NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
1325 1ahk cing 1-original 4 MR format nomenclature mapping



  Entry H atom name         Submitted Coord H atom name
    1   1H    ASP   1          2H        ASP   1  -1.481  -1.054  -1.054
    2   2H    ASP   1          3H        ASP   1  -1.134  -1.035  -1.035
    3   3H    ASP   1          1H        ASP   1  -0.192  -0.118  -0.118
    4    HA   ASP   1           HA       ASP   1  -1.549   1.609   1.609
    5   1HB   ASP   1          1HB       ASP   1  -3.109  -0.195  -0.195
    6   2HB   ASP   1          2HB       ASP   1  -3.244   1.561   1.561
    7    H    GLN   2           H        GLN   2  -2.838   2.257   2.257
    8    HA   GLN   2           HA       GLN   2  -4.490   0.546   0.546
    9   1HB   GLN   2          1HB       GLN   2  -5.615   2.804   2.804
   10   2HB   GLN   2          2HB       GLN   2  -3.913   2.562   2.562
   11   1HG   GLN   2          1HG       GLN   2  -3.172   3.901   3.901
   12   2HG   GLN   2          2HG       GLN   2  -4.711   3.776   3.776
   13   1HE2  GLN   2          2HE2      GLN   2  -4.153   6.852   6.852
   14   2HE2  GLN   2          1HE2      GLN   2  -2.896   5.860   5.860
   15    H    VAL   3           H        VAL   3  -6.966   1.295   1.295
   16    HA   VAL   3           HA       VAL   3  -8.228   1.618   1.618
   17    HB   VAL   3           HB       VAL   3  -9.699  -0.452  -0.452
   18   1HG1  VAL   3          3HG1      VAL   3  -9.240  -0.029  -0.029
   19   2HG1  VAL   3          1HG1      VAL   3  -7.616  -0.671  -0.671
   20   3HG1  VAL   3          2HG1      VAL   3  -9.019  -1.712  -1.712
   21   1HG2  VAL   3          2HG2      VAL   3  -6.707  -0.883  -0.883
   22   2HG2  VAL   3          3HG2      VAL   3  -7.888  -1.007  -1.007
   23   3HG2  VAL   3          1HG2      VAL   3  -7.877  -2.203  -2.203
   24    H    ASP   4           H        ASP   4 -10.861   0.950   0.950
   25    HA   ASP   4           HA       ASP   4 -11.272   3.021   3.021
   26   1HB   ASP   4          1HB       ASP   4 -12.285   2.874   2.874
   27   2HB   ASP   4          2HB       ASP   4 -13.632   2.727   2.727
   28    H    VAL   5           H        VAL   5 -11.039   0.823   0.823
   29    HA   VAL   5           HA       VAL   5 -13.503  -0.804  -0.804
   30    HB   VAL   5           HB       VAL   5 -12.346  -1.963  -1.963
   31   1HG1  VAL   5          1HG1      VAL   5 -12.190  -2.480  -2.480
   32   2HG1  VAL   5          2HG1      VAL   5 -10.528  -1.920  -1.920
   33   3HG1  VAL   5          3HG1      VAL   5 -11.107  -3.298  -3.298
   34   1HG2  VAL   5          2HG2      VAL   5 -10.899   0.195   0.195
   35   2HG2  VAL   5          3HG2      VAL   5 -10.147  -1.383  -1.383
   36   3HG2  VAL   5          1HG2      VAL   5  -9.884  -0.496  -0.496
   37    H    LYS   6           H        LYS   6 -15.171  -0.571  -0.571
   38    HA   LYS   6           HA       LYS   6 -15.302   1.863   1.863
   39   1HB   LYS   6          1HB       LYS   6 -17.062  -0.471  -0.471
   40   2HB   LYS   6          2HB       LYS   6 -17.330   0.385   0.385
   41   1HG   LYS   6          1HG       LYS   6 -17.776   2.435   2.435
   42   2HG   LYS   6          2HG       LYS   6 -17.077   1.869   1.869
   43   1HD   LYS   6          1HD       LYS   6 -19.083   1.104   1.104
   44   2HD   LYS   6          2HD       LYS   6 -19.184   0.077   0.077
   45   1HE   LYS   6          1HE       LYS   6 -21.013   1.422   1.422
