NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
5906 1i5u cing 1-original 2 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
    1   1H    ALA   3          H1        ALA   3   5.129 -12.664 -12.878
    2   2H    ALA   3          H2        ALA   3   5.389 -14.088 -13.720
    3   3H    ALA   3          H3        ALA   3   3.861 -13.625 -13.249
    4    HA   ALA   3           HA       ALA   3   6.081 -14.496 -11.560
    5   1HB   ALA   3          HB1       ALA   3   4.454 -16.228 -12.372
    6   2HB   ALA   3          HB2       ALA   3   4.439 -16.049 -10.615
    7   3HB   ALA   3          HB3       ALA   3   3.138 -15.326 -11.585
    8    H    VAL   4           HN       VAL   4   4.418 -14.580  -9.143
    9    HA   VAL   4           HA       VAL   4   4.808 -11.877  -8.323
   10    HB   VAL   4           HB       VAL   4   2.498 -11.789  -9.373
   11   1HG1  VAL   4          HG11      VAL   4   1.805 -14.149  -8.737
   12   2HG1  VAL   4          HG12      VAL   4   1.614 -13.577  -7.063
   13   3HG1  VAL   4          HG13      VAL   4   0.618 -12.896  -8.354
   14   1HG2  VAL   4          HG21      VAL   4   2.422 -11.397  -6.372
   15   2HG2  VAL   4          HG22      VAL   4   3.219 -10.279  -7.505
   16   3HG2  VAL   4          HG23      VAL   4   1.475 -10.552  -7.605
   17    H    LYS   5           HN       LYS   5   4.737 -11.889  -5.913
   18    HA   LYS   5           HA       LYS   5   4.882 -14.648  -4.766
   19   1HB   LYS   5          HB2       LYS   5   6.149 -12.036  -3.865
   20   2HB   LYS   5          HB3       LYS   5   6.085 -13.524  -2.896
   21   1HG   LYS   5          HG2       LYS   5   7.217 -14.737  -4.801
   22   2HG   LYS   5          HG3       LYS   5   7.442 -13.173  -5.607
   23   1HD   LYS   5          HD2       LYS   5   8.779 -12.361  -3.697
   24   2HD   LYS   5          HD3       LYS   5   8.474 -13.875  -2.820
   25   1HE   LYS   5          HE2       LYS   5   9.606 -15.156  -4.667
   26   2HE   LYS   5          HE3       LYS   5   9.982 -13.625  -5.476
   27   1HZ   LYS   5          HZ1       LYS   5  10.940 -14.443  -2.808
   28   2HZ   LYS   5          HZ2       LYS   5  11.823 -14.444  -4.193
   29   3HZ   LYS   5          HZ3       LYS   5  11.303 -13.021  -3.555
   30    H    TYR   6           HN       TYR   6   3.512 -15.099  -3.060
   31    HA   TYR   6           HA       TYR   6   1.275 -13.177  -2.635
   32   1HB   TYR   6          HB2       TYR   6   1.560 -16.166  -2.178
   33   2HB   TYR   6          HB3       TYR   6   0.178 -15.194  -1.713
   34    HD1  TYR   6           HD1      TYR   6   2.028 -16.611  -4.592
   35    HD2  TYR   6           HD2      TYR   6  -1.400 -14.303  -3.368
   36    HE1  TYR   6           HE1      TYR   6   1.098 -16.785  -6.874
   37    HE2  TYR   6           HE2      TYR   6  -2.341 -14.507  -5.667
   38    HH   TYR   6           HH       TYR   6  -0.660 -16.251  -8.274
   39    H    TYR   7           HN       TYR   7   1.056 -12.251  -0.571
   40    HA   TYR   7           HA       TYR   7   2.782 -13.363   1.616
   41   1HB   TYR   7          HB2       TYR   7   2.134 -10.439   1.328
   42   2HB   TYR   7          HB3       TYR   7   3.244 -11.198   2.450
   43    HD1  TYR   7           HD1      TYR   7   5.061 -12.836   0.979
   44    HD2  TYR   7           HD2      TYR   7   3.289  -9.084  -0.191
   45    HE1  TYR   7           HE1      TYR   7   6.942 -12.424  -0.583
   46    HE2  TYR   7           HE2      TYR   7   5.229  -8.620  -1.626
   47    HH   TYR   7           HH       TYR   7   6.894  -9.700  -2.863
   48    H    THR   8           HN       THR   8   1.914 -13.389   3.666
   49    HA   THR   8           HA       THR   8  -0.948 -13.666   3.742
   50    HB   THR   8           HB       THR   8   0.006 -14.317   6.211
   51    HG1  THR   8           HG1      THR   8   2.145 -14.309   6.175
   52   1HG2  THR   8          HG21      THR   8   0.376 -16.598   5.333
   53   2HG2  THR   8          HG22      THR   8  -1.080 -15.877   4.614
   54   3HG2  THR   8          HG23      THR   8   0.431 -15.965   3.675
   55    H    LEU   9           HN       LEU   9  -2.369 -12.534   4.999
   56    HA   LEU   9           HA       LEU   9  -1.941  -9.794   5.317
   57   1HB   LEU   9          HB2       LEU   9  -4.105 -10.889   5.130
   58   2HB   LEU   9          HB3       LEU   9  -3.975 -11.543   6.765
   59    HG   LEU   9           HG       LEU   9  -3.582  -8.578   6.479
   60   1HD1  LEU   9          HD11      LEU   9  -6.311  -9.866   6.076
   61   2HD1  LEU   9          HD12      LEU   9  -6.008  -8.133   6.334
   62   3HD1  LEU   9          HD13      LEU   9  -5.400  -8.927   4.873
   63   1HD2  LEU   9          HD21      LEU   9  -3.636  -9.692   8.718
   64   2HD2  LEU   9          HD22      LEU   9  -4.965  -8.538   8.521
   65   3HD2  LEU   9          HD23      LEU   9  -5.275 -10.277   8.373
   66    H    GLU  10           HN       GLU  10  -1.667 -12.358   7.740
   67    HA   GLU  10           HA       GLU  10  -0.854 -11.130  10.091
   68   1HB   GLU  10          HB2       GLU  10  -1.016 -13.493   9.891
   69   2HB   GLU  10          HB3       GLU  10   0.224 -13.559   8.633
   70   1HG   GLU  10          HG2       GLU  10   1.066 -14.355  10.783
   71   2HG   GLU  10          HG3       GLU  10   1.945 -12.964  10.155
   72    H    GLU  11           HN       GLU  11   1.336 -11.875   7.307
   73    HA   GLU  11           HA       GLU  11   3.613 -10.591   8.432
   74   1HB   GLU  11          HB2       GLU  11   2.810 -11.759   5.766
   75   2HB   GLU  11          HB3       GLU  11   4.122 -10.625   5.798
   76   1HG   GLU  11          HG2       GLU  11   4.805 -13.050   6.065
   77   2HG   GLU  11          HG3       GLU  11   5.401 -11.969   7.333
   78    H    ILE  12           HN       ILE  12   1.286  -9.575   5.907
   79    HA   ILE  12           HA       ILE  12   2.339  -7.005   5.548
   80    HB   ILE  12           HB       ILE  12  -0.577  -7.850   5.416
   81   1HG1  ILE  12          HG12      ILE  12   0.840  -9.286   4.028
