NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type
6702 1je4 5073 cing recoord 1-original 4 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
    1   1H    ALA   1          HT1       ALA   1  -5.060  30.237  -3.252
    2   2H    ALA   1          HT2       ALA   1  -6.045  31.386  -2.442
    3   3H    ALA   1          HT3       ALA   1  -5.538  31.673  -4.057
    4    HA   ALA   1           HA       ALA   1  -7.821  30.992  -3.930
    5   1HB   ALA   1          HB1       ALA   1  -6.459  28.675  -5.176
    6   2HB   ALA   1          HB2       ALA   1  -6.006  30.283  -5.742
    7   3HB   ALA   1          HB3       ALA   1  -7.687  29.758  -5.831
    8    HA   PRO   2           HA       PRO   2  -9.424  27.917  -1.232
    9   1HB   PRO   2          HB2       PRO   2 -10.358  26.343  -3.584
   10   2HB   PRO   2          HB1       PRO   2 -11.265  26.912  -2.179
   11   1HG   PRO   2          HG2       PRO   2 -11.523  28.119  -4.537
   12   2HG   PRO   2          HG1       PRO   2 -11.500  29.056  -3.031
   13   1HD   PRO   2          HD2       PRO   2  -9.362  28.712  -5.085
   14   2HD   PRO   2          HD1       PRO   2  -9.771  30.136  -4.107
   15    H    MET   3           HN       MET   3  -8.470  26.061  -4.130
   16    HA   MET   3           HA       MET   3  -7.506  23.857  -2.648
   17   1HB   MET   3          HB2       MET   3  -6.700  24.572  -5.465
   18   2HB   MET   3          HB1       MET   3  -6.762  22.974  -4.738
   19   1HG   MET   3          HG2       MET   3  -9.322  24.344  -4.668
   20   2HG   MET   3          HG1       MET   3  -8.695  24.124  -6.299
   21   1HE   MET   3          HE1       MET   3 -10.917  21.408  -3.746
   22   2HE   MET   3          HE2       MET   3 -11.570  22.135  -5.214
   23   3HE   MET   3          HE3       MET   3 -10.853  23.157  -3.968
   24    H    GLY   4           HN       GLY   4  -5.572  23.440  -1.764
   25   1HA   GLY   4          HA2       GLY   4  -3.679  25.461  -1.344
   26   2HA   GLY   4          HA1       GLY   4  -3.412  23.749  -1.053
   27    H    SER   5           HN       SER   5  -1.196  24.548  -1.748
   28    HA   SER   5           HA       SER   5  -0.724  25.179  -4.472
   29   1HB   SER   5          HB2       SER   5   1.036  24.251  -2.213
   30   2HB   SER   5          HB1       SER   5   1.675  24.445  -3.846
   31    HG   SER   5           HG       SER   5   1.941  26.347  -2.628
   32    H    ASP   6           HN       ASP   6  -0.222  22.170  -2.628
   33    HA   ASP   6           HA       ASP   6  -0.824  20.629  -5.023
   34   1HB   ASP   6          HB2       ASP   6   1.750  20.202  -3.489
   35   2HB   ASP   6          HB1       ASP   6   1.196  19.281  -4.885
   36    HA   PRO   7           HA       PRO   7  -2.298  18.911  -0.878
   37   1HB   PRO   7          HB2       PRO   7  -4.959  19.080  -1.376
   38   2HB   PRO   7          HB1       PRO   7  -4.036  20.397  -0.642
   39   1HG   PRO   7          HG2       PRO   7  -4.890  20.042  -3.489
   40   2HG   PRO   7          HG1       PRO   7  -4.931  21.502  -2.483
   41   1HD   PRO   7          HD2       PRO   7  -2.985  21.046  -4.309
   42   2HD   PRO   7          HD1       PRO   7  -2.690  21.936  -2.801
   43    HA   PRO   8           HA       PRO   8  -2.610  15.172  -3.450
   44   1HB   PRO   8          HB2       PRO   8  -1.869  13.439  -1.511
   45   2HB   PRO   8          HB1       PRO   8  -0.701  14.415  -2.409
   46   1HG   PRO   8          HG2       PRO   8  -1.861  14.878   0.312
   47   2HG   PRO   8          HG1       PRO   8  -0.182  15.050  -0.232
   48   1HD   PRO   8          HD2       PRO   8  -1.855  17.166   0.052
   49   2HD   PRO   8          HD1       PRO   8  -0.564  17.121  -1.165
   50    H    THR   9           HN       THR   9  -4.011  13.359  -3.461
   51    HA   THR   9           HA       THR   9  -6.347  13.694  -1.720
   52    HB   THR   9           HB       THR   9  -7.142  11.878  -3.573
   53    HG1  THR   9           HG1      THR   9  -5.577  11.818  -4.991
   54   1HG2  THR   9          HG21      THR   9  -8.188  14.093  -3.020
   55   2HG2  THR   9          HG22      THR   9  -8.283  13.597  -4.710
   56   3HG2  THR   9          HG23      THR   9  -7.103  14.809  -4.211
   57    H    ALA  10           HN       ALA  10  -4.392  11.069  -3.133
   58    HA   ALA  10           HA       ALA  10  -4.258   9.665  -0.651
   59   1HB   ALA  10          HB1       ALA  10  -6.336   8.923  -2.617
   60   2HB   ALA  10          HB2       ALA  10  -6.305   8.721  -0.866
   61   3HB   ALA  10          HB3       ALA  10  -5.418   7.600  -1.899
   62    H    CYS  11           HN       CYS  11  -2.484  10.651  -2.722