   46   2HE   LYS   6          2HE       LYS   6 -19.771   2.417   2.417
   47   1HZ   LYS   6          1HZ       LYS   6 -19.898   2.925   2.925
   48   2HZ   LYS   6          2HZ       LYS   6 -21.431   3.129   3.129
   49   3HZ   LYS   6          3HZ       LYS   6 -20.100   4.003   4.003
   50    H    ASP   7           H        ASP   7 -13.477   1.739   1.739
   51    HA   ASP   7           HA       ASP   7 -13.334  -0.477  -0.477
   52   1HB   ASP   7          1HB       ASP   7 -11.398   0.817   0.817
   53   2HB   ASP   7          2HB       ASP   7 -11.238   0.479   0.479
   54    H    CYS   8           H        CYS   8 -13.267   0.069   0.069
   55    HA   CYS   8           HA       CYS   8 -14.835   2.477   2.477
   56   1HB   CYS   8          1HB       CYS   8 -15.743  -0.122  -0.122
   57   2HB   CYS   8          2HB       CYS   8 -16.652   1.364   1.364
   58    H    ALA   9           H        ALA   9 -12.155   2.120   2.120
   59    HA   ALA   9           HA       ALA   9 -11.873   0.906   0.906
   60   1HB   ALA   9          1HB       ALA   9 -10.087   1.792   1.792
   61   2HB   ALA   9          2HB       ALA   9  -9.704   2.672   2.672
   62   3HB   ALA   9          3HB       ALA   9  -9.688   0.908   0.908
   63    H    ASN  10           H        ASN  10 -11.051   4.183   4.183
   64    HA   ASN  10           HA       ASN  10 -12.739   5.695   5.695
   65   1HB   ASN  10          1HB       ASN  10 -10.730   4.209   4.209
   66   2HB   ASN  10          2HB       ASN  10 -10.495   5.947   5.947
   67   1HD2  ASN  10          2HD2      ASN  10 -13.557   6.416   6.416
   68   2HD2  ASN  10          1HD2      ASN  10 -12.346   7.202   7.202
   69    H    ASN  11           H        ASN  11 -11.223   5.837   5.837
   70    HA   ASN  11           HA       ASN  11  -9.837   7.316   7.316
   71   1HB   ASN  11          1HB       ASN  11 -11.714   8.802   8.802
   72   2HB   ASN  11          2HB       ASN  11 -10.451   9.345   9.345
   73   1HD2  ASN  11          2HD2      ASN  11 -10.059  11.761  11.761
   74   2HD2  ASN  11          1HD2      ASN  11 -10.952  11.487  11.487
   75    H    GLU  12           H        GLU  12  -8.673   5.713   5.713
   76    HA   GLU  12           HA       GLU  12  -6.364   7.501   7.501
   77   1HB   GLU  12          1HB       GLU  12  -7.565   5.223   5.223
   78   2HB   GLU  12          2HB       GLU  12  -6.030   5.995   5.995
   79   1HG   GLU  12          1HG       GLU  12  -8.332   7.818   7.818
   80   2HG   GLU  12          2HG       GLU  12  -8.391   6.828   6.828
   81    H    ILE  13           H        ILE  13  -7.382   4.665   4.665
   82    HA   ILE  13           HA       ILE  13  -5.285   2.859   2.859
   83    HB   ILE  13           HB       ILE  13  -6.611   3.785   3.785
   84   1HG1  ILE  13          1HG1      ILE  13  -7.223   1.612   1.612
   85   2HG1  ILE  13          2HG1      ILE  13  -8.262   2.953   2.953
   86   1HG2  ILE  13          1HG2      ILE  13  -4.464   1.902   1.902
   87   2HG2  ILE  13          2HG2      ILE  13  -5.853   1.092   1.092
   88   3HG2  ILE  13          3HG2      ILE  13  -5.106   2.456   2.456
   89   1HD1  ILE  13          1HD1      ILE  13  -7.929   1.842   1.842
   90   2HD1  ILE  13          2HD1      ILE  13  -7.679   0.397   0.397
   91   3HD1  ILE  13          3HD1      ILE  13  -9.192   1.297   1.297
   92    H    LYS  14           H        LYS  14  -3.223   2.674   2.674
