.969
  113   1HB   ARG  18          2HB       ARG  18  22.829   1.580  -0.148
  114   2HB   ARG  18          1HB       ARG  18  22.543   1.383   1.565
  115   1HG   ARG  18          2HG       ARG  18  21.670  -0.838   1.217
  116   2HG   ARG  18          1HG       ARG  18  21.481  -0.574  -0.497
  117   1HD   ARG  18          2HD       ARG  18  24.010  -0.378  -0.691
  118   2HD   ARG  18          1HD       ARG  18  24.115  -0.891   0.994
  119    HE   ARG  18           HE       ARG  18  22.492  -2.793  -0.237
  120   1HH1  ARG  18          2HH1      ARG  18  24.258  -2.078  -2.588
  121   2HH1  ARG  18          1HH1      ARG  18  25.527  -3.248  -2.435
  122   1HH2  ARG  18          1HH2      ARG  18  24.666  -4.044   0.869
  123   2HH2  ARG  18          2HH2      ARG  18  25.764  -4.389  -0.427
  124    H    CYS  19           H        CYS  19  21.227   3.817  -0.832
  125    HA   CYS  19           HA       CYS  19  19.614   3.290  -3.196
  126   1HB   CYS  19          2HB       CYS  19  20.204   5.536  -2.096
  127   2HB   CYS  19          1HB       CYS  19  21.719   5.447  -2.939
  128    H    GLY  20           H        GLY  20  20.344   1.497  -4.336
  129   1HA   GLY  20          2HA       GLY  20  23.113   1.036  -5.020
  130   2HA   GLY  20          1HA       GLY  20  21.713   0.236  -5.744
  131    H    ARG  21           H        ARG  21  23.905   2.856  -5.970
  132    HA   ARG  21           HA       ARG  21  22.741   4.457  -7.954
  133   1HB   ARG  21          2HB       ARG  21  24.960   4.671  -6.451
  134   2HB   ARG  21          1HB       ARG  21  25.730   4.068  -7.898
  135   1HG   ARG  21          2HG       ARG  21  25.810   6.387  -8.235
  136   2HG   ARG  21          1HG       ARG  21  24.377   5.957  -9.144
  137   1HD   ARG  21          2HD       ARG  21  22.907   6.759  -7.417
  138   2HD   ARG  21          1HD       ARG  21  24.195   6.803  -6.218
  139    HE   ARG  21           HE       ARG  21  23.680   8.822  -8.287
  140   1HH1  ARG  21          1HH2      ARG  21  26.425   8.651  -8.754
  141   2HH1  ARG  21          2HH2      ARG  21  27.190   9.513  -7.461
  142   1HH2  ARG  21          2HH1      ARG  21  24.342   9.382  -5.424
  143   2HH2  ARG  21          1HH1      ARG  21  25.979   9.938  -5.526
  144    H    GLY  22           H        GLY  22  24.238   1.386  -8.253
  145   1HA   GLY  22          2HA       GLY  22  25.173   1.362 -10.910
  146   2HA   GLY  22          1HA       GLY  22  24.513  -0.048 -10.080
  147    H    ASN  23           H        ASN  23  24.210   1.289 -12.868
  148    HA   ASN  23           HA       ASN  23  21.378   1.862 -13.048
  149   1HB   ASN  23          2HB       ASN  23  23.649   1.676 -15.015
  150   2HB   ASN  23          1HB       ASN  23  21.994   1.759 -15.601
  151   1HD2  ASN  23          2HD2      ASN  23  23.762   5.099 -14.242
  152   2HD2  ASN  23          1HD2      ASN  23  24.604   3.643 -14.471
  153    HA   PRO  24           HA       PRO  24  19.495   1.569 -14.164
  154   1HB   PRO  24          2HB       PRO  24  17.205   0.255 -13.285
  155   2HB   PRO  24          1HB       PRO  24  17.664   0.520 -14.959
  156   1HG   PRO  24          2HG       PRO  24  17.755  -1.997 -13.408
  157   2HG   PRO  24          1HG       PRO  24  17.814  -1.777 -15.152
  158   1HD   PRO  24          2HD       PRO  24  20.032  -2.383 -13.420
  159   2HD   PRO  24          1HD       PRO  24  20.116  -2.000 -15.147
  160    H    GLN  25           H        GLN  25  19.437   2.982 -12.557
  161    HA   GLN  25           HA       GLN  25  20.284   2.559  -9.930
  162   1HB   GLN  25          2HB       GLN  25  18.462   4.695 -11.098
  163   2HB   GLN  25          1HB       GLN  25  19.118   4.788  -9.472
  164   1HG   GLN  25          2HG       GLN  25  21.380   4.894 -10.269
  165   2HG   GLN  25          1HG       GLN  25  20.932   4.388 -11.889
  166   1HE2  GLN  25          2HE2      GLN  25  20.310   8.274 -10.748
  167   2HE2  GLN  25          1HE2      GLN  25  20.561   7.082  -9.565
  168    H    LYS  26           H        LYS  26  19.440   1.599  -8.284
  169    HA   LYS  26           HA       LYS  26  16.610   1.700  -7.587
  170   1HB   LYS  26          2HB       LYS  26  17.737  -0.628  -9.027
  171   2HB   LYS  26          1HB       LYS  26  16.988  -1.095  -7.519
  172   1HG   LYS  26          2HG       LYS  26  14.901  -0.510  -8.150
  173   2HG   LYS  26          1HG       LYS  26  15.391   0.788  -9.213
  174   1HD   LYS  26          2HD       LYS  26  15.464  -0.577 -11.040
  175   2HD   LYS  26          1HD       LYS  26  16.355  -1.828 -10.195
  176   1HE   LYS  26          2HE       LYS  26  14.143  -2.482  -9.073
  177   2HE   LYS  26          1HE       LYS  26  13.354  -1.413 -10.228
  178   1HZ   LYS  26          1HZ       LYS  26  14.616  -2.711 -11.972
  179   2HZ   LYS  26          3HZ       LYS  26  14.908  -3.858 -10.754
  180   3HZ   LYS  26          2HZ       LYS  26  13.313  -3.491 -11.209
  181    H    CYS  27           H        CYS  27  16.234   1.186  -5.383
  182    HA   CYS  27           HA       CYS  27  18.634   1.120  -3.774
  183   1HB   CYS  27          2HB       CYS  27  15.746   0.827  -2.823
  184   2HB   CYS  27          1HB       CYS  27  17.156   1.101  -1.882
  185    H    ILE  28           H        ILE  28  19.264  -0.557  -2.456
  186    HA   ILE  28           HA       ILE  28  17.962  -3.218  -2.756
  187    HB   ILE  28           HB       ILE  28  20.197  -4.230  -2.939
  188   1HG1  ILE  28          2HG1      ILE  28  21.286  -2.237  -1.653
  189   2HG1  ILE  28          1HG1      ILE  28  22.177  -3.080  -2.851
  190   1HG2  ILE  28          2HG2      ILE  28  19.673  -2.120  -5.073
  191   2HG2  ILE  28          1HG2      ILE  28  20.849  -3.415  -5.230
  192   3HG2  ILE  28          3HG2      ILE  28  19.144  -3.792  -5.066
  193   1HD1  ILE  28          2HD1      ILE  28  20.720  -0.661  -3.789
  194   2HD1  ILE  28          1HD1      ILE  28  22.128  -0.440  -2.765
  195   3HD1  ILE  28          3HD1      ILE  28  22.274  -1.324  -4.277
  196    H    GLY  29           H        GLY  29  19.397  -4.611  -0.967
  197   1HA   GLY  29          2HA       GLY  29  19.005  -3.050   1.494
  198   2HA   GLY  29          1HA       GLY  29  19.023  -4.770   1.415
  199    H    ALA  30           H        ALA  30  20.544  -2.646   2.907
  200    HA   ALA  30           HA       ALA  30  23.352  -2.912   2.115
  201   1HB   ALA  30          2HB       ALA  30  21.963  -1.683   4.536
  202   2HB   ALA  30          1HB       ALA  30  23.708  -1.671   4.328
  203   3HB   ALA  30          3HB       ALA  30  22.683  -0.820   3.189
  204    H    HIS  31           H        HIS  31  21.208  -3.975   4.643
  205    HA   HIS  31           HA       HIS  31  23.155  -5.941   5.707
  206   1HB   HIS  31          2HB       HIS  31  20.478  -4.821   6.635
  207   2HB   HIS  31          1HB       HIS  31  21.142  -6.257   7.392
  208    HD1  HIS  31           HD1      HIS  31  22.375  -5.569   9.424
  209    HD2  HIS  31           HD2      HIS  31  22.830  -2.725   6.533
  210    HE1  HIS  31           HE1      HIS  31  23.827  -3.828  10.389
  211   1HN   CGU  32           HN       CGU  32  22.173  -6.252   3.120
  212    HA   CGU  32           HA       CGU  32  20.351  -8.606   3.241
  213   1HB   CGU  32          1HB       CGU  32  21.232  -6.789   0.959
  214   2HB   CGU  32          2HB       CGU  32  19.667  -6.753   1.743
  215    HG   CGU  32           HG       CGU  32  20.557  -9.312   0.450
  216    H    ASP  33           H        ASP  33  22.183  -9.657   4.203
  217    HA   ASP  33           HA       ASP  33  24.423 -10.428   2.423
  218   1HB   ASP  33          2HB       ASP  33  24.612  -9.875   4.972
  219   2HB   ASP  33          1HB       ASP  33  23.876 -11.440   5.261
  220    H    VAL  34           H        VAL  34  21.936 -11.098   1.531
  221    HA   VAL  34           HA       VAL  34  22.148 -13.981   1.196
  222    HB   VAL  34           HB       VAL  34  20.828 -13.803   3.312
  223   1HG1  VAL  34          1HG1      VAL  34  19.845 -11.506   2.755
  224   2HG1  VAL  34          3HG1      VAL  34  18.671 -12.335   1.745
  225   3HG1  VAL  34          2HG1      VAL  34  18.727 -12.650   3.469
  226   1HG2  VAL  34          2HG2      VAL  34  20.318 -15.613   1.595
  227   2HG2  VAL  34          1HG2      VAL  34  19.012 -15.259   2.712
  228   3HG2  VAL  34          3HG2      VAL  34  18.952 -14.639   1.070
   
  No H/Q in entry =         228
  Start of MODEL   11
    1   1H    ALA   1          1H        ALA   1   7.483   9.456   0.303
    2   2H    ALA   1          3H        ALA   1   6.039   9.504   1.200
    3   3H    ALA   1          2H        ALA   1   7.458  10.185   1.837
    4    HA   ALA   1           HA       ALA   1   7.665   8.272   2.924
    5   1HB   ALA   1          3HB       ALA   1   5.965   7.018   0.715
    6   2HB   ALA   1          2HB       ALA   1   6.532   6.152   2.137
    7   3HB   ALA   1          1HB       ALA   1   5.407   7.488   2.312
    8    H    CYS   2           H        CYS   2   9.323   6.850   2.908
    9    HA   CYS   2           HA       CYS   2  11.425   7.080   1.083
   10   1HB   CYS   2          2HB       CYS   2  12.290   5.012   2.201
   11   2HB   CYS   2          1HB       CYS   2  11.807   6.231   3.330
   12    H    SER   3           H        SER   3  12.490   5.121   0.061
   13    HA   SER   3           HA       SER   3  10.583   3.936  -1.914
   14   1HB   SER   3          2HB       SER   3  13.544   4.605  -1.977
   15   2HB   SER   3          1HB       SER   3  12.875   3.456  -3.136
   16    HG   SER   3           HG       SER   3  12.761   5.546  -3.859
   17    H    GLY   4           H        GLY   4  10.608   1.732  -2.337
   18   1HA   GLY   4          2HA       GLY   4  11.618   0.033  -0.112
   19   2HA   GLY   4          1HA       GLY   4  10.425  -0.439  -1.318
   20    H    ARG   5           H        ARG   5  12.356  -2.217  -0.904
   21    HA   ARG   5           HA       ARG   5  14.710  -1.834  -2.520
   22   1HB   ARG   5          2HB       ARG   5  14.195  -3.582  -0.603
   23   2HB   ARG   5          1HB       ARG   5  13.571  -4.585  -1.891
   24   1HG   ARG   5          2HG       ARG   5  16.181  -3.297  -2.518
   25   2HG   ARG   5          1HG       ARG   5  16.259  -4.373  -1.152
   26   1HD   ARG   5          2HD       ARG   5  15.016  -5.202  -3.809
   27   2HD   ARG   5          1HD       ARG   5  16.720  -5.435  -3.438
   28    HE   ARG   5           HE       ARG   5  15.747  -6.638  -1.304
   29   1HH1  ARG   5          2HH1      ARG   5  13.198  -6.332  -3.324
   30   2HH1  ARG   5          1HH1      ARG   5  13.007  -8.020  -3.662
   31   1HH2  ARG   5          1HH2      ARG   5  16.089  -8.872  -2.255
   32   2HH2  ARG   5          2HH2      ARG   5  14.689  -9.499  -3.062
   33    H    GLY   6           H        GLY   6  14.078  -1.107  -4.418
   34   1HA   GLY   6          2HA       GLY   6  13.953  -2.534  -6.692
   35   2HA   GLY   6          1HA       GLY   6  12.259  -2.581  -6.215
   36    H    SER   7           H        SER   7  13.207   0.215  -4.970
   37    HA   SER   7           HA       SER   7  12.740   1.854  -7.431
   38   1HB   SER   7          2HB       SER   7  11.681   2.232  -4.578
   39   2HB   SER   7          1HB       SER   7  11.524   3.453  -5.855
   40    HG   SER   7           HG       SER   7   9.734   2.025  -5.776
   41    H    ARG   8           H        ARG   8  14.028   3.728  -7.570
   42    HA   ARG   8           HA       ARG   8  16.506   3.649  -6.029
   43   1HB   ARG   8          2HB       ARG   8  17.221   5.443  -7.572
   44   2HB   ARG   8          1HB       ARG   8  16.523   4.100  -8.431
   45   1HG   ARG   8          2HG       ARG   8  14.400   5.957  -7.739
   46   2HG   ARG   8          1HG       ARG   8  15.697   6.824  -8.514
   47   1HD   ARG   8          2HD       ARG   8  15.658   5.234 -10.421
   48   2HD   ARG   8          1HD       ARG   8  14.357   4.332  -9.645
   49    HE   ARG   8           HE       ARG   8  14.140   7.043 -10.824
   50   1HH1  ARG   8          1HH2      ARG   8  12.510   7.007  -8.369
   51   2HH1  ARG   8          2HH2      ARG   8  11.000   6.363  -8.915
   52   1HH2  ARG   8          2HH1      ARG   8  12.361   5.083 -11.873
   53   2HH2  ARG   8          1HH1      ARG   8  10.908   5.245 -10.943
   54    H    CYS   9           H        CYS   9  17.349   6.068  -5.711
   55    HA   CYS   9           HA       CYS   9  15.485   7.314  -3.810
   56   1HB   CYS   9          2HB       CYS   9  17.340   7.975  -2.475
   57   2HB   CYS   9          1HB       CYS   9  17.501   6.280  -2.821
   58    HA   HYP  10           HA       HYP  10  15.130   8.973  -2.805
   59   1HB   HYP  10          1HB       HYP  10  14.800  11.021  -2.012
   60   2HB   HYP  10          2HB       HYP  10  13.430  11.212  -3.084
   61   1HD   HYP  10          1HD1      HYP  10  17.120  11.387  -5.018
   62   2HD   HYP  10          2HD1      HYP  10  15.640  11.313  -5.983
   63    HOD  HYP  10           HD2      HYP  10  16.383  13.430  -3.182
   64    HG   HYP  10           HG       HYP  10  14.755  12.792  -4.355
   65    HA   HYP  11           HA       HYP  11  12.536   9.933  -1.729
   66   1HB   HYP  11          1HB       HYP  11  10.585   9.158  -0.919
   67   2HB   HYP  11          2HB       HYP  11  11.145   7.493  -0.992
   68   1HD   HYP  11          1HD1      HYP  11  10.757   9.117  -4.713
   69   2HD   HYP  11          2HD1      HYP  11  11.249   7.421  -4.609
   70    HOD  HYP  11           HD2      HYP  11   9.716  10.010  -2.894
   71    HG   HYP  11           HG       HYP  11   9.729   7.165  -2.817
   72    H    GLN  12           H        GLN  12  14.098   9.604  -0.245
   73    HA   GLN  12           HA       GLN  12  16.238   7.887  -0.540
   74   1HB   GLN  12          2HB       GLN  12  15.151   9.556   1.627
   75   2HB   GLN  12          1HB       GLN  12  15.912   8.127   2.294
   76   1HG   GLN  12          2HG       GLN  12  17.617   9.858   2.100
   77   2HG   GLN  12          1HG       GLN  12  17.969   8.642   0.885
   78   1HE2  GLN  12          2HE2      GLN  12  17.186  12.403  -0.294
   79   2HE2  GLN  12          1HE2      GLN  12  17.370  11.997   1.350
   80    H    CYS  13           H        CYS  13  16.615   5.775  -0.289
   81    HA   CYS  13           HA       CYS  13  14.530   3.922  -0.037
   82   1HB   CYS  13          2HB       CYS  13  17.206   3.100   0.956
   83   2HB   CYS  13          1HB       CYS  13  16.106   2.311  -0.132
   84    H    CYS  14           H        CYS  14  13.577   2.928   1.514
   85    HA   CYS  14           HA       CYS  14  13.286   3.948   4.098
   86   1HB   CYS  14          2HB       CYS  14  12.753   1.106   3.189
   87   2HB   CYS  14          1HB       CYS  14  12.051   1.885   4.580
   88    H    MET  15           H        MET  15  13.631   2.754   6.149
   89    HA   MET  15           HA       MET  15  16.322   2.476   6.778
   90   1HB   MET  15          2HB       MET  15  14.355   2.764   8.385
   91   2HB   MET  15          1HB       MET  15  14.037   1.049   8.215
   92   1HG   MET  15          2HG       MET  15  16.232   0.505   9.104
   93   2HG   MET  15          1HG       MET  15  16.709   2.180   9.104
   94   1HE   MET  15          3HE       MET  15  15.172   3.988  10.465
   95   2HE   MET  15          2HE       MET  15  15.301   3.703  12.188
   96   3HE   MET  15          1HE       MET  15  16.748   3.596  11.194
   97    H    GLY  16           H        GLY  16  17.791   0.976   6.566
   98   1HA   GLY  16          2HA       GLY  16  18.639  -1.261   6.633
   99   2HA   GLY  16          1HA       GLY  16  17.071  -1.841   6.090
  100    H    LEU  17           H        LEU  17  16.964   0.338   4.012
  101    HA   LEU  17           HA       LEU  17  18.486  -1.096   1.990
  102   1HB   LEU  17          2HB       LEU  17  16.574   1.229   1.731
  103   2HB   LEU  17          1HB       LEU  17  17.269   0.386   0.370
  104    HG   LEU  17           HG       LEU  17  15.295  -0.680   2.411
  105   1HD1  LEU  17          1HD1      LEU  17  14.376   0.845   0.722
  106   2HD1  LEU  17          3HD1      LEU  17  14.974  -0.202  -0.556
  107   3HD1  LEU  17          2HD1      LEU  17  13.743  -0.780   0.559
  108   1HD2  LEU  17          3HD2      LEU  17  16.887  -2.512   1.640
  109   2HD2  LEU  17          2HD2      LEU  17  15.223  -2.777   1.180
  110   3HD2  LEU  17          1HD2      LEU  17  16.367  -2.186  -0.010
  111    H    ARG  18           H        ARG  18  19.554   0.031   0.312
  112    HA   ARG  18           HA       ARG  18  20.890   2.593   0.946
  113   1HB   ARG  18          2HB       ARG  18  22.907   1.222  -0.299
  114   2HB   ARG  18          1HB       ARG  18  22.768   1.413   1.432
  115   1HG   ARG  18          2HG       ARG  18  21.972  -0.723   1.762
  116   2HG   ARG  18          1HG       ARG  18  21.443  -0.949   0.116
  117   1HD   ARG  18          2HD       ARG  18  24.087  -0.620  -0.407
  118   2HD   ARG  18          1HD       ARG  18  24.239  -1.199   1.247
  119    HE   ARG  18           HE       ARG  18  22.473  -2.908  -0.259
  120   1HH1  ARG  18          2HH1      ARG  18  25.550  -1.950  -1.144
  121   2HH1  ARG  18          1HH1      ARG  18  26.255  -3.531  -1.050
  122   1HH2  ARG  18          1HH2      ARG  18  23.442  -4.932   0.435
  123   2HH2  ARG  18          2HH2      ARG  18  25.035  -5.278  -0.122
  124    H    CYS  19           H        CYS  19  21.214   3.736  -0.818
  125    HA   CYS  19           HA       CYS  19  19.672   3.142  -3.201
  126   1HB   CYS  19          2HB       CYS  19  20.128   5.408  -2.131
  127   2HB   CYS  19          1HB       CYS  19  21.689   5.375  -2.895
  128    H    GLY  20           H        GLY  20  20.434   1.445  -4.415
  129   1HA   GLY  20          2HA       GLY  20  23.264   1.181  -5.118
  130   2HA   GLY  20          1HA       GLY  20  21.941   0.158  -5.676
  131    H    ARG  21           H        ARG  21  24.124   2.396  -6.707
  132    HA   ARG  21           HA       ARG  21  22.604   3.945  -8.528
  133   1HB   ARG  21          2HB       ARG  21  25.393   3.585  -7.850
  134   2HB   ARG  21          1HB       ARG  21  25.270   3.507  -9.593
  135   1HG   ARG  21          2HG       ARG  21  24.100   5.654  -9.671
  136   2HG   ARG  21          1HG       ARG  21  24.002   5.699  -7.920
  137   1HD   ARG  21          2HD       ARG  21  26.660   5.540  -8.038
  138   2HD   ARG  21          1HD       ARG  21  26.424   6.100  -9.688
  139    HE   ARG  21           HE       ARG  21  25.777   8.206  -8.843
  140   1HH1  ARG  21          1HH2      ARG  21  23.705   7.353  -6.949
  141   2HH1  ARG  21          2HH2      ARG  21  24.379   7.768  -5.407
  142   1HH2  ARG  21          2HH1      ARG  21  27.628   8.063  -6.691
  143   2HH2  ARG  21          1HH1      ARG  21  26.663   8.178  -5.257
  144    H    GLY  22           H        GLY  22  22.967   3.851 -10.914
  145   1HA   GLY  22          2HA       GLY  22  23.578   1.900 -12.644
  146   2HA   GLY  22          1HA       GLY  22  22.123   1.202 -11.920
  147    H    ASN  23           H        ASN  23  21.107   1.362 -13.990
  148    HA   ASN  23           HA       ASN  23  19.695   3.888 -14.346
  149   1HB   ASN  23          2HB       ASN  23  21.855   4.227 -15.627
  150   2HB   ASN  23          1HB       ASN  23  21.409   2.885 -16.667
  151   1HD2  ASN  23          2HD2      ASN  23  18.787   4.706 -18.306
  152   2HD2  ASN  23          1HD2      ASN  23  19.292   3.142 -17.881
  153    HA   PRO  24           HA       PRO  24  17.739   4.112 -14.066
  154   1HB   PRO  24          2HB       PRO  24  15.535   2.889 -12.878
  155   2HB   PRO  24          1HB       PRO  24  15.515   3.992 -14.242
  156   1HG   PRO  24          2HG       PRO  24  15.068   1.083 -14.253
  157   2HG   PRO  24          1HG       PRO  24  14.743   2.249 -15.528
  158   1HD   PRO  24          2HD       PRO  24  16.929   0.372 -15.423
  159   2HD   PRO  24          1HD       PRO  24  16.672   1.635 -16.637
  160    H    GLN  25           H        GLN  25  18.324   4.494 -11.983
  161    HA   GLN  25           HA       GLN  25  19.880   2.614 -10.509
  162   1HB   GLN  25          2HB       GLN  25  18.475   5.158  -9.577
  163   2HB   GLN  25          1HB       GLN  25  19.644   4.286  -8.602
  164   1HG   GLN  25          2HG       GLN  25  21.379   4.664 -10.333
  165   2HG   GLN  25          1HG       GLN  25  20.212   5.496 -11.350
  166   1HE2  GLN  25          2HE2      GLN  25  20.306   8.499  -9.480
  167   2HE2  GLN  25          1HE2      GLN  25  19.476   7.610 -10.663
  168    H    LYS  26           H        LYS  26  19.360   1.824  -8.255
  169    HA   LYS  26           HA       LYS  26  16.573   1.535  -7.503
  170   1HB   LYS  26          2HB       LYS  26  17.827  -0.472  -9.223
  171   2HB   LYS  26          1HB       LYS  26  17.389  -1.210  -7.697
  172   1HG   LYS  26          2HG       LYS  26  15.145  -0.797  -7.945
  173   2HG   LYS  26          1HG       LYS  26  15.346   0.555  -9.036
  174   1HD   LYS  26          2HD       LYS  26  14.617  -1.095 -10.514
  175   2HD   LYS  26          1HD       LYS  26  16.349  -1.251 -10.690
  176   1HE   LYS  26          2HE       LYS  26  15.889  -3.483 -10.267
  177   2HE   LYS  26          1HE       LYS  26  15.942  -2.978  -8.587
  178   1HZ   LYS  26          1HZ       LYS  26  13.463  -2.399  -9.045
  179   2HZ   LYS  26          3HZ       LYS  26  13.635  -3.549 -10.284
  180   3HZ   LYS  26          2HZ       LYS  26  13.933  -3.988  -8.670
  181    H    CYS  27           H        CYS  27  16.337   1.135  -5.323
  182    HA   CYS  27           HA       CYS  27  18.739   1.009  -3.745
  183   1HB   CYS  27          2HB       CYS  27  15.879   0.673  -2.704
  184   2HB   CYS  27          1HB       CYS  27  17.319   1.047  -1.840