   63    HA   CYS  11           HA       CYS  11  -1.457   8.251  -4.013
   64   1HB   CYS  11          HB2       CYS  11  -0.254  11.013  -4.138
   65   2HB   CYS  11          HB1       CYS  11  -0.049   9.688  -5.278
   66    H    CYS  12           HN       CYS  12   1.230   8.673  -4.064
   67    HA   CYS  12           HA       CYS  12   2.110   8.833  -1.275
   68   1HB   CYS  12          HB2       CYS  12   1.632   6.399  -2.344
   69   2HB   CYS  12          HB1       CYS  12   3.299   6.630  -2.860
   70    H    ALA  13           HN       ALA  13   4.258   9.433  -0.994
   71    HA   ALA  13           HA       ALA  13   5.482  10.654  -3.350
   72   1HB   ALA  13          HB1       ALA  13   5.588  11.142  -0.437
   73   2HB   ALA  13          HB2       ALA  13   5.552  12.284  -1.780
   74   3HB   ALA  13          HB3       ALA  13   7.060  11.478  -1.349
   75    H    SER  14           HN       SER  14   6.038   8.157  -0.971
   76    HA   SER  14           HA       SER  14   8.256   7.154  -2.570
   77   1HB   SER  14          HB2       SER  14   8.491   8.002   0.310
   78   2HB   SER  14          HB1       SER  14   9.544   6.758  -0.364
   79    HG   SER  14           HG       SER  14  10.647   8.266  -1.305
   80    H    TYR  15           HN       TYR  15   8.608   4.936  -2.359
   81    HA   TYR  15           HA       TYR  15   6.405   3.499  -1.065
   82   1HB   TYR  15          HB2       TYR  15   8.404   2.308  -2.979
   83   2HB   TYR  15          HB1       TYR  15   6.794   1.721  -2.575
   84    HD1  TYR  15           HD1      TYR  15   8.736   3.764  -4.794
   85    HD2  TYR  15           HD2      TYR  15   4.792   3.075  -3.353
   86    HE1  TYR  15           HE1      TYR  15   7.822   4.954  -6.742
   87    HE2  TYR  15           HE2      TYR  15   3.868   4.262  -5.298
   88    HH   TYR  15           HH       TYR  15   4.486   4.894  -7.535
   89    H    THR  16           HN       THR  16   7.433   1.013  -0.738
   90    HA   THR  16           HA       THR  16   9.373   1.443   1.419
   91    HB   THR  16           HB       THR  16   7.223   0.367   2.004
   92    HG1  THR  16           HG1      THR  16   9.582  -1.171   2.238
   93   1HG2  THR  16          HG21      THR  16   6.975  -0.868  -0.185
   94   2HG2  THR  16          HG22      THR  16   6.597  -1.774   1.280
   95   3HG2  THR  16          HG23      THR  16   8.133  -2.033   0.454
   96    H    ALA  17           HN       ALA  17  11.394   0.717   1.269
   97    HA   ALA  17           HA       ALA  17  12.123  -0.884  -1.070
   98   1HB   ALA  17          HB1       ALA  17  13.261   1.358  -0.107
   99   2HB   ALA  17          HB2       ALA  17  14.127   0.153  -1.059
  100   3HB   ALA  17          HB3       ALA  17  14.246   0.138   0.701
  101    H    ARG  18           HN       ARG  18  10.785  -2.215   1.041
  102    HA   ARG  18           HA       ARG  18  12.784  -4.232   1.651
  103   1HB   ARG  18          HB2       ARG  18  11.315  -2.656   3.747
  104   2HB   ARG  18          HB1       ARG  18  11.860  -4.297   4.067
  105   1HG   ARG  18          HG2       ARG  18  14.152  -3.328   3.178
  106   2HG   ARG  18          HG1       ARG  18  13.432  -1.808   3.713
  107   1HD   ARG  18          HD2       ARG  18  12.918  -3.094   5.896
  108   2HD   ARG  18          HD1       ARG  18  14.126  -4.241   5.319
  109    HE   ARG  18           HE       ARG  18  15.250  -1.704   5.158
  110   1HH1  ARG  18          HH11      ARG  18  14.071  -3.872   7.626
  111   2HH1  ARG  18          HH12      ARG  18  15.148  -3.274   8.842
  112   1HH2  ARG  18          HH21      ARG  18  16.668  -0.916   6.757
  113   2HH2  ARG  18          HH22      ARG  18  16.623  -1.596   8.350
  114    H    LYS  19           HN       LYS  19  11.522  -6.008   3.091
  115    HA   LYS  19           HA       LYS  19   9.051  -6.555   1.590
  116   1HB   LYS  19          HB2       LYS  19  10.891  -8.161   1.234
  117   2HB   LYS  19          HB1       LYS  19  10.917  -8.502   2.958
  118   1HG   LYS  19          HG2       LYS  19   8.501  -9.218   2.714
  119   2HG   LYS  19          HG1       LYS  19   8.765  -9.155   0.970
  120   1HD   LYS  19          HD2       LYS  19  10.515 -10.806   1.128
  121   2HD   LYS  19          HD1       LYS  19  10.421 -10.790   2.890
  122   1HE   LYS  19          HE2       LYS  19   8.070 -11.584   2.707
  123   2HE   LYS  19          HE1       LYS  19   8.299 -11.731   0.966
  124   1HZ   LYS  19          HZ1       LYS  19   8.643 -13.854   1.962
  125   2HZ   LYS  19          HZ2       LYS  19   9.740 -13.226   3.086
  126   3HZ   LYS  19          HZ3       LYS  19  10.150 -13.283   1.447
  127    H    LEU  20           HN       LEU  20   7.201  -7.200   2.644