   82   2HG1  ILE  12          HG13      ILE  12  -0.099  -8.195   3.007
   83   1HG2  ILE  12          HG21      ILE  12  -0.561  -5.496   5.384
   84   2HG2  ILE  12          HG22      ILE  12   0.882  -5.416   4.352
   85   3HG2  ILE  12          HG23      ILE  12  -0.662  -5.994   3.687
   86   1HD1  ILE  12          HD11      ILE  12   2.851  -8.135   3.724
   87   2HD1  ILE  12          HD12      ILE  12   2.120  -8.365   2.148
   88   3HD1  ILE  12          HD13      ILE  12   2.026  -6.768   2.913
   89    H    GLN  13           HN       GLN  13   0.071  -7.960   8.164
   90    HA   GLN  13           HA       GLN  13  -0.270  -5.314   9.173
   91   1HB   GLN  13          HB2       GLN  13  -0.479  -8.039  10.495
   92   2HB   GLN  13          HB3       GLN  13  -0.770  -6.522  11.362
   93   1HG   GLN  13          HG2       GLN  13  -2.462  -5.866   9.680
   94   2HG   GLN  13          HG3       GLN  13  -2.288  -7.440   8.886
   95   1HE2  GLN  13          HE21      GLN  13  -4.710  -6.298  10.097
   96   2HE2  GLN  13          HE22      GLN  13  -5.150  -7.382  11.411
   97    H    LYS  14           HN       LYS  14   2.532  -7.387   9.403
   98    HA   LYS  14           HA       LYS  14   3.690  -5.908  11.683
   99   1HB   LYS  14          HB2       LYS  14   4.508  -8.218   9.919
  100   2HB   LYS  14          HB3       LYS  14   5.758  -7.318  10.715
  101   1HG   LYS  14          HG2       LYS  14   4.691  -7.722  12.918
  102   2HG   LYS  14          HG3       LYS  14   3.246  -8.372  12.138
  103   1HD   LYS  14          HD2       LYS  14   5.985  -9.710  12.219
  104   2HD   LYS  14          HD3       LYS  14   4.523 -10.148  13.129
  105   1HE   LYS  14          HE2       LYS  14   3.445 -10.257  10.686
  106   2HE   LYS  14          HE3       LYS  14   5.130 -10.532  10.194
  107   1HZ   LYS  14          HZ1       LYS  14   3.405 -12.138  11.949
  108   2HZ   LYS  14          HZ2       LYS  14   4.091 -12.568  10.525
  109   3HZ   LYS  14          HZ3       LYS  14   5.043 -12.418  11.843
  110    H    HIS  15           HN       HIS  15   3.413  -5.628   8.216
  111    HA   HIS  15           HA       HIS  15   5.717  -3.759   8.082
  112   1HB   HIS  15          HB2       HIS  15   4.080  -5.207   5.997
  113   2HB   HIS  15          HB3       HIS  15   5.225  -3.951   5.623
  114    HD1  HIS  15           HD1      HIS  15   7.948  -4.624   6.007
  115    HD2  HIS  15           HD2      HIS  15   5.031  -7.587   6.675
  116    HE1  HIS  15           HE1      HIS  15   9.168  -6.827   6.128
  117    H    ASN  16           HN       ASN  16   4.076  -2.531   9.627
  118    HA   ASN  16           HA       ASN  16   2.299  -0.792   7.951
  119   1HB   ASN  16          HB2       ASN  16   0.661  -0.875   9.669
  120   2HB   ASN  16          HB3       ASN  16   1.097  -2.550   9.289
  121   1HD2  ASN  16          HD21      ASN  16  -0.204  -1.785  11.674
  122   2HD2  ASN  16          HD22      ASN  16   0.902  -2.146  12.991
  123    H    ASN  17           HN       ASN  17   5.029   0.013   8.643
  124    HA   ASN  17           HA       ASN  17   4.400   2.470  10.028
  125   1HB   ASN  17          HB2       ASN  17   4.681   0.610  11.879
  126   2HB   ASN  17          HB3       ASN  17   6.392   0.665  11.458
  127   1HD2  ASN  17          HD21      ASN  17   6.981   1.461  13.548
  128   2HD2  ASN  17          HD22      ASN  17   6.599   3.092  14.052
  129    H    SER  18           HN       SER  18   6.882   3.506  10.668
  130    HA   SER  18           HA       SER  18   7.896   4.311   8.340
  131   1HB   SER  18          HB2       SER  18   9.626   3.946  10.804
  132   2HB   SER  18          HB3       SER  18   9.603   5.300   9.658
  133    HG   SER  18           HG       SER  18   7.594   5.893  10.480
  134    H    LYS  19           HN       LYS  19   9.107   1.431  10.116
  135    HA   LYS  19           HA       LYS  19  11.358   0.981   8.371
  136   1HB   LYS  19          HB2       LYS  19   9.985  -0.518  10.582
  137   2HB   LYS  19          HB3       LYS  19  10.782  -1.508   9.364
  138   1HG   LYS  19          HG2       LYS  19  12.870  -0.134   9.647
  139   2HG   LYS  19          HG3       LYS  19  12.107   0.632  11.058
  140   1HD   LYS  19          HD2       LYS  19  11.838  -1.607  12.107
  141   2HD   LYS  19          HD3       LYS  19  12.487  -2.379  10.645
  142   1HE   LYS  19          HE2       LYS  19  14.651  -1.145  10.976
  143   2HE   LYS  19          HE3       LYS  19  14.020  -0.491  12.497
  144   1HZ   LYS  19          HZ1       LYS  19  15.386  -2.421  12.847
  145   2HZ   LYS  19          HZ2       LYS  19  13.844  -2.761  13.302
  146   3HZ   LYS  19          HZ3       LYS  19  14.436  -3.348  11.882
  147    H    SER  20           HN       SER  20   7.957   0.377   7.911
  148    HA   SER  20           HA       SER  20   8.343  -0.793   5.328
  149   1HB   SER  20          HB2       SER  20   7.612  -2.606   7.629
  150   2HB   SER  20          HB3       SER  20   7.048  -2.863   5.961
  151    HG   SER  20           HG       SER  20   9.773  -2.448   6.346
  152    H    THR  21           HN       THR  21   6.667   0.529   4.503
  153    HA   THR  21           HA       THR  21   4.027   0.507   5.952
  154    HB   THR  21           HB       THR  21   5.145   2.622   4.082
  155    HG1  THR  21           HG1      THR  21   5.780   2.282   6.513
  156   1HG2  THR  21          HG21      THR  21   3.066   3.853   4.765
  157   2HG2  THR  21          HG22      THR  21   2.640   2.346   3.953
  158   3HG2  THR  21          HG23      THR  21   2.599   2.456   5.730
  159    H    TRP  22           HN       TRP  22   3.381  -1.465   5.090
  160    HA   TRP  22           HA       TRP  22   2.819  -1.499   2.157
  161   1HB   TRP  22          HB2       TRP  22   3.112  -3.848   4.063
  162   2HB   TRP  22          HB3       TRP  22   2.880  -3.918   2.323
  163    HD1  TRP  22           HD1      TRP  22   5.639  -1.562   2.581
  164    HE1  TRP  22           HE1      TRP  22   7.872  -2.674   2.365