  185    H    ILE  28           H        ILE  28  19.350  -0.625  -2.406
  186    HA   ILE  28           HA       ILE  28  18.161  -3.344  -2.732
  187    HB   ILE  28           HB       ILE  28  20.513  -4.202  -2.615
  188   1HG1  ILE  28          2HG1      ILE  28  21.245  -1.838  -1.608
  189   2HG1  ILE  28          1HG1      ILE  28  22.356  -2.858  -2.454
  190   1HG2  ILE  28          3HG2      ILE  28  19.821  -2.420  -4.986
  191   2HG2  ILE  28          2HG2      ILE  28  21.140  -3.580  -4.983
  192   3HG2  ILE  28          1HG2      ILE  28  19.485  -4.129  -4.793
  193   1HD1  ILE  28          2HD1      ILE  28  20.815  -0.720  -3.893
  194   2HD1  ILE  28          1HD1      ILE  28  22.303  -0.374  -3.026
  195   3HD1  ILE  28          3HD1      ILE  28  22.314  -1.519  -4.362
  196    H    GLY  29           H        GLY  29  19.675  -4.557  -0.795
  197   1HA   GLY  29          2HA       GLY  29  19.049  -2.951   1.623
  198   2HA   GLY  29          1HA       GLY  29  18.943  -4.681   1.582
  199    H    ALA  30           H        ALA  30  20.587  -2.532   3.082
  200    HA   ALA  30           HA       ALA  30  23.366  -2.937   2.469
  201   1HB   ALA  30          2HB       ALA  30  21.984  -2.158   5.083
  202   2HB   ALA  30          1HB       ALA  30  23.720  -2.050   4.813
  203   3HB   ALA  30          3HB       ALA  30  22.624  -1.043   3.886
  204    H    HIS  31           H        HIS  31  21.087  -4.376   4.648
  205    HA   HIS  31           HA       HIS  31  22.955  -6.565   5.397
  206   1HB   HIS  31          2HB       HIS  31  21.449  -5.244   7.088
  207   2HB   HIS  31          1HB       HIS  31  20.102  -6.156   6.424
  208    HD1  HIS  31           HD1      HIS  31  23.467  -6.913   7.941
  209    HD2  HIS  31           HD2      HIS  31  19.781  -8.633   7.586
  210    HE1  HIS  31           HE1      HIS  31  23.542  -8.993   9.267
  211   1HN   CGU  32           HN       CGU  32  22.128  -6.329   2.783
  212    HA   CGU  32           HA       CGU  32  20.877  -8.943   2.298
  213   1HB   CGU  32          1HB       CGU  32  19.783  -6.602   0.675
  214   2HB   CGU  32          2HB       CGU  32  19.185  -6.839   2.293
  215    HG   CGU  32           HG       CGU  32  18.844  -9.345   1.475
  216    H    ASP  33           H        ASP  33  22.808  -9.574   1.552
  217    HA   ASP  33           HA       ASP  33  23.900  -8.210  -0.884
  218   1HB   ASP  33          2HB       ASP  33  25.226  -8.572   1.531
  219   2HB   ASP  33          1HB       ASP  33  25.698 -10.037   0.701
  220    H    VAL  34           H        VAL  34  21.783  -9.914  -0.991
  221    HA   VAL  34           HA       VAL  34  22.835 -12.053  -2.696
  222    HB   VAL  34           HB       VAL  34  22.846 -13.199  -0.567
  223   1HG1  VAL  34          1HG1      VAL  34  21.173 -11.520   0.550
  224   2HG1  VAL  34          3HG1      VAL  34  19.918 -12.615  -0.003
  225   3HG1  VAL  34          2HG1      VAL  34  21.161 -13.187   1.087
  226   1HG2  VAL  34          1HG2      VAL  34  21.811 -14.399  -2.569
  227   2HG2  VAL  34          3HG2      VAL  34  21.416 -15.069  -0.997
  228   3HG2  VAL  34          2HG2      VAL  34  20.239 -14.085  -1.849
   
  No H/Q in entry =         228
  Start of MODEL   12
    1   1H    ALA   1          2H        ALA   1   7.532   9.171   0.120
    2   2H    ALA   1          1H        ALA   1   6.027   8.930   0.872
    3   3H    ALA   1          3H        ALA   1   7.105  10.092   1.482
    4    HA   ALA   1           HA       ALA   1   7.978   8.609   2.827
    5   1HB   ALA   1          1HB       ALA   1   5.751   7.472   2.727
    6   2HB   ALA   1          3HB       ALA   1   6.294   6.536   1.343
    7   3HB   ALA   1          2HB       ALA   1   7.046   6.301   2.914
    8    H    CYS   2           H        CYS   2   9.613   7.043   2.980
    9    HA   CYS   2           HA       CYS   2  11.687   7.097   1.177
   10   1HB   CYS   2          2HB       CYS   2  12.473   5.020   2.330
   11   2HB   CYS   2          1HB       CYS   2  12.053   6.295   3.418
   12    H    SER   3           H        SER   3  12.759   5.214   0.122
   13    HA   SER   3           HA       SER   3  10.901   4.010  -1.864
   14   1HB   SER   3          2HB       SER   3  12.827   5.260  -2.737
   15   2HB   SER   3          1HB       SER   3  13.965   4.230  -1.856
   16    HG   SER   3           HG       SER   3  13.167   2.469  -3.020
   17    H    GLY   4           H        GLY   4  11.315   1.699  -2.522
   18   1HA   GLY   4          2HA       GLY   4  12.132   0.022  -0.178
   19   2HA   GLY   4          1HA       GLY   4  10.748  -0.350  -1.196
   20    H    ARG   5           H        ARG   5  12.248  -2.360  -1.053
   21    HA   ARG   5           HA       ARG   5  14.571  -2.466  -2.678
   22   1HB   ARG   5          2HB       ARG   5  12.589  -4.635  -1.820
   23   2HB   ARG   5          1HB       ARG   5  14.019  -5.022  -2.752
   24   1HG   ARG   5          2HG       ARG   5  15.498  -4.479  -1.014
   25   2HG   ARG   5          1HG       ARG   5  14.346  -3.419  -0.228
   26   1HD   ARG   5          2HD       ARG   5  14.176  -5.214   1.200
   27   2HD   ARG   5          1HD       ARG   5  12.956  -5.721   0.036
   28    HE   ARG   5           HE       ARG   5  15.309  -6.752  -0.991
   29   1HH1  ARG   5          2HH1      ARG   5  15.487  -6.585   2.213
   30   2HH1  ARG   5          1HH1      ARG   5  15.267  -8.267   2.565
   31   1HH2  ARG   5          1HH2      ARG   5  14.223  -9.025  -0.686
   32   2HH2  ARG   5          2HH2      ARG   5  14.534  -9.679   0.888
   33    H    GLY   6           H        GLY   6  14.428  -1.725  -4.718
   34   1HA   GLY   6          2HA       GLY   6  13.946  -2.716  -7.014
   35   2HA   GLY   6          1HA       GLY   6  12.265  -2.760  -6.521
   36    H    SER   7           H        SER   7  13.298  -0.019  -5.138
   37    HA   SER   7           HA       SER   7  12.926   1.662  -7.594
   38   1HB   SER   7          2HB       SER   7  11.696   3.226  -5.703
   39   2HB   SER   7          1HB       SER   7  10.787   2.019  -6.618
   40    HG   SER   7           HG       SER   7  11.884   1.930  -4.085
   41    H    ARG   8           H        ARG   8  14.149   3.477  -7.667
   42    HA   ARG   8           HA       ARG   8  16.537   3.566  -6.033
   43   1HB   ARG   8          2HB       ARG   8  17.140   5.468  -7.548
   44   2HB   ARG   8          1HB       ARG   8  16.645   4.032  -8.391
   45   1HG   ARG   8          2HG       ARG   8  14.390   5.879  -7.773
   46   2HG   ARG   8          1HG       ARG   8  15.603   6.551  -8.831
   47   1HD   ARG   8          2HD       ARG   8  15.144   5.074 -10.559
   48   2HD   ARG   8          1HD       ARG   8  14.671   3.765  -9.479
   49    HE   ARG   8           HE       ARG   8  12.723   5.696  -9.090
   50   1HH1  ARG   8          2HH1      ARG   8  12.529   6.763 -11.578
   51   2HH1  ARG   8          1HH1      ARG   8  11.761   5.594 -12.600
   52   1HH2  ARG   8          1HH2      ARG   8  12.430   2.943 -10.407
   53   2HH2  ARG   8          2HH2      ARG   8  11.703   3.377 -11.918
   54    H    CYS   9           H        CYS   9  17.263   6.065  -5.768
   55    HA   CYS   9           HA       CYS   9  15.354   7.267  -3.884
   56   1HB   CYS   9          2HB       CYS   9  17.111   7.794  -2.406
   57   2HB   CYS   9          1HB       CYS   9  17.388   6.146  -2.879
   58    HA   HYP  10           HA       HYP  10  15.205   8.987  -2.772
   59   1HB   HYP  10          1HB       HYP  10  15.016  11.091  -2.012
   60   2HB   HYP  10          2HB       HYP  10  13.597  11.308  -3.005
   61   1HD   HYP  10          1HD1      HYP  10  17.199  11.282  -5.106
   62   2HD   HYP  10          2HD1      HYP  10  15.693  11.235  -6.030
   63    HOD  HYP  10           HD2      HYP  10  17.005  11.737  -2.840
   64    HG   HYP  10           HG       HYP  10  14.886  12.777  -4.424
   65    HA   HYP  11           HA       HYP  11  12.732  10.038  -1.622
   66   1HB   HYP  11          1HB       HYP  11  10.706   9.444  -0.852
   67   2HB   HYP  11          2HB       HYP  11  11.263   7.795  -0.638
   68   1HD   HYP  11          1HD1      HYP  11  10.776   9.052  -4.503
   69   2HD   HYP  11          2HD1      HYP  11  11.349   7.385  -4.355
   70    HOD  HYP  11           HD2      HYP  11   8.462   8.509  -2.757
   71    HG   HYP  11           HG       HYP  11   9.995   7.102  -2.456
   72    H    GLN  12           H        GLN  12  14.299   9.695  -0.156
   73    HA   GLN  12           HA       GLN  12  16.401   7.943  -0.368
   74   1HB   GLN  12          2HB       GLN  12  15.120   9.059   2.154
   75   2HB   GLN  12          1HB       GLN  12  16.672   8.247   2.169
   76   1HG   GLN  12          2HG       GLN  12  17.776  10.032   1.232
   77   2HG   GLN  12          1HG       GLN  12  16.491  10.375   0.086
   78   1HE2  GLN  12          2HE2      GLN  12  16.633  12.373   3.612
   79   2HE2  GLN  12          1HE2      GLN  12  17.747  11.143   3.260
   80    H    CYS  13           H        CYS  13  16.610   5.784  -0.277
   81    HA   CYS  13           HA       CYS  13  14.516   3.984   0.101
   82   1HB   CYS  13          2HB       CYS  13  17.184   3.018   0.988
   83   2HB   CYS  13          1HB       CYS  13  16.030   2.341  -0.110
   84    H    CYS  14           H        CYS  14  13.611   2.971   1.648
   85    HA   CYS  14           HA       CYS  14  13.394   3.932   4.251
   86   1HB   CYS  14          2HB       CYS  14  12.807   1.155   3.212
   87   2HB   CYS  14          1HB       CYS  14  12.159   1.809   4.682
   88    H    MET  15           H        MET  15  13.677   2.599   6.249
   89    HA   MET  15           HA       MET  15  16.392   2.254   6.854
   90   1HB   MET  15          2HB       MET  15  14.684   2.652   8.591
   91   2HB   MET  15          1HB       MET  15  13.902   1.129   8.225
   92   1HG   MET  15          2HG       MET  15  15.536  -0.129   9.265
   93   2HG   MET  15          1HG       MET  15  16.802   1.028   8.983
   94   1HE   MET  15          2HE       MET  15  16.671   3.502  10.248
   95   2HE   MET  15          1HE       MET  15  16.976   3.210  11.951
   96   3HE   MET  15          3HE       MET  15  17.891   2.306  10.756
   97    H    GLY  16           H        GLY  16  17.768   0.705   6.493
   98   1HA   GLY  16          2HA       GLY  16  18.458  -1.610   6.525
   99   2HA   GLY  16          1HA       GLY  16  16.866  -2.050   5.917
  100    H    LEU  17           H        LEU  17  16.850   0.179   3.966
  101    HA   LEU  17           HA       LEU  17  18.472  -1.143   1.924
  102   1HB   LEU  17          2HB       LEU  17  16.209   0.856   1.788
  103   2HB   LEU  17          1HB       LEU  17  17.236   0.585   0.402
  104    HG   LEU  17           HG       LEU  17  16.538  -2.018   1.312
  105   1HD1  LEU  17          3HD1      LEU  17  14.636  -0.955   2.504
  106   2HD1  LEU  17          2HD1      LEU  17  14.126  -0.204   0.994
  107   3HD1  LEU  17          1HD1      LEU  17  14.075  -1.948   1.170
  108   1HD2  LEU  17          3HD2      LEU  17  16.785  -0.721  -1.105
  109   2HD2  LEU  17          2HD2      LEU  17  16.163  -2.332  -0.899
  110   3HD2  LEU  17          1HD2      LEU  17  15.060  -0.969  -1.026
  111    H    ARG  18           H        ARG  18  19.387   0.106   0.285
  112    HA   ARG  18           HA       ARG  18  20.654   2.686   0.954
  113   1HB   ARG  18          2HB       ARG  18  22.763   1.510  -0.156
  114   2HB   ARG  18          1HB       ARG  18  22.469   1.359   1.560
  115   1HG   ARG  18          2HG       ARG  18  21.586  -0.853   1.290
  116   2HG   ARG  18          1HG       ARG  18  21.346  -0.649  -0.427
  117   1HD   ARG  18          2HD       ARG  18  24.112  -0.675   0.845
  118   2HD   ARG  18          1HD       ARG  18  23.345  -2.094   0.128
  119    HE   ARG  18           HE       ARG  18  23.273   0.115  -1.707
  120   1HH1  ARG  18          2HH1      ARG  18  23.810  -2.273  -2.990
  121   2HH1  ARG  18          1HH1      ARG  18  25.531  -2.377  -3.157
  122   1HH2  ARG  18          1HH2      ARG  18  26.110   0.052  -0.697
  123   2HH2  ARG  18          2HH2      ARG  18  26.871  -1.023  -1.824
  124    H    CYS  19           H        CYS  19  21.208   3.787  -0.852
  125    HA   CYS  19           HA       CYS  19  19.603   3.278  -3.232
  126   1HB   CYS  19          2HB       CYS  19  20.221   5.522  -2.125
  127   2HB   CYS  19          1HB       CYS  19  21.733   5.411  -2.974
  128    H    GLY  20           H        GLY  20  20.327   1.477  -4.359
  129   1HA   GLY  20          2HA       GLY  20  23.108   1.015  -5.015
  130   2HA   GLY  20          1HA       GLY  20  21.718   0.179  -5.707
  131    H    ARG  21           H        ARG  21  24.080   2.511  -6.275
  132    HA   ARG  21           HA       ARG  21  22.799   4.137  -8.214
  133   1HB   ARG  21          2HB       ARG  21  25.168   4.310  -6.955
  134   2HB   ARG  21          1HB       ARG  21  25.750   3.531  -8.406
  135   1HG   ARG  21          2HG       ARG  21  25.921   5.717  -9.136
  136   2HG   ARG  21          1HG       ARG  21  24.254   5.463  -9.596
  137   1HD   ARG  21          2HD       ARG  21  24.177   7.497  -8.374
  138   2HD   ARG  21          1HD       ARG  21  23.688   6.315  -7.162
  139    HE   ARG  21           HE       ARG  21  26.580   6.943  -7.332
  140   1HH1  ARG  21          1HH2      ARG  21  26.575   6.014  -4.933
  141   2HH1  ARG  21          2HH2      ARG  21  25.913   7.173  -3.827
  142   1HH2  ARG  21          2HH1      ARG  21  24.388   9.034  -6.371
  143   2HH2  ARG  21          1HH1      ARG  21  24.646   8.925  -4.661
  144    H    GLY  22           H        GLY  22  23.098   4.137 -10.496
  145   1HA   GLY  22          2HA       GLY  22  24.228   2.513 -12.305
  146   2HA   GLY  22          1HA       GLY  22  22.960   1.442 -11.698
  147    H    ASN  23           H        ASN  23  22.223   1.572 -13.968
  148    HA   ASN  23           HA       ASN  23  20.256   3.735 -14.288
  149   1HB   ASN  23          2HB       ASN  23  21.026   3.641 -16.821
  150   2HB   ASN  23          1HB       ASN  23  21.865   4.684 -15.682
  151   1HD2  ASN  23          2HD2      ASN  23  23.781   1.476 -17.317
  152   2HD2  ASN  23          1HD2      ASN  23  22.118   1.709 -17.569
  153    HA   PRO  24           HA       PRO  24  18.275   3.733 -14.252
  154   1HB   PRO  24          2HB       PRO  24  16.028   2.419 -13.299
  155   2HB   PRO  24          1HB       PRO  24  16.138   3.338 -14.791
  156   1HG   PRO  24          2HG       PRO  24  15.991   0.408 -14.453
  157   2HG   PRO  24          1HG       PRO  24  15.724   1.363 -15.906
  158   1HD   PRO  24          2HD       PRO  24  18.066  -0.191 -15.265
  159   2HD   PRO  24          1HD       PRO  24  17.847   0.870 -16.667
  160    H    GLN  25           H        GLN  25  18.582   4.330 -12.168
  161    HA   GLN  25           HA       GLN  25  20.019   2.722 -10.323
  162   1HB   GLN  25          2HB       GLN  25  18.410   5.279 -10.024
  163   2HB   GLN  25          1HB       GLN  25  19.086   4.500  -8.607
  164   1HG   GLN  25          2HG       GLN  25  21.336   4.523  -9.964
  165   2HG   GLN  25          1HG       GLN  25  20.538   5.741 -10.946
  166   1HE2  GLN  25          2HE2      GLN  25  21.946   8.004  -8.620
  167   2HE2  GLN  25          1HE2      GLN  25  22.079   7.336 -10.175
  168    H    LYS  26           H        LYS  26  19.359   1.871  -8.262
  169    HA   LYS  26           HA       LYS  26  16.540   1.519  -7.639
  170   1HB   LYS  26          2HB       LYS  26  17.975  -0.523  -9.229
  171   2HB   LYS  26          1HB       LYS  26  17.361  -1.202  -7.735
  172   1HG   LYS  26          2HG       LYS  26  15.128  -0.328  -8.218
  173   2HG   LYS  26          1HG       LYS  26  15.668   0.369  -9.726
  174   1HD   LYS  26          2HD       LYS  26  16.057  -2.594  -9.180
  175   2HD   LYS  26          1HD       LYS  26  14.524  -1.993  -9.774
  176   1HE   LYS  26          2HE       LYS  26  15.769  -0.892 -11.701
  177   2HE   LYS  26          1HE       LYS  26  17.230  -1.699 -11.147
  178   1HZ   LYS  26          3HZ       LYS  26  14.900  -3.386 -11.479
  179   2HZ   LYS  26          2HZ       LYS  26  15.556  -2.737 -12.903
  180   3HZ   LYS  26          1HZ       LYS  26  16.526  -3.675 -11.871
  181    H    CYS  27           H        CYS  27  16.264   1.169  -5.444
  182    HA   CYS  27           HA       CYS  27  18.656   1.084  -3.830
  183   1HB   CYS  27          2HB       CYS  27  15.773   0.810  -2.866
  184   2HB   CYS  27          1HB       CYS  27  17.187   1.108  -1.936
  185    H    ILE  28           H        ILE  28  19.215  -0.581  -2.460
  186    HA   ILE  28           HA       ILE  28  17.874  -3.226  -2.741
  187    HB   ILE  28           HB       ILE  28  20.122  -4.277  -2.865
  188   1HG1  ILE  28          2HG1      ILE  28  21.273  -2.307  -1.665
  189   2HG1  ILE  28          1HG1      ILE  28  22.110  -3.109  -2.930
  190   1HG2  ILE  28          1HG2      ILE  28  19.466  -2.328  -5.097
  191   2HG2  ILE  28          3HG2      ILE  28  20.807  -3.455  -5.200
  192   3HG2  ILE  28          2HG2      ILE  28  19.171  -4.053  -5.016
  193   1HD1  ILE  28          1HD1      ILE  28  20.640  -0.868  -4.051
  194   2HD1  ILE  28          3HD1      ILE  28  21.664  -0.365  -2.721
  195   3HD1  ILE  28          2HD1      ILE  28  22.359  -1.221  -4.082
  196    H    GLY  29           H        GLY  29  19.360  -4.597  -0.943
  197   1HA   GLY  29          2HA       GLY  29  18.955  -2.995   1.492
  198   2HA   GLY  29          1HA       GLY  29  18.951  -4.717   1.444
  199    H    ALA  30           H        ALA  30  20.476  -2.650   2.940
  200    HA   ALA  30           HA       ALA  30  23.297  -2.963   2.168
  201   1HB   ALA  30          3HB       ALA  30  21.845  -1.601   4.474
  202   2HB   ALA  30          2HB       ALA  30  23.596  -1.747   4.459
  203   3HB   ALA  30          1HB       ALA  30  22.781  -0.841   3.198
  204    H    HIS  31           H        HIS  31  21.096  -3.874   4.709
  205    HA   HIS  31           HA       HIS  31  22.938  -5.897   5.847
  206   1HB   HIS  31          2HB       HIS  31  21.343  -4.252   7.181
  207   2HB   HIS  31          1HB       HIS  31  20.067  -5.382   6.759
  208    HD1  HIS  31           HD1      HIS  31  22.252  -7.827   7.135
  209    HD2  HIS  31           HD2      HIS  31  21.100  -5.064   9.910
  210    HE1  HIS  31           HE1      HIS  31  22.732  -8.819   9.343
  211   1HN   CGU  32           HN       CGU  32  22.140  -6.228   3.253
  212    HA   CGU  32           HA       CGU  32  20.166  -8.437   3.156
  213   1HB   CGU  32          1HB       CGU  32  21.658  -7.080   0.884
  214   2HB   CGU  32          2HB       CGU  32  20.256  -6.347   1.611
  215    HG   CGU  32           HG       CGU  32  20.020  -9.158   0.599
  216    H    ASP  33           H        ASP  33  22.674  -8.668   4.423
  217    HA   ASP  33           HA       ASP  33  24.528 -10.041   4.624
  218   1HB   ASP  33          2HB       ASP  33  22.541 -11.675   4.408
  219   2HB   ASP  33          1HB       ASP  33  22.954 -11.841   2.719
  220    H    VAL  34           H        VAL  34  24.628  -8.056   2.691
  221    HA   VAL  34           HA       VAL  34  26.225  -9.199   0.450
  222    HB   VAL  34           HB       VAL  34  24.848  -6.504   0.865
  223   1HG1  VAL  34          1HG1      VAL  34  26.782  -7.351  -1.334
  224   2HG1  VAL  34          3HG1      VAL  34  25.680  -5.995  -1.503
  225   3HG1  VAL  34          2HG1      VAL  34  26.924  -5.959  -0.272
  226   1HG2  VAL  34          2HG2      VAL  34  23.771  -8.835  -0.092
  227   2HG2  VAL  34          1HG2      VAL  34  23.261  -7.253  -0.646
  228   3HG2  VAL  34          3HG2      VAL  34  24.410  -8.184  -1.582
   
  No H/Q in entry =         228
  Start of MODEL   13
    1   1H    ALA   1          2H        ALA   1   8.939  10.711   2.310
    2   2H    ALA   1          1H        ALA   1   7.535  10.367   3.202
    3   3H    ALA   1          3H        ALA   1   9.036   9.748   3.707
    4    HA   ALA   1           HA       ALA   1   7.767   8.017   2.672
    5   1HB   ALA   1          1HB       ALA   1   7.756   9.905   0.275
    6   2HB   ALA   1          3HB       ALA   1   7.191   8.241   0.234
    7   3HB   ALA   1          2HB       ALA   1   6.352   9.433   1.217
    8    H    CYS   2           H        CYS   2   9.208   6.479   2.350
    9    HA   CYS   2           HA       CYS   2  11.825   7.114   1.081
   10   1HB   CYS   2          2HB       CYS   2  12.509   4.988   2.230
   11   2HB   CYS   2          1HB       CYS   2  12.049   6.213   3.360
   12    H    SER   3           H        SER   3  12.804   4.982   0.197
   13    HA   SER   3           HA       SER   3  10.954   3.965  -1.921
   14   1HB   SER   3          2HB       SER   3  12.804   5.022  -2.977
   15   2HB   SER   3          1HB       SER   3  13.958   4.406  -1.792
   16    HG   SER   3           HG       SER   3  13.715   3.390  -3.936
   17    H    GLY   4           H        GLY   4  10.854   1.786  -2.357
   18   1HA   GLY   4          2HA       GLY   4  11.687  -0.030  -0.134
   19   2HA   GLY   4          1HA       GLY   4  10.429  -0.371  -1.327
   20    H    ARG   5           H        ARG   5  12.317  -2.284  -0.982
   21    HA   ARG   5           HA       ARG   5  14.620  -1.997  -2.677
   22   1HB   ARG   5          2HB       ARG   5  14.193  -3.725  -0.798
   23   2HB   ARG   5          1HB       ARG   5  13.247  -4.626  -1.967
   24   1HG   ARG   5          2HG       ARG   5  15.281  -4.571  -3.511
   25   2HG   ARG   5          1HG       ARG   5  16.169  -3.823  -2.196
   26   1HD   ARG   5          2HD       ARG   5  14.711  -6.409  -1.646
   27   2HD   ARG   5          1HD       ARG   5  16.235  -6.450  -2.529