  128    HA   LEU  20           HA       LEU  20   7.265  -7.324   5.572
  129   1HB   LEU  20          HB2       LEU  20   5.839  -5.352   3.883
  130   2HB   LEU  20          HB1       LEU  20   4.940  -6.016   5.234
  131    HG   LEU  20           HG       LEU  20   7.561  -4.527   5.386
  132   1HD1  LEU  20          HD11      LEU  20   6.216  -2.890   6.652
  133   2HD1  LEU  20          HD12      LEU  20   4.768  -3.823   6.273
  134   3HD1  LEU  20          HD13      LEU  20   5.690  -3.061   4.977
  135   1HD2  LEU  20          HD21      LEU  20   5.993  -6.047   7.434
  136   2HD2  LEU  20          HD22      LEU  20   6.989  -4.668   7.897
  137   3HD2  LEU  20          HD23      LEU  20   7.728  -6.067   7.117
  138    HA   PRO  21           HA       PRO  21   5.088 -11.092   4.198
  139   1HB   PRO  21          HB2       PRO  21   4.922 -11.265   7.175
  140   2HB   PRO  21          HB1       PRO  21   5.353 -12.512   5.998
  141   1HG   PRO  21          HG2       PRO  21   7.234 -11.317   7.449
  142   2HG   PRO  21          HG1       PRO  21   7.516 -11.710   5.743
  143   1HD   PRO  21          HD2       PRO  21   6.952  -9.074   7.013
  144   2HD   PRO  21          HD1       PRO  21   7.967  -9.459   5.609
  145    H    ARG  22           HN       ARG  22   2.940 -11.595   4.061
  146    HA   ARG  22           HA       ARG  22   1.030  -9.600   4.481
  147   1HB   ARG  22          HB2       ARG  22  -0.628 -11.523   4.138
  148   2HB   ARG  22          HB1       ARG  22   0.513 -11.198   2.840
  149   1HG   ARG  22          HG2       ARG  22   1.592 -13.163   3.108
  150   2HG   ARG  22          HG1       ARG  22   1.355 -13.182   4.857
  151   1HD   ARG  22          HD2       ARG  22  -1.010 -13.769   4.507
  152   2HD   ARG  22          HD1       ARG  22  -0.730 -13.801   2.766
  153    HE   ARG  22           HE       ARG  22   1.103 -15.547   3.709
  154   1HH1  ARG  22          HH11      ARG  22  -2.340 -15.226   4.184
  155   2HH1  ARG  22          HH12      ARG  22  -2.592 -16.924   4.415
  156   1HH2  ARG  22          HH21      ARG  22   0.773 -17.780   4.013
  157   2HH2  ARG  22          HH22      ARG  22  -0.825 -18.374   4.318
  158    H    ASN  23           HN       ASN  23   2.041 -12.281   6.503
  159    HA   ASN  23           HA       ASN  23  -0.078 -12.255   8.341
  160   1HB   ASN  23          HB2       ASN  23   1.981 -13.888   8.027
  161   2HB   ASN  23          HB1       ASN  23   2.696 -12.864   9.268
  162   1HD2  ASN  23          HD21      ASN  23   2.304 -15.484   9.785
  163   2HD2  ASN  23          HD22      ASN  23   1.026 -15.688  10.929
  164    H    PHE  24           HN       PHE  24   2.651 -10.148   7.943
  165    HA   PHE  24           HA       PHE  24   2.183  -8.898  10.547
  166   1HB   PHE  24          HB2       PHE  24   4.462  -9.144   8.749
  167   2HB   PHE  24          HB1       PHE  24   4.219  -7.485   9.285
  168    HD1  PHE  24           HD1      PHE  24   6.277  -9.952   9.918
  169    HD2  PHE  24           HD2      PHE  24   3.245  -7.816  12.004
  170    HE1  PHE  24           HE1      PHE  24   7.375 -10.488  12.053
  171    HE2  PHE  24           HE2      PHE  24   4.338  -8.347  14.144
  172    HZ   PHE  24           HZ       PHE  24   6.406  -9.684  14.170
  173    H    VAL  25           HN       VAL  25   0.247  -8.671   8.375
  174    HA   VAL  25           HA       VAL  25   0.188  -5.743   8.207
  175    HB   VAL  25           HB       VAL  25  -0.565  -7.512   5.880
  176   1HG1  VAL  25          HG11      VAL  25  -0.194  -5.089   4.823
  177   2HG1  VAL  25          HG12      VAL  25  -0.687  -4.610   6.447
  178   3HG1  VAL  25          HG13      VAL  25  -1.747  -5.622   5.466
  179   1HG2  VAL  25          HG21      VAL  25   1.560  -6.116   4.986
  180   2HG2  VAL  25          HG22      VAL  25   1.670  -7.743   5.658
  181   3HG2  VAL  25          HG23      VAL  25   2.024  -6.345   6.672
  182    H    VAL  26           HN       VAL  26  -1.823  -4.827   8.374
  183    HA   VAL  26           HA       VAL  26  -3.941  -6.591   9.310
  184    HB   VAL  26           HB       VAL  26  -3.887  -3.571   9.219
  185   1HG1  VAL  26          HG11      VAL  26  -6.135  -4.640   9.331
  186   2HG1  VAL  26          HG12      VAL  26  -5.742  -3.646  10.734
  187   3HG1  VAL  26          HG13      VAL  26  -5.644  -5.404  10.843
  188   1HG2  VAL  26          HG21      VAL  26  -2.206  -5.051  10.700
  189   2HG2  VAL  26          HG22      VAL  26  -3.598  -5.009  11.782
  190   3HG2  VAL  26          HG23      VAL  26  -2.861  -3.503  11.234
  191    H    ASP  27           HN       ASP  27  -3.866  -3.744   7.154