  165    HE3  TRP  22           HE3      TRP  22   4.173  -6.367   3.420
  166    HZ2  TRP  22           HZ2      TRP  22   8.954  -5.392   2.509
  167    HZ3  TRP  22           HZ3      TRP  22   5.799  -8.232   3.309
  168    HH2  TRP  22           HH2      TRP  22   8.206  -7.748   2.853
  169    H    LEU  23           HN       LEU  23   0.745  -2.102   1.570
  170    HA   LEU  23           HA       LEU  23  -1.265  -2.637   3.635
  171   1HB   LEU  23          HB2       LEU  23  -2.286  -0.652   1.801
  172   2HB   LEU  23          HB3       LEU  23  -2.284  -0.636   3.559
  173    HG   LEU  23           HG       LEU  23   0.132   0.349   3.307
  174   1HD1  LEU  23          HD11      LEU  23   0.119  -0.366   0.731
  175   2HD1  LEU  23          HD12      LEU  23  -0.879   1.065   0.524
  176   3HD1  LEU  23          HD13      LEU  23   0.760   1.209   1.207
  177   1HD2  LEU  23          HD21      LEU  23  -1.832   1.674   3.942
  178   2HD2  LEU  23          HD22      LEU  23  -0.741   2.565   2.870
  179   3HD2  LEU  23          HD23      LEU  23  -2.257   1.871   2.235
  180    H    ILE  24           HN       ILE  24  -3.332  -3.163   2.565
  181    HA   ILE  24           HA       ILE  24  -2.860  -4.625   0.048
  182    HB   ILE  24           HB       ILE  24  -5.320  -4.641   1.829
  183   1HG1  ILE  24          HG12      ILE  24  -4.656  -6.999   2.219
  184   2HG1  ILE  24          HG13      ILE  24  -3.018  -6.596   1.637
  185   1HG2  ILE  24          HG21      ILE  24  -5.956  -6.568   0.444
  186   2HG2  ILE  24          HG22      ILE  24  -5.831  -5.100  -0.520
  187   3HG2  ILE  24          HG23      ILE  24  -4.512  -6.297  -0.563
  188   1HD1  ILE  24          HD11      ILE  24  -3.250  -6.669   4.111
  189   2HD1  ILE  24          HD12      ILE  24  -2.832  -5.031   3.616
  190   3HD1  ILE  24          HD13      ILE  24  -4.511  -5.433   4.043
  191    H    LEU  25           HN       LEU  25  -3.497  -3.706  -1.886
  192    HA   LEU  25           HA       LEU  25  -5.916  -1.965  -1.858
  193   1HB   LEU  25          HB2       LEU  25  -3.549  -1.515  -3.713
  194   2HB   LEU  25          HB3       LEU  25  -5.127  -0.788  -3.843
  195    HG   LEU  25           HG       LEU  25  -3.603   0.823  -3.060
  196   1HD1  LEU  25          HD11      LEU  25  -4.727   1.632  -1.092
  197   2HD1  LEU  25          HD12      LEU  25  -5.890   0.896  -2.206
  198   3HD1  LEU  25          HD13      LEU  25  -5.376   0.017  -0.750
  199   1HD2  LEU  25          HD21      LEU  25  -2.882  -0.759  -0.604
  200   2HD2  LEU  25          HD22      LEU  25  -1.866  -0.523  -2.045
  201   3HD2  LEU  25          HD23      LEU  25  -2.370   0.866  -1.096
  202    H    HIS  26           HN       HIS  26  -7.464  -2.977  -3.091
  203    HA   HIS  26           HA       HIS  26  -8.473  -4.558  -4.363
  204   1HB   HIS  26          HB2       HIS  26  -6.167  -4.094  -6.284
  205   2HB   HIS  26          HB3       HIS  26  -7.820  -4.578  -6.681
  206    HD1  HIS  26           HD1      HIS  26  -9.695  -2.571  -6.559
  207    HD2  HIS  26           HD2      HIS  26  -5.640  -1.536  -6.098
  208    HE1  HIS  26           HE1      HIS  26  -9.529  -0.068  -6.977
  209    H    TYR  27           HN       TYR  27  -6.744  -5.745  -2.457
  210    HA   TYR  27           HA       TYR  27  -5.869  -7.672  -1.765
  211   1HB   TYR  27          HB2       TYR  27  -6.676  -8.981  -4.332
  212   2HB   TYR  27          HB3       TYR  27  -6.363  -9.741  -2.794
  213    HD1  TYR  27           HD1      TYR  27  -8.936  -9.482  -4.818
  214    HD2  TYR  27           HD2      TYR  27  -7.904  -8.205  -0.825
  215    HE1  TYR  27           HE1      TYR  27 -11.276  -9.839  -4.084
  216    HE2  TYR  27           HE2      TYR  27 -10.220  -8.605  -0.099
  217    HH   TYR  27           HH       TYR  27 -12.236  -9.665  -0.691
  218    H    LYS  28           HN       LYS  28  -4.129  -5.792  -3.394
  219    HA   LYS  28           HA       LYS  28  -1.927  -7.735  -3.544
  220   1HB   LYS  28          HB2       LYS  28  -2.288  -5.396  -5.490
  221   2HB   LYS  28          HB3       LYS  28  -0.835  -6.378  -5.308
  222   1HG   LYS  28          HG2       LYS  28  -1.916  -7.333  -7.154
  223   2HG   LYS  28          HG3       LYS  28  -2.296  -8.391  -5.789
  224   1HD   LYS  28          HD2       LYS  28  -4.455  -8.155  -6.132
  225   2HD   LYS  28          HD3       LYS  28  -4.315  -6.396  -5.849
  226   1HE   LYS  28          HE2       LYS  28  -3.961  -5.927  -8.140
  227   2HE   LYS  28          HE3       LYS  28  -3.906  -7.656  -8.567
  228   1HZ   LYS  28          HZ1       LYS  28  -6.226  -6.566  -7.155
  229   2HZ   LYS  28          HZ2       LYS  28  -6.121  -7.899  -8.094
  230   3HZ   LYS  28          HZ3       LYS  28  -6.119  -6.412  -8.812
  231    H    VAL  29           HN       VAL  29   0.166  -6.860  -3.197
  232    HA   VAL  29           HA       VAL  29  -0.002  -5.123  -0.806
  233    HB   VAL  29           HB       VAL  29   2.006  -7.252  -1.635
  234   1HG1  VAL  29          HG11      VAL  29   2.927  -6.920   0.626
  235   2HG1  VAL  29          HG12      VAL  29   3.003  -5.407  -0.255
  236   3HG1  VAL  29          HG13      VAL  29   1.724  -5.643   0.941
  237   1HG2  VAL  29          HG21      VAL  29  -0.235  -8.167  -1.009
  238   2HG2  VAL  29          HG22      VAL  29   0.979  -8.555   0.201
  239   3HG2  VAL  29          HG23      VAL  29  -0.177  -7.239   0.502
  240    H    TYR  30           HN       TYR  30   0.676  -3.141  -1.101
  241    HA   TYR  30           HA       TYR  30   2.626  -2.489  -3.264
  242   1HB   TYR  30          HB2       TYR  30   0.546  -0.794  -1.872
  243   2HB   TYR  30          HB3       TYR  30   1.714  -0.229  -3.064
  244    HD1  TYR  30           HD1      TYR  30   1.192  -0.307  -5.360
  245    HD2  TYR  30           HD2      TYR  30  -1.040  -2.741  -2.612
  246    HE1  TYR  30           HE1      TYR  30  -0.324  -1.016  -7.202
  247    HE2  TYR  30           HE2      TYR  30  -2.456  -3.519  -4.453
