NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_dress stage position program type
4692 1fjk 4907 cing dress 1-original 2 MR format nomenclature mapping


  Entry H atom name         Submitted Coord H atom name
    1   1H    MET   1          HT1       MET   1 -21.090  20.287 -20.339
    2   2H    MET   1          HT2       MET   1 -21.841  21.266 -19.173
    3   3H    MET   1          HT3       MET   1 -22.299  19.639 -19.340
    4    HA   MET   1           HA       MET   1 -20.785  20.210 -17.399
    5   1HB   MET   1          HB2       MET   1 -19.583  18.057 -17.821
    6   2HB   MET   1          HB1       MET   1 -21.298  17.966 -18.171
    7   1HG   MET   1          HG2       MET   1 -20.844  18.334 -20.563
    8   2HG   MET   1          HG1       MET   1 -19.127  18.408 -20.199
    9   1HE   MET   1          HE1       MET   1 -19.147  15.101 -21.978
   10   2HE   MET   1          HE2       MET   1 -18.941  16.849 -22.058
   11   3HE   MET   1          HE3       MET   1 -20.533  16.144 -22.325
   12    H    ASP   2           HN       ASP   2 -18.831  20.967 -16.831
   13    HA   ASP   2           HA       ASP   2 -16.553  21.125 -18.662
   14   1HB   ASP   2          HB2       ASP   2 -16.538  23.608 -18.700
   15   2HB   ASP   2          HB1       ASP   2 -18.001  22.964 -19.446
   16    H    LYS   3           HN       LYS   3 -18.051  22.296 -15.653
   17    HA   LYS   3           HA       LYS   3 -15.354  22.254 -14.357
   18   1HB   LYS   3          HB2       LYS   3 -16.381  23.815 -12.751
   19   2HB   LYS   3          HB1       LYS   3 -16.620  24.400 -14.398
   20   1HG   LYS   3          HG2       LYS   3 -18.893  23.441 -14.417
   21   2HG   LYS   3          HG1       LYS   3 -18.657  22.849 -12.773
   22   1HD   LYS   3          HD2       LYS   3 -18.357  25.153 -11.972
   23   2HD   LYS   3          HD1       LYS   3 -18.547  25.760 -13.618
   24   1HE   LYS   3          HE2       LYS   3 -20.841  24.825 -13.701
   25   2HE   LYS   3          HE1       LYS   3 -20.655  24.244 -12.035
   26   1HZ   LYS   3          HZ1       LYS   3 -20.439  26.403 -11.222
   27   2HZ   LYS   3          HZ2       LYS   3 -21.686  26.545 -12.367
   28   3HZ   LYS   3          HZ3       LYS   3 -20.114  27.061 -12.751
   29    H    VAL   4           HN       VAL   4 -18.705  21.131 -14.079
   30    HA   VAL   4           HA       VAL   4 -18.430  19.843 -11.528
   31    HB   VAL   4           HB       VAL   4 -20.566  20.366 -12.647
   32   1HG1  VAL   4          HG11      VAL   4 -19.287  19.277 -14.884
   33   2HG1  VAL   4          HG12      VAL   4 -20.969  19.799 -14.794
   34   3HG1  VAL   4          HG13      VAL   4 -20.552  18.112 -14.491
   35   1HG2  VAL   4          HG21      VAL   4 -20.390  17.359 -12.510
   36   2HG2  VAL   4          HG22      VAL   4 -21.711  18.410 -12.001
   37   3HG2  VAL   4          HG23      VAL   4 -20.225  18.340 -11.054
   38    H    GLN   5           HN       GLN   5 -17.059  19.094 -14.599
   39    HA   GLN   5           HA       GLN   5 -16.976  16.225 -14.299
   40   1HB   GLN   5          HB2       GLN   5 -15.483  16.367 -16.249
   41   2HB   GLN   5          HB1       GLN   5 -16.875  17.424 -16.466
   42   1HG   GLN   5          HG2       GLN   5 -15.497  19.346 -15.670
   43   2HG   GLN   5          HG1       GLN   5 -14.110  18.271 -15.553
   44   1HE2  GLN   5          HE21      GLN   5 -15.801  17.152 -18.235
   45   2HE2  GLN   5          HE22      GLN   5 -15.014  18.060 -19.428
   46    H    TYR   6           HN       TYR   6 -14.522  18.807 -13.731
   47    HA   TYR   6           HA       TYR   6 -12.711  16.771 -12.653
   48   1HB   TYR   6          HB2       TYR   6 -11.060  18.468 -12.671
   49   2HB   TYR   6          HB1       TYR   6 -12.045  18.803 -14.086
   50    HD1  TYR   6           HD1      TYR   6 -13.974  20.590 -13.783
   51    HD2  TYR   6           HD2      TYR   6 -10.671  20.095 -11.077
   52    HE1  TYR   6           HE1      TYR   6 -14.342  22.880 -12.897
   53    HE2  TYR   6           HE2      TYR   6 -11.044  22.382 -10.203
   54    HH   TYR   6           HH       TYR   6 -12.199  24.605 -11.310
   55    H    LEU   7           HN       LEU   7 -14.814  19.363 -11.480
   56    HA   LEU   7           HA       LEU   7 -13.960  19.444  -8.768