   28    HE   ARG   5           HE       ARG   5  16.077  -5.032   0.098
   29   1HH1  ARG   5          1HH2      ARG   5  18.492  -5.595  -1.754
   30   2HH1  ARG   5          2HH2      ARG   5  19.297  -6.838  -0.866
   31   1HH2  ARG   5          2HH1      ARG   5  16.510  -7.427   1.191
   32   2HH2  ARG   5          1HH1      ARG   5  18.139  -7.909   0.856
   33    H    GLY   6           H        GLY   6  14.022  -1.183  -4.588
   34   1HA   GLY   6          2HA       GLY   6  13.832  -2.453  -6.886
   35   2HA   GLY   6          1HA       GLY   6  12.161  -2.666  -6.368
   36    H    SER   7           H        SER   7  12.849   0.136  -4.984
   37    HA   SER   7           HA       SER   7  11.911   1.755  -7.311
   38   1HB   SER   7          2HB       SER   7  11.118   1.667  -4.484
   39   2HB   SER   7          1HB       SER   7  11.730   3.281  -4.875
   40    HG   SER   7           HG       SER   7   9.856   3.505  -5.730
   41    H    ARG   8           H        ARG   8  12.859   3.841  -7.533
   42    HA   ARG   8           HA       ARG   8  15.742   3.817  -7.357
   43   1HB   ARG   8          2HB       ARG   8  15.529   6.064  -8.459
   44   2HB   ARG   8          1HB       ARG   8  14.592   4.833  -9.271
   45   1HG   ARG   8          2HG       ARG   8  13.059   6.181  -7.108
   46   2HG   ARG   8          1HG       ARG   8  13.623   7.296  -8.323
   47   1HD   ARG   8          2HD       ARG   8  12.456   6.189 -10.077
   48   2HD   ARG   8          1HD       ARG   8  12.203   4.733  -9.115
   49    HE   ARG   8           HE       ARG   8  10.953   6.819  -7.703
   50   1HH1  ARG   8          1HH2      ARG   8  10.290   7.892 -10.357
   51   2HH1  ARG   8          2HH2      ARG   8   8.833   7.054 -10.772
   52   1HH2  ARG   8          2HH1      ARG   8   9.350   4.575  -8.339
   53   2HH2  ARG   8          1HH1      ARG   8   8.283   5.113  -9.595
   54    H    CYS   9           H        CYS   9  16.583   6.239  -6.799
   55    HA   CYS   9           HA       CYS   9  15.605   7.037  -4.176
   56   1HB   CYS   9          2HB       CYS   9  18.167   6.935  -3.474
   57   2HB   CYS   9          1HB       CYS   9  17.067   5.608  -3.255
   58    HA   HYP  10           HA       HYP  10  15.501   8.671  -3.006
   59   1HB   HYP  10          1HB       HYP  10  15.349  10.751  -2.190
   60   2HB   HYP  10          2HB       HYP  10  14.002  11.054  -3.258
   61   1HD   HYP  10          1HD1      HYP  10  17.838  10.933  -4.894
   62   2HD   HYP  10          2HD1      HYP  10  16.528  11.031  -6.077
   63    HOD  HYP  10           HD2      HYP  10  16.496  12.934  -2.680
   64    HG   HYP  10           HG       HYP  10  15.452  12.481  -4.580
   65    HA   HYP  11           HA       HYP  11  12.814   9.716  -2.129
   66   1HB   HYP  11          1HB       HYP  11  10.679   8.977  -1.857
   67   2HB   HYP  11          2HB       HYP  11  11.370   7.556  -1.089
   68   1HD   HYP  11          1HD1      HYP  11  11.284   8.263  -5.123
   69   2HD   HYP  11          2HD1      HYP  11  12.197   6.765  -4.884
   70    HOD  HYP  11           HD2      HYP  11   9.230   7.021  -4.124
   71    HG   HYP  11           HG       HYP  11  10.916   6.212  -2.984
   72    H    GLN  12           H        GLN  12  14.221   9.526  -0.466
   73    HA   GLN  12           HA       GLN  12  16.450   7.877  -0.470
   74   1HB   GLN  12          2HB       GLN  12  15.078   8.922   2.057
   75   2HB   GLN  12          1HB       GLN  12  16.784   8.549   1.871
   76   1HG   GLN  12          2HG       GLN  12  16.682  10.317  -0.111
   77   2HG   GLN  12          1HG       GLN  12  15.201  10.847   0.667
   78   1HE2  GLN  12          2HE2      GLN  12  18.049  12.859   1.965
   79   2HE2  GLN  12          1HE2      GLN  12  17.406  12.532   0.425
   80    H    CYS  13           H        CYS  13  16.638   5.731  -0.309
   81    HA   CYS  13           HA       CYS  13  14.596   3.916   0.120
   82   1HB   CYS  13          2HB       CYS  13  17.279   3.075   1.098
   83   2HB   CYS  13          1HB       CYS  13  16.134   2.298   0.053
   84    H    CYS  14           H        CYS  14  13.728   2.834   1.608
   85    HA   CYS  14           HA       CYS  14  13.355   3.832   4.209
   86   1HB   CYS  14          2HB       CYS  14  12.789   1.071   3.126
   87   2HB   CYS  14          1HB       CYS  14  12.050   1.747   4.542
   88    H    MET  15           H        MET  15  13.445   2.282   6.137
   89    HA   MET  15           HA       MET  15  16.101   2.014   6.984
   90   1HB   MET  15          2HB       MET  15  14.006   2.150   8.438
   91   2HB   MET  15          1HB       MET  15  13.717   0.460   8.081
   92   1HG   MET  15          2HG       MET  15  14.865   0.550  10.174
   93   2HG   MET  15          1HG       MET  15  15.990  -0.072   9.009
   94   1HE   MET  15          2HE       MET  15  15.408   2.129  11.864
   95   2HE   MET  15          1HE       MET  15  16.308   3.606  11.590
   96   3HE   MET  15          3HE       MET  15  14.834   3.326  10.676
   97    H    GLY  16           H        GLY  16  17.596   0.541   6.719
   98   1HA   GLY  16          2HA       GLY  16  18.489  -1.655   6.595
   99   2HA   GLY  16          1HA       GLY  16  16.934  -2.236   6.027
  100    H    LEU  17           H        LEU  17  16.873   0.115   4.074
  101    HA   LEU  17           HA       LEU  17  18.418  -1.236   1.993
  102   1HB   LEU  17          2HB       LEU  17  16.431   1.052   1.833
  103   2HB   LEU  17          1HB       LEU  17  17.178   0.351   0.427
  104    HG   LEU  17           HG       LEU  17  15.124  -0.858   2.286
  105   1HD1  LEU  17          2HD1      LEU  17  14.507   0.691   0.377
  106   2HD1  LEU  17          1HD1      LEU  17  14.982  -0.611  -0.703
  107   3HD1  LEU  17          3HD1      LEU  17  13.684  -0.857   0.463
  108   1HD2  LEU  17          3HD2      LEU  17  16.875  -2.644   1.631
  109   2HD2  LEU  17          2HD2      LEU  17  15.233  -2.972   1.132
  110   3HD2  LEU  17          1HD2      LEU  17  16.384  -2.364  -0.036
  111    H    ARG  18           H        ARG  18  19.404   0.048   0.350
  112    HA   ARG  18           HA       ARG  18  20.667   2.605   1.093
  113   1HB   ARG  18          2HB       ARG  18  22.805   1.416   0.014
  114   2HB   ARG  18          1HB       ARG  18  22.494   1.351   1.735
  115   1HG   ARG  18          2HG       ARG  18  21.762  -0.848   1.662
  116   2HG   ARG  18          1HG       ARG  18  21.331  -0.799  -0.025
  117   1HD   ARG  18          2HD       ARG  18  24.240  -0.545   0.833
  118   2HD   ARG  18          1HD       ARG  18  23.485  -2.109   0.529
  119    HE   ARG  18           HE       ARG  18  22.951  -0.302  -1.638
  120   1HH1  ARG  18          2HH1      ARG  18  24.317  -3.209  -0.989
  121   2HH1  ARG  18          1HH1      ARG  18  25.638  -3.080  -2.105
  122   1HH2  ARG  18          1HH2      ARG  18  25.069   0.316  -2.726
  123   2HH2  ARG  18          2HH2      ARG  18  26.072  -1.044  -3.109
  124    H    CYS  19           H        CYS  19  21.243   3.724  -0.670
  125    HA   CYS  19           HA       CYS  19  19.741   3.202  -3.091
  126   1HB   CYS  19          2HB       CYS  19  19.992   5.427  -2.160
  127   2HB   CYS  19          1HB       CYS  19  21.712   5.384  -2.438
  128    H    GLY  20           H        GLY  20  20.366   1.712  -4.496
  129   1HA   GLY  20          2HA       GLY  20  23.191   1.268  -5.183
  130   2HA   GLY  20          1HA       GLY  20  21.794   0.405  -5.845
  131    H    ARG  21           H        ARG  21  24.051   2.816  -6.414
  132    HA   ARG  21           HA       ARG  21  22.664   4.551  -8.169
  133   1HB   ARG  21          2HB       ARG  21  25.586   3.785  -7.902
  134   2HB   ARG  21          1HB       ARG  21  25.049   5.033  -9.006
  135   1HG   ARG  21          2HG       ARG  21  24.561   6.540  -7.322
  136   2HG   ARG  21          1HG       ARG  21  24.015   5.302  -6.208
  137   1HD   ARG  21          2HD       ARG  21  26.119   6.318  -5.402
  138   2HD   ARG  21          1HD       ARG  21  26.377   4.620  -5.792
  139    HE   ARG  21           HE       ARG  21  27.056   6.774  -7.761
  140   1HH1  ARG  21          2HH1      ARG  21  27.507   3.965  -8.524
  141   2HH1  ARG  21          1HH1      ARG  21  29.165   3.703  -8.100
  142   1HH2  ARG  21          1HH2      ARG  21  29.295   6.525  -6.031
  143   2HH2  ARG  21          2HH2      ARG  21  30.203   5.189  -6.654
  144    H    GLY  22           H        GLY  22  21.949   4.247 -10.141
  145   1HA   GLY  22          2HA       GLY  22  23.246   2.774 -12.217
  146   2HA   GLY  22          1HA       GLY  22  21.964   1.779 -11.518
  147    H    ASN  23           H        ASN  23  21.302   2.088 -13.879
  148    HA   ASN  23           HA       ASN  23  19.375   4.331 -14.025
  149   1HB   ASN  23          2HB       ASN  23  20.013   4.159 -16.617
  150   2HB   ASN  23          1HB       ASN  23  20.916   5.201 -15.532
  151   1HD2  ASN  23          2HD2      ASN  23  22.666   1.829 -17.064
  152   2HD2  ASN  23          1HD2      ASN  23  20.983   2.034 -17.169
  153    HA   PRO  24           HA       PRO  24  17.426   4.377 -13.748
  154   1HB   PRO  24          2HB       PRO  24  15.286   3.156 -12.504
  155   2HB   PRO  24          1HB       PRO  24  15.232   4.028 -14.028
  156   1HG   PRO  24          2HG       PRO  24  15.068   1.108 -13.575
  157   2HG   PRO  24          1HG       PRO  24  14.617   2.027 -15.004
  158   1HD   PRO  24          2HD       PRO  24  17.006   0.446 -14.643
  159   2HD   PRO  24          1HD       PRO  24  16.609   1.463 -16.037
  160    H    GLN  25           H        GLN  25  17.900   4.969 -11.678
  161    HA   GLN  25           HA       GLN  25  19.603   3.416 -10.020
  162   1HB   GLN  25          2HB       GLN  25  17.735   5.704  -9.227
  163   2HB   GLN  25          1HB       GLN  25  18.957   5.033  -8.166
  164   1HG   GLN  25          2HG       GLN  25  20.738   5.698  -9.756
  165   2HG   GLN  25          1HG       GLN  25  19.523   6.360 -10.847
  166   1HE2  GLN  25          2HE2      GLN  25  20.190   8.284  -7.268
  167   2HE2  GLN  25          1HE2      GLN  25  20.465   6.611  -7.370
  168    H    LYS  26           H        LYS  26  19.180   2.215  -8.076
  169    HA   LYS  26           HA       LYS  26  16.412   1.770  -7.249
  170   1HB   LYS  26          2HB       LYS  26  17.850  -0.177  -9.007
  171   2HB   LYS  26          1HB       LYS  26  17.028  -0.888  -7.635
  172   1HG   LYS  26          2HG       LYS  26  14.962   0.540  -8.380
  173   2HG   LYS  26          1HG       LYS  26  15.812   0.726  -9.901
  174   1HD   LYS  26          2HD       LYS  26  15.305  -2.008  -8.674
  175   2HD   LYS  26          1HD       LYS  26  14.157  -1.229  -9.743
  176   1HE   LYS  26          2HE       LYS  26  15.948  -1.045 -11.502
  177   2HE   LYS  26          1HE       LYS  26  17.032  -1.947 -10.447
  178   1HZ   LYS  26          2HZ       LYS  26  14.952  -3.560 -10.431
  179   2HZ   LYS  26          1HZ       LYS  26  14.727  -2.856 -11.960
  180   3HZ   LYS  26          3HZ       LYS  26  16.183  -3.652 -11.598
  181    H    CYS  27           H        CYS  27  16.271   1.368  -5.209
  182    HA   CYS  27           HA       CYS  27  18.564   1.099  -3.543
  183   1HB   CYS  27          2HB       CYS  27  15.612   0.796  -2.772
  184   2HB   CYS  27          1HB       CYS  27  16.973   1.007  -1.719
  185    H    ILE  28           H        ILE  28  19.241  -0.569  -2.378
  186    HA   ILE  28           HA       ILE  28  18.052  -3.287  -2.723
  187    HB   ILE  28           HB       ILE  28  20.449  -4.126  -2.739
  188   1HG1  ILE  28          2HG1      ILE  28  21.210  -1.768  -1.777
  189   2HG1  ILE  28          1HG1      ILE  28  22.272  -2.719  -2.753
  190   1HG2  ILE  28          1HG2      ILE  28  19.508  -2.393  -5.051
  191   2HG2  ILE  28          3HG2      ILE  28  20.909  -3.448  -5.146
  192   3HG2  ILE  28          2HG2      ILE  28  19.319  -4.124  -4.846
  193   1HD1  ILE  28          2HD1      ILE  28  20.545  -0.670  -4.091
  194   2HD1  ILE  28          1HD1      ILE  28  22.020  -0.205  -3.265
  195   3HD1  ILE  28          3HD1      ILE  28  22.085  -1.358  -4.593
  196    H    GLY  29           H        GLY  29  19.847  -4.517  -0.907
  197   1HA   GLY  29          2HA       GLY  29  19.171  -3.045   1.566
  198   2HA   GLY  29          1HA       GLY  29  19.272  -4.764   1.467
  199    H    ALA  30           H        ALA  30  20.546  -2.708   3.120
  200    HA   ALA  30           HA       ALA  30  23.440  -2.830   2.573
  201   1HB   ALA  30          1HB       ALA  30  21.710  -1.555   4.731
  202   2HB   ALA  30          3HB       ALA  30  23.453  -1.654   4.922
  203   3HB   ALA  30          2HB       ALA  30  22.771  -0.751   3.586
  204    H    HIS  31           H        HIS  31  21.008  -4.152   4.624
  205    HA   HIS  31           HA       HIS  31  22.867  -5.856   6.170
  206   1HB   HIS  31          2HB       HIS  31  20.616  -4.666   6.987
  207   2HB   HIS  31          1HB       HIS  31  19.823  -6.061   6.279
  208    HD1  HIS  31           HD1      HIS  31  21.649  -5.075   9.246
  209    HD2  HIS  31           HD2      HIS  31  20.713  -8.624   7.459
  210    HE1  HIS  31           HE1      HIS  31  22.030  -6.827  10.937
  211   1HN   CGU  32           HN       CGU  32  23.123  -6.253   3.570
  212    HA   CGU  32           HA       CGU  32  22.593  -9.047   3.167
  213   1HB   CGU  32          1HB       CGU  32  21.158  -6.927   1.489
  214   2HB   CGU  32          2HB       CGU  32  20.442  -8.264   2.349
  215    HG   CGU  32           HG       CGU  32  22.214  -9.610   0.741
  216    H    ASP  33           H        ASP  33  24.552  -9.497   2.667
  217    HA   ASP  33           HA       ASP  33  26.075  -7.880   0.656
  218   1HB   ASP  33          2HB       ASP  33  26.855  -7.858   3.184
  219   2HB   ASP  33          1HB       ASP  33  27.403  -9.496   2.883
  220    H    VAL  34           H        VAL  34  24.516  -9.571  -0.348
  221    HA   VAL  34           HA       VAL  34  25.981 -12.100  -0.918
  222    HB   VAL  34           HB       VAL  34  23.002 -11.548  -1.287
  223   1HG1  VAL  34          1HG1      VAL  34  23.952 -13.404  -2.673
  224   2HG1  VAL  34          3HG1      VAL  34  24.558 -14.176  -1.216
  225   3HG1  VAL  34          2HG1      VAL  34  22.829 -13.999  -1.468
  226   1HG2  VAL  34          1HG2      VAL  34  24.459 -12.832   1.065
  227   2HG2  VAL  34          3HG2      VAL  34  23.425 -11.415   1.105
  228   3HG2  VAL  34          2HG2      VAL  34  22.730 -12.991   0.789
   
  No H/Q in entry =         228
  Start of MODEL   14
    1   1H    ALA   1          2H        ALA   1   9.174  10.407   3.486
    2   2H    ALA   1          1H        ALA   1   8.703  10.831   1.910
    3   3H    ALA   1          3H        ALA   1   7.526  10.590   3.112
    4    HA   ALA   1           HA       ALA   1   8.022   8.274   3.229
    5   1HB   ALA   1          2HB       ALA   1   6.446   9.058   1.427
    6   2HB   ALA   1          1HB       ALA   1   7.803   9.165   0.316
    7   3HB   ALA   1          3HB       ALA   1   7.308   7.603   0.954
    8    H    CYS   2           H        CYS   2   9.111   6.445   2.089
    9    HA   CYS   2           HA       CYS   2  11.876   7.116   1.218
   10   1HB   CYS   2          2HB       CYS   2  12.492   4.989   2.372
   11   2HB   CYS   2          1HB       CYS   2  12.095   6.266   3.463
   12    H    SER   3           H        SER   3  12.887   5.129   0.182
   13    HA   SER   3           HA       SER   3  10.960   4.072  -1.840
   14   1HB   SER   3          2HB       SER   3  13.857   4.821  -1.923
   15   2HB   SER   3          1HB       SER   3  13.468   3.317  -2.750
   16    HG   SER   3           HG       SER   3  12.057   4.279  -3.959
   17    H    GLY   4           H        GLY   4  11.479   1.855  -2.646
   18   1HA   GLY   4          2HA       GLY   4  12.027  -0.002  -0.357
   19   2HA   GLY   4          1HA       GLY   4  10.765  -0.287  -1.545
   20    H    ARG   5           H        ARG   5  12.584  -2.237  -1.189
   21    HA   ARG   5           HA       ARG   5  14.883  -2.058  -2.908
   22   1HB   ARG   5          2HB       ARG   5  14.465  -3.718  -0.963
   23   2HB   ARG   5          1HB       ARG   5  13.429  -4.615  -2.046
   24   1HG   ARG   5          2HG       ARG   5  15.862  -4.169  -3.500
   25   2HG   ARG   5          1HG       ARG   5  16.358  -4.551  -1.867
   26   1HD   ARG   5          2HD       ARG   5  14.288  -6.319  -3.188
   27   2HD   ARG   5          1HD       ARG   5  15.982  -6.495  -3.632
   28    HE   ARG   5           HE       ARG   5  15.615  -6.439  -0.754
   29   1HH1  ARG   5          2HH1      ARG   5  17.688  -8.108  -1.909
   30   2HH1  ARG   5          1HH1      ARG   5  17.025  -9.704  -1.830
   31   1HH2  ARG   5          1HH2      ARG   5  13.750  -8.544  -1.399
   32   2HH2  ARG   5          2HH2      ARG   5  14.741  -9.959  -1.543
   33    H    GLY   6           H        GLY   6  14.031  -1.173  -4.760
   34   1HA   GLY   6          2HA       GLY   6  13.693  -2.634  -7.026
   35   2HA   GLY   6          1HA       GLY   6  12.042  -2.551  -6.414
   36    H    SER   7           H        SER   7  13.273   0.167  -5.247
   37    HA   SER   7           HA       SER   7  13.006   1.820  -7.711
   38   1HB   SER   7          2HB       SER   7  11.539   3.430  -6.398
   39   2HB   SER   7          1HB       SER   7  10.761   1.849  -6.565
   40    HG   SER   7           HG       SER   7  11.906   3.052  -4.350
   41    H    ARG   8           H        ARG   8  14.396   3.426  -7.775
   42    HA   ARG   8           HA       ARG   8  16.625   3.544  -5.987
   43   1HB   ARG   8          2HB       ARG   8  17.374   5.328  -7.444
   44   2HB   ARG   8          1HB       ARG   8  16.738   4.017  -8.381
   45   1HG   ARG   8          2HG       ARG   8  14.910   6.341  -7.667
   46   2HG   ARG   8          1HG       ARG   8  16.046   6.469  -8.978
   47   1HD   ARG   8          2HD       ARG   8  14.400   5.568 -10.264
   48   2HD   ARG   8          1HD       ARG   8  14.876   4.028  -9.569
   49    HE   ARG   8           HE       ARG   8  13.118   4.520  -7.764
   50   1HH1  ARG   8          2HH1      ARG   8  11.970   6.956  -8.148
   51   2HH1  ARG   8          1HH1      ARG   8  10.735   6.762  -9.348
   52   1HH2  ARG   8          1HH2      ARG   8  12.067   3.724 -10.494
   53   2HH2  ARG   8          2HH2      ARG   8  10.786   4.872 -10.714
   54    H    CYS   9           H        CYS   9  17.331   6.068  -5.701
   55    HA   CYS   9           HA       CYS   9  15.349   7.204  -3.839
   56   1HB   CYS   9          2HB       CYS   9  17.164   7.939  -2.460
   57   2HB   CYS   9          1HB       CYS   9  17.400   6.250  -2.790
   58    HA   HYP  10           HA       HYP  10  15.081   8.970  -2.792
   59   1HB   HYP  10          1HB       HYP  10  14.891  11.103  -2.129
   60   2HB   HYP  10          2HB       HYP  10  13.419  11.236  -3.075
   61   1HD   HYP  10          1HD1      HYP  10  16.921  11.250  -5.313
   62   2HD   HYP  10          2HD1      HYP  10  15.374  11.086  -6.159
   63    HOD  HYP  10           HD2      HYP  10  16.687  13.155  -4.006
   64    HG   HYP  10           HG       HYP  10  14.575  12.668  -4.599
   65    HA   HYP  11           HA       HYP  11  12.626  10.072  -1.623
   66   1HB   HYP  11          1HB       HYP  11  10.597   9.556  -0.768
   67   2HB   HYP  11          2HB       HYP  11  11.065   7.878  -0.568
   68   1HD   HYP  11          1HD1      HYP  11  10.650   8.943  -4.509
   69   2HD   HYP  11          2HD1      HYP  11  11.136   7.284  -4.147
   70    HOD  HYP  11           HD2      HYP  11   9.714  10.150  -2.745
   71    HG   HYP  11           HG       HYP  11   9.626   7.335  -2.330
   72    H    GLN  12           H        GLN  12  14.298   9.713  -0.241
   73    HA   GLN  12           HA       GLN  12  16.294   7.872  -0.511
   74   1HB   GLN  12          2HB       GLN  12  15.975   9.871   1.203
   75   2HB   GLN  12          1HB       GLN  12  15.479   8.618   2.317
   76   1HG   GLN  12          2HG       GLN  12  18.117   8.588   0.763
   77   2HG   GLN  12          1HG       GLN  12  17.961   9.159   2.415
   78   1HE2  GLN  12          2HE2      GLN  12  17.452   5.853   3.755
   79   2HE2  GLN  12          1HE2      GLN  12  16.992   7.470   3.998
   80    H    CYS  13           H        CYS  13  16.468   5.747  -0.410
   81    HA   CYS  13           HA       CYS  13  14.467   3.926   0.085
   82   1HB   CYS  13          2HB       CYS  13  17.178   3.098   0.979
   83   2HB   CYS  13          1HB       CYS  13  16.036   2.306  -0.059
   84    H    CYS  14           H        CYS  14  13.589   2.904   1.672
   85    HA   CYS  14           HA       CYS  14  13.387   3.936   4.260
   86   1HB   CYS  14          2HB       CYS  14  12.801   1.141   3.268
   87   2HB   CYS  14          1HB       CYS  14  12.145   1.814   4.726
   88    H    MET  15           H        MET  15  13.718   2.682   6.291
   89    HA   MET  15           HA       MET  15  16.445   2.388   6.854
   90   1HB   MET  15          2HB       MET  15  14.499   2.762   8.495
   91   2HB   MET  15          1HB       MET  15  14.188   1.043   8.403
   92   1HG   MET  15          2HG       MET  15  16.958   1.203   8.901
   93   2HG   MET  15          1HG       MET  15  16.288   2.500   9.842
   94   1HE   MET  15          1HE       MET  15  15.492  -1.239   8.958
   95   2HE   MET  15          3HE       MET  15  17.140  -1.160   9.626
   96   3HE   MET  15          2HE       MET  15  15.857  -1.973  10.505
   97    H    GLY  16           H        GLY  16  17.843   0.833   6.577
   98   1HA   GLY  16          2HA       GLY  16  18.573  -1.465   6.671
   99   2HA   GLY  16          1HA       GLY  16  16.977  -1.955   6.111