  248    HH   TYR  30           HH       TYR  30  -2.262  -2.155  -7.742
  249    H    ASP  31           HN       ASP  31   4.702  -2.272  -2.412
  250    HA   ASP  31           HA       ASP  31   5.053  -1.421   0.390
  251   1HB   ASP  31          HB2       ASP  31   6.730  -2.821  -0.024
  252   2HB   ASP  31          HB3       ASP  31   6.940  -2.385  -1.758
  253    H    LEU  32           HN       LEU  32   4.660   0.643   0.836
  254    HA   LEU  32           HA       LEU  32   5.657   2.726  -1.094
  255   1HB   LEU  32          HB2       LEU  32   3.620   3.050   1.104
  256   2HB   LEU  32          HB3       LEU  32   3.966   4.174  -0.199
  257    HG   LEU  32           HG       LEU  32   2.666   1.423  -0.479
  258   1HD1  LEU  32          HD11      LEU  32   1.291   3.291   0.497
  259   2HD1  LEU  32          HD12      LEU  32   1.469   4.132  -1.063
  260   3HD1  LEU  32          HD13      LEU  32   0.650   2.553  -0.975
  261   1HD2  LEU  32          HD21      LEU  32   3.139   3.486  -2.682
  262   2HD2  LEU  32          HD22      LEU  32   4.101   2.017  -2.487
  263   3HD2  LEU  32          HD23      LEU  32   2.398   1.880  -2.847
  264    H    THR  33           HN       THR  33   7.091   1.004   1.144
  265    HA   THR  33           HA       THR  33   7.492   2.754   3.344
  266    HB   THR  33           HB       THR  33   9.519   0.800   2.180
  267    HG1  THR  33           HG1      THR  33   7.706  -0.291   2.402
  268   1HG2  THR  33          HG21      THR  33  10.381   2.240   4.039
  269   2HG2  THR  33          HG22      THR  33   9.000   1.749   5.040
  270   3HG2  THR  33          HG23      THR  33  10.208   0.549   4.525
  271    H    LYS  34           HN       LYS  34   9.371   2.463   0.287
  272    HA   LYS  34           HA       LYS  34  10.969   4.819   1.049
  273   1HB   LYS  34          HB2       LYS  34  11.691   2.575  -0.178
  274   2HB   LYS  34          HB3       LYS  34  11.194   3.465  -1.627
  275   1HG   LYS  34          HG2       LYS  34  12.748   5.326  -0.940
  276   2HG   LYS  34          HG3       LYS  34  13.182   4.392   0.508
  277   1HD   LYS  34          HD2       LYS  34  13.915   2.507  -1.013
  278   2HD   LYS  34          HD3       LYS  34  13.652   3.597  -2.393
  279   1HE   LYS  34          HE2       LYS  34  15.288   5.224  -1.368
  280   2HE   LYS  34          HE3       LYS  34  15.557   4.088  -0.035
  281   1HZ   LYS  34          HZ1       LYS  34  16.175   3.585  -2.870
  282   2HZ   LYS  34          HZ2       LYS  34  17.260   3.904  -1.677
  283   3HZ   LYS  34          HZ3       LYS  34  16.395   2.505  -1.645
  284    H    PHE  35           HN       PHE  35   7.930   4.849   0.302
  285    HA   PHE  35           HA       PHE  35   8.079   6.999  -1.768
  286   1HB   PHE  35          HB2       PHE  35   6.856   4.821  -2.347
  287   2HB   PHE  35          HB3       PHE  35   5.766   5.203  -1.040
  288    HD1  PHE  35           HD1      PHE  35   7.208   7.269  -3.874
  289    HD2  PHE  35           HD2      PHE  35   3.677   5.777  -1.883
  290    HE1  PHE  35           HE1      PHE  35   5.787   8.645  -5.347
  291    HE2  PHE  35           HE2      PHE  35   2.273   6.999  -3.462
  292    HZ   PHE  35           HZ       PHE  35   3.309   8.544  -5.145
  293    H    LEU  36           HN       LEU  36   7.388   6.282   1.557
  294    HA   LEU  36           HA       LEU  36   5.340   7.897   2.316
  295   1HB   LEU  36          HB2       LEU  36   8.080   7.627   3.640
  296   2HB   LEU  36          HB3       LEU  36   6.658   8.302   4.431
  297    HG   LEU  36           HG       LEU  36   6.985   5.438   3.454
  298   1HD1  LEU  36          HD11      LEU  36   6.692   6.626   6.243
  299   2HD1  LEU  36          HD12      LEU  36   6.888   4.905   5.842
  300   3HD1  LEU  36          HD13      LEU  36   8.208   6.041   5.523
  301   1HD2  LEU  36          HD21      LEU  36   4.801   5.125   4.699
  302   2HD2  LEU  36          HD22      LEU  36   4.556   6.870   4.589
  303   3HD2  LEU  36          HD23      LEU  36   4.673   5.889   3.110
  304    H    GLU  37           HN       GLU  37   8.713   9.165   2.013
  305    HA   GLU  37           HA       GLU  37   8.073  11.843   2.558
  306   1HB   GLU  37          HB2       GLU  37  10.338  10.564   0.945
  307   2HB   GLU  37          HB3       GLU  37  10.307  12.219   1.547
  308   1HG   GLU  37          HG2       GLU  37  10.215  11.430   3.873
  309   2HG   GLU  37          HG3       GLU  37  10.216   9.743   3.336
  310    H    GLU  38           HN       GLU  38   7.965   9.964  -0.444
  311    HA   GLU  38           HA       GLU  38   7.950  12.254  -2.210
  312   1HB   GLU  38          HB2       GLU  38   7.298   9.305  -2.573
  313   2HB   GLU  38          HB3       GLU  38   7.356  10.439  -3.912
  314   1HG   GLU  38          HG2       GLU  38   9.794  10.124  -2.122
  315   2HG   GLU  38          HG3       GLU  38   9.433   8.931  -3.374
  316    H    HIS  39           HN       HIS  39   5.543  10.046  -0.846
  317    HA   HIS  39           HA       HIS  39   3.465  10.559  -2.551
  318   1HB   HIS  39          HB2       HIS  39   3.539   8.760  -0.899
  319   2HB   HIS  39          HB3       HIS  39   3.321   9.924   0.411
  320    HD1  HIS  39           HD1      HIS  39   0.865  10.032   1.184
  321    HD2  HIS  39           HD2      HIS  39   1.361   8.976  -2.867
  322    HE1  HIS  39           HE1      HIS  39  -1.424   9.475   0.299
  323    HA   PRO  40           HA       PRO  40   2.871  14.908  -1.615
  324   1HB   PRO  40          HB2       PRO  40   0.651  15.411  -3.180
  325   2HB   PRO  40          HB3       PRO  40   2.296  15.244  -3.850
  326   1HG   PRO  40          HG2       PRO  40   0.161  13.155  -3.671
  327   2HG   PRO  40          HG3       PRO  40   1.191  13.567  -5.083
  328   1HD   PRO  40          HD2       PRO  40   1.756  11.471  -3.516
  329   2HD   PRO  40          HD3       PRO  40   3.093  12.519  -4.089
  330    H    GLY  41           HN       GLY  41   0.306  12.473  -1.272