  192    HA   ASP  27           HA       ASP  27  -5.531  -5.174   5.233
  193   1HB   ASP  27          HB2       ASP  27  -6.368  -2.729   6.753
  194   2HB   ASP  27          HB1       ASP  27  -6.946  -2.975   5.109
  195    H    TYR  28           HN       TYR  28  -6.028  -3.464   3.349
  196    HA   TYR  28           HA       TYR  28  -3.490  -2.082   2.768
  197   1HB   TYR  28          HB2       TYR  28  -3.876  -2.684   0.369
  198   2HB   TYR  28          HB1       TYR  28  -3.563  -4.067   1.412
  199    HD1  TYR  28           HD1      TYR  28  -5.357  -5.642   1.962
  200    HD2  TYR  28           HD2      TYR  28  -6.025  -2.377  -0.682
  201    HE1  TYR  28           HE1      TYR  28  -7.433  -6.706   1.181
  202    HE2  TYR  28           HE2      TYR  28  -8.102  -3.430  -1.469
  203    HH   TYR  28           HH       TYR  28  -9.517  -6.114   0.116
  204    H    TYR  29           HN       TYR  29  -3.851  -0.567   0.768
  205    HA   TYR  29           HA       TYR  29  -6.466   0.670   0.691
  206   1HB   TYR  29          HB2       TYR  29  -4.770   1.599   2.617
  207   2HB   TYR  29          HB1       TYR  29  -4.369   2.658   1.269
  208    HD1  TYR  29           HD1      TYR  29  -7.659   1.193   2.229
  209    HD2  TYR  29           HD2      TYR  29  -5.308   4.716   1.823
  210    HE1  TYR  29           HE1      TYR  29  -9.638   2.564   2.727
  211    HE2  TYR  29           HE2      TYR  29  -7.282   6.097   2.320
  212    HH   TYR  29           HH       TYR  29 -10.459   4.798   2.413
  213    H    GLU  30           HN       GLU  30  -6.806   1.888  -1.143
  214    HA   GLU  30           HA       GLU  30  -4.641   1.782  -3.126
  215   1HB   GLU  30          HB2       GLU  30  -7.603   1.605  -3.282
  216   2HB   GLU  30          HB1       GLU  30  -6.776   2.382  -4.626
  217   1HG   GLU  30          HG2       GLU  30  -6.906   0.187  -5.311
  218   2HG   GLU  30          HG1       GLU  30  -5.284   0.279  -4.626
  219    H    THR  31           HN       THR  31  -4.488   3.587  -4.661
  220    HA   THR  31           HA       THR  31  -4.737   6.123  -3.247
  221    HB   THR  31           HB       THR  31  -3.269   7.012  -4.998
  222    HG1  THR  31           HG1      THR  31  -3.405   6.033  -6.842
  223   1HG2  THR  31          HG21      THR  31  -1.697   4.647  -4.642
  224   2HG2  THR  31          HG22      THR  31  -2.519   5.066  -3.139
  225   3HG2  THR  31          HG23      THR  31  -1.487   6.252  -3.941
  226    H    SER  32           HN       SER  32  -5.505   8.043  -4.388
  227    HA   SER  32           HA       SER  32  -8.069   7.695  -5.459
  228   1HB   SER  32          HB2       SER  32  -7.224   9.769  -4.329
  229   2HB   SER  32          HB1       SER  32  -6.307  10.133  -5.791
  230    HG   SER  32           HG       SER  32  -8.638  10.963  -5.397
  231    H    SER  33           HN       SER  33  -8.368   9.285  -7.638
  232    HA   SER  33           HA       SER  33  -6.856   7.850  -9.722
  233   1HB   SER  33          HB2       SER  33  -8.990   8.490 -11.118
  234   2HB   SER  33          HB1       SER  33  -9.025   7.091 -10.044
  235    HG   SER  33           HG       SER  33  -9.860   9.676  -9.243
  236    H    LEU  34           HN       LEU  34  -6.111  10.358  -8.439
  237    HA   LEU  34           HA       LEU  34  -6.468  12.264 -10.648
  238   1HB   LEU  34          HB2       LEU  34  -5.969  12.551  -7.728
  239   2HB   LEU  34          HB1       LEU  34  -5.309  13.777  -8.793
  240    HG   LEU  34           HG       LEU  34  -8.220  13.015  -8.843
  241   1HD1  LEU  34          HD11      LEU  34  -8.730  14.713  -7.307
  242   2HD1  LEU  34          HD12      LEU  34  -7.094  15.368  -7.358
  243   3HD1  LEU  34          HD13      LEU  34  -7.399  13.819  -6.573
  244   1HD2  LEU  34          HD21      LEU  34  -6.597  15.313  -9.900
  245   2HD2  LEU  34          HD22      LEU  34  -8.352  15.381  -9.743
  246   3HD2  LEU  34          HD23      LEU  34  -7.606  14.180 -10.798
  247    H    CYS  35           HN       CYS  35  -4.095  10.481  -8.807
  248    HA   CYS  35           HA       CYS  35  -1.848  11.824 -10.030
  249   1HB   CYS  35          HB2       CYS  35  -2.147   9.539  -8.102
  250   2HB   CYS  35          HB1       CYS  35  -0.596   9.866  -8.867
  251    H    SER  36           HN       SER  36  -0.430  10.955 -11.539
  252    HA   SER  36           HA       SER  36  -1.616   8.956 -13.291
  253   1HB   SER  36          HB2       SER  36   1.003  10.153 -13.987
  254   2HB   SER  36          HB1       SER  36  -0.429   9.908 -14.987
  255    HG   SER  36           HG       SER  36   0.364  12.113 -13.640