   57   1HB   LEU   7          HB2       LEU   7 -16.688  19.731 -10.063
   58   2HB   LEU   7          HB1       LEU   7 -16.346  20.180  -8.392
   59    HG   LEU   7           HG       LEU   7 -14.962  21.316 -10.831
   60   1HD1  LEU   7          HD11      LEU   7 -16.700  22.746 -10.924
   61   2HD1  LEU   7          HD12      LEU   7 -16.285  23.297  -9.301
   62   3HD1  LEU   7          HD13      LEU   7 -17.438  21.980  -9.517
   63   1HD2  LEU   7          HD21      LEU   7 -14.234  22.990  -8.948
   64   2HD2  LEU   7          HD22      LEU   7 -13.372  21.461  -9.124
   65   3HD2  LEU   7          HD23      LEU   7 -14.598  21.643  -7.869
   66    H    THR   8           HN       THR   8 -16.241  17.253 -10.428
   67    HA   THR   8           HA       THR   8 -17.029  15.814  -8.057
   68    HB   THR   8           HB       THR   8 -17.020  15.047 -10.989
   69    HG1  THR   8           HG1      THR   8 -19.162  15.852 -10.879
   70   1HG2  THR   8          HG21      THR   8 -17.474  13.356  -8.943
   71   2HG2  THR   8          HG22      THR   8 -18.352  13.256 -10.469
   72   3HG2  THR   8          HG23      THR   8 -19.081  14.069  -9.085
   73    H    ARG   9           HN       ARG   9 -14.584  15.232 -10.583
   74    HA   ARG   9           HA       ARG   9 -13.686  12.674  -9.865
   75   1HB   ARG   9          HB2       ARG   9 -12.976  13.941 -11.830
   76   2HB   ARG   9          HB1       ARG   9 -12.169  15.103 -10.788
   77   1HG   ARG   9          HG2       ARG   9 -10.652  13.350  -9.967
   78   2HG   ARG   9          HG1       ARG   9 -11.466  12.167 -10.992
   79   1HD   ARG   9          HD2       ARG   9 -10.809  13.437 -13.007
   80   2HD   ARG   9          HD1       ARG   9 -10.001  14.641 -11.985
   81    HE   ARG   9           HE       ARG   9  -8.887  12.098 -12.696
   82   1HH1  ARG   9          HH21      ARG   9  -7.204  14.294 -11.664
   83   2HH1  ARG   9          HH22      ARG   9  -6.748  13.727 -10.092
   84   1HH2  ARG   9          HH11      ARG   9  -9.235  11.315  -9.950
   85   2HH2  ARG   9          HH12      ARG   9  -7.898  12.041  -9.122
   86    H    SER  10           HN       SER  10 -12.739  15.819  -8.509
   87    HA   SER  10           HA       SER  10 -10.946  14.577  -6.557
   88   1HB   SER  10          HB2       SER  10 -10.611  16.951  -5.909
   89   2HB   SER  10          HB1       SER  10 -10.446  16.722  -7.648
   90    HG   SER  10           HG       SER  10 -11.799  18.436  -7.387
   91    H    ALA  11           HN       ALA  11 -14.299  15.167  -6.735
   92    HA   ALA  11           HA       ALA  11 -14.756  15.842  -3.949
   93   1HB   ALA  11          HB1       ALA  11 -17.139  15.326  -4.682
   94   2HB   ALA  11          HB2       ALA  11 -16.470  14.907  -6.259
   95   3HB   ALA  11          HB3       ALA  11 -16.306  16.550  -5.641
   96    H    ILE  12           HN       ILE  12 -14.638  12.844  -5.830
   97    HA   ILE  12           HA       ILE  12 -15.358  11.335  -3.381
   98    HB   ILE  12           HB       ILE  12 -15.547  10.666  -6.303
   99   1HG1  ILE  12          HG12      ILE  12 -18.004  10.471  -5.728
  100   2HG1  ILE  12          HG11      ILE  12 -17.620  11.155  -4.151
  101   1HG2  ILE  12          HG21      ILE  12 -15.952   8.975  -3.847
  102   2HG2  ILE  12          HG22      ILE  12 -15.030   8.594  -5.302
  103   3HG2  ILE  12          HG23      ILE  12 -16.793   8.606  -5.353
  104   1HD1  ILE  12          HD11      ILE  12 -18.342  12.655  -6.296
  105   2HD1  ILE  12          HD12      ILE  12 -16.588  12.665  -6.484
  106   3HD1  ILE  12          HD13      ILE  12 -17.318  13.257  -4.992
  107    H    ARG  13           HN       ARG  13 -13.050  11.441  -6.089
  108    HA   ARG  13           HA       ARG  13 -11.517   9.158  -5.293
  109   1HB   ARG  13          HB2       ARG  13 -10.722  11.672  -6.799
  110   2HB   ARG  13          HB1       ARG  13  -9.847  10.142  -6.830
  111   1HG   ARG  13          HG2       ARG  13 -12.705  10.550  -7.763
  112   2HG   ARG  13          HG1       ARG  13 -11.305  10.348  -8.802
  113   1HD   ARG  13          HD2       ARG  13 -10.897   8.107  -7.835
  114   2HD   ARG  13          HD1       ARG  13 -12.343   8.312  -6.839
  115    HE   ARG  13           HE       ARG  13 -13.594   7.750  -8.750