  331   1HA   GLY  41          HA1       GLY  41  -1.483  14.047   0.328
  332   2HA   GLY  41          HA2       GLY  41  -1.418  12.284   0.216
  333    H    GLY  42           HN       GLY  42   1.702  12.965   1.135
  334   1HA   GLY  42          HA1       GLY  42   2.732  13.237   3.222
  335   2HA   GLY  42          HA2       GLY  42   1.166  13.324   4.031
  336    H    GLU  43           HN       GLU  43   3.229  11.770   4.999
  337    HA   GLU  43           HA       GLU  43   3.136   9.048   4.101
  338   1HB   GLU  43          HB2       GLU  43   4.655   8.651   5.972
  339   2HB   GLU  43          HB3       GLU  43   5.167   9.981   4.923
  340   1HG   GLU  43          HG2       GLU  43   4.464  11.627   6.619
  341   2HG   GLU  43          HG3       GLU  43   3.864  10.317   7.660
  342    H    GLU  44           HN       GLU  44   1.871  10.788   6.952
  343    HA   GLU  44           HA       GLU  44   1.020   8.557   8.398
  344   1HB   GLU  44          HB2       GLU  44   0.235  11.467   8.403
  345   2HB   GLU  44          HB3       GLU  44  -0.652  10.316   9.401
  346   1HG   GLU  44          HG2       GLU  44   2.368  10.337   9.557
  347   2HG   GLU  44          HG3       GLU  44   1.419  11.554  10.413
  348    H    VAL  45           HN       VAL  45  -0.668  10.247   5.764
  349    HA   VAL  45           HA       VAL  45  -3.208   9.101   6.321
  350    HB   VAL  45           HB       VAL  45  -2.309   9.824   3.508
  351   1HG1  VAL  45          HG11      VAL  45  -4.669  10.443   3.263
  352   2HG1  VAL  45          HG12      VAL  45  -4.618   8.805   3.925
  353   3HG1  VAL  45          HG13      VAL  45  -4.965  10.170   4.988
  354   1HG2  VAL  45          HG21      VAL  45  -3.145  11.702   5.769
  355   2HG2  VAL  45          HG22      VAL  45  -1.612  11.737   4.872
  356   3HG2  VAL  45          HG23      VAL  45  -3.120  12.148   4.052
  357    H    LEU  46           HN       LEU  46  -0.462   7.846   4.364
  358    HA   LEU  46           HA       LEU  46  -1.990   5.461   3.591
  359   1HB   LEU  46          HB2       LEU  46   0.990   5.309   3.558
  360   2HB   LEU  46          HB3       LEU  46  -0.222   4.681   2.474
  361    HG   LEU  46           HG       LEU  46  -0.510   7.304   1.860
  362   1HD1  LEU  46          HD11      LEU  46   1.185   8.119   3.356
  363   2HD1  LEU  46          HD12      LEU  46   2.363   6.889   2.863
  364   3HD1  LEU  46          HD13      LEU  46   1.923   8.176   1.753
  365   1HD2  LEU  46          HD21      LEU  46   0.013   5.427   0.308
  366   2HD2  LEU  46          HD22      LEU  46   0.958   6.876  -0.050
  367   3HD2  LEU  46          HD23      LEU  46   1.724   5.536   0.815
  368    H    ARG  47           HN       ARG  47   0.667   6.258   5.850
  369    HA   ARG  47           HA       ARG  47   1.086   3.712   6.891
  370   1HB   ARG  47          HB2       ARG  47   2.621   5.539   7.073
  371   2HB   ARG  47          HB3       ARG  47   1.507   6.438   8.094
  372   1HG   ARG  47          HG2       ARG  47   2.138   3.767   9.223
  373   2HG   ARG  47          HG3       ARG  47   3.585   4.748   8.914
  374   1HD   ARG  47          HD3       ARG  47   2.585   6.666  10.076
  375   2HD   ARG  47          HD2       ARG  47   1.136   5.706  10.459
  376    HE   ARG  47           HE       ARG  47   3.509   4.377  11.418
  377   1HH1  ARG  47          HH22      ARG  47   1.605   7.323  12.035
  378   2HH1  ARG  47          HH21      ARG  47   1.982   7.390  13.716
  379   1HH2  ARG  47          HH12      ARG  47   4.124   4.495  13.487
  380   2HH2  ARG  47          HH11      ARG  47   3.487   5.675  14.630
  381    H    ALA  48           HN       ALA  48  -1.313   6.127   7.947
  382    HA   ALA  48           HA       ALA  48  -2.318   4.864  10.241
  383   1HB   ALA  48          HB1       ALA  48  -3.003   7.097   9.549
  384   2HB   ALA  48          HB2       ALA  48  -3.749   6.458   8.068
  385   3HB   ALA  48          HB3       ALA  48  -4.434   6.059   9.661
  386    H    GLN  49           HN       GLN  49  -2.952   4.126   6.791
  387    HA   GLN  49           HA       GLN  49  -4.999   2.090   7.519
  388   1HB   GLN  49          HB2       GLN  49  -4.021   2.916   4.774
  389   2HB   GLN  49          HB3       GLN  49  -5.455   1.961   5.189
  390   1HG   GLN  49          HG2       GLN  49  -5.026   4.926   5.783
  391   2HG   GLN  49          HG3       GLN  49  -6.050   4.220   4.539
  392   1HE2  GLN  49          HE21      GLN  49  -5.742   4.796   8.019
  393   2HE2  GLN  49          HE22      GLN  49  -7.416   4.419   8.389
  394    H    ALA  50           HN       ALA  50  -1.630   2.397   6.681
  395    HA   ALA  50           HA       ALA  50  -1.090  -0.002   5.407
  396   1HB   ALA  50          HB1       ALA  50   1.192   0.247   6.148
  397   2HB   ALA  50          HB2       ALA  50   0.486   1.818   5.730
  398   3HB   ALA  50          HB3       ALA  50   0.693   1.354   7.446
  399    H    GLY  51           HN       GLY  51  -0.273  -2.023   6.033
  400   1HA   GLY  51          HA1       GLY  51  -0.385  -3.958   7.282
  401   2HA   GLY  51          HA2       GLY  51  -1.068  -3.091   8.669
  402    H    GLY  52           HN       GLY  52  -3.106  -1.791   6.615
  403   1HA   GLY  52          HA1       GLY  52  -5.044  -4.074   6.711
  404   2HA   GLY  52          HA2       GLY  52  -5.403  -2.362   6.981
  405    H    ASP  53           HN       ASP  53  -6.985  -3.190   5.223
  406    HA   ASP  53           HA       ASP  53  -5.893  -2.790   2.513
  407   1HB   ASP  53          HB2       ASP  53  -7.515  -4.490   2.403
  408   2HB   ASP  53          HB3       ASP  53  -8.552  -3.721   3.584
  409    H    ALA  54           HN       ALA  54  -6.294  -1.079   1.296
  410    HA   ALA  54           HA       ALA  54  -7.670   1.255   2.553
  411   1HB   ALA  54          HB1       ALA  54  -5.845   2.747   1.843
  412   2HB   ALA  54          HB2       ALA  54  -5.243   1.502   2.953
  413   3HB   ALA  54          HB3       ALA  54  -4.931   1.355   1.222
  414    H    THR  55           HN       THR  55  -8.111  -0.848   0.219