  256    H    GLN  37           HN       GLN  37  -0.327   8.274 -10.657
  257    HA   GLN  37           HA       GLN  37   1.263   6.065 -11.668
  258   1HB   GLN  37          HB2       GLN  37   3.062   6.511  -9.965
  259   2HB   GLN  37          HB1       GLN  37   3.017   7.640 -11.312
  260   1HG   GLN  37          HG2       GLN  37   2.614   9.381  -9.986
  261   2HG   GLN  37          HG1       GLN  37   1.408   8.504  -9.046
  262   1HE2  GLN  37          HE21      GLN  37   2.273   9.531  -7.179
  263   2HE2  GLN  37          HE22      GLN  37   3.719   8.940  -6.441
  264    HA   PRO  38           HA       PRO  38  -1.785   4.783  -8.428
  265   1HB   PRO  38          HB2       PRO  38  -1.049   2.215  -9.751
  266   2HB   PRO  38          HB1       PRO  38  -2.640   2.823  -9.282
  267   1HG   PRO  38          HG2       PRO  38  -1.881   2.845 -11.832
  268   2HG   PRO  38          HG1       PRO  38  -2.816   4.189 -11.149
  269   1HD   PRO  38          HD2       PRO  38   0.091   4.040 -11.806
  270   2HD   PRO  38          HD1       PRO  38  -1.028   5.411 -11.938
  271    H    ALA  39           HN       ALA  39  -1.515   3.448  -6.574
  272    HA   ALA  39           HA       ALA  39   0.986   2.080  -6.132
  273   1HB   ALA  39          HB1       ALA  39   0.396   4.714  -4.839
  274   2HB   ALA  39          HB2       ALA  39   1.894   4.139  -5.572
  275   3HB   ALA  39          HB3       ALA  39   1.377   3.505  -4.010
  276    H    VAL  40           HN       VAL  40   0.713   0.437  -4.749
  277    HA   VAL  40           HA       VAL  40  -1.869   0.196  -3.406
  278    HB   VAL  40           HB       VAL  40   0.313  -1.872  -3.725
  279   1HG1  VAL  40          HG11      VAL  40  -0.935  -3.300  -2.542
  280   2HG1  VAL  40          HG12      VAL  40  -2.427  -2.785  -3.329
  281   3HG1  VAL  40          HG13      VAL  40  -1.792  -1.873  -1.960
  282   1HG2  VAL  40          HG21      VAL  40  -1.684  -2.730  -5.313
  283   2HG2  VAL  40          HG22      VAL  40  -0.329  -1.758  -5.886
  284   3HG2  VAL  40          HG23      VAL  40  -1.868  -0.986  -5.500
  285    H    VAL  41           HN       VAL  41  -2.033   0.818  -1.361
  286    HA   VAL  41           HA       VAL  41   0.341   1.021   0.310
  287    HB   VAL  41           HB       VAL  41  -2.508   1.789   0.961
  288   1HG1  VAL  41          HG11      VAL  41  -1.416   3.206   2.691
  289   2HG1  VAL  41          HG12      VAL  41   0.115   2.419   2.307
  290   3HG1  VAL  41          HG13      VAL  41  -1.222   1.475   2.962
  291   1HG2  VAL  41          HG21      VAL  41  -1.850   4.074   0.440
  292   2HG2  VAL  41          HG22      VAL  41  -1.646   3.033  -0.969
  293   3HG2  VAL  41          HG23      VAL  41  -0.240   3.520  -0.021
  294    H    PHE  42           HN       PHE  42   0.413   0.138   2.461
  295    HA   PHE  42           HA       PHE  42  -1.417  -2.071   3.018
  296   1HB   PHE  42          HB2       PHE  42   1.491  -2.320   2.426
  297   2HB   PHE  42          HB1       PHE  42   0.836  -3.322   3.717
  298    HD1  PHE  42           HD1      PHE  42   1.635  -3.328   0.383
  299    HD2  PHE  42           HD2      PHE  42  -1.552  -4.413   2.987
  300    HE1  PHE  42           HE1      PHE  42   0.823  -4.939  -1.289
  301    HE2  PHE  42           HE2      PHE  42  -2.369  -6.027   1.320
  302    HZ   PHE  42           HZ       PHE  42  -1.181  -6.292  -0.821
  303    H    GLN  43           HN       GLN  43  -2.234  -1.069   4.812
  304    HA   GLN  43           HA       GLN  43  -0.700   0.300   6.743
  305   1HB   GLN  43          HB2       GLN  43  -3.481  -0.736   6.569
  306   2HB   GLN  43          HB1       GLN  43  -2.859  -0.378   8.174
  307   1HG   GLN  43          HG2       GLN  43  -2.166   1.889   7.083
  308   2HG   GLN  43          HG1       GLN  43  -3.396   1.461   5.894
  309   1HE2  GLN  43          HE21      GLN  43  -3.523   3.695   7.592
  310   2HE2  GLN  43          HE22      GLN  43  -4.872   3.492   8.652
  311    H    THR  44           HN       THR  44   0.636  -0.462   8.234
  312    HA   THR  44           HA       THR  44   0.688  -3.319   8.785
  313    HB   THR  44           HB       THR  44   2.645  -1.931  10.318
  314    HG1  THR  44           HG1      THR  44   3.709  -0.855   8.568
  315   1HG2  THR  44          HG21      THR  44   3.310  -3.196   7.711
  316   2HG2  THR  44          HG22      THR  44   2.688  -4.194   9.025
  317   3HG2  THR  44          HG23      THR  44   4.166  -3.260   9.251
  318    H    LYS  45           HN       LYS  45   0.933  -4.086  11.023
  319    HA   LYS  45           HA       LYS  45  -1.201  -3.282  12.640
  320   1HB   LYS  45          HB2       LYS  45   1.237  -4.964  13.175