  100    H    LEU  17           H        LEU  17  16.857   0.186   4.101
  101    HA   LEU  17           HA       LEU  17  18.383  -1.147   2.019
  102   1HB   LEU  17          2HB       LEU  17  16.416   1.161   1.844
  103   2HB   LEU  17          1HB       LEU  17  17.135   0.384   0.461
  104    HG   LEU  17           HG       LEU  17  15.065  -0.695   2.370
  105   1HD1  LEU  17          1HD1      LEU  17  14.320   0.699   0.502
  106   2HD1  LEU  17          3HD1      LEU  17  15.084  -0.410  -0.631
  107   3HD1  LEU  17          2HD1      LEU  17  13.748  -0.957   0.376
  108   1HD2  LEU  17          2HD2      LEU  17  16.730  -2.563   1.902
  109   2HD2  LEU  17          1HD2      LEU  17  15.145  -2.862   1.222
  110   3HD2  LEU  17          3HD2      LEU  17  16.439  -2.314   0.182
  111    H    ARG  18           H        ARG  18  19.286   0.116   0.328
  112    HA   ARG  18           HA       ARG  18  20.610   2.663   0.982
  113   1HB   ARG  18          2HB       ARG  18  22.680   1.465  -0.175
  114   2HB   ARG  18          1HB       ARG  18  22.433   1.338   1.551
  115   1HG   ARG  18          2HG       ARG  18  21.555  -0.859   1.358
  116   2HG   ARG  18          1HG       ARG  18  21.224  -0.706  -0.346
  117   1HD   ARG  18          2HD       ARG  18  24.023  -0.827   0.862
  118   2HD   ARG  18          1HD       ARG  18  23.210  -2.149   0.024
  119    HE   ARG  18           HE       ARG  18  23.222   0.180  -1.637
  120   1HH1  ARG  18          2HH1      ARG  18  26.038   0.016  -0.543
  121   2HH1  ARG  18          1HH1      ARG  18  26.824  -0.963  -1.737
  122   1HH2  ARG  18          1HH2      ARG  18  23.797  -2.083  -3.100
  123   2HH2  ARG  18          2HH2      ARG  18  25.521  -2.181  -3.222
  124    H    CYS  19           H        CYS  19  21.123   3.766  -0.836
  125    HA   CYS  19           HA       CYS  19  19.498   3.238  -3.198
  126   1HB   CYS  19          2HB       CYS  19  20.136   5.498  -2.142
  127   2HB   CYS  19          1HB       CYS  19  21.649   5.357  -2.985
  128    H    GLY  20           H        GLY  20  20.182   1.448  -4.311
  129   1HA   GLY  20          2HA       GLY  20  22.937   0.862  -4.945
  130   2HA   GLY  20          1HA       GLY  20  21.521   0.085  -5.651
  131    H    ARG  21           H        ARG  21  24.100   1.460  -6.560
  132    HA   ARG  21           HA       ARG  21  24.165   3.588  -8.057
  133   1HB   ARG  21          2HB       ARG  21  25.527   2.369  -9.715
  134   2HB   ARG  21          1HB       ARG  21  25.884   1.852  -8.087
  135   1HG   ARG  21          2HG       ARG  21  23.741   0.259  -9.486
  136   2HG   ARG  21          1HG       ARG  21  25.344   0.123 -10.165
  137   1HD   ARG  21          2HD       ARG  21  24.895  -0.213  -7.174
  138   2HD   ARG  21          1HD       ARG  21  24.685  -1.553  -8.291
  139    HE   ARG  21           HE       ARG  21  27.252  -0.035  -8.003
  140   1HH1  ARG  21          1HH2      ARG  21  27.256  -1.636 -10.391
  141   2HH1  ARG  21          2HH2      ARG  21  27.811  -3.192  -9.869
  142   1HH2  ARG  21          2HH1      ARG  21  27.138  -2.516  -6.497
  143   2HH2  ARG  21          1HH1      ARG  21  27.741  -3.703  -7.604
  144    H    GLY  22           H        GLY  22  23.767   4.438  -9.872
  145   1HA   GLY  22          2HA       GLY  22  21.204   4.255 -11.068
  146   2HA   GLY  22          1HA       GLY  22  22.485   5.313 -11.573
  147    H    ASN  23           H        ASN  23  22.097   1.785 -11.606
  148    HA   ASN  23           HA       ASN  23  21.748   1.769 -14.440
  149   1HB   ASN  23          2HB       ASN  23  24.444   1.833 -13.453
  150   2HB   ASN  23          1HB       ASN  23  24.209   0.168 -13.932
  151   1HD2  ASN  23          2HD2      ASN  23  23.983   0.903 -17.394
  152   2HD2  ASN  23          1HD2      ASN  23  23.667  -0.260 -16.196
  153    HA   PRO  24           HA       PRO  24  19.811   1.750 -14.077
  154   1HB   PRO  24          2HB       PRO  24  17.293   0.705 -13.816
  155   2HB   PRO  24          1HB       PRO  24  18.240   0.640 -15.297
  156   1HG   PRO  24          2HG       PRO  24  17.590  -1.567 -13.422
  157   2HG   PRO  24          1HG       PRO  24  18.145  -1.670 -15.086
  158   1HD   PRO  24          2HD       PRO  24  19.731  -2.029 -12.670
  159   2HD   PRO  24          1HD       PRO  24  20.291  -2.129 -14.349
  160    H    GLN  25           H        GLN  25  19.883   3.147 -12.406
  161    HA   GLN  25           HA       GLN  25  20.032   3.080  -9.794
  162   1HB   GLN  25          2HB       GLN  25  18.780   4.947 -11.595
  163   2HB   GLN  25          1HB       GLN  25  17.740   4.865 -10.198
  164   1HG   GLN  25          2HG       GLN  25  20.356   4.966  -9.129
  165   2HG   GLN  25          1HG       GLN  25  20.415   6.075 -10.471
  166   1HE2  GLN  25          2HE2      GLN  25  17.829   8.228  -9.042
  167   2HE2  GLN  25          1HE2      GLN  25  18.190   7.496 -10.532
  168    H    LYS  26           H        LYS  26  19.365   1.871  -8.277
  169    HA   LYS  26           HA       LYS  26  16.518   1.628  -7.615
  170   1HB   LYS  26          2HB       LYS  26  17.900  -0.541  -9.091
  171   2HB   LYS  26          1HB       LYS  26  17.125  -1.113  -7.635
  172   1HG   LYS  26          2HG       LYS  26  15.004  -0.568  -8.325
  173   2HG   LYS  26          1HG       LYS  26  15.510   0.661  -9.460
  174   1HD   LYS  26          2HD       LYS  26  16.625  -1.300 -10.783
  175   2HD   LYS  26          1HD       LYS  26  15.673  -2.357  -9.756
  176   1HE   LYS  26          2HE       LYS  26  13.590  -1.200 -10.516
  177   2HE   LYS  26          1HE       LYS  26  14.558  -0.165 -11.558
  178   1HZ   LYS  26          1HZ       LYS  26  14.496  -3.119 -11.720
  179   2HZ   LYS  26          3HZ       LYS  26  13.588  -2.075 -12.707
  180   3HZ   LYS  26          2HZ       LYS  26  15.287  -2.055 -12.783
  181    H    CYS  27           H        CYS  27  16.149   1.176  -5.389
  182    HA   CYS  27           HA       CYS  27  18.531   1.056  -3.760
  183   1HB   CYS  27          2HB       CYS  27  15.671   0.707  -2.725
  184   2HB   CYS  27          1HB       CYS  27  17.110   1.063  -1.873
  185    H    ILE  28           H        ILE  28  19.073  -0.600  -2.381
  186    HA   ILE  28           HA       ILE  28  17.774  -3.249  -2.665
  187    HB   ILE  28           HB       ILE  28  20.002  -4.289  -2.849
  188   1HG1  ILE  28          2HG1      ILE  28  21.199  -2.405  -1.586
  189   2HG1  ILE  28          1HG1      ILE  28  22.012  -3.108  -2.928
  190   1HG2  ILE  28          1HG2      ILE  28  19.448  -2.226  -5.017
  191   2HG2  ILE  28          3HG2      ILE  28  20.658  -3.488  -5.158
  192   3HG2  ILE  28          2HG2      ILE  28  18.966  -3.910  -4.975
  193   1HD1  ILE  28          1HD1      ILE  28  20.511  -0.796  -3.851
  194   2HD1  ILE  28          3HD1      ILE  28  21.618  -0.392  -2.559
  195   3HD1  ILE  28          2HD1      ILE  28  22.211  -1.190  -4.000
  196    H    GLY  29           H        GLY  29  19.369  -4.564  -0.877
  197   1HA   GLY  29          2HA       GLY  29  18.989  -2.961   1.578
  198   2HA   GLY  29          1HA       GLY  29  18.958  -4.689   1.543
  199    H    ALA  30           H        ALA  30  20.568  -2.641   3.009
  200    HA   ALA  30           HA       ALA  30  23.339  -2.979   2.131
  201   1HB   ALA  30          3HB       ALA  30  22.129  -1.926   4.735
  202   2HB   ALA  30          2HB       ALA  30  23.841  -1.850   4.342
  203   3HB   ALA  30          1HB       ALA  30  22.679  -0.941   3.390
  204    H    HIS  31           H        HIS  31  21.272  -4.049   4.713
  205    HA   HIS  31           HA       HIS  31  23.109  -6.216   5.559
  206   1HB   HIS  31          2HB       HIS  31  20.646  -4.857   6.692
  207   2HB   HIS  31          1HB       HIS  31  21.087  -6.442   7.308
  208    HD1  HIS  31           HD1      HIS  31  22.634  -6.242   9.216
  209    HD2  HIS  31           HD2      HIS  31  23.182  -3.079   6.692
  210    HE1  HIS  31           HE1      HIS  31  24.379  -4.830  10.240
  211   1HN   CGU  32           HN       CGU  32  22.102  -6.419   3.028
  212    HA   CGU  32           HA       CGU  32  19.984  -8.508   3.086
  213   1HB   CGU  32          1HB       CGU  32  21.268  -7.381   0.573
  214   2HB   CGU  32          2HB       CGU  32  20.251  -6.343   1.534
  215    HG   CGU  32           HG       CGU  32  18.442  -8.073   1.401
  216    H    ASP  33           H        ASP  33  22.475  -8.967   4.213
  217    HA   ASP  33           HA       ASP  33  24.266 -10.424   4.297
  218   1HB   ASP  33          2HB       ASP  33  22.215 -11.955   4.062
  219   2HB   ASP  33          1HB       ASP  33  22.552 -12.046   2.346
  220    H    VAL  34           H        VAL  34  24.408  -8.352   2.459
  221    HA   VAL  34           HA       VAL  34  26.292  -9.446   0.412
  222    HB   VAL  34           HB       VAL  34  24.271  -7.167   0.066
  223   1HG1  VAL  34          3HG1      VAL  34  26.472  -8.174  -1.795
  224   2HG1  VAL  34          2HG1      VAL  34  25.181  -7.094  -2.303
  225   3HG1  VAL  34          1HG1      VAL  34  26.339  -6.566  -1.097
  226   1HG2  VAL  34          3HG2      VAL  34  24.010  -9.994  -0.442
  227   2HG2  VAL  34          2HG2      VAL  34  22.889  -8.714  -0.857
  228   3HG2  VAL  34          1HG2      VAL  34  24.122  -9.202  -1.996
   
  No H/Q in entry =         228
  Start of MODEL   15
    1   1H    ALA   1          3H        ALA   1   9.733  10.677   3.312
    2   2H    ALA   1          2H        ALA   1   8.161  10.514   3.935
    3   3H    ALA   1          1H        ALA   1   9.411   9.517   4.511
    4    HA   ALA   1           HA       ALA   1   8.076   8.238   3.046
    5   1HB   ALA   1          3HB       ALA   1   7.276  10.391   1.816
    6   2HB   ALA   1          2HB       ALA   1   8.717  10.226   0.829
    7   3HB   ALA   1          1HB       ALA   1   7.502   8.954   0.831
    8    H    CYS   2           H        CYS   2   9.141   6.558   2.043
    9    HA   CYS   2           HA       CYS   2  11.936   7.003   1.146
   10   1HB   CYS   2          2HB       CYS   2  12.483   4.878   2.181
   11   2HB   CYS   2          1HB       CYS   2  12.036   6.054   3.370
   12    H    SER   3           H        SER   3  12.797   5.052   0.055
   13    HA   SER   3           HA       SER   3  10.847   4.082  -2.004
   14   1HB   SER   3          2HB       SER   3  13.811   4.726  -2.054
   15   2HB   SER   3          1HB       SER   3  13.208   3.478  -3.148
   16    HG   SER   3           HG       SER   3  11.868   5.953  -2.834
   17    H    GLY   4           H        GLY   4  10.864   1.855  -2.543
   18   1HA   GLY   4          2HA       GLY   4  11.789   0.084  -0.320
   19   2HA   GLY   4          1HA       GLY   4  10.527  -0.301  -1.481
   20    H    ARG   5           H        ARG   5  12.282  -2.224  -1.202
   21    HA   ARG   5           HA       ARG   5  14.633  -2.007  -2.864
   22   1HB   ARG   5          2HB       ARG   5  13.910  -3.785  -0.958
   23   2HB   ARG   5          1HB       ARG   5  13.292  -4.680  -2.325
   24   1HG   ARG   5          2HG       ARG   5  15.630  -4.372  -3.398
   25   2HG   ARG   5          1HG       ARG   5  16.139  -3.726  -1.846
   26   1HD   ARG   5          2HD       ARG   5  16.666  -6.143  -1.975
   27   2HD   ARG   5          1HD       ARG   5  15.438  -5.859  -0.740
   28    HE   ARG   5           HE       ARG   5  14.264  -6.400  -3.338
   29   1HH1  ARG   5          1HH2      ARG   5  12.626  -7.486  -1.512
   30   2HH1  ARG   5          2HH2      ARG   5  13.133  -9.118  -1.225
   31   1HH2  ARG   5          2HH1      ARG   5  16.316  -8.581  -2.586
   32   2HH2  ARG   5          1HH1      ARG   5  15.274  -9.754  -1.850
   33    H    GLY   6           H        GLY   6  13.938  -1.120  -4.718
   34   1HA   GLY   6          2HA       GLY   6  13.629  -2.441  -7.034
   35   2HA   GLY   6          1HA       GLY   6  11.958  -2.435  -6.470
   36    H    SER   7           H        SER   7  13.125   0.254  -5.164
   37    HA   SER   7           HA       SER   7  12.670   2.020  -7.536
   38   1HB   SER   7          2HB       SER   7  11.620   2.387  -4.667
   39   2HB   SER   7          1HB       SER   7  11.430   3.566  -5.977
   40    HG   SER   7           HG       SER   7  10.439   1.873  -7.191
   41    H    ARG   8           H        ARG   8  14.050   3.819  -7.582
   42    HA   ARG   8           HA       ARG   8  16.446   3.584  -5.896
   43   1HB   ARG   8          2HB       ARG   8  17.334   5.374  -7.384
   44   2HB   ARG   8          1HB       ARG   8  16.735   3.989  -8.251
   45   1HG   ARG   8          2HG       ARG   8  14.566   5.887  -7.899
   46   2HG   ARG   8          1HG       ARG   8  15.950   6.723  -8.548
   47   1HD   ARG   8          2HD       ARG   8  16.145   4.873 -10.322
   48   2HD   ARG   8          1HD       ARG   8  14.565   4.304  -9.775
   49    HE   ARG   8           HE       ARG   8  14.102   6.966 -10.243
   50   1HH1  ARG   8          2HH1      ARG   8  16.557   6.303 -12.111
   51   2HH1  ARG   8          1HH1      ARG   8  15.724   6.128 -13.616
   52   1HH2  ARG   8          1HH2      ARG   8  12.579   5.935 -12.110
   53   2HH2  ARG   8          2HH2      ARG   8  13.435   5.916 -13.617
   54    H    CYS   9           H        CYS   9  17.360   5.996  -5.561
   55    HA   CYS   9           HA       CYS   9  15.431   7.281  -3.744
   56   1HB   CYS   9          2HB       CYS   9  17.273   7.946  -2.383
   57   2HB   CYS   9          1HB       CYS   9  17.446   6.251  -2.725
   58    HA   HYP  10           HA       HYP  10  15.202   8.998  -2.688
   59   1HB   HYP  10          1HB       HYP  10  15.097  11.088  -1.932
   60   2HB   HYP  10          2HB       HYP  10  13.631  11.322  -2.870
   61   1HD   HYP  10          1HD1      HYP  10  17.166  11.299  -5.065
   62   2HD   HYP  10          2HD1      HYP  10  15.639  11.239  -5.958
   63    HOD  HYP  10           HD2      HYP  10  16.261  13.409  -2.885
   64    HG   HYP  10           HG       HYP  10  14.844  12.766  -4.349
   65    HA   HYP  11           HA       HYP  11  12.775  10.076  -1.496
   66   1HB   HYP  11          1HB       HYP  11  10.674   9.591  -0.828
   67   2HB   HYP  11          2HB       HYP  11  11.189   7.963  -0.448
   68   1HD   HYP  11          1HD1      HYP  11  10.721   9.178  -4.322
   69   2HD   HYP  11          2HD1      HYP  11  11.290   7.503  -4.288
   70    HOD  HYP  11           HD2      HYP  11   9.459   9.862  -2.587
   71    HG   HYP  11           HG       HYP  11  10.078   7.097  -2.310
   72    H    GLN  12           H        GLN  12  14.366   9.637  -0.098
   73    HA   GLN  12           HA       GLN  12  16.413   7.855  -0.419
   74   1HB   GLN  12          2HB       GLN  12  15.239   8.927   2.174
   75   2HB   GLN  12          1HB       GLN  12  16.738   8.017   2.133
   76   1HG   GLN  12          2HG       GLN  12  17.670   9.715   0.493
   77   2HG   GLN  12          1HG       GLN  12  16.198  10.657   0.699
   78   1HE2  GLN  12          2HE2      GLN  12  17.164  11.971   3.827
   79   2HE2  GLN  12          1HE2      GLN  12  15.960  11.883   2.634
   80    H    CYS  13           H        CYS  13  16.679   5.698  -0.339
   81    HA   CYS  13           HA       CYS  13  14.600   3.888  -0.012
   82   1HB   CYS  13          2HB       CYS  13  17.284   2.951   0.905
   83   2HB   CYS  13          1HB       CYS  13  16.118   2.229  -0.147
   84    H    CYS  14           H        CYS  14  13.692   2.824   1.487
   85    HA   CYS  14           HA       CYS  14  13.394   3.743   4.104
   86   1HB   CYS  14          2HB       CYS  14  12.838   0.955   3.061
   87   2HB   CYS  14          1HB       CYS  14  12.096   1.688   4.455
   88    H    MET  15           H        MET  15  13.649   2.479   6.090
   89    HA   MET  15           HA       MET  15  16.327   2.127   6.786
   90   1HB   MET  15          2HB       MET  15  14.329   2.510   8.329
   91   2HB   MET  15          1HB       MET  15  13.936   0.812   8.160
   92   1HG   MET  15          2HG       MET  15  16.689   1.676   9.058
   93   2HG   MET  15          1HG       MET  15  15.374   1.618  10.193
   94   1HE   MET  15          2HE       MET  15  13.762  -0.764  10.094
   95   2HE   MET  15          1HE       MET  15  14.717  -1.997  10.887
   96   3HE   MET  15          3HE       MET  15  14.717  -0.371  11.546
   97    H    GLY  16           H        GLY  16  17.727   0.620   6.454
   98   1HA   GLY  16          2HA       GLY  16  18.478  -1.677   6.568
   99   2HA   GLY  16          1HA       GLY  16  16.901  -2.176   5.960
  100    H    LEU  17           H        LEU  17  16.793  -0.045   3.967
  101    HA   LEU  17           HA       LEU  17  18.388  -1.342   1.913
  102   1HB   LEU  17          2HB       LEU  17  16.406   0.952   1.709
  103   2HB   LEU  17          1HB       LEU  17  17.162   0.191   0.337
  104    HG   LEU  17           HG       LEU  17  15.125  -0.970   2.262
  105   1HD1  LEU  17          3HD1      LEU  17  14.305   0.517   0.488
  106   2HD1  LEU  17          2HD1      LEU  17  15.001  -0.545  -0.727
  107   3HD1  LEU  17          1HD1      LEU  17  13.711  -1.124   0.320
  108   1HD2  LEU  17          2HD2      LEU  17  16.773  -2.792   1.670
  109   2HD2  LEU  17          1HD2      LEU  17  15.187  -3.082   0.990
  110   3HD2  LEU  17          3HD2      LEU  17  16.469  -2.467  -0.032
  111    H    ARG  18           H        ARG  18  19.320  -0.026   0.254
  112    HA   ARG  18           HA       ARG  18  20.611   2.519   0.995
  113   1HB   ARG  18          2HB       ARG  18  22.689   1.395  -0.192
  114   2HB   ARG  18          1HB       ARG  18  22.440   1.170   1.527
  115   1HG   ARG  18          2HG       ARG  18  21.549  -1.022   1.192
  116   2HG   ARG  18          1HG       ARG  18  21.291  -0.770  -0.511
  117   1HD   ARG  18          2HD       ARG  18  24.098  -0.710   0.666
  118   2HD   ARG  18          1HD       ARG  18  23.345  -2.206   0.115
  119    HE   ARG  18           HE       ARG  18  23.210  -0.027  -1.822
  120   1HH1  ARG  18          2HH1      ARG  18  23.861  -3.233  -1.530
  121   2HH1  ARG  18          1HH1      ARG  18  25.241  -3.264  -2.577
  122   1HH2  ARG  18          1HH2      ARG  18  25.470   0.224  -2.731
  123   2HH2  ARG  18          2HH2      ARG  18  26.177  -1.264  -3.265
  124    H    CYS  19           H        CYS  19  21.242   3.628  -0.865
  125    HA   CYS  19           HA       CYS  19  19.551   3.108  -3.203
  126   1HB   CYS  19          2HB       CYS  19  20.080   5.356  -2.115
  127   2HB   CYS  19          1HB       CYS  19  21.622   5.292  -2.908
  128    H    GLY  20           H        GLY  20  20.253   1.421  -4.445
  129   1HA   GLY  20          2HA       GLY  20  23.068   0.999  -5.092
  130   2HA   GLY  20          1HA       GLY  20  21.696   0.091  -5.724
  131    H    ARG  21           H        ARG  21  23.891   2.614  -6.395
  132    HA   ARG  21           HA       ARG  21  22.469   4.062  -8.361
  133   1HB   ARG  21          2HB       ARG  21  25.372   3.634  -7.688
  134   2HB   ARG  21          1HB       ARG  21  25.016   4.344  -9.245
  135   1HG   ARG  21          2HG       ARG  21  25.201   6.239  -7.860
  136   2HG   ARG  21          1HG       ARG  21  23.467   5.998  -7.925
  137   1HD   ARG  21          2HD       ARG  21  23.582   4.739  -5.760
  138   2HD   ARG  21          1HD       ARG  21  25.322   5.029  -5.702
  139    HE   ARG  21           HE       ARG  21  23.737   7.468  -5.989
  140   1HH1  ARG  21          2HH1      ARG  21  23.398   5.347  -3.565
  141   2HH1  ARG  21          1HH1      ARG  21  24.167   6.275  -2.323
  142   1HH2  ARG  21          1HH2      ARG  21  25.475   8.599  -4.595
  143   2HH2  ARG  21          2HH2      ARG  21  25.376   8.161  -2.922
  144    H    GLY  22           H        GLY  22  22.083   3.752 -10.465
  145   1HA   GLY  22          2HA       GLY  22  23.463   1.879 -12.176
  146   2HA   GLY  22          1HA       GLY  22  21.909   1.225 -11.646
  147    H    ASN  23           H        ASN  23  21.000   1.348 -13.729
  148    HA   ASN  23           HA       ASN  23  19.883   3.952 -14.376
  149   1HB   ASN  23          2HB       ASN  23  22.330   3.581 -15.517
  150   2HB   ASN  23          1HB       ASN  23  21.361   2.799 -16.750
  151   1HD2  ASN  23          2HD2      ASN  23  21.260   6.824 -16.346
  152   2HD2  ASN  23          1HD2      ASN  23  22.213   5.854 -15.331
  153    HA   PRO  24           HA       PRO  24  17.956   4.230 -14.003
  154   1HB   PRO  24          2HB       PRO  24  15.628   3.188 -12.909
  155   2HB   PRO  24          1HB       PRO  24  15.730   4.252 -14.303
  156   1HG   PRO  24          2HG       PRO  24  15.123   1.365 -14.260
  157   2HG   PRO  24          1HG       PRO  24  14.843   2.537 -15.541
  158   1HD   PRO  24          2HD       PRO  24  16.935   0.572 -15.454
  159   2HD   PRO  24          1HD       PRO  24  16.758   1.869 -16.646
  160    H    GLN  25           H        GLN  25  18.561   4.486 -11.918
  161    HA   GLN  25           HA       GLN  25  19.930   2.446 -10.483
  162   1HB   GLN  25          2HB       GLN  25  18.670   4.764  -8.999
  163   2HB   GLN  25          1HB       GLN  25  20.216   4.009  -8.724
  164   1HG   GLN  25          2HG       GLN  25  21.140   5.730  -9.890
  165   2HG   GLN  25          1HG       GLN  25  20.437   5.048 -11.341
  166   1HE2  GLN  25          2HE2      GLN  25  19.007   8.528 -10.021
  167   2HE2  GLN  25          1HE2      GLN  25  20.435   7.832  -9.421
  168    H    LYS  26           H        LYS  26  19.325   1.675  -8.248
  169    HA   LYS  26           HA       LYS  26  16.505   1.492  -7.543
  170   1HB   LYS  26          2HB       LYS  26  17.799  -0.626  -9.153
  171   2HB   LYS  26          1HB       LYS  26  17.140  -1.266  -7.664