  116   1HH1  ARG  13          HH11      ARG  13 -10.786   7.164 -10.049
  117   2HH1  ARG  13          HH12      ARG  13 -10.991   7.998 -11.553
  118   1HH2  ARG  13          HH21      ARG  13 -13.799   9.743 -10.509
  119   2HH2  ARG  13          HH22      ARG  13 -12.699   9.452 -11.816
  120    H    ARG  14           HN       ARG  14 -11.061  12.643  -4.604
  121    HA   ARG  14           HA       ARG  14  -8.841  11.994  -2.786
  122   1HB   ARG  14          HB2       ARG  14 -10.156  14.609  -3.590
  123   2HB   ARG  14          HB1       ARG  14  -8.650  14.450  -2.691
  124   1HG   ARG  14          HG2       ARG  14  -7.590  13.313  -4.568
  125   2HG   ARG  14          HG1       ARG  14  -9.111  13.289  -5.453
  126   1HD   ARG  14          HD2       ARG  14  -7.904  15.113  -6.399
  127   2HD   ARG  14          HD1       ARG  14  -9.026  15.885  -5.267
  128    HE   ARG  14           HE       ARG  14  -6.151  15.875  -5.015
  129   1HH1  ARG  14          HH11      ARG  14  -8.419  17.618  -3.717
  130   2HH1  ARG  14          HH12      ARG  14  -8.041  17.367  -2.045
  131   1HH2  ARG  14          HH21      ARG  14  -5.942  14.673  -2.652
  132   2HH2  ARG  14          HH22      ARG  14  -6.634  15.702  -1.442
  133    H    ALA  15           HN       ALA  15 -11.705  11.229  -2.190
  134    HA   ALA  15           HA       ALA  15 -11.807  12.374   0.528
  135   1HB   ALA  15          HB1       ALA  15 -13.423  13.198  -1.638
  136   2HB   ALA  15          HB2       ALA  15 -13.644  13.609   0.063
  137   3HB   ALA  15          HB3       ALA  15 -14.457  12.199  -0.617
  138    H    SER  16           HN       SER  16 -13.122  10.028  -1.799
  139    HA   SER  16           HA       SER  16 -13.996   8.275   0.394
  140   1HB   SER  16          HB2       SER  16 -14.326   8.263  -2.581
  141   2HB   SER  16          HB1       SER  16 -14.982   7.023  -1.535
  142    HG   SER  16           HG       SER  16 -16.492   8.703  -1.974
  143    H    THR  17           HN       THR  17 -11.166   8.721  -1.239
  144    HA   THR  17           HA       THR  17 -10.471   5.831  -1.074
  145    HB   THR  17           HB       THR  17  -9.469   7.976  -2.968
  146    HG1  THR  17           HG1      THR  17 -11.577   7.294  -3.425
  147   1HG2  THR  17          HG21      THR  17  -8.743   5.615  -4.075
  148   2HG2  THR  17          HG22      THR  17  -8.619   5.199  -2.366
  149   3HG2  THR  17          HG23      THR  17  -7.686   6.548  -3.015
  150    H    ILE  18           HN       ILE  18  -9.763   8.995   0.035
  151    HA   ILE  18           HA       ILE  18  -7.072   8.153   0.958
  152    HB   ILE  18           HB       ILE  18  -7.228  10.172  -0.465
  153   1HG1  ILE  18          HG12      ILE  18  -6.051  11.719   1.061
  154   2HG1  ILE  18          HG11      ILE  18  -6.619  10.786   2.446
  155   1HG2  ILE  18          HG21      ILE  18  -8.452  11.930   1.467
  156   2HG2  ILE  18          HG22      ILE  18  -9.560  10.615   1.074
  157   3HG2  ILE  18          HG23      ILE  18  -8.914  11.638  -0.208
  158   1HD1  ILE  18          HD11      ILE  18  -5.279   8.934   1.910
  159   2HD1  ILE  18          HD12      ILE  18  -4.233  10.298   1.517
  160   3HD1  ILE  18          HD13      ILE  18  -5.085   9.442   0.232
  161    H    GLU  19           HN       GLU  19 -10.295   8.962   1.978
  162    HA   GLU  19           HA       GLU  19  -9.421   9.289   4.787
  163   1HB   GLU  19          HB2       GLU  19 -12.029   9.748   3.372
  164   2HB   GLU  19          HB1       GLU  19 -11.751  10.099   5.073
  165   1HG   GLU  19          HG2       GLU  19 -10.254  11.330   2.739
  166   2HG   GLU  19          HG1       GLU  19 -11.482  12.137   3.714
  167    H    MET  20           HN       MET  20 -10.952   7.047   2.638
  168    HA   MET  20           HA       MET  20 -11.346   5.170   4.919
  169   1HB   MET  20          HB2       MET  20 -13.618   4.661   4.020
  170   2HB   MET  20          HB1       MET  20 -13.471   6.336   4.551
  171   1HG   MET  20          HG2       MET  20 -13.051   7.045   2.229
  172   2HG   MET  20          HG1       MET  20 -13.188   5.372   1.689
  173   1HE   MET  20          HE1       MET  20 -14.840   3.957   2.685
  174   2HE   MET  20          HE2       MET  20 -16.388   4.175   1.873
  175   3HE   MET  20          HE3       MET  20 -16.256   4.487   3.603