  321   2HB   LYS  45          HB1       LYS  45   0.040  -4.655  14.425
  322   1HG   LYS  45          HG2       LYS  45  -1.677  -5.559  12.778
  323   2HG   LYS  45          HG1       LYS  45  -0.298  -6.148  11.847
  324   1HD   LYS  45          HD2       LYS  45   0.442  -7.165  14.139
  325   2HD   LYS  45          HD1       LYS  45  -1.265  -6.984  14.548
  326   1HE   LYS  45          HE2       LYS  45  -1.783  -8.232  12.418
  327   2HE   LYS  45          HE1       LYS  45  -0.060  -8.589  12.304
  328   1HZ   LYS  45          HZ1       LYS  45  -1.999  -9.503  14.335
  329   2HZ   LYS  45          HZ2       LYS  45  -0.338  -9.510  14.654
  330   3HZ   LYS  45          HZ3       LYS  45  -0.956 -10.427  13.375
  331    H    ARG  46           HN       ARG  46   2.261  -3.009  13.467
  332    HA   ARG  46           HA       ARG  46   1.629  -0.878  15.345
  333   1HB   ARG  46          HB2       ARG  46   4.191  -2.356  14.732
  334   2HB   ARG  46          HB1       ARG  46   4.079  -1.048  15.902
  335   1HG   ARG  46          HG2       ARG  46   3.369  -2.442  17.465
  336   2HG   ARG  46          HG1       ARG  46   2.042  -2.985  16.437
  337   1HD   ARG  46          HD2       ARG  46   3.114  -4.867  15.837
  338   2HD   ARG  46          HD1       ARG  46   4.671  -4.051  15.695
  339    HE   ARG  46           HE       ARG  46   4.278  -4.156  18.366
  340   1HH1  ARG  46          HH11      ARG  46   4.160  -6.570  15.849
  341   2HH1  ARG  46          HH12      ARG  46   4.662  -7.860  16.890
  342   1HH2  ARG  46          HH21      ARG  46   4.939  -5.851  19.736
  343   2HH2  ARG  46          HH22      ARG  46   5.104  -7.452  19.097
  344    H    SER  47           HN       SER  47   3.318  -1.360  12.301
  345    HA   SER  47           HA       SER  47   4.322   1.345  12.227
  346   1HB   SER  47          HB2       SER  47   4.541  -1.073  10.516
  347   2HB   SER  47          HB1       SER  47   4.712   0.486   9.708
  348    HG   SER  47           HG       SER  47   6.701  -0.428  10.541
  349    H    LYS  48           HN       LYS  48   3.857   2.738  10.304
  350    HA   LYS  48           HA       LYS  48   1.004   3.065  10.059
  351   1HB   LYS  48          HB2       LYS  48   3.142   4.665   8.654
  352   2HB   LYS  48          HB1       LYS  48   1.492   5.156   9.015
  353   1HG   LYS  48          HG2       LYS  48   2.085   5.950  10.996
  354   2HG   LYS  48          HG1       LYS  48   2.887   4.439  11.428
  355   1HD   LYS  48          HD2       LYS  48   4.936   5.197  10.817
  356   2HD   LYS  48          HD1       LYS  48   4.297   6.169   9.489
  357   1HE   LYS  48          HE2       LYS  48   3.690   7.927  10.928
  358   2HE   LYS  48          HE1       LYS  48   3.855   6.917  12.364
  359   1HZ   LYS  48          HZ1       LYS  48   5.892   8.326  10.842
  360   2HZ   LYS  48          HZ2       LYS  48   6.324   6.791  11.407
  361   3HZ   LYS  48          HZ3       LYS  48   5.819   7.982  12.498
  362    H    GLN  49           HN       GLN  49   0.764   4.138   7.500
  363    HA   GLN  49           HA       GLN  49   0.194   1.890   5.960
  364   1HB   GLN  49          HB2       GLN  49   0.463   4.809   5.348
  365   2HB   GLN  49          HB1       GLN  49   0.245   3.666   4.031
  366   1HG   GLN  49          HG2       GLN  49  -1.878   3.054   4.746
  367   2HG   GLN  49          HG1       GLN  49  -1.612   3.674   6.375
  368   1HE2  GLN  49          HE21      GLN  49  -3.722   4.206   4.356
  369   2HE2  GLN  49          HE22      GLN  49  -3.747   5.923   4.171
  370    H    VAL  50           HN       VAL  50   1.169   0.977   4.135
  371    HA   VAL  50           HA       VAL  50   4.012   1.641   3.740
  372    HB   VAL  50           HB       VAL  50   2.835  -1.144   3.760
  373   1HG1  VAL  50          HG11      VAL  50   4.703  -0.793   2.161
  374   2HG1  VAL  50          HG12      VAL  50   5.081  -1.938   3.448
  375   3HG1  VAL  50          HG13      VAL  50   5.717  -0.295   3.515
  376   1HG2  VAL  50          HG21      VAL  50   4.824  -0.003   5.705
  377   2HG2  VAL  50          HG22      VAL  50   3.924  -1.515   5.821
  378   3HG2  VAL  50          HG23      VAL  50   3.085   0.027   5.995
  379    H    CYS  51           HN       CYS  51   4.129   2.511   1.771
  380    HA   CYS  51           HA       CYS  51   2.320   1.721  -0.340
  381   1HB   CYS  51          HB2       CYS  51   4.510   3.771  -0.111
  382   2HB   CYS  51          HB1       CYS  51   3.774   3.395  -1.665
  383    H    ALA  52           HN       ALA  52   2.809   0.580  -2.167
  384    HA   ALA  52           HA       ALA  52   5.552  -0.366  -2.544