  172   1HG   LYS  26          2HG       LYS  26  14.949  -0.292  -8.170
  173   2HG   LYS  26          1HG       LYS  26  15.566   0.418  -9.648
  174   1HD   LYS  26          2HD       LYS  26  16.265  -1.997 -10.316
  175   2HD   LYS  26          1HD       LYS  26  15.223  -2.532  -9.008
  176   1HE   LYS  26          2HE       LYS  26  13.267  -1.653 -10.058
  177   2HE   LYS  26          1HE       LYS  26  14.197  -0.639 -11.154
  178   1HZ   LYS  26          2HZ       LYS  26  14.514  -3.557 -11.208
  179   2HZ   LYS  26          1HZ       LYS  26  13.204  -2.821 -11.998
  180   3HZ   LYS  26          3HZ       LYS  26  14.796  -2.418 -12.436
  181    H    CYS  27           H        CYS  27  16.225   1.076  -5.369
  182    HA   CYS  27           HA       CYS  27  18.600   0.915  -3.765
  183   1HB   CYS  27          2HB       CYS  27  15.712   0.613  -2.778
  184   2HB   CYS  27          1HB       CYS  27  17.136   0.929  -1.871
  185    H    ILE  28           H        ILE  28  19.231  -0.734  -2.478
  186    HA   ILE  28           HA       ILE  28  17.968  -3.418  -2.751
  187    HB   ILE  28           HB       ILE  28  20.250  -4.383  -2.892
  188   1HG1  ILE  28          2HG1      ILE  28  21.412  -2.451  -1.725
  189   2HG1  ILE  28          1HG1      ILE  28  22.197  -3.104  -3.111
  190   1HG2  ILE  28          3HG2      ILE  28  19.424  -2.478  -5.096
  191   2HG2  ILE  28          2HG2      ILE  28  20.850  -3.490  -5.246
  192   3HG2  ILE  28          1HG2      ILE  28  19.276  -4.223  -5.019
  193   1HD1  ILE  28          3HD1      ILE  28  20.642  -0.967  -4.137
  194   2HD1  ILE  28          2HD1      ILE  28  21.400  -0.397  -2.662
  195   3HD1  ILE  28          1HD1      ILE  28  22.385  -1.060  -3.942
  196    H    GLY  29           H        GLY  29  19.679  -4.703  -0.937
  197   1HA   GLY  29          2HA       GLY  29  19.104  -3.168   1.506
  198   2HA   GLY  29          1HA       GLY  29  19.284  -4.881   1.439
  199    H    ALA  30           H        ALA  30  20.572  -2.663   2.968
  200    HA   ALA  30           HA       ALA  30  23.444  -2.836   2.287
  201   1HB   ALA  30          1HB       ALA  30  21.704  -1.148   4.086
  202   2HB   ALA  30          3HB       ALA  30  23.375  -1.374   4.579
  203   3HB   ALA  30          2HB       ALA  30  23.011  -0.645   3.027
  204    H    HIS  31           H        HIS  31  21.086  -3.695   4.654
  205    HA   HIS  31           HA       HIS  31  22.947  -5.305   6.297
  206   1HB   HIS  31          2HB       HIS  31  20.908  -3.783   7.085
  207   2HB   HIS  31          1HB       HIS  31  19.925  -5.176   6.680
  208    HD1  HIS  31           HD1      HIS  31  20.494  -4.123   9.584
  209    HD2  HIS  31           HD2      HIS  31  22.339  -7.367   7.923
  210    HE1  HIS  31           HE1      HIS  31  21.279  -5.514  11.464
  211   1HN   CGU  32           HN       CGU  32  22.807  -6.095   3.715
  212    HA   CGU  32           HA       CGU  32  21.307  -8.672   3.764
  213   1HB   CGU  32          1HB       CGU  32  22.091  -6.915   1.398
  214   2HB   CGU  32          2HB       CGU  32  20.492  -6.956   2.107
  215    HG   CGU  32           HG       CGU  32  21.841  -9.398   0.953
  216    H    ASP  33           H        ASP  33  23.250  -9.347   4.958
  217    HA   ASP  33           HA       ASP  33  25.721  -9.645   3.362
  218   1HB   ASP  33          2HB       ASP  33  25.503  -9.063   5.959
  219   2HB   ASP  33          1HB       ASP  33  25.316 -10.798   6.148
  220    H    VAL  34           H        VAL  34  23.404 -10.947   2.479
  221    HA   VAL  34           HA       VAL  34  24.447 -13.639   2.109
  222    HB   VAL  34           HB       VAL  34  23.247 -13.886   4.278
  223   1HG1  VAL  34          1HG1      VAL  34  21.588 -12.035   3.984
  224   2HG1  VAL  34          3HG1      VAL  34  20.712 -13.027   2.824
  225   3HG1  VAL  34          2HG1      VAL  34  20.841 -13.534   4.497
  226   1HG2  VAL  34          1HG2      VAL  34  23.205 -15.737   2.506
  227   2HG2  VAL  34          3HG2      VAL  34  21.969 -15.831   3.747
  228   3HG2  VAL  34          2HG2      VAL  34  21.558 -15.237   2.147
   
  No H/Q in entry =         228
  Start of MODEL   16
    1   1H    ALA   1          3H        ALA   1   9.146   9.145   4.273
    2   2H    ALA   1          2H        ALA   1   7.454   9.140   4.122
    3   3H    ALA   1          1H        ALA   1   8.332   7.706   3.878
    4    HA   ALA   1           HA       ALA   1   7.656   8.597   1.772
    5   1HB   ALA   1          3HB       ALA   1   7.495  10.986   2.524
    6   2HB   ALA   1          2HB       ALA   1   9.243  11.063   2.651
    7   3HB   ALA   1          1HB       ALA   1   8.485  10.855   1.081
    8    H    CYS   2           H        CYS   2   9.203   6.677   2.313
    9    HA   CYS   2           HA       CYS   2  11.881   7.187   1.112
   10   1HB   CYS   2          2HB       CYS   2  12.479   5.055   2.286
   11   2HB   CYS   2          1HB       CYS   2  12.139   6.329   3.400
   12    H    SER   3           H        SER   3  12.715   4.988   0.229
   13    HA   SER   3           HA       SER   3  10.702   3.938  -1.731
   14   1HB   SER   3          2HB       SER   3  13.637   4.629  -1.921
   15   2HB   SER   3          1HB       SER   3  13.051   3.303  -2.917
   16    HG   SER   3           HG       SER   3  11.575   4.576  -3.819
   17    H    GLY   4           H        GLY   4  10.838   1.641  -2.238
   18   1HA   GLY   4          2HA       GLY   4  11.817   0.022   0.082
   19   2HA   GLY   4          1HA       GLY   4  10.554  -0.469  -1.046
   20    H    ARG   5           H        ARG   5  12.628  -2.245  -0.663
   21    HA   ARG   5           HA       ARG   5  14.850  -1.828  -2.364
   22   1HB   ARG   5          2HB       ARG   5  14.197  -3.848  -0.643
   23   2HB   ARG   5          1HB       ARG   5  13.794  -4.654  -2.143
   24   1HG   ARG   5          2HG       ARG   5  16.017  -4.235  -3.058
   25   2HG   ARG   5          1HG       ARG   5  16.431  -3.214  -1.695
   26   1HD   ARG   5          2HD       ARG   5  17.468  -5.267  -1.205
   27   2HD   ARG   5          1HD       ARG   5  16.013  -5.309  -0.213
   28    HE   ARG   5           HE       ARG   5  15.360  -6.469  -2.711
   29   1HH1  ARG   5          1HH2      ARG   5  17.914  -7.757  -2.770
   30   2HH1  ARG   5          2HH2      ARG   5  17.747  -9.126  -1.724
   31   1HH2  ARG   5          2HH1      ARG   5  14.879  -7.857  -0.174
   32   2HH2  ARG   5          1HH1      ARG   5  15.989  -9.185  -0.221
   33    H    GLY   6           H        GLY   6  14.839  -1.469  -4.447
   34   1HA   GLY   6          2HA       GLY   6  14.535  -2.477  -6.704
   35   2HA   GLY   6          1HA       GLY   6  12.876  -2.858  -6.249
   36    H    SER   7           H        SER   7  12.852  -0.168  -4.795
   37    HA   SER   7           HA       SER   7  11.838   1.423  -7.048
   38   1HB   SER   7          2HB       SER   7  11.954   1.902  -4.020
   39   2HB   SER   7          1HB       SER   7  11.251   3.065  -5.157
   40    HG   SER   7           HG       SER   7   9.592   1.783  -4.639
   41    H    ARG   8           H        ARG   8  12.674   3.663  -7.339
   42    HA   ARG   8           HA       ARG   8  15.589   3.667  -7.338
   43   1HB   ARG   8          2HB       ARG   8  15.385   5.725  -8.601
   44   2HB   ARG   8          1HB       ARG   8  14.085   4.686  -9.148
   45   1HG   ARG   8          2HG       ARG   8  12.610   5.863  -7.381
   46   2HG   ARG   8          1HG       ARG   8  13.895   7.022  -7.205
   47   1HD   ARG   8          2HD       ARG   8  12.329   7.938  -8.822
   48   2HD   ARG   8          1HD       ARG   8  13.788   7.473  -9.694
   49    HE   ARG   8           HE       ARG   8  11.571   5.495  -9.554
   50   1HH1  ARG   8          1HH2      ARG   8  13.734   5.073 -11.442
   51   2HH1  ARG   8          2HH2      ARG   8  13.122   5.721 -12.929
   52   1HH2  ARG   8          2HH1      ARG   8  10.603   7.550 -11.318
   53   2HH2  ARG   8          1HH1      ARG   8  11.302   7.164 -12.856
   54    H    CYS   9           H        CYS   9  16.220   6.236  -6.817
   55    HA   CYS   9           HA       CYS   9  15.298   7.030  -4.206
   56   1HB   CYS   9          2HB       CYS   9  17.844   6.829  -3.398
   57   2HB   CYS   9          1HB       CYS   9  16.683   5.554  -3.191
   58    HA   HYP  10           HA       HYP  10  15.423   8.626  -2.944
   59   1HB   HYP  10          1HB       HYP  10  15.580  10.667  -2.051
   60   2HB   HYP  10          2HB       HYP  10  14.199  11.159  -3.011
   61   1HD   HYP  10          1HD1      HYP  10  17.850  10.736  -4.966
   62   2HD   HYP  10          2HD1      HYP  10  16.446  10.983  -6.011
   63    HOD  HYP  10           HD2      HYP  10  17.593  11.201  -2.724
   64    HG   HYP  10           HG       HYP  10  15.678  12.490  -4.381
   65    HA   HYP  11           HA       HYP  11  12.943   9.991  -1.830
   66   1HB   HYP  11          1HB       HYP  11  10.821   9.489  -1.237
   67   2HB   HYP  11          2HB       HYP  11  11.311   7.837  -0.902
   68   1HD   HYP  11          1HD1      HYP  11  11.086   9.071  -4.815
   69   2HD   HYP  11          2HD1      HYP  11  11.641   7.397  -4.668
   70    HOD  HYP  11           HD2      HYP  11   8.907   8.933  -2.315
   71    HG   HYP  11           HG       HYP  11  10.211   7.089  -2.820
   72    H    GLN  12           H        GLN  12  14.484   9.586  -0.379
   73    HA   GLN  12           HA       GLN  12  16.492   7.741  -0.526
   74   1HB   GLN  12          2HB       GLN  12  16.298   9.683   1.104
   75   2HB   GLN  12          1HB       GLN  12  15.294   8.669   2.124
   76   1HG   GLN  12          2HG       GLN  12  17.135   7.052   2.406
   77   2HG   GLN  12          1HG       GLN  12  18.131   7.936   1.255
   78   1HE2  GLN  12          2HE2      GLN  12  19.072  10.443   3.573
   79   2HE2  GLN  12          1HE2      GLN  12  19.051   9.981   1.939
   80    H    CYS  13           H        CYS  13  16.695   5.567  -0.297
   81    HA   CYS  13           HA       CYS  13  14.468   3.875   0.073
   82   1HB   CYS  13          2HB       CYS  13  17.097   2.722   0.903
   83   2HB   CYS  13          1HB       CYS  13  15.885   2.179  -0.188
   84    H    CYS  14           H        CYS  14  13.589   2.887   1.734
   85    HA   CYS  14           HA       CYS  14  13.590   4.027   4.310
   86   1HB   CYS  14          2HB       CYS  14  12.673   1.219   3.682
   87   2HB   CYS  14          1HB       CYS  14  12.062   2.291   4.907
   88    H    MET  15           H        MET  15  13.831   2.640   6.331
   89    HA   MET  15           HA       MET  15  16.561   1.995   6.683
   90   1HB   MET  15          2HB       MET  15  14.886   2.715   8.503
   91   2HB   MET  15          1HB       MET  15  14.196   1.108   8.433
   92   1HG   MET  15          2HG       MET  15  15.676   0.964  10.224
   93   2HG   MET  15          1HG       MET  15  16.600   0.258   8.938
   94   1HE   MET  15          2HE       MET  15  18.346   1.004   7.852
   95   2HE   MET  15          1HE       MET  15  19.047   2.609   7.852
   96   3HE   MET  15          3HE       MET  15  19.625   1.376   8.993
   97    H    GLY  16           H        GLY  16  17.572   0.409   5.925
   98   1HA   GLY  16          2HA       GLY  16  17.780  -2.157   6.238
   99   2HA   GLY  16          1HA       GLY  16  16.271  -2.156   5.297
  100    H    LEU  17           H        LEU  17  16.583  -0.158   3.611
  101    HA   LEU  17           HA       LEU  17  18.410  -1.268   1.714
  102   1HB   LEU  17          2HB       LEU  17  16.451   1.008   1.642
  103   2HB   LEU  17          1HB       LEU  17  17.306   0.470   0.210
  104    HG   LEU  17           HG       LEU  17  15.603  -0.776  -0.182
  105   1HD1  LEU  17          3HD1      LEU  17  16.332  -2.403   2.190
  106   2HD1  LEU  17          2HD1      LEU  17  15.215  -2.871   0.911
  107   3HD1  LEU  17          1HD1      LEU  17  16.902  -2.577   0.527
  108   1HD2  LEU  17          3HD2      LEU  17  14.177   0.578   1.184
  109   2HD2  LEU  17          2HD2      LEU  17  13.654  -1.096   1.196
  110   3HD2  LEU  17          1HD2      LEU  17  14.518  -0.438   2.586
  111    H    ARG  18           H        ARG  18  19.393   0.065   0.202
  112    HA   ARG  18           HA       ARG  18  20.783   2.512   1.021
  113   1HB   ARG  18          2HB       ARG  18  22.842   1.188  -0.163
  114   2HB   ARG  18          1HB       ARG  18  22.593   1.195   1.567
  115   1HG   ARG  18          2HG       ARG  18  21.690  -0.946   1.580
  116   2HG   ARG  18          1HG       ARG  18  21.272  -0.944  -0.107
  117   1HD   ARG  18          2HD       ARG  18  24.141  -0.984   0.937
  118   2HD   ARG  18          1HD       ARG  18  23.281  -2.387   0.299
  119    HE   ARG  18           HE       ARG  18  23.031  -0.520  -1.707
  120   1HH1  ARG  18          2HH1      ARG  18  25.378   0.859  -1.417
  121   2HH1  ARG  18          1HH1      ARG  18  26.651  -0.156  -2.012
  122   1HH2  ARG  18          1HH2      ARG  18  24.690  -3.057  -1.802
  123   2HH2  ARG  18          2HH2      ARG  18  26.249  -2.440  -2.241
  124    H    CYS  19           H        CYS  19  21.303   3.652  -0.768
  125    HA   CYS  19           HA       CYS  19  19.738   3.063  -3.165
  126   1HB   CYS  19          2HB       CYS  19  19.876   5.304  -2.177
  127   2HB   CYS  19          1HB       CYS  19  21.565   5.389  -2.593
  128    H    GLY  20           H        GLY  20  20.444   1.673  -4.622
  129   1HA   GLY  20          2HA       GLY  20  23.297   1.439  -5.328
  130   2HA   GLY  20          1HA       GLY  20  21.968   0.466  -5.971
  131    H    ARG  21           H        ARG  21  24.032   3.021  -6.598
  132    HA   ARG  21           HA       ARG  21  22.536   4.729  -8.246
  133   1HB   ARG  21          2HB       ARG  21  25.335   4.242  -7.623
  134   2HB   ARG  21          1HB       ARG  21  25.202   4.505  -9.342
  135   1HG   ARG  21          2HG       ARG  21  23.674   6.416  -7.583
  136   2HG   ARG  21          1HG       ARG  21  25.419   6.517  -7.523
  137   1HD   ARG  21          2HD       ARG  21  25.587   6.955  -9.897
  138   2HD   ARG  21          1HD       ARG  21  23.901   6.522 -10.165
  139    HE   ARG  21           HE       ARG  21  23.352   8.720  -9.603
  140   1HH1  ARG  21          1HH2      ARG  21  23.878   8.799  -6.830
  141   2HH1  ARG  21          2HH2      ARG  21  25.212   9.889  -6.644
  142   1HH2  ARG  21          2HH1      ARG  21  26.122   9.659 -10.022
  143   2HH2  ARG  21          1HH1      ARG  21  26.516  10.388  -8.501
  144    H    GLY  22           H        GLY  22  22.238   4.875 -10.439
  145   1HA   GLY  22          2HA       GLY  22  23.092   3.202 -12.503
  146   2HA   GLY  22          1HA       GLY  22  21.679   2.396 -11.813
  147    H    ASN  23           H        ASN  23  20.636   2.732 -13.830
  148    HA   ASN  23           HA       ASN  23  19.113   5.219 -13.909
  149   1HB   ASN  23          2HB       ASN  23  21.131   5.890 -15.189
  150   2HB   ASN  23          1HB       ASN  23  20.934   4.509 -16.258
  151   1HD2  ASN  23          2HD2      ASN  23  18.338   7.679 -16.575
  152   2HD2  ASN  23          1HD2      ASN  23  19.195   7.443 -15.130
  153    HA   PRO  24           HA       PRO  24  17.157   5.267 -13.527
  154   1HB   PRO  24          2HB       PRO  24  15.092   3.819 -12.370
  155   2HB   PRO  24          1HB       PRO  24  14.937   4.985 -13.677
  156   1HG   PRO  24          2HG       PRO  24  14.770   2.035 -13.816
  157   2HG   PRO  24          1HG       PRO  24  14.203   3.227 -14.976
  158   1HD   PRO  24          2HD       PRO  24  16.565   1.615 -15.211
  159   2HD   PRO  24          1HD       PRO  24  16.115   2.965 -16.264
  160    H    GLN  25           H        GLN  25  17.825   5.479 -11.440
  161    HA   GLN  25           HA       GLN  25  19.590   3.598 -10.243
  162   1HB   GLN  25          2HB       GLN  25  17.972   5.779  -8.839
  163   2HB   GLN  25          1HB       GLN  25  19.400   4.991  -8.186
  164   1HG   GLN  25          2HG       GLN  25  20.714   5.842 -10.161
  165   2HG   GLN  25          1HG       GLN  25  19.291   6.729 -10.688
  166   1HE2  GLN  25          2HE2      GLN  25  21.702   8.496  -8.124
  167   2HE2  GLN  25          1HE2      GLN  25  22.128   7.247  -9.191
  168    H    LYS  26           H        LYS  26  19.273   2.300  -8.289
  169    HA   LYS  26           HA       LYS  26  16.513   1.712  -7.474
  170   1HB   LYS  26          2HB       LYS  26  18.207  -0.247  -9.045
  171   2HB   LYS  26          1HB       LYS  26  16.993  -0.827  -7.919
  172   1HG   LYS  26          2HG       LYS  26  15.363   0.791  -9.159
  173   2HG   LYS  26          1HG       LYS  26  16.588   0.833 -10.417
  174   1HD   LYS  26          2HD       LYS  26  16.494  -1.658 -10.581
  175   2HD   LYS  26          1HD       LYS  26  15.221  -1.680  -9.373
  176   1HE   LYS  26          2HE       LYS  26  15.098  -0.402 -12.139
  177   2HE   LYS  26          1HE       LYS  26  14.137  -1.750 -11.549
  178   1HZ   LYS  26          3HZ       LYS  26  13.393  -0.093  -9.777
  179   2HZ   LYS  26          2HZ       LYS  26  13.961   1.094 -10.839
  180   3HZ   LYS  26          1HZ       LYS  26  12.722   0.035 -11.338
  181    H    CYS  27           H        CYS  27  16.383   1.267  -5.453
  182    HA   CYS  27           HA       CYS  27  18.663   1.021  -3.762
  183   1HB   CYS  27          2HB       CYS  27  15.753   0.510  -3.008
  184   2HB   CYS  27          1HB       CYS  27  17.090   0.826  -1.963
  185    H    ILE  28           H        ILE  28  19.247  -0.623  -2.501
  186    HA   ILE  28           HA       ILE  28  18.212  -3.379  -2.950
  187    HB   ILE  28           HB       ILE  28  20.650  -4.114  -2.838
  188   1HG1  ILE  28          2HG1      ILE  28  21.168  -1.596  -1.973
  189   2HG1  ILE  28          1HG1      ILE  28  22.371  -2.629  -2.660
  190   1HG2  ILE  28          2HG2      ILE  28  19.795  -2.457  -5.246
  191   2HG2  ILE  28          1HG2      ILE  28  21.141  -3.587  -5.242
  192   3HG2  ILE  28          3HG2      ILE  28  19.507  -4.164  -4.974
  193   1HD1  ILE  28          1HD1      ILE  28  20.748  -0.640  -4.250
  194   2HD1  ILE  28          3HD1      ILE  28  22.321  -0.293  -3.541
  195   3HD1  ILE  28          2HD1      ILE  28  22.177  -1.524  -4.790
  196    H    GLY  29           H        GLY  29  19.811  -4.577  -1.087
  197   1HA   GLY  29          2HA       GLY  29  19.147  -3.075   1.381
  198   2HA   GLY  29          1HA       GLY  29  19.176  -4.796   1.302
  199    H    ALA  30           H        ALA  30  20.528  -2.752   2.946
  200    HA   ALA  30           HA       ALA  30  23.416  -3.118   2.413
  201   1HB   ALA  30          3HB       ALA  30  21.740  -1.376   4.193
  202   2HB   ALA  30          2HB       ALA  30  23.331  -1.803   4.804
  203   3HB   ALA  30          1HB       ALA  30  23.177  -0.964   3.275
  204    H    HIS  31           H        HIS  31  20.976  -3.844   4.786
  205    HA   HIS  31           HA       HIS  31  22.719  -5.785   6.228
  206   1HB   HIS  31          2HB       HIS  31  21.256  -3.994   7.414
  207   2HB   HIS  31          1HB       HIS  31  19.863  -4.944   6.929
  208    HD1  HIS  31           HD1      HIS  31  23.131  -5.757   8.650
  209    HD2  HIS  31           HD2      HIS  31  19.167  -6.707   8.894
  210    HE1  HIS  31           HE1      HIS  31  22.905  -7.316  10.550
  211   1HN   CGU  32           HN       CGU  32  22.143  -6.447   3.680
  212    HA   CGU  32           HA       CGU  32  19.898  -8.366   3.631
  213   1HB   CGU  32          1HB       CGU  32  21.855  -7.962   1.351
  214   2HB   CGU  32          2HB       CGU  32  20.798  -6.654   1.782
  215    HG   CGU  32           HG       CGU  32  19.056  -8.838   1.754
  216    H    ASP  33           H        ASP  33  21.095  -9.409   5.411
  217    HA   ASP  33           HA       ASP  33  23.401 -11.075   4.639
  218   1HB   ASP  33          2HB       ASP  33  22.003 -11.279   7.320
  219   2HB   ASP  33          1HB       ASP  33  23.711 -11.388   6.950
  220    H    VAL  34           H        VAL  34  21.160 -11.624   3.130
  221    HA   VAL  34           HA       VAL  34  20.461 -14.370   4.063
  222    HB   VAL  34           HB       VAL  34  18.578 -12.812   4.496
  223   1HG1  VAL  34          3HG1      VAL  34  18.633 -12.256   1.497
  224   2HG1  VAL  34          2HG1      VAL  34  17.375 -11.729   2.603
  225   3HG1  VAL  34          1HG1      VAL  34  19.003 -11.109   2.782
  226   1HG2  VAL  34          1HG2      VAL  34  18.204 -15.239   3.675
  227   2HG2  VAL  34          3HG2      VAL  34  16.838 -14.141   3.580
  228   3HG2  VAL  34          2HG2      VAL  34  17.755 -14.525   2.134
   
  No H/Q in entry =         228
  Start of MODEL   17
    1   1H    ALA   1          3H        ALA   1   9.087  10.171   3.683
    2   2H    ALA   1          2H        ALA   1   8.713  10.813   2.155
    3   3H    ALA   1          1H        ALA   1   7.467  10.448   3.250
    4    HA   ALA   1           HA       ALA   1   7.903   8.126   3.091
    5   1HB   ALA   1          2HB       ALA   1   6.443   9.172   1.337
    6   2HB   ALA   1          1HB       ALA   1   7.854   9.396   0.314
    7   3HB   ALA   1          3HB       ALA   1   7.302   7.775   0.712
    8    H    CYS   2           H        CYS   2   9.021   6.405   1.967
    9    HA   CYS   2           HA       CYS   2  11.813   7.053   1.178
   10   1HB   CYS   2          2HB       CYS   2  12.416   4.936   2.301
   11   2HB   CYS   2          1HB       CYS   2  11.904   6.137   3.435
   12    H    SER   3           H        SER   3  12.811   4.997   0.207
   13    HA   SER   3           HA       SER   3  10.962   3.986  -1.921
   14   1HB   SER   3          2HB       SER   3  13.874   4.727  -1.869