  176    HA   PRO  21           HA       PRO  21  -9.669   3.408   0.867
  177   1HB   PRO  21          HB2       PRO  21  -7.132   2.836   1.729
  178   2HB   PRO  21          HB1       PRO  21  -7.568   4.376   0.976
  179   1HG   PRO  21          HG2       PRO  21  -7.202   3.723   3.834
  180   2HG   PRO  21          HG1       PRO  21  -6.740   5.179   2.949
  181   1HD   PRO  21          HD2       PRO  21  -8.940   5.039   4.551
  182   2HD   PRO  21          HD1       PRO  21  -8.824   6.115   3.140
  183    H    GLN  22           HN       GLN  22  -9.376   2.557   4.274
  184    HA   GLN  22           HA       GLN  22  -9.097  -0.318   3.728
  185   1HB   GLN  22          HB2       GLN  22  -9.537   1.286   6.236
  186   2HB   GLN  22          HB1       GLN  22  -9.116  -0.421   6.200
  187   1HG   GLN  22          HG2       GLN  22  -7.020   0.125   5.016
  188   2HG   GLN  22          HG1       GLN  22  -7.441   1.835   5.059
  189   1HE2  GLN  22          HE21      GLN  22  -8.563   0.605   7.989
  190   2HE2  GLN  22          HE22      GLN  22  -7.193   0.910   8.935
  191    H    GLN  23           HN       GLN  23 -11.617   1.963   4.677
  192    HA   GLN  23           HA       GLN  23 -13.584  -0.114   5.219
  193   1HB   GLN  23          HB2       GLN  23 -13.540   2.024   6.410
  194   2HB   GLN  23          HB1       GLN  23 -13.749   2.870   4.885
  195   1HG   GLN  23          HG2       GLN  23 -15.903   2.725   6.026
  196   2HG   GLN  23          HG1       GLN  23 -15.938   1.727   4.573
  197   1HE2  GLN  23          HE21      GLN  23 -16.745   1.672   7.821
  198   2HE2  GLN  23          HE22      GLN  23 -16.714  -0.005   8.079
  199    H    ALA  24           HN       ALA  24 -13.099   2.361   2.695
  200    HA   ALA  24           HA       ALA  24 -15.295   1.784   1.034
  201   1HB   ALA  24          HB1       ALA  24 -13.711   2.651  -0.765
  202   2HB   ALA  24          HB2       ALA  24 -12.441   2.631   0.458
  203   3HB   ALA  24          HB3       ALA  24 -13.847   3.677   0.663
  204    H    ARG  25           HN       ARG  25 -12.063   0.248   1.074
  205    HA   ARG  25           HA       ARG  25 -12.416  -1.512  -1.115
  206   1HB   ARG  25          HB2       ARG  25 -10.298  -1.052   0.029
  207   2HB   ARG  25          HB1       ARG  25 -10.912  -1.851   1.468
  208   1HG   ARG  25          HG2       ARG  25 -11.115  -3.968   0.252
  209   2HG   ARG  25          HG1       ARG  25 -10.560  -3.182  -1.226
  210   1HD   ARG  25          HD2       ARG  25  -8.931  -3.391   1.335
  211   2HD   ARG  25          HD1       ARG  25  -8.698  -4.396  -0.110
  212    HE   ARG  25           HE       ARG  25  -8.718  -1.665  -0.920
  213   1HH1  ARG  25          HH21      ARG  25  -7.035  -1.196   1.431
  214   2HH1  ARG  25          HH22      ARG  25  -5.448  -1.608   0.876
  215   1HH2  ARG  25          HH11      ARG  25  -6.583  -3.377  -1.882
  216   2HH2  ARG  25          HH12      ARG  25  -5.191  -2.842  -1.000
  217    H    GLN  26           HN       GLN  26 -13.143  -1.993   2.340
  218    HA   GLN  26           HA       GLN  26 -14.161  -4.662   2.055
  219   1HB   GLN  26          HB2       GLN  26 -14.633  -2.515   4.110
  220   2HB   GLN  26          HB1       GLN  26 -14.967  -4.227   4.348
  221   1HG   GLN  26          HG2       GLN  26 -12.254  -3.038   3.721
  222   2HG   GLN  26          HG1       GLN  26 -12.776  -3.589   5.314
  223   1HE2  GLN  26          HE21      GLN  26 -11.026  -4.590   2.654
  224   2HE2  GLN  26          HE22      GLN  26 -11.214  -6.269   2.817
  225    H    ASN  27           HN       ASN  27 -15.726  -1.476   2.276
  226    HA   ASN  27           HA       ASN  27 -18.427  -2.316   2.181
  227   1HB   ASN  27          HB2       ASN  27 -17.627  -0.059   2.724
  228   2HB   ASN  27          HB1       ASN  27 -17.101   0.138   1.058
  229   1HD2  ASN  27          HD21      ASN  27 -18.582   1.326  -0.147
  230   2HD2  ASN  27          HD22      ASN  27 -20.265   1.287   0.066
  231    H    LEU  28           HN       LEU  28 -16.173  -1.578  -0.484
  232    HA   LEU  28           HA       LEU  28 -17.895  -1.734  -2.686
  233   1HB   LEU  28          HB2       LEU  28 -15.513  -1.146  -2.738
  234   2HB   LEU  28          HB1       LEU  28 -15.106  -2.813  -2.360