  385   1HB   ALA  52          HB1       ALA  52   4.949  -2.273  -1.485
  386   2HB   ALA  52          HB2       ALA  52   4.285  -2.667  -3.071
  387   3HB   ALA  52          HB3       ALA  52   3.231  -2.038  -1.805
  388    H    ASP  53           HN       ASP  53   6.135  -0.542  -4.638
  389    HA   ASP  53           HA       ASP  53   4.618   0.637  -6.656
  390   1HB   ASP  53          HB2       ASP  53   6.995  -1.215  -6.757
  391   2HB   ASP  53          HB1       ASP  53   6.287  -0.512  -8.209
  392    HA   PRO  54           HA       PRO  54   1.666  -2.753  -7.218
  393   1HB   PRO  54          HB2       PRO  54   0.864  -0.988  -9.470
  394   2HB   PRO  54          HB1       PRO  54  -0.126  -1.710  -8.198
  395   1HG   PRO  54          HG2       PRO  54   0.469   0.886  -8.150
  396   2HG   PRO  54          HG1       PRO  54   0.422  -0.068  -6.655
  397   1HD   PRO  54          HD2       PRO  54   2.782   0.879  -8.229
  398   2HD   PRO  54          HD1       PRO  54   2.568   0.774  -6.469
  399    H    SER  55           HN       SER  55   3.866  -1.347  -9.524
  400    HA   SER  55           HA       SER  55   3.412  -3.012 -11.725
  401   1HB   SER  55          HB2       SER  55   5.928  -1.628 -10.778
  402   2HB   SER  55          HB1       SER  55   5.801  -2.461 -12.327
  403    HG   SER  55           HG       SER  55   3.942  -1.026 -12.706
  404    H    GLU  56           HN       GLU  56   5.345  -3.487  -8.821
  405    HA   GLU  56           HA       GLU  56   6.754  -5.769  -9.626
  406   1HB   GLU  56          HB2       GLU  56   5.793  -5.123  -6.835
  407   2HB   GLU  56          HB1       GLU  56   7.126  -6.185  -7.265
  408   1HG   GLU  56          HG2       GLU  56   8.234  -4.184  -8.313
  409   2HG   GLU  56          HG1       GLU  56   6.976  -3.201  -7.563
  410    H    SER  57           HN       SER  57   6.422  -7.996  -8.755
  411    HA   SER  57           HA       SER  57   3.685  -8.812  -9.300
  412   1HB   SER  57          HB2       SER  57   6.277 -10.334  -9.037
  413   2HB   SER  57          HB1       SER  57   4.718 -11.138  -9.216
  414    HG   SER  57           HG       SER  57   5.986 -10.668 -11.198
  415    H    TRP  58           HN       TRP  58   6.059  -9.032  -6.681
  416    HA   TRP  58           HA       TRP  58   4.749 -10.723  -4.949
  417   1HB   TRP  58          HB2       TRP  58   6.057  -9.795  -3.190
  418   2HB   TRP  58          HB1       TRP  58   7.037  -9.695  -4.649
  419    HD1  TRP  58           HD1      TRP  58   5.975  -7.018  -5.889
  420    HE1  TRP  58           HE1      TRP  58   6.443  -4.770  -4.725
  421    HE3  TRP  58           HE3      TRP  58   6.878  -8.728  -1.159
  422    HZ2  TRP  58           HZ2      TRP  58   7.108  -3.846  -2.140
  423    HZ3  TRP  58           HZ3      TRP  58   7.422  -7.099   0.602
  424    HH2  TRP  58           HH2      TRP  58   7.535  -4.708   0.120
  425    H    VAL  59           HN       VAL  59   3.960  -7.429  -5.749
  426    HA   VAL  59           HA       VAL  59   2.327  -6.824  -3.532
  427    HB   VAL  59           HB       VAL  59   2.014  -5.778  -6.349
  428   1HG1  VAL  59          HG11      VAL  59   0.949  -4.956  -3.686
  429   2HG1  VAL  59          HG12      VAL  59   0.137  -5.027  -5.251
  430   3HG1  VAL  59          HG13      VAL  59   1.275  -3.724  -4.906
  431   1HG2  VAL  59          HG21      VAL  59   3.462  -3.924  -5.612
  432   2HG2  VAL  59          HG22      VAL  59   4.302  -5.475  -5.619
  433   3HG2  VAL  59          HG23      VAL  59   3.752  -4.777  -4.096
  434    H    GLN  60           HN       GLN  60   1.415  -7.903  -6.810
  435    HA   GLN  60           HA       GLN  60  -1.318  -8.217  -6.285
  436   1HB   GLN  60          HB2       GLN  60  -0.055  -8.222  -8.538
  437   2HB   GLN  60          HB1       GLN  60   0.179  -9.940  -8.244
  438   1HG   GLN  60          HG2       GLN  60  -2.397  -9.955  -7.898
  439   2HG   GLN  60          HG1       GLN  60  -2.337  -8.438  -8.795
  440   1HE2  GLN  60          HE21      GLN  60  -3.377 -11.203  -9.398
  441   2HE2  GLN  60          HE22      GLN  60  -2.691 -11.590 -10.936
  442    H    GLU  61           HN       GLU  61   1.409 -10.309  -5.680
  443    HA   GLU  61           HA       GLU  61   0.068 -12.739  -5.314
  444   1HB   GLU  61          HB2       GLU  61   2.666 -11.600  -4.411
  445   2HB   GLU  61          HB1       GLU  61   2.086 -13.048  -3.599
  446   1HG   GLU  61          HG2       GLU  61   2.076 -14.283  -5.623
  447   2HG   GLU  61          HG1       GLU  61   2.346 -12.829  -6.584
  448    H    TYR  62           HN       TYR  62   1.036 -10.318  -2.882