  415    HA   THR  55           HA       THR  55  -8.057   0.401  -2.248
  416    HB   THR  55           HB       THR  55 -10.269  -1.382  -1.143
  417    HG1  THR  55           HG1      THR  55  -8.317  -2.379  -1.002
  418   1HG2  THR  55          HG21      THR  55 -10.969  -0.327  -3.271
  419   2HG2  THR  55          HG22      THR  55  -9.393  -0.717  -3.991
  420   3HG2  THR  55          HG23      THR  55 -10.521  -2.018  -3.554
  421    H    ALA  56           HN       ALA  56 -10.783   0.607   0.101
  422    HA   ALA  56           HA       ALA  56 -12.389   2.357  -1.353
  423   1HB   ALA  56          HB1       ALA  56 -12.024   2.232   1.680
  424   2HB   ALA  56          HB2       ALA  56 -13.404   2.957   0.828
  425   3HB   ALA  56          HB3       ALA  56 -13.113   1.210   0.714
  426    H    ASN  57           HN       ASN  57  -9.734   3.242   0.902
  427    HA   ASN  57           HA       ASN  57 -10.134   6.083   0.707
  428   1HB   ASN  57          HB2       ASN  57  -7.596   4.505   1.270
  429   2HB   ASN  57          HB3       ASN  57  -7.810   6.245   1.488
  430   1HD2  ASN  57          HD21      ASN  57  -8.093   3.182   2.994
  431   2HD2  ASN  57          HD22      ASN  57  -8.787   3.771   4.487
  432    H    PHE  58           HN       PHE  58  -8.177   3.712  -1.153
  433    HA   PHE  58           HA       PHE  58  -6.567   5.660  -2.522
  434   1HB   PHE  58          HB2       PHE  58  -5.894   3.354  -2.233
  435   2HB   PHE  58          HB3       PHE  58  -7.309   2.774  -3.102
  436    HD1  PHE  58           HD1      PHE  58  -7.107   2.194  -5.358
  437    HD2  PHE  58           HD2      PHE  58  -4.231   4.904  -3.611
  438    HE1  PHE  58           HE1      PHE  58  -5.683   1.946  -7.333
  439    HE2  PHE  58           HE2      PHE  58  -2.878   4.789  -5.681
  440    HZ   PHE  58           HZ       PHE  58  -3.576   3.261  -7.540
  441    H    GLU  59           HN       GLU  59  -9.576   3.912  -3.246
  442    HA   GLU  59           HA       GLU  59  -9.935   5.087  -5.850
  443   1HB   GLU  59          HB2       GLU  59 -11.777   3.536  -3.980
  444   2HB   GLU  59          HB3       GLU  59 -12.118   3.885  -5.687
  445   1HG   GLU  59          HG2       GLU  59  -9.588   2.387  -4.782
  446   2HG   GLU  59          HG3       GLU  59 -11.074   1.598  -5.202
  447    H    ALA  60           HN       ALA  60 -11.242   5.817  -2.579
  448    HA   ALA  60           HA       ALA  60 -13.024   7.879  -3.311
  449   1HB   ALA  60          HB1       ALA  60 -12.891   6.964  -1.039
  450   2HB   ALA  60          HB2       ALA  60 -11.265   7.651  -0.834
  451   3HB   ALA  60          HB3       ALA  60 -12.666   8.724  -1.017
  452    H    VAL  61           HN       VAL  61  -9.492   8.027  -2.656
  453    HA   VAL  61           HA       VAL  61  -9.257  10.847  -3.283
  454    HB   VAL  61           HB       VAL  61  -7.279   8.563  -3.054
  455   1HG1  VAL  61          HG11      VAL  61  -6.712  11.535  -3.466
  456   2HG1  VAL  61          HG12      VAL  61  -5.534  10.361  -2.862
  457   3HG1  VAL  61          HG13      VAL  61  -6.155  10.187  -4.490
  458   1HG2  VAL  61          HG21      VAL  61  -7.829  10.944  -1.234
  459   2HG2  VAL  61          HG22      VAL  61  -8.453   9.309  -0.955
  460   3HG2  VAL  61          HG23      VAL  61  -6.711   9.600  -0.924
  461    H    GLY  62           HN       GLY  62  -9.930   8.189  -5.351
  462   1HA   GLY  62          HA1       GLY  62 -10.160   8.173  -7.609
  463   2HA   GLY  62          HA2       GLY  62  -9.515   9.816  -7.722
  464    H    HIS  63           HN       HIS  63  -7.104   9.932  -7.086
  465    HA   HIS  63           HA       HIS  63  -4.966   9.587  -7.735
  466   1HB   HIS  63          HB2       HIS  63  -5.712   6.657  -7.380
  467   2HB   HIS  63          HB3       HIS  63  -4.114   7.198  -7.841
  468    HD1  HIS  63           HD1      HIS  63  -6.377   7.103  -4.784
  469    HD2  HIS  63           HD2      HIS  63  -2.594   8.383  -6.057
  470    HE1  HIS  63           HE1      HIS  63  -5.020   7.577  -2.662
  471    H    SER  64           HN       SER  64  -4.244  10.204  -9.702
  472    HA   SER  64           HA       SER  64  -5.600   9.725 -12.121
  473   1HB   SER  64          HB2       SER  64  -2.648  10.372 -11.752
  474   2HB   SER  64          HB3       SER  64  -3.636  10.668 -13.193
  475    HG   SER  64           HG       SER  64  -3.733  11.907 -10.651
  476    H    THR  65           HN       THR  65  -5.122   8.445 -14.001
  477    HA   THR  65           HA       THR  65  -4.574   5.773 -13.830
  478    HB   THR  65           HB       THR  65  -3.627   7.644 -16.058
  479    HG1  THR  65           HG1      THR  65  -5.781   7.581 -16.749
  480   1HG2  THR  65          HG21      THR  65  -4.329   5.794 -17.540
  481   2HG2  THR  65          HG22      THR  65  -3.107   5.233 -16.387
  482   3HG2  THR  65          HG23      THR  65  -4.817   4.828 -16.130
  483    H    ASP  66           HN       ASP  66  -2.272   8.427 -14.264
  484    HA   ASP  66           HA       ASP  66   0.131   6.961 -14.536
  485   1HB   ASP  66          HB2       ASP  66  -0.144   9.664 -13.108
  486   2HB   ASP  66          HB3       ASP  66   1.159   9.111 -14.155
  487    H    ALA  67           HN       ALA  67  -1.565   8.170 -11.643
  488    HA   ALA  67           HA       ALA  67   0.457   7.389  -9.742
  489   1HB   ALA  67          HB1       ALA  67  -2.519   7.813  -9.314
  490   2HB   ALA  67          HB2       ALA  67  -1.276   7.687  -8.061
  491   3HB   ALA  67          HB3       ALA  67  -1.265   9.056  -9.194
  492    H    ARG  68           HN       ARG  68  -2.503   5.874 -11.026
  493    HA   ARG  68           HA       ARG  68  -2.433   3.434  -9.517
  494   1HB   ARG  68          HB2       ARG  68  -3.800   4.436 -11.986
  495   2HB   ARG  68          HB3       ARG  68  -3.529   2.711 -11.940
  496   1HG   ARG  68          HG2       ARG  68  -5.667   3.079 -11.102
  497   2HG   ARG  68          HG3       ARG  68  -4.677   2.570  -9.732