  235    HG   LEU  28           HG       LEU  28 -16.196  -3.563  -4.442
  236   1HD1  LEU  28          HD11      LEU  28 -17.271  -0.899  -4.332
  237   2HD1  LEU  28          HD12      LEU  28 -17.702  -2.213  -5.427
  238   3HD1  LEU  28          HD13      LEU  28 -16.397  -1.104  -5.850
  239   1HD2  LEU  28          HD21      LEU  28 -13.744  -2.390  -4.196
  240   2HD2  LEU  28          HD22      LEU  28 -14.456  -1.404  -5.474
  241   3HD2  LEU  28          HD23      LEU  28 -14.324  -3.151  -5.678
  242    H    GLN  29           HN       GLN  29 -16.794  -4.294  -0.590
  243    HA   GLN  29           HA       GLN  29 -17.151  -6.583  -2.182
  244   1HB   GLN  29          HB2       GLN  29 -17.756  -6.069   0.718
  245   2HB   GLN  29          HB1       GLN  29 -17.596  -7.673   0.017
  246   1HG   GLN  29          HG2       GLN  29 -15.288  -7.151  -0.663
  247   2HG   GLN  29          HG1       GLN  29 -15.444  -5.534   0.015
  248   1HE2  GLN  29          HE21      GLN  29 -17.174  -7.506   2.126
  249   2HE2  GLN  29          HE22      GLN  29 -15.932  -7.861   3.221
  250    H    ASN  30           HN       ASN  30 -19.569  -4.492  -0.702
  251    HA   ASN  30           HA       ASN  30 -21.832  -6.191  -0.821
  252   1HB   ASN  30          HB2       ASN  30 -21.536  -3.224  -1.194
  253   2HB   ASN  30          HB1       ASN  30 -23.061  -4.027  -0.861
  254   1HD2  ASN  30          HD21      ASN  30 -20.805  -5.802   0.881
  255   2HD2  ASN  30          HD22      ASN  30 -20.889  -4.964   2.349
  256    H    LEU  31           HN       LEU  31 -20.223  -4.331  -3.347
  257    HA   LEU  31           HA       LEU  31 -22.281  -4.409  -5.314
  258   1HB   LEU  31          HB2       LEU  31 -20.290  -2.978  -5.380
  259   2HB   LEU  31          HB1       LEU  31 -19.284  -4.408  -5.561
  260    HG   LEU  31           HG       LEU  31 -20.414  -4.953  -7.684
  261   1HD1  LEU  31          HD21      LEU  31 -21.929  -2.398  -7.082
  262   2HD1  LEU  31          HD22      LEU  31 -22.604  -4.017  -7.270
  263   3HD1  LEU  31          HD23      LEU  31 -21.919  -3.179  -8.663
  264   1HD2  LEU  31          HD11      LEU  31 -18.403  -3.377  -7.540
  265   2HD2  LEU  31          HD12      LEU  31 -19.551  -2.054  -7.737
  266   3HD2  LEU  31          HD13      LEU  31 -19.370  -3.261  -9.010
  267    H    PHE  32           HN       PHE  32 -19.917  -6.789  -4.286
  268    HA   PHE  32           HA       PHE  32 -20.177  -8.536  -6.557
  269   1HB   PHE  32          HB2       PHE  32 -18.225  -8.461  -5.072
  270   2HB   PHE  32          HB1       PHE  32 -19.228  -8.966  -3.712
  271    HD1  PHE  32           HD1      PHE  32 -18.668 -10.082  -7.261
  272    HD2  PHE  32           HD2      PHE  32 -19.028 -11.200  -3.130
  273    HE1  PHE  32           HE1      PHE  32 -18.312 -12.459  -7.873
  274    HE2  PHE  32           HE2      PHE  32 -18.672 -13.576  -3.742
  275    HZ   PHE  32           HZ       PHE  32 -18.314 -14.205  -6.113
  276    H    ILE  33           HN       ILE  33 -21.410  -8.779  -3.197
  277    HA   ILE  33           HA       ILE  33 -22.981 -11.126  -3.617
  278    HB   ILE  33           HB       ILE  33 -22.202 -10.126  -1.458
  279   1HG1  ILE  33          HG12      ILE  33 -24.090 -11.781  -1.525
  280   2HG1  ILE  33          HG11      ILE  33 -24.169 -10.684  -0.153
  281   1HG2  ILE  33          HG21      ILE  33 -23.511  -8.261  -0.494
  282   2HG2  ILE  33          HG22      ILE  33 -24.395  -8.114  -2.012
  283   3HG2  ILE  33          HG23      ILE  33 -22.663  -7.784  -1.964
  284   1HD1  ILE  33          HD11      ILE  33 -26.012 -10.976  -2.438
  285   2HD1  ILE  33          HD12      ILE  33 -25.631  -9.307  -2.021
  286   3HD1  ILE  33          HD13      ILE  33 -26.324 -10.381  -0.809
  287    H    ASN  34           HN       ASN  34 -23.777  -7.667  -3.996
  288    HA   ASN  34           HA       ASN  34 -26.589  -7.979  -4.389
  289   1HB   ASN  34          HB2       ASN  34 -25.361  -5.866  -3.922
  290   2HB   ASN  34          HB1       ASN  34 -24.637  -5.951  -5.524
  291   1HD2  ASN  34          HD21      ASN  34 -27.844  -7.125  -5.748
  292   2HD2  ASN  34          HD22      ASN  34 -28.576  -5.685  -6.251
  293    H    PHE  35           HN       PHE  35 -23.982  -7.603  -6.826