   93    HA   LYS  14           HA       LYS  14  -1.956   5.274   5.274
   94   1HB   LYS  14          1HB       LYS  14  -0.207   2.936   2.936
   95   2HB   LYS  14          2HB       LYS  14  -0.113   4.505   4.505
   96   1HG   LYS  14          1HG       LYS  14  -2.277   3.528   3.528
   97   2HG   LYS  14          2HG       LYS  14  -1.479   2.004   2.004
   98   1HD   LYS  14          1HD       LYS  14  -0.637   2.670   2.670
   99   2HD   LYS  14          2HD       LYS  14   0.645   3.015   3.015
  100   1HE   LYS  14          1HE       LYS  14  -1.288   5.213   5.213
  101   2HE   LYS  14          2HE       LYS  14  -0.312   4.833   4.833
  102   1HZ   LYS  14          2HZ       LYS  14   1.282   4.815   4.815
  103   2HZ   LYS  14          3HZ       LYS  14   0.457   6.295   6.295
  104   3HZ   LYS  14          1HZ       LYS  14   1.448   5.763   5.763
  105    H    LYS  15           H        LYS  15  -2.869   2.233   2.233
  106    HA   LYS  15           HA       LYS  15  -2.086   3.063   3.063
  107   1HB   LYS  15          1HB       LYS  15  -0.088   1.844   1.844
  108   2HB   LYS  15          2HB       LYS  15  -0.566   0.680   0.680
  109   1HG   LYS  15          1HG       LYS  15  -0.420   2.863   2.863
  110   2HG   LYS  15          2HG       LYS  15   0.733   3.351   3.351
  111   1HD   LYS  15          1HD       LYS  15   0.825   0.813   0.813
  112   2HD   LYS  15          2HD       LYS  15   1.936   2.179   2.179
  113   1HE   LYS  15          1HE       LYS  15   1.691   1.132   1.132
  114   2HE   LYS  15          2HE       LYS  15   2.294  -0.072  -0.072
  115   1HZ   LYS  15          3HZ       LYS  15   3.387   2.676   2.676
  116   2HZ   LYS  15          1HZ       LYS  15   4.020   1.378   1.378
  117   3HZ   LYS  15          2HZ       LYS  15   4.052   1.339   1.339
  118    H    VAL  16           H        VAL  16  -3.919   2.280   2.280
  119    HA   VAL  16           HA       VAL  16  -4.480  -0.633  -0.633
  120    HB   VAL  16           HB       VAL  16  -6.132   0.644   0.644
  121   1HG1  VAL  16          3HG1      VAL  16  -5.818   2.624   2.624
  122   2HG1  VAL  16          1HG1      VAL  16  -7.266   1.878   1.878
  123   3HG1  VAL  16          2HG1      VAL  16  -7.274   2.472   2.472
  124   1HG2  VAL  16          2HG2      VAL  16  -6.676  -1.212  -1.212
  125   2HG2  VAL  16          3HG2      VAL  16  -7.670  -0.870  -0.870
  126   3HG2  VAL  16          1HG2      VAL  16  -7.948   0.007   0.007
  127    H    MET  17           H        MET  17  -3.967  -1.443  -1.443
  128    HA   MET  17           HA       MET  17  -5.269  -0.215  -0.215
  129   1HB   MET  17          1HB       MET  17  -2.332  -0.964  -0.964
  130   2HB   MET  17          2HB       MET  17  -3.226  -0.248  -0.248
  131   1HG   MET  17          1HG       MET  17  -2.360   1.692   1.692
  132   2HG   MET  17          2HG       MET  17  -3.774   1.577   1.577
  133   1HE   MET  17          1HE       MET  17  -0.756   2.653   2.653
  134   2HE   MET  17          2HE       MET  17  -1.235   3.301   3.301
  135   3HE   MET  17          3HE       MET  17   0.219   2.315   2.315
  136    H    VAL  18           H        VAL  18  -4.368  -1.814  -1.814
  137    HA   VAL  18           HA       VAL  18  -4.324  -4.620  -4.620
  138    HB   VAL  18           HB       VAL  18  -6.540  -4.169  -4.169
  139   1HG1  VAL  18          3HG1      VAL  18  -5.817  -6.285  -6.285
  140   2HG1  VAL  18          1HG1      VAL  18  -6.593  -5.534  -5.534