  498   1HD   ARG  68          HD2       ARG  68  -4.590   4.891  -8.905
  499   2HD   ARG  68          HD3       ARG  68  -5.284   5.477 -10.400
  500    HE   ARG  68           HE       ARG  68  -6.706   3.921  -8.248
  501   1HH1  ARG  68          HH22      ARG  68  -7.088   6.406 -10.636
  502   2HH1  ARG  68          HH21      ARG  68  -8.671   5.933 -11.165
  503   1HH2  ARG  68          HH12      ARG  68  -8.919   3.528  -8.554
  504   2HH2  ARG  68          HH11      ARG  68  -9.836   4.399  -9.727
  505    H    GLU  69           HN       GLU  69  -1.088   4.254 -12.704
  506    HA   GLU  69           HA       GLU  69   0.216   1.823 -13.284
  507   1HB   GLU  69          HB2       GLU  69   0.568   4.681 -14.130
  508   2HB   GLU  69          HB3       GLU  69   1.646   3.454 -14.723
  509   1HG   GLU  69          HG2       GLU  69  -1.395   3.505 -15.034
  510   2HG   GLU  69          HG3       GLU  69  -0.152   3.703 -16.269
  511    H    LEU  70           HN       LEU  70   1.382   4.771 -11.573
  512    HA   LEU  70           HA       LEU  70   4.028   3.876 -11.062
  513   1HB   LEU  70          HB2       LEU  70   3.632   6.162 -10.827
  514   2HB   LEU  70          HB3       LEU  70   2.162   5.917  -9.899
  515    HG   LEU  70           HG       LEU  70   3.421   5.165  -7.967
  516   1HD1  LEU  70          HD11      LEU  70   5.881   6.032  -9.552
  517   2HD1  LEU  70          HD12      LEU  70   5.839   5.649  -7.816
  518   3HD1  LEU  70          HD13      LEU  70   5.527   4.378  -9.005
  519   1HD2  LEU  70          HD21      LEU  70   4.252   7.415  -7.349
  520   2HD2  LEU  70          HD22      LEU  70   4.204   7.899  -9.056
  521   3HD2  LEU  70          HD23      LEU  70   2.699   7.505  -8.200
  522    H    SER  71           HN       SER  71   0.981   3.463  -9.131
  523    HA   SER  71           HA       SER  71   1.990   2.134  -6.954
  524   1HB   SER  71          HB2       SER  71  -0.537   1.249  -8.351
  525   2HB   SER  71          HB3       SER  71  -0.142   1.251  -6.626
  526    HG   SER  71           HG       SER  71  -1.436   3.038  -7.157
  527    H    LYS  72           HN       LYS  72   1.691   0.780 -10.274
  528    HA   LYS  72           HA       LYS  72   2.017  -1.968  -9.546
  529   1HB   LYS  72          HB2       LYS  72   2.947  -0.580 -12.073
  530   2HB   LYS  72          HB3       LYS  72   2.820  -2.319 -11.814
  531   1HG   LYS  72          HG2       LYS  72   0.391  -2.172 -11.504
  532   2HG   LYS  72          HG3       LYS  72   0.454  -0.401 -11.672
  533   1HD   LYS  72          HD2       LYS  72   1.425  -0.619 -13.912
  534   2HD   LYS  72          HD3       LYS  72   1.350  -2.393 -13.814
  535   1HE   LYS  72          HE2       LYS  72  -1.115  -2.329 -13.752
  536   2HE   LYS  72          HE3       LYS  72  -1.076  -0.567 -13.539
  537   1HZ   LYS  72          HZ1       LYS  72  -1.412  -0.586 -15.691
  538   2HZ   LYS  72          HZ2       LYS  72   0.146  -0.539 -15.708
  539   3HZ   LYS  72          HZ3       LYS  72  -0.572  -2.013 -16.032
  540    H    THR  73           HN       THR  73   4.407   0.687 -10.084
  541    HA   THR  73           HA       THR  73   6.731  -0.871 -10.033
  542    HB   THR  73           HB       THR  73   6.435   1.908  -8.846
  543    HG1  THR  73           HG1      THR  73   6.332   2.673 -10.923
  544   1HG2  THR  73          HG21      THR  73   8.723   0.927  -8.842
  545   2HG2  THR  73          HG22      THR  73   8.590   0.618 -10.587
  546   3HG2  THR  73          HG23      THR  73   8.608   2.285  -9.975
  547    H    PHE  74           HN       PHE  74   4.484  -0.140  -7.439
  548    HA   PHE  74           HA       PHE  74   6.454  -0.887  -5.331
  549   1HB   PHE  74          HB2       PHE  74   3.682   0.350  -5.179
  550   2HB   PHE  74          HB3       PHE  74   4.746   0.037  -3.824
  551    HD1  PHE  74           HD1      PHE  74   7.372   1.008  -4.602
  552    HD2  PHE  74           HD2      PHE  74   3.479   2.698  -5.358
  553    HE1  PHE  74           HE1      PHE  74   8.402   3.203  -5.008
  554    HE2  PHE  74           HE2      PHE  74   4.508   4.911  -5.673
  555    HZ   PHE  74           HZ       PHE  74   6.967   5.201  -5.405
  556    H    ILE  75           HN       ILE  75   4.127  -2.380  -7.305
  557    HA   ILE  75           HA       ILE  75   2.878  -4.045  -5.296
  558    HB   ILE  75           HB       ILE  75   3.211  -4.189  -8.277
  559   1HG1  ILE  75          HG12      ILE  75   0.862  -3.863  -6.364
  560   2HG1  ILE  75          HG13      ILE  75   1.604  -2.625  -7.389
  561   1HG2  ILE  75          HG21      ILE  75   1.815  -6.261  -6.482
  562   2HG2  ILE  75          HG22      ILE  75   1.765  -6.251  -8.258
  563   3HG2  ILE  75          HG23      ILE  75   3.272  -6.581  -7.444
  564   1HD1  ILE  75          HD11      ILE  75  -0.092  -4.991  -8.211
  565   2HD1  ILE  75          HD12      ILE  75  -0.357  -3.273  -8.548
  566   3HD1  ILE  75          HD13      ILE  75   0.947  -4.140  -9.384
  567    H    ILE  76           HN       ILE  76   4.095  -5.164  -3.992
  568    HA   ILE  76           HA       ILE  76   6.581  -6.519  -5.018
  569    HB   ILE  76           HB       ILE  76   7.068  -6.903  -2.601
  570   1HG1  ILE  76          HG12      ILE  76   5.102  -4.662  -2.016
  571   2HG1  ILE  76          HG13      ILE  76   4.608  -6.356  -1.900
  572   1HG2  ILE  76          HG21      ILE  76   8.183  -5.193  -3.965
  573   2HG2  ILE  76          HG22      ILE  76   6.911  -4.023  -3.581
  574   3HG2  ILE  76          HG23      ILE  76   7.986  -4.627  -2.306
  575   1HD1  ILE  76          HD11      ILE  76   6.939  -5.136  -0.363
  576   2HD1  ILE  76          HD12      ILE  76   5.328  -5.491   0.278
  577   3HD1  ILE  76          HD13      ILE  76   6.377  -6.815  -0.260
  578    H    GLY  77           HN       GLY  77   3.262  -7.170  -4.181
  579   1HA   GLY  77          HA1       GLY  77   3.539  -9.846  -5.022
  580   2HA   GLY  77          HA2       GLY  77   3.508  -9.799  -3.242