  294    HA   PHE  35           HA       PHE  35 -25.601  -8.049  -9.117
  295   1HB   PHE  35          HB2       PHE  35 -23.314  -7.127  -9.119
  296   2HB   PHE  35          HB1       PHE  35 -22.679  -8.681  -8.578
  297    HD1  PHE  35           HD1      PHE  35 -25.055  -7.476 -11.230
  298    HD2  PHE  35           HD2      PHE  35 -21.693  -9.962 -10.246
  299    HE1  PHE  35           HE1      PHE  35 -24.937  -8.248 -13.584
  300    HE2  PHE  35           HE2      PHE  35 -21.574 -10.735 -12.600
  301    HZ   PHE  35           HZ       PHE  35 -23.197  -9.878 -14.269
  302    H    CYS  36           HN       CYS  36 -23.671 -10.372  -7.189
  303    HA   CYS  36           HA       CYS  36 -24.240 -12.700  -8.712
  304   1HB   CYS  36          HB2       CYS  36 -22.538 -12.515  -6.939
  305   2HB   CYS  36          HB1       CYS  36 -23.805 -12.312  -5.731
  306    HG   CYS  36           HG       CYS  36 -24.586 -14.774  -6.231
  307    H    LEU  37           HN       LEU  37 -26.025 -11.151  -6.056
  308    HA   LEU  37           HA       LEU  37 -28.050 -13.137  -5.725
  309   1HB   LEU  37          HB2       LEU  37 -27.415 -11.204  -4.219
  310   2HB   LEU  37          HB1       LEU  37 -28.195 -10.122  -5.366
  311    HG   LEU  37           HG       LEU  37 -29.663 -10.705  -3.440
  312   1HD1  LEU  37          HD21      LEU  37 -30.405 -10.413  -5.995
  313   2HD1  LEU  37          HD22      LEU  37 -31.568 -10.771  -4.719
  314   3HD1  LEU  37          HD23      LEU  37 -30.960 -12.068  -5.748
  315   1HD2  LEU  37          HD11      LEU  37 -29.861 -12.814  -2.710
  316   2HD2  LEU  37          HD12      LEU  37 -28.649 -13.289  -3.899
  317   3HD2  LEU  37          HD13      LEU  37 -30.364 -13.366  -4.307
  318    H    ILE  38           HN       ILE  38 -28.141 -10.034  -7.516
  319    HA   ILE  38           HA       ILE  38 -30.673 -10.542  -8.792
  320    HB   ILE  38           HB       ILE  38 -29.598  -8.324  -8.431
  321   1HG1  ILE  38          HG12      ILE  38 -30.101  -7.398 -10.673
  322   2HG1  ILE  38          HG11      ILE  38 -30.071  -9.028 -11.346
  323   1HG2  ILE  38          HG21      ILE  38 -27.691  -9.283 -10.583
  324   2HG2  ILE  38          HG22      ILE  38 -27.280  -8.987  -8.895
  325   3HG2  ILE  38          HG23      ILE  38 -27.754  -7.645  -9.934
  326   1HD1  ILE  38          HD11      ILE  38 -31.811  -8.933  -9.037
  327   2HD1  ILE  38          HD12      ILE  38 -32.192  -9.401 -10.694
  328   3HD1  ILE  38          HD13      ILE  38 -32.286  -7.707 -10.212
  329    H    LEU  39           HN       LEU  39 -27.401 -11.501  -9.554
  330    HA   LEU  39           HA       LEU  39 -27.869 -12.047 -12.353
  331   1HB   LEU  39          HB2       LEU  39 -25.704 -11.394 -11.527
  332   2HB   LEU  39          HB1       LEU  39 -25.711 -12.697 -10.338
  333    HG   LEU  39           HG       LEU  39 -25.726 -14.344 -12.153
  334   1HD1  LEU  39          HD11      LEU  39 -26.269 -11.957 -13.729
  335   2HD1  LEU  39          HD12      LEU  39 -26.488 -13.653 -14.163
  336   3HD1  LEU  39          HD13      LEU  39 -24.920 -12.879 -14.392
  337   1HD2  LEU  39          HD21      LEU  39 -23.426 -14.159 -12.679
  338   2HD2  LEU  39          HD22      LEU  39 -23.592 -13.260 -11.170
  339   3HD2  LEU  39          HD23      LEU  39 -23.490 -12.397 -12.705
  340    H    ILE  40           HN       ILE  40 -27.949 -13.958  -9.361
  341    HA   ILE  40           HA       ILE  40 -28.314 -16.443 -10.896
  342    HB   ILE  40           HB       ILE  40 -28.079 -15.863  -7.960
  343   1HG1  ILE  40          HG12      ILE  40 -26.055 -16.884  -9.969
  344   2HG1  ILE  40          HG11      ILE  40 -26.058 -15.277  -9.243
  345   1HG2  ILE  40          HG21      ILE  40 -28.789 -18.255  -9.421
  346   2HG2  ILE  40          HG22      ILE  40 -28.729 -18.001  -7.676
  347   3HG2  ILE  40          HG23      ILE  40 -27.276 -18.494  -8.547
  348   1HD1  ILE  40          HD11      ILE  40 -25.840 -16.316  -6.995
  349   2HD1  ILE  40          HD12      ILE  40 -24.483 -16.724  -8.046
  350   3HD1  ILE  40          HD13      ILE  40 -25.761 -17.904  -7.758
  351    H    PHE  41           HN       PHE  41 -30.180 -14.235  -8.903
  352    HA   PHE  41           HA       PHE  41 -32.409 -16.090  -8.616