   15   2HB   SER   3          1HB       SER   3  13.456   3.320  -2.843
   16    HG   SER   3           HG       SER   3  12.641   5.945  -3.038
   17    H    GLY   4           H        GLY   4  10.938   1.802  -2.422
   18   1HA   GLY   4          2HA       GLY   4  11.742  -0.018  -0.187
   19   2HA   GLY   4          1HA       GLY   4  10.511  -0.359  -1.404
   20    H    ARG   5           H        ARG   5  12.253  -2.328  -1.106
   21    HA   ARG   5           HA       ARG   5  14.635  -2.041  -2.726
   22   1HB   ARG   5          2HB       ARG   5  14.328  -3.780  -0.886
   23   2HB   ARG   5          1HB       ARG   5  13.207  -4.628  -1.928
   24   1HG   ARG   5          2HG       ARG   5  14.881  -5.391  -3.353
   25   2HG   ARG   5          1HG       ARG   5  15.843  -3.937  -3.188
   26   1HD   ARG   5          2HD       ARG   5  16.966  -5.915  -2.153
   27   2HD   ARG   5          1HD       ARG   5  16.636  -4.660  -0.966
   28    HE   ARG   5           HE       ARG   5  15.228  -6.174   0.124
   29   1HH1  ARG   5          1HH2      ARG   5  13.014  -6.641  -1.398
   30   2HH1  ARG   5          2HH2      ARG   5  13.169  -8.231  -2.068
   31   1HH2  ARG   5          2HH1      ARG   5  16.616  -8.337  -1.476
   32   2HH2  ARG   5          1HH1      ARG   5  15.276  -9.223  -2.128
   33    H    GLY   6           H        GLY   6  13.720  -1.092  -4.548
   34   1HA   GLY   6          2HA       GLY   6  13.379  -2.544  -6.855
   35   2HA   GLY   6          1HA       GLY   6  11.734  -2.385  -6.232
   36    H    SER   7           H        SER   7  13.262   0.255  -5.102
   37    HA   SER   7           HA       SER   7  12.961   1.914  -7.555
   38   1HB   SER   7          2HB       SER   7  11.628   3.599  -6.206
   39   2HB   SER   7          1HB       SER   7  10.773   2.056  -6.337
   40    HG   SER   7           HG       SER   7  11.968   3.246  -4.169
   41    H    ARG   8           H        ARG   8  14.396   3.531  -7.686
   42    HA   ARG   8           HA       ARG   8  16.685   3.595  -5.953
   43   1HB   ARG   8          2HB       ARG   8  17.467   5.342  -7.514
   44   2HB   ARG   8          1HB       ARG   8  16.792   3.999  -8.393
   45   1HG   ARG   8          2HG       ARG   8  14.780   6.117  -7.726
   46   2HG   ARG   8          1HG       ARG   8  16.089   6.661  -8.730
   47   1HD   ARG   8          2HD       ARG   8  14.579   5.925 -10.353
   48   2HD   ARG   8          1HD       ARG   8  15.542   4.467 -10.149
   49    HE   ARG   8           HE       ARG   8  13.264   4.650  -8.318
   50   1HH1  ARG   8          1HH2      ARG   8  14.822   2.580 -10.340
   51   2HH1  ARG   8          2HH2      ARG   8  13.403   1.889 -11.045
   52   1HH2  ARG   8          2HH1      ARG   8  11.269   4.288  -9.675
   53   2HH2  ARG   8          1HH1      ARG   8  11.349   2.873 -10.671
   54    H    CYS   9           H        CYS   9  17.482   6.029  -5.553
   55    HA   CYS   9           HA       CYS   9  15.448   7.235  -3.797
   56   1HB   CYS   9          2HB       CYS   9  17.196   7.919  -2.346
   57   2HB   CYS   9          1HB       CYS   9  17.483   6.248  -2.729
   58    HA   HYP  10           HA       HYP  10  15.173   8.953  -2.717
   59   1HB   HYP  10          1HB       HYP  10  14.983  11.043  -1.961
   60   2HB   HYP  10          2HB       HYP  10  13.558  11.256  -2.964
   61   1HD   HYP  10          1HD1      HYP  10  17.125  11.288  -5.103
   62   2HD   HYP  10          2HD1      HYP  10  15.584  11.210  -5.969
   63    HOD  HYP  10           HD2      HYP  10  17.002  11.683  -2.835
   64    HG   HYP  10           HG       HYP  10  14.837  12.756  -4.336
   65    HA   HYP  11           HA       HYP  11  12.667  10.065  -1.589
   66   1HB   HYP  11          1HB       HYP  11  10.625   9.497  -0.807
   67   2HB   HYP  11          2HB       HYP  11  11.116   7.824  -0.631
   68   1HD   HYP  11          1HD1      HYP  11  10.772   9.047  -4.531
   69   2HD   HYP  11          2HD1      HYP  11  11.272   7.371  -4.272
   70    HOD  HYP  11           HD2      HYP  11   9.727  10.098  -2.781
   71    HG   HYP  11           HG       HYP  11   9.770   7.272  -2.452
   72    H    GLN  12           H        GLN  12  14.260   9.691  -0.144
   73    HA   GLN  12           HA       GLN  12  16.325   7.923  -0.381
   74   1HB   GLN  12          2HB       GLN  12  15.825   9.852   1.385
   75   2HB   GLN  12          1HB       GLN  12  15.345   8.524   2.422
   76   1HG   GLN  12          2HG       GLN  12  17.587   7.446   2.043
   77   2HG   GLN  12          1HG       GLN  12  18.054   8.815   1.040
   78   1HE2  GLN  12          2HE2      GLN  12  18.226  11.096   3.835
   79   2HE2  GLN  12          1HE2      GLN  12  17.774  11.041   2.199
   80    H    CYS  13           H        CYS  13  16.598   5.768  -0.243
   81    HA   CYS  13           HA       CYS  13  14.532   3.936   0.084
   82   1HB   CYS  13          2HB       CYS  13  17.183   3.001   1.074
   83   2HB   CYS  13          1HB       CYS  13  16.067   2.315  -0.055
   84    H    CYS  14           H        CYS  14  13.655   2.817   1.605
   85    HA   CYS  14           HA       CYS  14  13.319   3.822   4.205
   86   1HB   CYS  14          2HB       CYS  14  12.764   1.027   3.192
   87   2HB   CYS  14          1HB       CYS  14  12.009   1.769   4.567
   88    H    MET  15           H        MET  15  13.516   2.407   6.171
   89    HA   MET  15           HA       MET  15  16.201   2.112   6.895
   90   1HB   MET  15          2HB       MET  15  14.192   2.376   8.436
   91   2HB   MET  15          1HB       MET  15  13.814   0.688   8.163
   92   1HG   MET  15          2HG       MET  15  15.023   0.791  10.200
   93   2HG   MET  15          1HG       MET  15  16.117   0.111   9.039
   94   1HE   MET  15          2HE       MET  15  18.239   0.600   8.754
   95   2HE   MET  15          1HE       MET  15  18.210   2.116   7.833
   96   3HE   MET  15          3HE       MET  15  19.163   1.967   9.312
   97    H    GLY  16           H        GLY  16  17.646   0.606   6.571
   98   1HA   GLY  16          2HA       GLY  16  18.425  -1.668   6.549
   99   2HA   GLY  16          1HA       GLY  16  16.862  -2.164   5.922
  100    H    LEU  17           H        LEU  17  16.881   0.148   3.987
  101    HA   LEU  17           HA       LEU  17  18.516  -1.177   1.951
  102   1HB   LEU  17          2HB       LEU  17  16.235   0.803   1.815
  103   2HB   LEU  17          1HB       LEU  17  17.266   0.560   0.429
  104    HG   LEU  17           HG       LEU  17  16.610  -2.060   1.281
  105   1HD1  LEU  17          1HD1      LEU  17  14.171  -0.257   1.114
  106   2HD1  LEU  17          3HD1      LEU  17  14.132  -2.014   1.130
  107   3HD1  LEU  17          2HD1      LEU  17  14.702  -1.137   2.546
  108   1HD2  LEU  17          3HD2      LEU  17  16.834  -0.791  -1.092
  109   2HD2  LEU  17          2HD2      LEU  17  16.035  -2.331  -0.909
  110   3HD2  LEU  17          1HD2      LEU  17  15.094  -0.844  -0.977
  111    H    ARG  18           H        ARG  18  19.427   0.116   0.315
  112    HA   ARG  18           HA       ARG  18  20.664   2.703   1.013
  113   1HB   ARG  18          2HB       ARG  18  22.791   1.610  -0.103
  114   2HB   ARG  18          1HB       ARG  18  22.503   1.380   1.608
  115   1HG   ARG  18          2HG       ARG  18  21.658  -0.841   1.232
  116   2HG   ARG  18          1HG       ARG  18  21.454  -0.564  -0.478
  117   1HD   ARG  18          2HD       ARG  18  23.950  -0.409  -0.745
  118   2HD   ARG  18          1HD       ARG  18  24.125  -0.795   0.969
  119    HE   ARG  18           HE       ARG  18  22.470  -2.762  -0.313
  120   1HH1  ARG  18          1HH2      ARG  18  25.072  -2.815   1.491
  121   2HH1  ARG  18          2HH2      ARG  18  26.049  -3.856   0.512
  122   1HH2  ARG  18          2HH1      ARG  18  23.950  -3.554  -2.273
  123   2HH2  ARG  18          1HH1      ARG  18  25.404  -4.277  -1.671
  124    H    CYS  19           H        CYS  19  21.213   3.827  -0.782
  125    HA   CYS  19           HA       CYS  19  19.602   3.347  -3.147
  126   1HB   CYS  19          2HB       CYS  19  20.280   5.573  -2.053
  127   2HB   CYS  19          1HB       CYS  19  21.783   5.425  -2.913
  128    H    GLY  20           H        GLY  20  20.253   1.563  -4.343
  129   1HA   GLY  20          2HA       GLY  20  23.025   1.056  -5.047
  130   2HA   GLY  20          1HA       GLY  20  21.607   0.231  -5.703
  131    H    ARG  21           H        ARG  21  23.659   3.000  -5.991
  132    HA   ARG  21           HA       ARG  21  22.366   4.341  -8.110
  133   1HB   ARG  21          2HB       ARG  21  24.607   4.776  -6.509
  134   2HB   ARG  21          1HB       ARG  21  25.331   4.552  -8.088
  135   1HG   ARG  21          2HG       ARG  21  23.883   6.316  -9.034
  136   2HG   ARG  21          1HG       ARG  21  23.050   6.489  -7.498
  137   1HD   ARG  21          2HD       ARG  21  25.224   7.147  -6.421
  138   2HD   ARG  21          1HD       ARG  21  26.005   7.052  -7.997
  139    HE   ARG  21           HE       ARG  21  23.727   8.923  -7.445
  140   1HH1  ARG  21          2HH1      ARG  21  24.728   8.600 -10.228
  141   2HH1  ARG  21          1HH1      ARG  21  25.870   9.896 -10.375
  142   1HH2  ARG  21          1HH2      ARG  21  26.050  10.376  -6.905
  143   2HH2  ARG  21          2HH2      ARG  21  26.634  10.936  -8.438
  144    H    GLY  22           H        GLY  22  23.994   1.398  -8.145
  145   1HA   GLY  22          2HA       GLY  22  25.152   1.405 -10.775
  146   2HA   GLY  22          1HA       GLY  22  24.694  -0.036  -9.856
  147    H    ASN  23           H        ASN  23  24.283   0.456 -12.698
  148    HA   ASN  23           HA       ASN  23  21.477   1.043 -13.102
  149   1HB   ASN  23          2HB       ASN  23  21.997   0.353 -15.473
  150   2HB   ASN  23          1HB       ASN  23  23.032   1.626 -14.851
  151   1HD2  ASN  23          2HD2      ASN  23  24.613  -2.000 -15.815
  152   2HD2  ASN  23          1HD2      ASN  23  22.936  -1.745 -15.860
  153    HA   PRO  24           HA       PRO  24  19.598   0.550 -13.991
  154   1HB   PRO  24          2HB       PRO  24  17.250  -0.452 -12.888
  155   2HB   PRO  24          1HB       PRO  24  17.733  -0.574 -14.571
  156   1HG   PRO  24          2HG       PRO  24  17.687  -2.698 -12.520
  157   2HG   PRO  24          1HG       PRO  24  17.815  -2.862 -14.266
  158   1HD   PRO  24          2HD       PRO  24  19.946  -3.141 -12.342
  159   2HD   PRO  24          1HD       PRO  24  20.098  -3.181 -14.105
  160    H    GLN  25           H        GLN  25  19.291   2.308 -12.719
  161    HA   GLN  25           HA       GLN  25  20.193   2.407 -10.033
  162   1HB   GLN  25          2HB       GLN  25  18.450   4.291 -11.674
  163   2HB   GLN  25          1HB       GLN  25  19.000   4.693 -10.054
  164   1HG   GLN  25          2HG       GLN  25  21.360   4.374 -10.760
  165   2HG   GLN  25          1HG       GLN  25  20.836   3.961 -12.387
  166   1HE2  GLN  25          2HE2      GLN  25  19.970   7.336 -13.235
  167   2HE2  GLN  25          1HE2      GLN  25  19.565   5.718 -13.557
  168    H    LYS  26           H        LYS  26  19.329   1.452  -8.408
  169    HA   LYS  26           HA       LYS  26  16.565   1.854  -7.594
  170   1HB   LYS  26          2HB       LYS  26  17.376  -0.628  -8.992
  171   2HB   LYS  26          1HB       LYS  26  16.641  -0.958  -7.438
  172   1HG   LYS  26          2HG       LYS  26  14.651   0.180  -7.987
  173   2HG   LYS  26          1HG       LYS  26  15.338   0.972  -9.368
  174   1HD   LYS  26          2HD       LYS  26  15.723  -1.598 -10.173
  175   2HD   LYS  26          1HD       LYS  26  14.353  -1.851  -9.109
  176   1HE   LYS  26          2HE       LYS  26  13.502  -1.433 -11.349
  177   2HE   LYS  26          1HE       LYS  26  13.120  -0.020 -10.381
  178   1HZ   LYS  26          2HZ       LYS  26  15.226   0.972 -11.263
  179   2HZ   LYS  26          1HZ       LYS  26  15.310  -0.336 -12.343
  180   3HZ   LYS  26          3HZ       LYS  26  13.993   0.735 -12.406
  181    H    CYS  27           H        CYS  27  16.161   1.206  -5.363
  182    HA   CYS  27           HA       CYS  27  18.602   1.156  -3.806
  183   1HB   CYS  27          2HB       CYS  27  15.732   0.874  -2.802
  184   2HB   CYS  27          1HB       CYS  27  17.160   1.119  -1.878
  185    H    ILE  28           H        ILE  28  19.217  -0.512  -2.448
  186    HA   ILE  28           HA       ILE  28  17.908  -3.168  -2.743
  187    HB   ILE  28           HB       ILE  28  20.144  -4.185  -2.941
  188   1HG1  ILE  28          2HG1      ILE  28  21.271  -2.227  -1.661
  189   2HG1  ILE  28          1HG1      ILE  28  22.132  -3.028  -2.914
  190   1HG2  ILE  28          1HG2      ILE  28  19.623  -2.076  -5.080
  191   2HG2  ILE  28          3HG2      ILE  28  20.773  -3.392  -5.239
  192   3HG2  ILE  28          2HG2      ILE  28  19.064  -3.736  -5.060
  193   1HD1  ILE  28          2HD1      ILE  28  20.660  -0.637  -3.828
  194   2HD1  ILE  28          1HD1      ILE  28  22.004  -0.368  -2.734
  195   3HD1  ILE  28          3HD1      ILE  28  22.260  -1.237  -4.237
  196    H    GLY  29           H        GLY  29  19.402  -4.551  -1.003
  197   1HA   GLY  29          2HA       GLY  29  18.974  -3.058   1.495
  198   2HA   GLY  29          1HA       GLY  29  19.032  -4.773   1.385
  199    H    ALA  30           H        ALA  30  20.471  -2.587   2.894
  200    HA   ALA  30           HA       ALA  30  23.302  -2.779   2.208
  201   1HB   ALA  30          3HB       ALA  30  22.335  -0.726   3.287
  202   2HB   ALA  30          2HB       ALA  30  21.921  -1.683   4.698
  203   3HB   ALA  30          1HB       ALA  30  23.608  -1.426   4.274
  204    H    HIS  31           H        HIS  31  21.093  -3.979   4.585
  205    HA   HIS  31           HA       HIS  31  23.095  -5.774   5.829
  206   1HB   HIS  31          2HB       HIS  31  21.164  -4.403   7.036
  207   2HB   HIS  31          1HB       HIS  31  20.124  -5.718   6.511
  208    HD1  HIS  31           HD1      HIS  31  23.169  -5.171   8.609
  209    HD2  HIS  31           HD2      HIS  31  20.374  -8.078   7.982
  210    HE1  HIS  31           HE1      HIS  31  23.558  -6.890  10.335
  211   1HN   CGU  32           HN       CGU  32  22.736  -6.187   3.214
  212    HA   CGU  32           HA       CGU  32  21.730  -8.943   3.044
  213   1HB   CGU  32          1HB       CGU  32  20.691  -6.548   1.475
  214   2HB   CGU  32          2HB       CGU  32  19.755  -7.791   2.257
  215    HG   CGU  32           HG       CGU  32  21.507  -8.424  -0.145
  216    H    ASP  33           H        ASP  33  23.818  -9.528   2.905
  217    HA   ASP  33           HA       ASP  33  25.517  -8.412   0.724
  218   1HB   ASP  33          2HB       ASP  33  26.276  -8.566   3.243
  219   2HB   ASP  33          1HB       ASP  33  26.439 -10.287   2.957
  220    H    VAL  34           H        VAL  34  23.327 -10.128   0.297
  221    HA   VAL  34           HA       VAL  34  24.689 -12.359  -1.117
  222    HB   VAL  34           HB       VAL  34  21.977 -12.936   0.118
  223   1HG1  VAL  34          1HG1      VAL  34  24.468 -14.607  -0.406
  224   2HG1  VAL  34          3HG1      VAL  34  22.934 -15.233   0.177
  225   3HG1  VAL  34          2HG1      VAL  34  23.045 -14.546  -1.433
  226   1HG2  VAL  34          3HG2      VAL  34  24.593 -13.045   1.688
  227   2HG2  VAL  34          2HG2      VAL  34  23.177 -12.091   2.094
  228   3HG2  VAL  34          1HG2      VAL  34  23.110 -13.838   2.185
   
  No H/Q in entry =         228
  Start of MODEL   18
    1   1H    ALA   1          1H        ALA   1   7.950   9.967   1.053
    2   2H    ALA   1          3H        ALA   1   6.785  10.134   2.279
    3   3H    ALA   1          2H        ALA   1   8.437  10.091   2.677
    4    HA   ALA   1           HA       ALA   1   7.710   7.971   3.198
    5   1HB   ALA   1          1HB       ALA   1   6.228   8.040   0.527
    6   2HB   ALA   1          3HB       ALA   1   6.268   6.656   1.609
    7   3HB   ALA   1          2HB       ALA   1   5.487   8.146   2.116
    8    H    CYS   2           H        CYS   2   9.544   6.923   3.084
    9    HA   CYS   2           HA       CYS   2  11.583   7.114   1.196
   10   1HB   CYS   2          2HB       CYS   2  12.398   4.974   2.269
   11   2HB   CYS   2          1HB       CYS   2  12.080   6.259   3.382
   12    H    SER   3           H        SER   3  12.604   5.101   0.181
   13    HA   SER   3           HA       SER   3  10.699   3.983  -1.816
   14   1HB   SER   3          2HB       SER   3  13.419   4.985  -1.978
   15   2HB   SER   3          1HB       SER   3  13.409   3.315  -2.519
   16    HG   SER   3           HG       SER   3  11.884   3.746  -3.952
   17    H    GLY   4           H        GLY   4  11.277   1.753  -2.600
   18   1HA   GLY   4          2HA       GLY   4  11.902  -0.063  -0.294
   19   2HA   GLY   4          1HA       GLY   4  10.644  -0.397  -1.484
   20    H    ARG   5           H        ARG   5  12.564  -2.269  -1.117
   21    HA   ARG   5           HA       ARG   5  14.832  -2.003  -2.860
   22   1HB   ARG   5          2HB       ARG   5  14.519  -3.682  -0.940
   23   2HB   ARG   5          1HB       ARG   5  13.466  -4.600  -1.988
   24   1HG   ARG   5          2HG       ARG   5  15.955  -3.955  -3.399
   25   2HG   ARG   5          1HG       ARG   5  16.331  -4.664  -1.844
   26   1HD   ARG   5          2HD       ARG   5  14.368  -5.918  -3.814
   27   2HD   ARG   5          1HD       ARG   5  16.082  -6.320  -3.761
   28    HE   ARG   5           HE       ARG   5  15.140  -6.622  -1.131
   29   1HH1  ARG   5          1HH2      ARG   5  12.870  -7.486  -3.114
   30   2HH1  ARG   5          2HH2      ARG   5  13.089  -9.206  -3.085
   31   1HH2  ARG   5          2HH1      ARG   5  16.245  -8.931  -1.576
   32   2HH2  ARG   5          1HH1      ARG   5  15.073 -10.060  -2.175
   33    H    GLY   6           H        GLY   6  14.008  -1.166  -4.699
   34   1HA   GLY   6          2HA       GLY   6  13.696  -2.606  -6.977
   35   2HA   GLY   6          1HA       GLY   6  12.038  -2.560  -6.375
   36    H    SER   7           H        SER   7  13.245   0.169  -5.195
   37    HA   SER   7           HA       SER   7  12.934   1.847  -7.634
   38   1HB   SER   7          2HB       SER   7  11.544   3.447  -6.098
   39   2HB   SER   7          1HB       SER   7  10.713   1.971  -6.594
   40    HG   SER   7           HG       SER   7  12.126   1.374  -4.434
   41    H    ARG   8           H        ARG   8  14.366   3.441  -7.695
   42    HA   ARG   8           HA       ARG   8  16.619   3.508  -5.947
   43   1HB   ARG   8          2HB       ARG   8  17.495   5.082  -7.442
   44   2HB   ARG   8          1HB       ARG   8  16.439   4.088  -8.410
   45   1HG   ARG   8          2HG       ARG   8  15.125   5.776  -9.013
   46   2HG   ARG   8          1HG       ARG   8  14.892   6.338  -7.385
   47   1HD   ARG   8          2HD       ARG   8  16.046   8.165  -8.198
   48   2HD   ARG   8          1HD       ARG   8  17.456   7.204  -7.773
   49    HE   ARG   8           HE       ARG   8  17.308   6.356 -10.215
   50   1HH1  ARG   8          1HH2      ARG   8  15.268   7.664 -11.504
   51   2HH1  ARG   8          2HH2      ARG   8  15.876   9.217 -11.973
   52   1HH2  ARG   8          2HH1      ARG   8  18.555   9.067  -9.719
   53   2HH2  ARG   8          1HH1      ARG   8  17.787  10.036 -10.934
   54    H    CYS   9           H        CYS   9  17.155   6.231  -5.983
   55    HA   CYS   9           HA       CYS   9  15.385   7.355  -3.939
   56   1HB   CYS   9          2HB       CYS   9  17.145   7.829  -2.429
   57   2HB   CYS   9          1HB       CYS   9  17.353   6.174  -2.914
   58    HA   HYP  10           HA       HYP  10  15.192   9.035  -2.818
   59   1HB   HYP  10          1HB       HYP  10  14.907  11.096  -2.046
   60   2HB   HYP  10          2HB       HYP  10  13.488  11.259  -3.054
   61   1HD   HYP  10          1HD1      HYP  10  17.154  11.423  -5.053
   62   2HD   HYP  10          2HD1      HYP  10  15.694  11.309  -6.048
   63    HOD  HYP  10           HD2      HYP  10  16.876  11.904  -2.838
   64    HG   HYP  10           HG       HYP  10  14.724  12.787  -4.473
   65    HA   HYP  11           HA       HYP  11  12.609   9.913  -1.710
   66   1HB   HYP  11          1HB       HYP  11  10.594   9.125  -1.119
   67   2HB   HYP  11          2HB       HYP  11  11.357   7.597  -0.712
   68   1HD   HYP  11          1HD1      HYP  11  10.710   8.903  -4.492
   69   2HD   HYP  11          2HD1      HYP  11  11.499   7.323  -4.654
   70    HOD  HYP  11           HD2      HYP  11   8.945   8.066  -1.832
   71    HG   HYP  11           HG       HYP  11  10.548   6.549  -2.638
   72    H    GLN  12           H        GLN  12  13.943   9.517   0.053
   73    HA   GLN  12           HA       GLN  12  16.279   8.016  -0.281
   74   1HB   GLN  12          2HB       GLN  12  16.508   8.202   2.251
   75   2HB   GLN  12          1HB       GLN  12  16.133   9.715   1.464
   76   1HG   GLN  12          2HG       GLN  12  13.574   8.607   2.077
   77   2HG   GLN  12          1HG       GLN  12  14.564   8.226   3.473
   78   1HE2  GLN  12          2HE2      GLN  12  14.810  11.581   4.556
   79   2HE2  GLN  12          1HE2      GLN  12  15.378   9.993   4.755
   80    H    CYS  13           H        CYS  13  16.705   5.795  -0.126
   81    HA   CYS  13           HA       CYS  13  14.553   3.958  -0.005
   82   1HB   CYS  13          2HB       CYS  13  17.234   3.063   0.944
   83   2HB   CYS  13          1HB       CYS  13  16.108   2.303  -0.130
   84    H    CYS  14           H        CYS  14  13.589   2.887   1.576
   85    HA   CYS  14           HA       CYS  14  13.404   3.894   4.177
   86   1HB   CYS  14          2HB       CYS  14  12.755   1.117   3.173