  449    HA   TYR  62           HA       TYR  62  -0.218 -11.597  -0.707
  450   1HB   TYR  62          HB2       TYR  62   0.541  -8.700  -1.122
  451   2HB   TYR  62          HB1       TYR  62  -0.016  -9.362   0.411
  452    HD1  TYR  62           HD1      TYR  62   1.407 -11.980   0.397
  453    HD2  TYR  62           HD2      TYR  62   2.750  -8.083  -0.657
  454    HE1  TYR  62           HE1      TYR  62   3.712 -12.630   0.955
  455    HE2  TYR  62           HE2      TYR  62   5.059  -8.723  -0.102
  456    HH   TYR  62           HH       TYR  62   6.287 -11.308  -0.032
  457    H    VAL  63           HN       VAL  63  -1.341  -9.176  -3.009
  458    HA   VAL  63           HA       VAL  63  -3.740  -8.473  -1.749
  459    HB   VAL  63           HB       VAL  63  -3.283  -8.622  -4.730
  460   1HG1  VAL  63          HG11      VAL  63  -5.472  -8.070  -4.655
  461   2HG1  VAL  63          HG12      VAL  63  -4.829  -6.459  -4.335
  462   3HG1  VAL  63          HG13      VAL  63  -5.376  -7.472  -2.999
  463   1HG2  VAL  63          HG21      VAL  63  -2.944  -6.029  -3.425
  464   2HG2  VAL  63          HG22      VAL  63  -1.963  -6.813  -4.663
  465   3HG2  VAL  63          HG23      VAL  63  -1.728  -7.220  -2.964
  466    H    TYR  64           HN       TYR  64  -2.875 -11.245  -3.692
  467    HA   TYR  64           HA       TYR  64  -5.624 -12.134  -3.945
  468   1HB   TYR  64          HB2       TYR  64  -3.543 -12.485  -5.577
  469   2HB   TYR  64          HB1       TYR  64  -3.341 -13.933  -4.598
  470    HD1  TYR  64           HD1      TYR  64  -5.771 -15.143  -4.166
  471    HD2  TYR  64           HD2      TYR  64  -4.675 -12.808  -7.550
  472    HE1  TYR  64           HE1      TYR  64  -7.485 -16.290  -5.505
  473    HE2  TYR  64           HE2      TYR  64  -6.386 -13.948  -8.898
  474    HH   TYR  64           HH       TYR  64  -7.773 -16.759  -8.116
  475    H    ASP  65           HN       ASP  65  -2.745 -12.925  -2.083
  476    HA   ASP  65           HA       ASP  65  -3.710 -15.305  -0.913
  477   1HB   ASP  65          HB2       ASP  65  -1.611 -13.322  -0.031
  478   2HB   ASP  65          HB1       ASP  65  -1.954 -14.805   0.855
  479    H    LEU  66           HN       LEU  66  -4.088 -11.922  -0.093
  480    HA   LEU  66           HA       LEU  66  -5.028 -12.194   2.531
  481   1HB   LEU  66          HB2       LEU  66  -5.538 -10.128   0.404
  482   2HB   LEU  66          HB1       LEU  66  -6.229  -9.998   2.010
  483    HG   LEU  66           HG       LEU  66  -3.263 -10.233   1.539
  484   1HD1  LEU  66          HD11      LEU  66  -4.445  -7.616   2.229
  485   2HD1  LEU  66          HD12      LEU  66  -4.654  -8.162   0.565
  486   3HD1  LEU  66          HD13      LEU  66  -3.034  -8.005   1.244
  487   1HD2  LEU  66          HD21      LEU  66  -4.594  -8.946   3.881
  488   2HD2  LEU  66          HD22      LEU  66  -3.009  -9.711   3.768
  489   3HD2  LEU  66          HD23      LEU  66  -4.467 -10.703   3.803
  490    H    GLU  67           HN       GLU  67  -6.729 -12.298  -0.567
  491    HA   GLU  67           HA       GLU  67  -9.330 -12.512   0.581
  492   1HB   GLU  67          HB2       GLU  67  -8.274 -13.112  -2.183
  493   2HB   GLU  67          HB1       GLU  67  -9.972 -13.251  -1.749
  494   1HG   GLU  67          HG2       GLU  67 -10.295 -11.029  -1.754
  495   2HG   GLU  67          HG1       GLU  67  -8.704 -10.687  -1.075
  496    H    LEU  68           HN       LEU  68  -6.848 -14.789  -0.346
  497    HA   LEU  68           HA       LEU  68  -8.557 -17.095  -0.152
  498   1HB   LEU  68          HB2       LEU  68  -5.544 -16.924  -0.219
  499   2HB   LEU  68          HB1       LEU  68  -6.495 -18.382  -0.430
  500    HG   LEU  68           HG       LEU  68  -6.704 -16.022  -2.290
  501   1HD1  LEU  68          HD11      LEU  68  -4.384 -17.071  -2.132
  502   2HD1  LEU  68          HD12      LEU  68  -5.129 -16.985  -3.728
  503   3HD1  LEU  68          HD13      LEU  68  -5.119 -18.509  -2.841
  504   1HD2  LEU  68          HD21      LEU  68  -7.866 -18.735  -2.139
  505   2HD2  LEU  68          HD22      LEU  68  -7.367 -18.173  -3.735
  506   3HD2  LEU  68          HD23      LEU  68  -8.539 -17.245  -2.800
  507    H    ASN  69           HN       ASN  69  -8.646 -18.604   1.491
  508    HA   ASN  69           HA       ASN  69  -7.036 -18.307   3.866
  509   1HB   ASN  69          HB2       ASN  69  -8.859 -16.619   4.166
  510   2HB   ASN  69          HB1       ASN  69 -10.029 -17.933   4.089
  511   1HD2  ASN  69          HD21      ASN  69  -6.918 -17.422   5.725
  512   2HD2  ASN  69          HD22      ASN  69  -7.482 -17.861   7.298


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