  353   1HB   PHE  41          HB2       PHE  41 -31.882 -13.199  -7.933
  354   2HB   PHE  41          HB1       PHE  41 -33.454 -13.948  -7.650
  355    HD1  PHE  41           HD1      PHE  41 -29.817 -14.839  -7.112
  356    HD2  PHE  41           HD2      PHE  41 -33.813 -14.788  -5.530
  357    HE1  PHE  41           HE1      PHE  41 -28.998 -15.858  -5.010
  358    HE2  PHE  41           HE2      PHE  41 -32.988 -15.802  -3.424
  359    HZ   PHE  41           HZ       PHE  41 -30.582 -16.338  -3.164
  360    H    LEU  42           HN       LEU  42 -31.469 -13.586 -10.887
  361    HA   LEU  42           HA       LEU  42 -34.029 -12.959 -11.954
  362   1HB   LEU  42          HB2       LEU  42 -32.699 -12.279 -13.956
  363   2HB   LEU  42          HB1       LEU  42 -32.003 -11.689 -12.453
  364    HG   LEU  42           HG       LEU  42 -30.461 -13.728 -12.507
  365   1HD1  LEU  42          HD21      LEU  42 -30.348 -14.195 -15.252
  366   2HD1  LEU  42          HD22      LEU  42 -32.075 -14.209 -14.901
  367   3HD1  LEU  42          HD23      LEU  42 -30.991 -15.306 -14.044
  368   1HD2  LEU  42          HD11      LEU  42 -28.893 -12.604 -13.878
  369   2HD2  LEU  42          HD12      LEU  42 -29.969 -11.317 -13.334
  370   3HD2  LEU  42          HD13      LEU  42 -30.145 -11.988 -14.954
  371    H    LEU  43           HN       LEU  43 -32.108 -15.836 -12.198
  372    HA   LEU  43           HA       LEU  43 -33.516 -16.837 -14.571
  373   1HB   LEU  43          HB2       LEU  43 -31.124 -17.259 -14.194
  374   2HB   LEU  43          HB1       LEU  43 -31.498 -18.055 -12.665
  375    HG   LEU  43           HG       LEU  43 -32.822 -19.756 -13.877
  376   1HD1  LEU  43          HD21      LEU  43 -32.160 -19.623 -16.499
  377   2HD1  LEU  43          HD22      LEU  43 -32.239 -17.901 -16.125
  378   3HD1  LEU  43          HD23      LEU  43 -33.646 -18.929 -15.850
  379   1HD2  LEU  43          HD11      LEU  43 -30.948 -20.935 -14.864
  380   2HD2  LEU  43          HD12      LEU  43 -30.356 -20.041 -13.464
  381   3HD2  LEU  43          HD13      LEU  43 -30.064 -19.427 -15.091
  382    H    LEU  44           HN       LEU  44 -33.431 -17.436 -11.069
  383    HA   LEU  44           HA       LEU  44 -35.129 -19.736 -11.035
  384   1HB   LEU  44          HB2       LEU  44 -34.631 -17.548  -8.993
  385   2HB   LEU  44          HB1       LEU  44 -35.332 -19.126  -8.633
  386    HG   LEU  44           HG       LEU  44 -32.574 -18.650  -9.804
  387   1HD1  LEU  44          HD11      LEU  44 -33.630 -19.050  -7.047
  388   2HD1  LEU  44          HD12      LEU  44 -32.209 -18.156  -7.588
  389   3HD1  LEU  44          HD13      LEU  44 -32.150 -19.914  -7.464
  390   1HD2  LEU  44          HD21      LEU  44 -33.327 -20.737 -10.641
  391   2HD2  LEU  44          HD22      LEU  44 -34.157 -21.134  -9.136
  392   3HD2  LEU  44          HD23      LEU  44 -32.395 -21.155  -9.203
  393    H    ILE  45           HN       ILE  45 -35.880 -16.258 -10.613
  394    HA   ILE  45           HA       ILE  45 -38.635 -16.460 -10.053
  395    HB   ILE  45           HB       ILE  45 -38.691 -14.151 -10.961
  396   1HG1  ILE  45          HG12      ILE  45 -35.903 -14.832 -11.954
  397   2HG1  ILE  45          HG11      ILE  45 -37.320 -14.585 -12.976
  398   1HG2  ILE  45          HG21      ILE  45 -37.654 -13.540  -9.060
  399   2HG2  ILE  45          HG22      ILE  45 -36.082 -13.920  -9.765
  400   3HG2  ILE  45          HG23      ILE  45 -36.999 -15.172  -8.926
  401   1HD1  ILE  45          HD11      ILE  45 -37.504 -12.283 -11.782
  402   2HD1  ILE  45          HD12      ILE  45 -36.259 -12.483 -13.015
  403   3HD1  ILE  45          HD13      ILE  45 -35.829 -12.567 -11.306
  404    H    CYS  46           HN       CYS  46 -36.965 -17.083 -13.045
  405    HA   CYS  46           HA       CYS  46 -39.298 -16.746 -14.753
  406   1HB   CYS  46          HB2       CYS  46 -36.999 -16.331 -15.491
  407   2HB   CYS  46          HB1       CYS  46 -36.607 -18.013 -15.169
  408    HG   CYS  46           HG       CYS  46 -37.215 -18.059 -17.644
  409    H    ILE  47           HN       ILE  47 -37.794 -19.359 -12.980
  410    HA   ILE  47           HA       ILE  47 -38.847 -21.594 -14.373
  411    HB   ILE  47           HB       ILE  47 -38.197 -21.127 -11.450
  412   1HG1  ILE  47          HG12      ILE  47 -36.338 -20.627 -12.994