   87   2HB   CYS  14          1HB       CYS  14  12.181   1.779   4.672
   88    H    MET  15           H        MET  15  13.662   2.546   6.163
   89    HA   MET  15           HA       MET  15  16.339   2.244   6.855
   90   1HB   MET  15          2HB       MET  15  14.311   2.477   8.382
   91   2HB   MET  15          1HB       MET  15  14.008   0.768   8.156
   92   1HG   MET  15          2HG       MET  15  15.462   0.326   9.815
   93   2HG   MET  15          1HG       MET  15  16.760   0.991   8.873
   94   1HE   MET  15          2HE       MET  15  13.767   2.118  11.173
   95   2HE   MET  15          1HE       MET  15  14.885   1.055  12.061
   96   3HE   MET  15          3HE       MET  15  14.721   2.743  12.506
   97    H    GLY  16           H        GLY  16  17.808   0.725   6.646
   98   1HA   GLY  16          2HA       GLY  16  18.659  -1.497   6.601
   99   2HA   GLY  16          1HA       GLY  16  17.091  -2.064   6.054
  100    H    LEU  17           H        LEU  17  16.974   0.173   4.050
  101    HA   LEU  17           HA       LEU  17  18.468  -1.193   1.962
  102   1HB   LEU  17          2HB       LEU  17  16.556   1.160   1.783
  103   2HB   LEU  17          1HB       LEU  17  17.250   0.354   0.402
  104    HG   LEU  17           HG       LEU  17  15.183  -0.697   2.347
  105   1HD1  LEU  17          3HD1      LEU  17  14.428   0.761   0.517
  106   2HD1  LEU  17          2HD1      LEU  17  15.115  -0.365  -0.647
  107   3HD1  LEU  17          1HD1      LEU  17  13.789  -0.870   0.396
  108   1HD2  LEU  17          1HD2      LEU  17  16.819  -2.579   1.781
  109   2HD2  LEU  17          3HD2      LEU  17  15.196  -2.845   1.184
  110   3HD2  LEU  17          2HD2      LEU  17  16.442  -2.302   0.080
  111    H    ARG  18           H        ARG  18  19.390   0.063   0.260
  112    HA   ARG  18           HA       ARG  18  20.781   2.570   0.924
  113   1HB   ARG  18          2HB       ARG  18  22.828   1.267  -0.245
  114   2HB   ARG  18          1HB       ARG  18  22.577   1.229   1.484
  115   1HG   ARG  18          2HG       ARG  18  21.555  -0.939   1.342
  116   2HG   ARG  18          1HG       ARG  18  21.347  -0.815  -0.381
  117   1HD   ARG  18          2HD       ARG  18  24.084  -0.926   0.961
  118   2HD   ARG  18          1HD       ARG  18  23.267  -2.328   0.268
  119    HE   ARG  18           HE       ARG  18  23.202  -0.623  -1.826
  120   1HH1  ARG  18          2HH1      ARG  18  25.233   1.063  -1.651
  121   2HH1  ARG  18          1HH1      ARG  18  26.719   0.201  -1.871
  122   1HH2  ARG  18          1HH2      ARG  18  25.238  -2.908  -1.209
  123   2HH2  ARG  18          2HH2      ARG  18  26.721  -2.111  -1.619
  124    H    CYS  19           H        CYS  19  21.218   3.692  -0.862
  125    HA   CYS  19           HA       CYS  19  19.602   3.171  -3.230
  126   1HB   CYS  19          2HB       CYS  19  20.149   5.413  -2.127
  127   2HB   CYS  19          1HB       CYS  19  21.684   5.349  -2.939
  128    H    GLY  20           H        GLY  20  20.316   1.447  -4.449
  129   1HA   GLY  20          2HA       GLY  20  23.127   1.072  -5.147
  130   2HA   GLY  20          1HA       GLY  20  21.759   0.146  -5.760
  131    H    ARG  21           H        ARG  21  24.043   2.411  -6.622
  132    HA   ARG  21           HA       ARG  21  22.571   3.969  -8.489
  133   1HB   ARG  21          2HB       ARG  21  24.935   4.409  -7.539
  134   2HB   ARG  21          1HB       ARG  21  25.522   3.280  -8.749
  135   1HG   ARG  21          2HG       ARG  21  24.458   4.679 -10.541
  136   2HG   ARG  21          1HG       ARG  21  23.901   5.806  -9.317
  137   1HD   ARG  21          2HD       ARG  21  26.296   6.215  -8.658
  138   2HD   ARG  21          1HD       ARG  21  26.809   5.154  -9.969
  139    HE   ARG  21           HE       ARG  21  25.544   7.822 -10.279
  140   1HH1  ARG  21          1HH2      ARG  21  24.509   6.006 -12.385
  141   2HH1  ARG  21          2HH2      ARG  21  25.688   6.178 -13.638
  142   1HH2  ARG  21          2HH1      ARG  21  28.077   7.592 -11.511
  143   2HH2  ARG  21          1HH1      ARG  21  27.752   7.092 -13.138
  144    H    GLY  22           H        GLY  22  22.262   3.755 -10.639
  145   1HA   GLY  22          2HA       GLY  22  23.342   1.765 -12.377
  146   2HA   GLY  22          1HA       GLY  22  21.766   1.224 -11.777
  147    H    ASN  23           H        ASN  23  20.862   1.429 -13.870
  148    HA   ASN  23           HA       ASN  23  19.815   4.081 -14.430
  149   1HB   ASN  23          2HB       ASN  23  22.234   3.401 -15.740
  150   2HB   ASN  23          1HB       ASN  23  21.017   3.085 -16.959
  151   1HD2  ASN  23          2HD2      ASN  23  21.283   6.925 -15.489
  152   2HD2  ASN  23          1HD2      ASN  23  21.594   5.613 -14.453
  153    HA   PRO  24           HA       PRO  24  17.913   4.409 -14.019
  154   1HB   PRO  24          2HB       PRO  24  15.565   3.417 -12.915
  155   2HB   PRO  24          1HB       PRO  24  15.694   4.536 -14.261
  156   1HG   PRO  24          2HG       PRO  24  14.950   1.683 -14.324
  157   2HG   PRO  24          1HG       PRO  24  14.748   2.899 -15.578
  158   1HD   PRO  24          2HD       PRO  24  16.739   0.814 -15.490
  159   2HD   PRO  24          1HD       PRO  24  16.621   2.117 -16.686
  160    H    GLN  25           H        GLN  25  18.583   4.633 -11.966
  161    HA   GLN  25           HA       GLN  25  19.900   2.602 -10.514
  162   1HB   GLN  25          2HB       GLN  25  18.576   5.057  -9.308
  163   2HB   GLN  25          1HB       GLN  25  19.923   4.178  -8.618
  164   1HG   GLN  25          2HG       GLN  25  21.465   5.207  -9.998
  165   2HG   GLN  25          1HG       GLN  25  20.389   5.214 -11.384
  166   1HE2  GLN  25          2HE2      GLN  25  20.030   8.658 -10.930
  167   2HE2  GLN  25          1HE2      GLN  25  20.486   7.378 -11.951
  168    H    LYS  26           H        LYS  26  19.285   1.831  -8.268
  169    HA   LYS  26           HA       LYS  26  16.460   1.636  -7.599
  170   1HB   LYS  26          2HB       LYS  26  17.752  -0.463  -9.228
  171   2HB   LYS  26          1HB       LYS  26  17.090  -1.123  -7.748
  172   1HG   LYS  26          2HG       LYS  26  14.920  -0.173  -8.213
  173   2HG   LYS  26          1HG       LYS  26  15.494   0.643  -9.641
  174   1HD   LYS  26          2HD       LYS  26  15.969  -2.325  -9.543
  175   2HD   LYS  26          1HD       LYS  26  14.308  -1.810  -9.726
  176   1HE   LYS  26          2HE       LYS  26  15.107  -1.983 -11.972
  177   2HE   LYS  26          1HE       LYS  26  15.176  -0.260 -11.649
  178   1HZ   LYS  26          3HZ       LYS  26  17.564  -1.589 -10.841
  179   2HZ   LYS  26          2HZ       LYS  26  17.227  -1.841 -12.486
  180   3HZ   LYS  26          1HZ       LYS  26  17.355  -0.262 -11.880
  181    H    CYS  27           H        CYS  27  16.177   1.239  -5.385
  182    HA   CYS  27           HA       CYS  27  18.582   1.031  -3.812
  183   1HB   CYS  27          2HB       CYS  27  15.731   0.729  -2.745
  184   2HB   CYS  27          1HB       CYS  27  17.186   1.049  -1.896
  185    H    ILE  28           H        ILE  28  19.176  -0.633  -2.480
  186    HA   ILE  28           HA       ILE  28  17.857  -3.286  -2.744
  187    HB   ILE  28           HB       ILE  28  20.140  -4.300  -2.833
  188   1HG1  ILE  28          2HG1      ILE  28  21.216  -2.179  -1.781
  189   2HG1  ILE  28          1HG1      ILE  28  22.106  -3.090  -2.933
  190   1HG2  ILE  28          2HG2      ILE  28  19.447  -2.458  -5.149
  191   2HG2  ILE  28          1HG2      ILE  28  20.724  -3.665  -5.212
  192   3HG2  ILE  28          3HG2      ILE  28  19.063  -4.158  -4.957
  193   1HD1  ILE  28          1HD1      ILE  28  20.538  -0.887  -4.127
  194   2HD1  ILE  28          3HD1      ILE  28  21.844  -0.418  -3.058
  195   3HD1  ILE  28          2HD1      ILE  28  22.173  -1.446  -4.443
  196    H    GLY  29           H        GLY  29  19.493  -4.589  -0.962
  197   1HA   GLY  29          2HA       GLY  29  19.095  -2.994   1.490
  198   2HA   GLY  29          1HA       GLY  29  19.028  -4.723   1.431
  199    H    ALA  30           H        ALA  30  20.611  -2.734   2.957
  200    HA   ALA  30           HA       ALA  30  23.425  -3.195   2.194
  201   1HB   ALA  30          3HB       ALA  30  22.163  -1.078   3.435
  202   2HB   ALA  30          2HB       ALA  30  22.791  -1.940   4.825
  203   3HB   ALA  30          1HB       ALA  30  23.884  -1.398   3.565
  204    H    HIS  31           H        HIS  31  21.207  -3.814   4.808
  205    HA   HIS  31           HA       HIS  31  22.963  -5.874   6.043
  206   1HB   HIS  31          2HB       HIS  31  21.504  -3.940   7.248
  207   2HB   HIS  31          1HB       HIS  31  20.229  -5.143   7.135
  208    HD1  HIS  31           HD1      HIS  31  21.085  -7.568   8.158
  209    HD2  HIS  31           HD2      HIS  31  23.136  -4.277   9.432
  210    HE1  HIS  31           HE1      HIS  31  22.271  -8.242  10.216
  211   1HN   CGU  32           HN       CGU  32  22.083  -6.399   3.546
  212    HA   CGU  32           HA       CGU  32  19.969  -8.474   3.745
  213   1HB   CGU  32          1HB       CGU  32  21.065  -7.182   1.237
  214   2HB   CGU  32          2HB       CGU  32  19.942  -6.302   2.232
  215    HG   CGU  32           HG       CGU  32  19.255  -9.080   1.284
  216    H    ASP  33           H        ASP  33  21.173  -9.087   1.111
  217    HA   ASP  33           HA       ASP  33  23.669 -10.528   1.799
  218   1HB   ASP  33          2HB       ASP  33  21.396 -11.957   2.046
  219   2HB   ASP  33          1HB       ASP  33  21.453 -12.002   0.297
  220    H    VAL  34           H        VAL  34  23.065  -8.216   0.407
  221    HA   VAL  34           HA       VAL  34  24.049  -8.869  -2.327
  222    HB   VAL  34           HB       VAL  34  21.911  -6.789  -1.645
  223   1HG1  VAL  34          2HG1      VAL  34  23.191  -7.604  -4.282
  224   2HG1  VAL  34          1HG1      VAL  34  21.728  -6.638  -4.172
  225   3HG1  VAL  34          3HG1      VAL  34  23.235  -6.017  -3.530
  226   1HG2  VAL  34          2HG2      VAL  34  21.696  -9.480  -3.069
  227   2HG2  VAL  34          1HG2      VAL  34  20.944  -9.051  -1.541
  228   3HG2  VAL  34          3HG2      VAL  34  20.410  -8.283  -3.023
   
  No H/Q in entry =         228
  Start of MODEL   19
    1   1H    ALA   1          3H        ALA   1   9.203  10.420   3.295
    2   2H    ALA   1          2H        ALA   1   8.860  10.904   1.703
    3   3H    ALA   1          1H        ALA   1   7.598  10.723   2.825
    4    HA   ALA   1           HA       ALA   1   8.027   8.361   2.966
    5   1HB   ALA   1          1HB       ALA   1   6.414   9.235   1.256
    6   2HB   ALA   1          3HB       ALA   1   7.725   9.337   0.090
    7   3HB   ALA   1          2HB       ALA   1   7.208   7.772   0.701
    8    H    CYS   2           H        CYS   2   9.110   6.524   2.076
    9    HA   CYS   2           HA       CYS   2  11.823   7.099   0.992
   10   1HB   CYS   2          2HB       CYS   2  12.472   5.020   2.166
   11   2HB   CYS   2          1HB       CYS   2  11.988   6.234   3.292
   12    H    SER   3           H        SER   3  12.715   4.938   0.092
   13    HA   SER   3           HA       SER   3  10.721   3.866  -1.877
   14   1HB   SER   3          2HB       SER   3  13.574   4.735  -2.107
   15   2HB   SER   3          1HB       SER   3  13.172   3.271  -2.996
   16    HG   SER   3           HG       SER   3  11.704   4.324  -4.139
   17    H    GLY   4           H        GLY   4  10.778   1.675  -2.365
   18   1HA   GLY   4          2HA       GLY   4  11.736  -0.069  -0.143
   19   2HA   GLY   4          1HA       GLY   4  10.525  -0.499  -1.347
   20    H    ARG   5           H        ARG   5  12.506  -2.328  -0.944
   21    HA   ARG   5           HA       ARG   5  14.845  -1.960  -2.569
   22   1HB   ARG   5          2HB       ARG   5  14.514  -3.783  -0.818
   23   2HB   ARG   5          1HB       ARG   5  13.458  -4.605  -1.943
   24   1HG   ARG   5          2HG       ARG   5  15.901  -3.866  -3.352
   25   2HG   ARG   5          1HG       ARG   5  16.361  -4.588  -1.827
   26   1HD   ARG   5          2HD       ARG   5  14.225  -6.002  -3.406
   27   2HD   ARG   5          1HD       ARG   5  15.868  -6.058  -4.041
   28    HE   ARG   5           HE       ARG   5  16.238  -6.673  -1.398
   29   1HH1  ARG   5          1HH2      ARG   5  13.375  -7.622  -1.555
   30   2HH1  ARG   5          2HH2      ARG   5  13.586  -9.297  -1.939
   31   1HH2  ARG   5          2HH1      ARG   5  16.930  -8.853  -2.907
   32   2HH2  ARG   5          1HH1      ARG   5  15.659 -10.013  -2.727
   33    H    GLY   6           H        GLY   6  14.791  -1.557  -4.636
   34   1HA   GLY   6          2HA       GLY   6  14.498  -2.513  -6.897
   35   2HA   GLY   6          1HA       GLY   6  12.856  -2.966  -6.449
   36    H    SER   7           H        SER   7  13.048  -0.191  -4.931
   37    HA   SER   7           HA       SER   7  11.926   1.410  -7.161
   38   1HB   SER   7          2HB       SER   7  10.621   1.139  -4.987
   39   2HB   SER   7          1HB       SER   7  11.934   1.983  -4.150
   40    HG   SER   7           HG       SER   7  10.366   2.952  -6.302
   41    H    ARG   8           H        ARG   8  12.758   3.595  -7.388
   42    HA   ARG   8           HA       ARG   8  15.629   3.739  -7.260
   43   1HB   ARG   8          2HB       ARG   8  15.369   5.760  -8.500
   44   2HB   ARG   8          1HB       ARG   8  14.066   4.732  -9.037
   45   1HG   ARG   8          2HG       ARG   8  13.824   6.991  -6.979
   46   2HG   ARG   8          1HG       ARG   8  13.286   7.026  -8.637
   47   1HD   ARG   8          2HD       ARG   8  12.131   5.290  -6.429
   48   2HD   ARG   8          1HD       ARG   8  11.358   6.641  -7.238
   49    HE   ARG   8           HE       ARG   8  12.207   4.289  -8.858
   50   1HH1  ARG   8          1HH2      ARG   8  10.713   6.048 -10.416
   51   2HH1  ARG   8          2HH2      ARG   8   9.051   5.621 -10.184
   52   1HH2  ARG   8          2HH1      ARG   8   9.800   3.856  -7.233
   53   2HH2  ARG   8          1HH1      ARG   8   8.493   4.293  -8.293
   54    H    CYS   9           H        CYS   9  16.230   6.272  -6.727
   55    HA   CYS   9           HA       CYS   9  15.325   7.064  -4.110
   56   1HB   CYS   9          2HB       CYS   9  17.877   6.871  -3.322
   57   2HB   CYS   9          1HB       CYS   9  16.724   5.590  -3.115
   58    HA   HYP  10           HA       HYP  10  15.400   8.666  -2.902
   59   1HB   HYP  10          1HB       HYP  10  15.584  10.703  -2.004
   60   2HB   HYP  10          2HB       HYP  10  14.195  11.201  -2.950
   61   1HD   HYP  10          1HD1      HYP  10  17.879  10.764  -4.836
   62   2HD   HYP  10          2HD1      HYP  10  16.525  11.010  -5.946
   63    HOD  HYP  10           HD2      HYP  10  17.237  13.056  -3.129
   64    HG   HYP  10           HG       HYP  10  15.645  12.499  -4.376
   65    HA   HYP  11           HA       HYP  11  12.844  10.041  -1.847
   66   1HB   HYP  11          1HB       HYP  11  10.734   9.455  -1.282
   67   2HB   HYP  11          2HB       HYP  11  11.253   7.802  -0.999
   68   1HD   HYP  11          1HD1      HYP  11  11.122   9.093  -4.904
   69   2HD   HYP  11          2HD1      HYP  11  11.685   7.427  -4.718
   70    HOD  HYP  11           HD2      HYP  11   8.911   9.034  -2.428
   71    HG   HYP  11           HG       HYP  11  10.156   7.128  -2.946
   72    H    GLN  12           H        GLN  12  14.343   9.668  -0.355
   73    HA   GLN  12           HA       GLN  12  16.429   7.917  -0.473
   74   1HB   GLN  12          2HB       GLN  12  16.034   9.831   1.195
   75   2HB   GLN  12          1HB       GLN  12  15.157   8.684   2.187
   76   1HG   GLN  12          2HG       GLN  12  17.336   7.194   1.984
   77   2HG   GLN  12          1HG       GLN  12  18.108   8.674   1.437
   78   1HE2  GLN  12          2HE2      GLN  12  18.033  10.205   4.651
   79   2HE2  GLN  12          1HE2      GLN  12  18.203  10.492   2.988
   80    H    CYS  13           H        CYS  13  16.724   5.762  -0.283
   81    HA   CYS  13           HA       CYS  13  14.613   3.940  -0.029
   82   1HB   CYS  13          2HB       CYS  13  17.298   3.113   0.982
   83   2HB   CYS  13          1HB       CYS  13  16.178   2.296  -0.061
   84    H    CYS  14           H        CYS  14  13.719   2.826   1.533
   85    HA   CYS  14           HA       CYS  14  13.395   3.916   4.104
   86   1HB   CYS  14          2HB       CYS  14  12.812   1.087   3.200
   87   2HB   CYS  14          1HB       CYS  14  12.075   1.895   4.547
   88    H    MET  15           H        MET  15  13.569   2.535   6.116
   89    HA   MET  15           HA       MET  15  16.234   2.298   6.909
   90   1HB   MET  15          2HB       MET  15  14.081   2.520   8.328
   91   2HB   MET  15          1HB       MET  15  13.912   0.786   8.171
   92   1HG   MET  15          2HG       MET  15  16.387   2.130   9.290
   93   2HG   MET  15          1HG       MET  15  15.046   1.646  10.277
   94   1HE   MET  15          3HE       MET  15  18.197   0.824   8.534
   95   2HE   MET  15          2HE       MET  15  18.423   0.722  10.295
   96   3HE   MET  15          1HE       MET  15  18.640  -0.698   9.272
   97    H    GLY  16           H        GLY  16  17.731   0.824   6.625
   98   1HA   GLY  16          2HA       GLY  16  18.589  -1.414   6.664
   99   2HA   GLY  16          1HA       GLY  16  17.024  -1.992   6.120
  100    H    LEU  17           H        LEU  17  16.970   0.255   4.074
  101    HA   LEU  17           HA       LEU  17  18.453  -1.194   2.028
  102   1HB   LEU  17          2HB       LEU  17  16.563   1.175   1.821
  103   2HB   LEU  17          1HB       LEU  17  17.258   0.386   0.433
  104    HG   LEU  17           HG       LEU  17  15.160  -0.646   2.347
  105   1HD1  LEU  17          3HD1      LEU  17  14.604   0.834   0.368
  106   2HD1  LEU  17          2HD1      LEU  17  15.077  -0.509  -0.657
  107   3HD1  LEU  17          1HD1      LEU  17  13.747  -0.691   0.481
  108   1HD2  LEU  17          3HD2      LEU  17  16.816  -2.536   1.813
  109   2HD2  LEU  17          2HD2      LEU  17  15.171  -2.804   1.283
  110   3HD2  LEU  17          1HD2      LEU  17  16.384  -2.318   0.120
  111    H    ARG  18           H        ARG  18  19.470  -0.008   0.346
  112    HA   ARG  18           HA       ARG  18  20.897   2.483   1.032
  113   1HB   ARG  18          2HB       ARG  18  22.874   1.136  -0.234
  114   2HB   ARG  18          1HB       ARG  18  22.714   1.175   1.506
  115   1HG   ARG  18          2HG       ARG  18  21.855  -0.968   1.619
  116   2HG   ARG  18          1HG       ARG  18  21.306  -1.010  -0.033
  117   1HD   ARG  18          2HD       ARG  18  24.261  -0.928   0.726
  118   2HD   ARG  18          1HD       ARG  18  23.385  -2.413   0.355
  119    HE   ARG  18           HE       ARG  18  22.979  -0.503  -1.738
  120   1HH1  ARG  18          1HH2      ARG  18  23.967  -3.501  -1.471
  121   2HH1  ARG  18          2HH2      ARG  18  25.390  -3.417  -2.456
  122   1HH2  ARG  18          2HH1      ARG  18  25.369   0.094  -2.486
  123   2HH2  ARG  18          1HH1      ARG  18  26.214  -1.314  -3.037
  124    H    CYS  19           H        CYS  19  21.281   3.630  -0.727
  125    HA   CYS  19           HA       CYS  19  19.685   3.080  -3.099
  126   1HB   CYS  19          2HB       CYS  19  19.905   5.318  -2.107
  127   2HB   CYS  19          1HB       CYS  19  21.593   5.349  -2.532
  128    H    GLY  20           H        GLY  20  20.384   1.577  -4.485
  129   1HA   GLY  20          2HA       GLY  20  23.208   1.287  -5.212
  130   2HA   GLY  20          1HA       GLY  20  21.855   0.352  -5.857
  131    H    ARG  21           H        ARG  21  24.079   2.654  -6.608
  132    HA   ARG  21           HA       ARG  21  22.812   4.533  -8.223
  133   1HB   ARG  21          2HB       ARG  21  25.064   4.469  -9.521
  134   2HB   ARG  21          1HB       ARG  21  25.120   4.878  -7.820
  135   1HG   ARG  21          2HG       ARG  21  25.929   2.717  -7.193
  136   2HG   ARG  21          1HG       ARG  21  25.475   1.993  -8.724
  137   1HD   ARG  21          2HD       ARG  21  27.584   4.183  -8.516
  138   2HD   ARG  21          1HD       ARG  21  27.956   2.462  -8.451
  139    HE   ARG  21           HE       ARG  21  26.466   3.601 -10.778
  140   1HH1  ARG  21          2HH1      ARG  21  27.478   0.708 -10.231
  141   2HH1  ARG  21          1HH1      ARG  21  28.809   0.635 -11.338
  142   1HH2  ARG  21          1HH2      ARG  21  28.836   4.109 -11.824
  143   2HH2  ARG  21          2HH2      ARG  21  29.600   2.618 -12.265
  144    H    GLY  22           H        GLY  22  22.449   4.691 -10.438
  145   1HA   GLY  22          2HA       GLY  22  22.846   2.888 -12.495
  146   2HA   GLY  22          1HA       GLY  22  21.383   2.299 -11.701
  147    H    ASN  23           H        ASN  23  20.385   2.794 -13.789
  148    HA   ASN  23           HA       ASN  23  19.129   5.426 -13.742
  149   1HB   ASN  23          2HB       ASN  23  21.292   5.824 -14.998
  150   2HB   ASN  23          1HB       ASN  23  20.760   4.674 -16.213
  151   1HD2  ASN  23          2HD2      ASN  23  18.820   8.289 -15.894
  152   2HD2  ASN  23          1HD2      ASN  23  19.642   7.662 -14.546
  153    HA   PRO  24           HA       PRO  24  17.202   5.580 -13.262
  154   1HB   PRO  24          2HB       PRO  24  15.014   4.287 -12.180
  155   2HB   PRO  24          1HB       PRO  24  14.964   5.527 -13.423
  156   1HG   PRO  24          2HG       PRO  24  14.546   2.606 -13.715
  157   2HG   PRO  24          1HG       PRO  24  14.032   3.904 -14.785