  581    H    GLU  78           HN       GLU  78   1.507 -11.139  -4.098
  582    HA   GLU  78           HA       GLU  78  -0.864  -9.340  -4.175
  583   1HB   GLU  78          HB2       GLU  78  -0.695 -12.269  -4.823
  584   2HB   GLU  78          HB3       GLU  78  -2.165 -11.344  -4.589
  585   1HG   GLU  78          HG2       GLU  78  -0.739  -9.881  -6.539
  586   2HG   GLU  78          HG3       GLU  78  -0.587 -11.578  -6.982
  587    H    LEU  79           HN       LEU  79  -2.687 -10.023  -2.760
  588    HA   LEU  79           HA       LEU  79  -1.965 -10.679  -0.043
  589   1HB   LEU  79          HB2       LEU  79  -3.917  -9.278  -0.728
  590   2HB   LEU  79          HB3       LEU  79  -4.593 -10.670  -1.588
  591    HG   LEU  79           HG       LEU  79  -4.817 -11.888   0.591
  592   1HD1  LEU  79          HD11      LEU  79  -3.923  -9.181   1.669
  593   2HD1  LEU  79          HD12      LEU  79  -4.702 -10.433   2.659
  594   3HD1  LEU  79          HD13      LEU  79  -3.112 -10.743   1.941
  595   1HD2  LEU  79          HD21      LEU  79  -6.151  -9.164   0.432
  596   2HD2  LEU  79          HD22      LEU  79  -6.669 -10.626  -0.437
  597   3HD2  LEU  79          HD23      LEU  79  -6.752 -10.574   1.334
  598    H    HIS  80           HN       HIS  80  -1.753 -12.786   0.812
  599    HA   HIS  80           HA       HIS  80  -1.722 -15.010  -0.826
  600   1HB   HIS  80          HB2       HIS  80  -0.939 -14.609   1.680
  601   2HB   HIS  80          HB3       HIS  80  -2.464 -15.384   2.081
  602    HD1  HIS  80           HD1      HIS  80  -2.537 -18.103   1.407
  603    HD2  HIS  80           HD2      HIS  80   1.006 -15.980   0.508
  604    HE1  HIS  80           HE1      HIS  80  -0.910 -19.776   0.652
  605    HA   PRO  81           HA       PRO  81  -5.957 -15.792  -1.689
  606   1HB   PRO  81          HB2       PRO  81  -5.990 -18.576  -2.029
  607   2HB   PRO  81          HB3       PRO  81  -5.552 -17.334  -3.232
  608   1HG   PRO  81          HG2       PRO  81  -3.715 -18.915  -1.394
  609   2HG   PRO  81          HG3       PRO  81  -3.498 -18.621  -3.146
  610   1HD   PRO  81          HD2       PRO  81  -2.165 -17.150  -1.354
  611   2HD   PRO  81          HD3       PRO  81  -2.913 -16.335  -2.752
  612    H    ASP  82           HN       ASP  82  -4.453 -17.973   0.809
  613    HA   ASP  82           HA       ASP  82  -6.689 -18.732   2.167
  614   1HB   ASP  82          HB2       ASP  82  -4.078 -17.742   3.383
  615   2HB   ASP  82          HB3       ASP  82  -5.248 -18.829   4.142
  616    H    ASP  83           HN       ASP  83  -5.449 -15.424   1.967
  617    HA   ASP  83           HA       ASP  83  -7.185 -14.479   4.189
  618   1HB   ASP  83          HB2       ASP  83  -4.972 -13.178   2.552
  619   2HB   ASP  83          HB3       ASP  83  -5.948 -12.338   3.760
  620    H    ARG  84           HN       ARG  84  -7.563 -15.066   0.838
  621    HA   ARG  84           HA       ARG  84  -8.620 -12.374   0.248
  622   1HB   ARG  84          HB2       ARG  84  -6.881 -13.542  -1.101
  623   2HB   ARG  84          HB3       ARG  84  -8.130 -14.691  -1.635
  624   1HG   ARG  84          HG2       ARG  84  -9.495 -12.756  -2.477
  625   2HG   ARG  84          HG3       ARG  84  -8.192 -11.656  -2.019
  626   1HD   ARG  84          HD2       ARG  84  -8.096 -13.861  -4.118
  627   2HD   ARG  84          HD3       ARG  84  -8.113 -12.108  -4.397
  628    HE   ARG  84           HE       ARG  84  -5.887 -13.162  -2.758
  629   1HH1  ARG  84          HH22      ARG  84  -6.778 -12.113  -6.097
  630   2HH1  ARG  84          HH21      ARG  84  -5.048 -12.020  -6.506
  631   1HH2  ARG  84          HH12      ARG  84  -3.742 -13.093  -3.545
  632   2HH2  ARG  84          HH11      ARG  84  -3.521 -12.638  -5.248
  633    HHA  HEM 201           HGM      HEM 201  -2.500  12.916  -4.000
  634    HHB  HEM 201           HDM      HEM 201   0.929   7.991  -6.392
  635    HHC  HEM 201           HAM      HEM 201  -1.544   4.125  -1.881
  636    HHD  HEM 201           HBM      HEM 201  -4.520   9.149   0.849
  637   1HMA  HEM 201          HM81      HEM 201   1.400  11.650  -7.330
  638   2HMA  HEM 201          HM82      HEM 201   1.738   9.926  -7.242
  639   3HMA  HEM 201          HM83      HEM 201   0.392  10.516  -8.247
  640   1HAA  HEM 201          HP72      HEM 201  -0.520  12.988  -7.281
  641   2HAA  HEM 201          HP71      HEM 201  -1.168  13.666  -5.806
  642   1HBA  HEM 201          HP74      HEM 201  -3.204  11.892  -6.593
  643   2HBA  HEM 201          HP73      HEM 201  -3.188  13.634  -6.872
  644   1HMB  HEM 201          HM11      HEM 201   1.652   4.227  -6.015
  645   2HMB  HEM 201          HM13      HEM 201   2.326   5.861  -6.023
  646   3HMB  HEM 201          HM12      HEM 201   0.967   5.446  -7.092
  647    HAB  HEM 201          HT2A      HEM 201   0.758   3.163  -3.119
  648   1HBB  HEM 201          HV2T      HEM 201  -0.859   1.546  -3.650
  649   2HBB  HEM 201          HV2C      HEM 201  -1.496   2.610  -5.035
  650   1HMC  HEM 201          HM32      HEM 201  -3.315   4.076   1.541
  651   2HMC  HEM 201          HM33      HEM 201  -3.543   3.443  -0.100
  652   3HMC  HEM 201          HM31      HEM 201  -1.906   3.748   0.524
  653    HAC  HEM 201          HT4A      HEM 201  -3.510   7.391   2.590
  654   1HBC  HEM 201          HV4C      HEM 201  -5.546   5.233   1.899
  655   2HBC  HEM 201          HV4T      HEM 201  -5.527   6.334   3.410
  656   1HMD  HEM 201          HM51      HEM 201  -5.365  12.873   0.478
  657   2HMD  HEM 201          HM52      HEM 201  -5.703  11.187   0.862
  658   3HMD  HEM 201          HM53      HEM 201  -4.221  11.952   1.484
  659   1HAD  HEM 201          HP62      HEM 201  -3.029  14.220  -2.195
  660   2HAD  HEM 201          HP61      HEM 201  -3.930  14.183  -0.701
  661   1HBD  HEM 201          HP63      HEM 201  -5.099  13.837  -3.488
  662   2HBD  HEM 201          HP64      HEM 201  -6.023  13.702  -1.979


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