  413   2HG1  ILE  47          HG11      ILE  47 -36.007 -22.097 -12.078
  414   1HG2  ILE  47          HG21      ILE  47 -38.567 -23.657 -13.065
  415   2HG2  ILE  47          HG22      ILE  47 -39.482 -23.152 -11.646
  416   3HG2  ILE  47          HG23      ILE  47 -37.789 -23.616 -11.483
  417   1HD1  ILE  47          HD11      ILE  47 -36.990 -23.393 -14.037
  418   2HD1  ILE  47          HD12      ILE  47 -35.451 -22.592 -14.354
  419   3HD1  ILE  47          HD13      ILE  47 -36.953 -21.880 -14.943
  420    H    ILE  48           HN       ILE  48 -40.239 -19.679 -11.700
  421    HA   ILE  48           HA       ILE  48 -42.592 -21.366 -11.488
  422    HB   ILE  48           HB       ILE  48 -43.266 -19.689  -9.835
  423   1HG1  ILE  48          HG12      ILE  48 -40.916 -18.087 -10.903
  424   2HG1  ILE  48          HG11      ILE  48 -42.617 -17.685 -11.133
  425   1HG2  ILE  48          HG21      ILE  48 -41.168 -19.697  -8.441
  426   2HG2  ILE  48          HG22      ILE  48 -40.307 -20.345  -9.837
  427   3HG2  ILE  48          HG23      ILE  48 -41.602 -21.279  -9.089
  428   1HD1  ILE  48          HD11      ILE  48 -42.526 -17.996  -8.424
  429   2HD1  ILE  48          HD12      ILE  48 -42.331 -16.447  -9.243
  430   3HD1  ILE  48          HD13      ILE  48 -40.911 -17.363  -8.740
  431    H    VAL  49           HN       VAL  49 -41.825 -18.282 -13.068
  432    HA   VAL  49           HA       VAL  49 -44.562 -17.635 -13.763
  433    HB   VAL  49           HB       VAL  49 -41.891 -16.776 -14.920
  434   1HG1  VAL  49          HG11      VAL  49 -43.268 -14.710 -15.526
  435   2HG1  VAL  49          HG12      VAL  49 -44.700 -15.681 -15.180
  436   3HG1  VAL  49          HG13      VAL  49 -43.602 -16.159 -16.475
  437   1HG2  VAL  49          HG21      VAL  49 -42.168 -14.838 -13.404
  438   2HG2  VAL  49          HG22      VAL  49 -42.100 -16.352 -12.500
  439   3HG2  VAL  49          HG23      VAL  49 -43.650 -15.554 -12.769
  440    H    MET  50           HN       MET  50 -41.991 -19.488 -15.338
  441    HA   MET  50           HA       MET  50 -43.428 -19.672 -17.868
  442   1HB   MET  50          HB2       MET  50 -40.988 -21.020 -16.754
  443   2HB   MET  50          HB1       MET  50 -41.509 -21.155 -18.428
  444   1HG   MET  50          HG2       MET  50 -40.819 -18.560 -17.016
  445   2HG   MET  50          HG1       MET  50 -39.768 -19.407 -18.150
  446   1HE   MET  50          HE1       MET  50 -40.424 -16.523 -18.374
  447   2HE   MET  50          HE2       MET  50 -40.995 -16.206 -20.011
  448   3HE   MET  50          HE3       MET  50 -39.591 -17.241 -19.760
  449    H    LEU  51           HN       LEU  51 -43.882 -21.178 -14.914
  450    HA   LEU  51           HA       LEU  51 -44.905 -23.671 -16.236
  451   1HB   LEU  51          HB2       LEU  51 -43.815 -23.177 -13.445
  452   2HB   LEU  51          HB1       LEU  51 -44.450 -24.722 -14.016
  453    HG   LEU  51           HG       LEU  51 -42.099 -23.230 -15.219
  454   1HD1  LEU  51          HD11      LEU  51 -42.069 -25.909 -13.825
  455   2HD1  LEU  51          HD12      LEU  51 -41.842 -24.405 -12.932
  456   3HD1  LEU  51          HD13      LEU  51 -40.705 -24.857 -14.203
  457   1HD2  LEU  51          HD21      LEU  51 -43.721 -25.583 -16.050
  458   2HD2  LEU  51          HD22      LEU  51 -41.973 -25.724 -16.236
  459   3HD2  LEU  51          HD23      LEU  51 -42.844 -24.417 -17.040
  460    H    LEU  52           HN       LEU  52 -45.493 -21.241 -13.699
  461    HA   LEU  52           HA       LEU  52 -48.385 -22.047 -13.732
  462   1HB   LEU  52          HB2       LEU  52 -46.660 -21.009 -11.458
  463   2HB   LEU  52          HB1       LEU  52 -48.372 -21.420 -11.333
  464    HG   LEU  52           HG       LEU  52 -46.149 -23.339 -12.095
  465   1HD1  LEU  52          HD21      LEU  52 -46.755 -22.417  -9.589
  466   2HD1  LEU  52          HD22      LEU  52 -46.084 -24.015  -9.919
  467   3HD1  LEU  52          HD23      LEU  52 -47.824 -23.815  -9.707
  468   1HD2  LEU  52          HD11      LEU  52 -49.148 -23.556 -11.962
  469   2HD2  LEU  52          HD12      LEU  52 -48.147 -24.974 -11.653
  470   3HD2  LEU  52          HD13      LEU  52 -48.049 -24.147 -13.208


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