  158   1HD   PRO  24          2HD       PRO  24  16.243   2.143 -15.220
  159   2HD   PRO  24          1HD       PRO  24  15.885   3.613 -16.143
  160    H    GLN  25           H        GLN  25  17.949   5.563 -11.223
  161    HA   GLN  25           HA       GLN  25  19.538   3.479 -10.177
  162   1HB   GLN  25          2HB       GLN  25  18.118   5.694  -8.630
  163   2HB   GLN  25          1HB       GLN  25  19.461   4.742  -8.021
  164   1HG   GLN  25          2HG       GLN  25  20.884   5.571  -9.900
  165   2HG   GLN  25          1HG       GLN  25  19.559   6.588 -10.450
  166   1HE2  GLN  25          2HE2      GLN  25  21.963   8.395  -8.102
  167   2HE2  GLN  25          1HE2      GLN  25  22.252   7.357  -9.415
  168    H    LYS  26           H        LYS  26  19.204   2.274  -8.124
  169    HA   LYS  26           HA       LYS  26  16.444   1.687  -7.346
  170   1HB   LYS  26          2HB       LYS  26  18.084  -0.169  -9.051
  171   2HB   LYS  26          1HB       LYS  26  17.149  -0.899  -7.764
  172   1HG   LYS  26          2HG       LYS  26  15.153   0.539  -8.739
  173   2HG   LYS  26          1HG       LYS  26  16.161   0.632 -10.175
  174   1HD   LYS  26          2HD       LYS  26  16.359  -1.914 -10.089
  175   2HD   LYS  26          1HD       LYS  26  15.147  -1.895  -8.827
  176   1HE   LYS  26          2HE       LYS  26  13.786  -2.189 -10.703
  177   2HE   LYS  26          1HE       LYS  26  13.773  -0.435 -10.614
  178   1HZ   LYS  26          1HZ       LYS  26  15.618  -0.394 -12.185
  179   2HZ   LYS  26          3HZ       LYS  26  15.565  -2.090 -12.300
  180   3HZ   LYS  26          2HZ       LYS  26  14.249  -1.161 -12.837
  181    H    CYS  27           H        CYS  27  16.346   1.313  -5.298
  182    HA   CYS  27           HA       CYS  27  18.661   1.023  -3.654
  183   1HB   CYS  27          2HB       CYS  27  15.742   0.712  -2.775
  184   2HB   CYS  27          1HB       CYS  27  17.140   1.002  -1.805
  185    H    ILE  28           H        ILE  28  19.202  -0.637  -2.383
  186    HA   ILE  28           HA       ILE  28  17.951  -3.315  -2.723
  187    HB   ILE  28           HB       ILE  28  20.358  -4.216  -2.667
  188   1HG1  ILE  28          2HG1      ILE  28  21.108  -1.756  -1.916
  189   2HG1  ILE  28          1HG1      ILE  28  22.176  -2.849  -2.726
  190   1HG2  ILE  28          3HG2      ILE  28  19.389  -2.681  -5.099
  191   2HG2  ILE  28          2HG2      ILE  28  20.810  -3.714  -5.131
  192   3HG2  ILE  28          1HG2      ILE  28  19.238  -4.394  -4.763
  193   1HD1  ILE  28          3HD1      ILE  28  20.512  -0.893  -4.294
  194   2HD1  ILE  28          2HD1      ILE  28  22.031  -0.425  -3.546
  195   3HD1  ILE  28          1HD1      ILE  28  22.007  -1.701  -4.759
  196    H    GLY  29           H        GLY  29  19.635  -4.559  -0.900
  197   1HA   GLY  29          2HA       GLY  29  19.114  -2.977   1.547
  198   2HA   GLY  29          1HA       GLY  29  19.085  -4.702   1.503
  199    H    ALA  30           H        ALA  30  20.549  -2.787   3.135
  200    HA   ALA  30           HA       ALA  30  23.402  -3.059   2.441
  201   1HB   ALA  30          1HB       ALA  30  21.830  -1.794   4.714
  202   2HB   ALA  30          3HB       ALA  30  23.563  -2.034   4.875
  203   3HB   ALA  30          2HB       ALA  30  22.932  -1.011   3.595
  204    H    HIS  31           H        HIS  31  21.116  -4.139   4.827
  205    HA   HIS  31           HA       HIS  31  22.900  -6.313   5.822
  206   1HB   HIS  31          2HB       HIS  31  21.628  -4.792   7.449
  207   2HB   HIS  31          1HB       HIS  31  20.129  -5.418   6.787
  208    HD1  HIS  31           HD1      HIS  31  19.287  -7.164   8.327
  209    HD2  HIS  31           HD2      HIS  31  23.367  -7.328   8.192
  210    HE1  HIS  31           HE1      HIS  31  19.955  -9.031   9.795
  211   1HN   CGU  32           HN       CGU  32  22.369  -6.630   3.328
  212    HA   CGU  32           HA       CGU  32  20.138  -8.567   2.994
  213   1HB   CGU  32          1HB       CGU  32  21.608  -7.002   0.870
  214   2HB   CGU  32          2HB       CGU  32  20.297  -6.296   1.765
  215    HG   CGU  32           HG       CGU  32  19.670  -8.958   0.624
  216    H    ASP  33           H        ASP  33  21.679  -8.896   0.457
  217    HA   ASP  33           HA       ASP  33  24.034 -10.494   1.137
  218   1HB   ASP  33          2HB       ASP  33  21.721 -11.878   1.391
  219   2HB   ASP  33          1HB       ASP  33  21.850 -12.018  -0.348
  220    H    VAL  34           H        VAL  34  24.149  -8.327  -0.178
  221    HA   VAL  34           HA       VAL  34  23.739  -8.584  -3.058
  222    HB   VAL  34           HB       VAL  34  25.244  -6.478  -1.429
  223   1HG1  VAL  34          3HG1      VAL  34  24.380  -6.560  -4.360
  224   2HG1  VAL  34          2HG1      VAL  34  24.731  -5.059  -3.531
  225   3HG1  VAL  34          1HG1      VAL  34  25.990  -6.260  -3.726
  226   1HG2  VAL  34          3HG2      VAL  34  22.825  -6.656  -0.850
  227   2HG2  VAL  34          2HG2      VAL  34  23.168  -5.150  -1.670
  228   3HG2  VAL  34          1HG2      VAL  34  22.407  -6.465  -2.546
   
  No H/Q in entry =         228
  Start of MODEL   20
    1   1H    ALA   1          2H        ALA   1   7.059   9.065   0.315
    2   2H    ALA   1          1H        ALA   1   5.662   8.926   1.274
    3   3H    ALA   1          3H        ALA   1   6.952   9.903   1.789
    4    HA   ALA   1           HA       ALA   1   7.545   8.149   3.001
    5   1HB   ALA   1          1HB       ALA   1   6.034   6.430   0.980
    6   2HB   ALA   1          3HB       ALA   1   6.798   5.806   2.434
    7   3HB   ALA   1          2HB       ALA   1   5.449   6.922   2.561
    8    H    CYS   2           H        CYS   2   9.207   6.575   2.940
    9    HA   CYS   2           HA       CYS   2  11.352   7.119   1.163
   10   1HB   CYS   2          2HB       CYS   2  12.314   5.014   2.250
   11   2HB   CYS   2          1HB       CYS   2  11.876   6.266   3.359
   12    H    SER   3           H        SER   3  12.548   5.060   0.230
   13    HA   SER   3           HA       SER   3  10.749   3.897  -1.853
   14   1HB   SER   3          2HB       SER   3  13.697   4.587  -1.766
   15   2HB   SER   3          1HB       SER   3  13.127   3.384  -2.919
   16    HG   SER   3           HG       SER   3  12.980   5.419  -3.762
   17    H    GLY   4           H        GLY   4  10.770   1.695  -2.285
   18   1HA   GLY   4          2HA       GLY   4  11.761  -0.038  -0.061
   19   2HA   GLY   4          1HA       GLY   4  10.478  -0.452  -1.199
   20    H    ARG   5           H        ARG   5  12.363  -2.323  -0.919
   21    HA   ARG   5           HA       ARG   5  14.662  -2.034  -2.577
   22   1HB   ARG   5          2HB       ARG   5  14.023  -3.927  -0.833
   23   2HB   ARG   5          1HB       ARG   5  13.250  -4.713  -2.180
   24   1HG   ARG   5          2HG       ARG   5  15.879  -3.847  -3.048
   25   2HG   ARG   5          1HG       ARG   5  16.076  -4.625  -1.490
   26   1HD   ARG   5          2HD       ARG   5  16.279  -6.267  -3.331
   27   2HD   ARG   5          1HD       ARG   5  14.831  -6.624  -2.386
   28    HE   ARG   5           HE       ARG   5  13.844  -4.955  -4.290
   29   1HH1  ARG   5          2HH1      ARG   5  16.270  -5.794  -5.906
   30   2HH1  ARG   5          1HH1      ARG   5  15.632  -7.116  -6.827
   31   1HH2  ARG   5          1HH2      ARG   5  12.816  -7.454  -4.768
   32   2HH2  ARG   5          2HH2      ARG   5  13.625  -8.082  -6.166
   33    H    GLY   6           H        GLY   6  14.378  -1.314  -4.568
   34   1HA   GLY   6          2HA       GLY   6  13.981  -2.442  -6.875
   35   2HA   GLY   6          1HA       GLY   6  12.296  -2.490  -6.362
   36    H    SER   7           H        SER   7  13.164   0.195  -4.934
   37    HA   SER   7           HA       SER   7  12.674   1.971  -7.296
   38   1HB   SER   7          2HB       SER   7  11.810   2.327  -4.374
   39   2HB   SER   7          1HB       SER   7  11.479   3.472  -5.687
   40    HG   SER   7           HG       SER   7  10.778   0.726  -5.669
   41    H    ARG   8           H        ARG   8  14.102   3.609  -7.598
   42    HA   ARG   8           HA       ARG   8  16.588   3.589  -6.108
   43   1HB   ARG   8          2HB       ARG   8  17.191   5.469  -7.671
   44   2HB   ARG   8          1HB       ARG   8  16.639   4.020  -8.464
   45   1HG   ARG   8          2HG       ARG   8  14.423   5.883  -7.846
   46   2HG   ARG   8          1HG       ARG   8  15.636   6.590  -8.879
   47   1HD   ARG   8          2HD       ARG   8  15.481   4.446 -10.320
   48   2HD   ARG   8          1HD       ARG   8  14.000   4.093  -9.430
   49    HE   ARG   8           HE       ARG   8  13.405   6.562 -10.200
   50   1HH1  ARG   8          1HH2      ARG   8  15.798   6.474 -12.053
   51   2HH1  ARG   8          2HH2      ARG   8  15.063   5.997 -13.548
   52   1HH2  ARG   8          2HH1      ARG   8  12.119   4.909 -11.985
   53   2HH2  ARG   8          1HH1      ARG   8  12.927   5.086 -13.509
   54    H    CYS   9           H        CYS   9  17.397   6.135  -5.897
   55    HA   CYS   9           HA       CYS   9  15.572   7.307  -3.911
   56   1HB   CYS   9          2HB       CYS   9  17.485   8.030  -2.643
   57   2HB   CYS   9          1HB       CYS   9  17.587   6.322  -2.942
   58    HA   HYP  10           HA       HYP  10  15.188   8.937  -2.872
   59   1HB   HYP  10          1HB       HYP  10  14.821  10.944  -2.013
   60   2HB   HYP  10          2HB       HYP  10  13.450  11.158  -3.076
   61   1HD   HYP  10          1HD1      HYP  10  17.116  11.426  -5.050
   62   2HD   HYP  10          2HD1      HYP  10  15.614  11.371  -5.985
   63    HOD  HYP  10           HD2      HYP  10  16.711  11.658  -2.557
   64    HG   HYP  10           HG       HYP  10  14.770  12.800  -4.280
   65    HA   HYP  11           HA       HYP  11  12.575   9.804  -1.738
   66   1HB   HYP  11          1HB       HYP  11  10.633   8.969  -1.022
   67   2HB   HYP  11          2HB       HYP  11  11.350   7.375  -0.878
   68   1HD   HYP  11          1HD1      HYP  11  10.711   8.967  -4.573
   69   2HD   HYP  11          2HD1      HYP  11  11.391   7.339  -4.725
   70    HOD  HYP  11           HD2      HYP  11   8.893   8.281  -1.869
   71    HG   HYP  11           HG       HYP  11  10.252   6.631  -2.784
   72    H    GLN  12           H        GLN  12  14.013   9.485  -0.122
   73    HA   GLN  12           HA       GLN  12  16.297   7.919  -0.450
   74   1HB   GLN  12          2HB       GLN  12  15.951   9.795   1.249
   75   2HB   GLN  12          1HB       GLN  12  15.044   8.669   2.239
   76   1HG   GLN  12          2HG       GLN  12  17.008   7.231   2.519
   77   2HG   GLN  12          1HG       GLN  12  17.927   8.179   1.354
   78   1HE2  GLN  12          2HE2      GLN  12  17.235   9.743   5.093
   79   2HE2  GLN  12          1HE2      GLN  12  16.192   8.549   4.487
   80    H    CYS  13           H        CYS  13  16.716   5.742  -0.138
   81    HA   CYS  13           HA       CYS  13  14.586   3.905   0.073
   82   1HB   CYS  13          2HB       CYS  13  17.228   3.015   1.095
   83   2HB   CYS  13          1HB       CYS  13  16.131   2.283  -0.034
   84    H    CYS  14           H        CYS  14  13.633   2.889   1.619
   85    HA   CYS  14           HA       CYS  14  13.308   3.931   4.191
   86   1HB   CYS  14          2HB       CYS  14  12.749   1.118   3.214
   87   2HB   CYS  14          1HB       CYS  14  12.071   1.824   4.649
   88    H    MET  15           H        MET  15  13.483   2.508   6.202
   89    HA   MET  15           HA       MET  15  16.170   2.266   6.946
   90   1HB   MET  15          2HB       MET  15  14.122   2.464   8.479
   91   2HB   MET  15          1HB       MET  15  13.840   0.753   8.220
   92   1HG   MET  15          2HG       MET  15  16.097   0.252   9.116
   93   2HG   MET  15          1HG       MET  15  16.388   1.952   9.359
   94   1HE   MET  15          2HE       MET  15  14.828   3.416  10.729
   95   2HE   MET  15          1HE       MET  15  14.476   2.959  12.376
   96   3HE   MET  15          3HE       MET  15  16.155   2.991  11.832
   97    H    GLY  16           H        GLY  16  17.646   0.791   6.651
   98   1HA   GLY  16          2HA       GLY  16  18.489  -1.451   6.632
   99   2HA   GLY  16          1HA       GLY  16  16.934  -2.000   6.037
  100    H    LEU  17           H        LEU  17  16.935   0.308   4.044
  101    HA   LEU  17           HA       LEU  17  18.548  -1.084   2.035
  102   1HB   LEU  17          2HB       LEU  17  16.277   0.895   1.848
  103   2HB   LEU  17          1HB       LEU  17  17.301   0.592   0.467
  104    HG   LEU  17           HG       LEU  17  16.627  -1.989   1.408
  105   1HD1  LEU  17          1HD1      LEU  17  14.710  -0.615   2.566
  106   2HD1  LEU  17          3HD1      LEU  17  14.071  -0.458   0.935
  107   3HD1  LEU  17          2HD1      LEU  17  14.293  -2.054   1.635
  108   1HD2  LEU  17          3HD2      LEU  17  16.850  -0.813  -1.012
  109   2HD2  LEU  17          2HD2      LEU  17  16.016  -2.330  -0.764
  110   3HD2  LEU  17          1HD2      LEU  17  15.111  -0.824  -0.885
  111    H    ARG  18           H        ARG  18  19.475   0.111   0.367
  112    HA   ARG  18           HA       ARG  18  20.719   2.727   0.930
  113   1HB   ARG  18          2HB       ARG  18  22.836   1.597  -0.126
  114   2HB   ARG  18          1HB       ARG  18  22.548   1.424   1.588
  115   1HG   ARG  18          2HG       ARG  18  21.812  -0.818   1.333
  116   2HG   ARG  18          1HG       ARG  18  21.432  -0.623  -0.357
  117   1HD   ARG  18          2HD       ARG  18  24.284  -0.559   0.712
  118   2HD   ARG  18          1HD       ARG  18  23.523  -1.991   0.023
  119    HE   ARG  18           HE       ARG  18  23.313   0.315  -1.722
  120   1HH1  ARG  18          1HH2      ARG  18  26.135  -0.847  -0.550
  121   2HH1  ARG  18          2HH2      ARG  18  26.718  -1.542  -2.026
  122   1HH2  ARG  18          2HH1      ARG  18  23.669  -1.170  -3.686
  123   2HH2  ARG  18          1HH1      ARG  18  25.296  -1.733  -3.825
  124    H    CYS  19           H        CYS  19  21.279   3.748  -0.929
  125    HA   CYS  19           HA       CYS  19  19.677   3.100  -3.276
  126   1HB   CYS  19          2HB       CYS  19  20.186   5.402  -2.290
  127   2HB   CYS  19          1HB       CYS  19  21.724   5.313  -3.097
  128    H    GLY  20           H        GLY  20  20.404   1.355  -4.445
  129   1HA   GLY  20          2HA       GLY  20  23.219   0.964  -5.129
  130   2HA   GLY  20          1HA       GLY  20  21.841   0.061  -5.789
  131    H    ARG  21           H        ARG  21  24.019   2.620  -6.373
  132    HA   ARG  21           HA       ARG  21  22.439   4.071  -8.250
  133   1HB   ARG  21          2HB       ARG  21  24.678   4.668  -6.920
  134   2HB   ARG  21          1HB       ARG  21  25.453   4.128  -8.391
  135   1HG   ARG  21          2HG       ARG  21  23.249   5.809  -9.190
  136   2HG   ARG  21          1HG       ARG  21  24.024   6.625  -7.852
  137   1HD   ARG  21          2HD       ARG  21  25.230   7.422  -9.701
  138   2HD   ARG  21          1HD       ARG  21  26.250   6.072  -9.217
  139    HE   ARG  21           HE       ARG  21  24.148   5.371 -11.153
  140   1HH1  ARG  21          1HH2      ARG  21  26.283   3.666 -11.364
  141   2HH1  ARG  21          2HH2      ARG  21  27.363   4.340 -12.543
  142   1HH2  ARG  21          2HH1      ARG  21  25.914   7.532 -12.291
  143   2HH2  ARG  21          1HH1      ARG  21  27.142   6.605 -13.087
  144    H    GLY  22           H        GLY  22  21.602   2.856  -9.772
  145   1HA   GLY  22          2HA       GLY  22  23.381   1.491 -11.770
  146   2HA   GLY  22          1HA       GLY  22  21.749   0.944 -11.375
  147    H    ASN  23           H        ASN  23  21.067   1.195 -13.541
  148    HA   ASN  23           HA       ASN  23  20.129   3.876 -14.190
  149   1HB   ASN  23          2HB       ASN  23  22.566   3.712 -15.068
  150   2HB   ASN  23          1HB       ASN  23  21.962   2.571 -16.255
  151   1HD2  ASN  23          2HD2      ASN  23  20.904   6.527 -16.495
  152   2HD2  ASN  23          1HD2      ASN  23  21.524   5.897 -15.044
  153    HA   PRO  24           HA       PRO  24  18.116   4.231 -14.025
  154   1HB   PRO  24          2HB       PRO  24  15.788   3.047 -13.014
  155   2HB   PRO  24          1HB       PRO  24  15.891   4.234 -14.304
  156   1HG   PRO  24          2HG       PRO  24  15.346   1.346 -14.524
  157   2HG   PRO  24          1HG       PRO  24  15.094   2.606 -15.722
  158   1HD   PRO  24          2HD       PRO  24  17.191   0.659 -15.728
  159   2HD   PRO  24          1HD       PRO  24  17.080   2.074 -16.788
  160    H    GLN  25           H        GLN  25  18.566   4.501 -11.927
  161    HA   GLN  25           HA       GLN  25  19.981   2.530 -10.454
  162   1HB   GLN  25          2HB       GLN  25  18.541   4.972  -9.341
  163   2HB   GLN  25          1HB       GLN  25  19.862   4.129  -8.553
  164   1HG   GLN  25          2HG       GLN  25  21.468   4.962 -10.099
  165   2HG   GLN  25          1HG       GLN  25  20.255   5.344 -11.311
  166   1HE2  GLN  25          2HE2      GLN  25  21.023   8.021  -8.346
  167   2HE2  GLN  25          1HE2      GLN  25  21.727   6.477  -8.304
  168    H    LYS  26           H        LYS  26  19.381   1.791  -8.217
  169    HA   LYS  26           HA       LYS  26  16.564   1.438  -7.597
  170   1HB   LYS  26          2HB       LYS  26  17.998  -0.572  -9.200
  171   2HB   LYS  26          1HB       LYS  26  17.404  -1.285  -7.717
  172   1HG   LYS  26          2HG       LYS  26  15.189  -0.830  -8.184
  173   2HG   LYS  26          1HG       LYS  26  15.525   0.469  -9.300
  174   1HD   LYS  26          2HD       LYS  26  16.721  -1.616 -10.647
  175   2HD   LYS  26          1HD       LYS  26  15.464  -2.482  -9.786
  176   1HE   LYS  26          2HE       LYS  26  14.477  -1.819 -11.874
  177   2HE   LYS  26          1HE       LYS  26  13.815  -0.703 -10.691
  178   1HZ   LYS  26          2HZ       LYS  26  15.614   0.865 -11.329
  179   2HZ   LYS  26          1HZ       LYS  26  16.048  -0.207 -12.574
  180   3HZ   LYS  26          3HZ       LYS  26  14.509   0.514 -12.577
  181    H    CYS  27           H        CYS  27  16.306   1.238  -5.382
  182    HA   CYS  27           HA       CYS  27  18.686   1.041  -3.768
  183   1HB   CYS  27          2HB       CYS  27  15.796   0.854  -2.772
  184   2HB   CYS  27          1HB       CYS  27  17.222   1.090  -1.857
  185    H    ILE  28           H        ILE  28  19.189  -0.610  -2.372
  186    HA   ILE  28           HA       ILE  28  17.796  -3.224  -2.597
  187    HB   ILE  28           HB       ILE  28  20.053  -4.307  -2.715
  188   1HG1  ILE  28          2HG1      ILE  28  21.126  -2.093  -1.732
  189   2HG1  ILE  28          1HG1      ILE  28  22.019  -3.155  -2.746
  190   1HG2  ILE  28          2HG2      ILE  28  19.355  -2.472  -5.037
  191   2HG2  ILE  28          1HG2      ILE  28  20.568  -3.740  -5.120
  192   3HG2  ILE  28          3HG2      ILE  28  18.892  -4.147  -4.809
  193   1HD1  ILE  28          1HD1      ILE  28  20.507  -0.888  -4.012
  194   2HD1  ILE  28          3HD1      ILE  28  22.024  -0.586  -3.191
  195   3HD1  ILE  28          2HD1      ILE  28  21.964  -1.711  -4.548
  196    H    GLY  29           H        GLY  29  19.250  -4.594  -0.843
  197   1HA   GLY  29          2HA       GLY  29  18.921  -2.975   1.600
  198   2HA   GLY  29          1HA       GLY  29  18.940  -4.693   1.577
  199    H    ALA  30           H        ALA  30  20.472  -2.686   3.085
  200    HA   ALA  30           HA       ALA  30  23.260  -2.808   2.204
  201   1HB   ALA  30          1HB       ALA  30  21.919  -1.906   4.796
  202   2HB   ALA  30          3HB       ALA  30  23.659  -1.826   4.546
  203   3HB   ALA  30          2HB       ALA  30  22.581  -0.871   3.537
  204    H    HIS  31           H        HIS  31  21.262  -4.162   4.722
  205    HA   HIS  31           HA       HIS  31  23.269  -6.263   5.382
  206   1HB   HIS  31          2HB       HIS  31  21.818  -4.772   7.097
  207   2HB   HIS  31          1HB       HIS  31  20.586  -5.988   6.802
  208    HD1  HIS  31           HD1      HIS  31  23.582  -5.456   8.721
  209    HD2  HIS  31           HD2      HIS  31  21.585  -8.747   7.364
  210    HE1  HIS  31           HE1      HIS  31  24.428  -7.368  10.029
  211   1HN   CGU  32           HN       CGU  32  22.418  -6.458   2.940
  212    HA   CGU  32           HA       CGU  32  20.323  -8.565   2.729
  213   1HB   CGU  32          1HB       CGU  32  21.518  -6.773   0.590
  214   2HB   CGU  32          2HB       CGU  32  20.183  -6.267   1.582
  215    HG   CGU  32           HG       CGU  32  19.673  -8.893   0.394
  216    H    ASP  33           H        ASP  33  21.673  -8.711   0.084
  217    HA   ASP  33           HA       ASP  33  24.005 -10.445   0.665
  218   1HB   ASP  33          2HB       ASP  33  22.286 -11.123  -1.719
  219   2HB   ASP  33          1HB       ASP  33  23.038 -12.174  -0.542
  220    H    VAL  34           H        VAL  34  23.793  -7.720   0.108
  221    HA   VAL  34           HA       VAL  34  24.472  -7.163  -2.670
  222    HB   VAL  34           HB       VAL  34  23.207  -5.585  -1.205
  223   1HG1  VAL  34          1HG1      VAL  34  24.442  -6.031   0.937
  224   2HG1  VAL  34          3HG1      VAL  34  25.820  -5.142   0.308
  225   3HG1  VAL  34          2HG1      VAL  34  24.296  -4.323   0.578
  226   1HG2  VAL  34          2HG2      VAL  34  24.672  -4.798  -3.175
  227   2HG2  VAL  34          1HG2      VAL  34  24.188  -3.588  -2.001
  228   3HG2  VAL  34          3HG2      VAL  34  25.818  -4.242  -1.962
   
  No H/Q in entry =         228


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