  141   3HG1  VAL  18          2HG1      VAL  18  -7.541  -5.912  -5.912
  142   1HG2  VAL  18          2HG2      VAL  18  -6.640  -2.177  -2.177
  143   2HG2  VAL  18          3HG2      VAL  18  -8.091  -3.152  -3.152
  144   3HG2  VAL  18          1HG2      VAL  18  -7.058  -3.401  -3.401
  145    H    ASP  19           H        ASP  19  -2.949  -5.563  -5.563
  146    HA   ASP  19           HA       ASP  19  -1.936  -4.216  -4.216
  147   1HB   ASP  19          1HB       ASP  19  -1.456  -6.683  -6.683
  148   2HB   ASP  19          2HB       ASP  19  -1.587  -7.013  -7.013
  149    H    GLY  20           H        GLY  20  -3.803  -3.586  -3.586
  150   1HA   GLY  20          1HA       GLY  20  -5.169  -3.861  -3.861
  151   2HA   GLY  20          2HA       GLY  20  -4.434  -5.448  -5.448
  152    H    CYS  21           H        CYS  21  -7.317  -4.318  -4.318
  153    HA   CYS  21           HA       CYS  21  -8.832  -6.529  -6.529
  154   1HB   CYS  21          1HB       CYS  21  -8.494  -7.006  -7.006
  155   2HB   CYS  21          2HB       CYS  21  -7.791  -5.424  -5.424
  156    H    HIS  22           H        HIS  22  -8.527  -3.095  -3.095
  157    HA   HIS  22           HA       HIS  22  -9.902  -1.279  -1.279
  158   1HB   HIS  22          1HB       HIS  22 -10.917  -3.340  -3.340
  159   2HB   HIS  22          2HB       HIS  22 -12.260  -2.422  -2.422
  160    HD1  HIS  22           HD1      HIS  22 -11.305   0.379   0.379
  161    HD2  HIS  22           HD2      HIS  22 -10.257  -2.117  -2.117
  162    HE1  HIS  22           HE1      HIS  22 -10.660   1.896   1.896
  163    H    GLY  23           H        GLY  23 -11.038  -0.310  -0.310
  164   1HA   GLY  23          1HA       GLY  23 -12.667  -2.030  -2.030
  165   2HA   GLY  23          2HA       GLY  23 -11.937  -0.494  -0.494
  166    H    SER  24           H        SER  24 -14.583  -0.794  -0.794
  167    HA   SER  24           HA       SER  24 -16.592   0.410   0.410
  168   1HB   SER  24          1HB       SER  24 -14.654   1.926   1.926
  169   2HB   SER  24          2HB       SER  24 -16.218   1.958   1.958
  170    HG   SER  24           HG       SER  24 -16.968   3.144   3.144
  171    H    ASP  25           H        ASP  25 -15.756   0.517   0.517
  172    HA   ASP  25           HA       ASP  25 -18.154  -0.594  -0.594
  173   1HB   ASP  25          1HB       ASP  25 -17.100  -0.474  -0.474
  174   2HB   ASP  25          2HB       ASP  25 -16.105   0.632   0.632
  175    HA   PRO  26           HA       PRO  26 -17.545  -4.956  -4.956
  176   1HB   PRO  26          1HB       PRO  26 -17.444  -6.019  -6.019
  177   2HB   PRO  26          2HB       PRO  26 -18.934  -5.448  -5.448
  178   1HG   PRO  26          1HG       PRO  26 -17.325  -4.163  -4.163
  179   2HG   PRO  26          2HG       PRO  26 -19.049  -3.985  -3.985
  180   1HD   PRO  26          1HD       PRO  26 -17.006  -2.153  -2.153
  181   2HD   PRO  26          2HD       PRO  26 -18.656  -2.122  -2.122
  182    H    CYS  27           H        CYS  27 -15.437  -4.570  -4.570
  183    HA   CYS  27           HA       CYS  27 -12.986  -4.202  -4.202
  184   1HB   CYS  27          1HB       CYS  27 -13.011  -4.845  -4.845
  185   2HB   CYS  27          2HB       CYS  27 -13.918  -6.318  -6.318
  186    H    ILE  28           H        ILE  28 -12.610  -4.669  -4.669
  187    HA   ILE  28           HA       ILE  28 -12.608  -7.526  -7.526
  188    HB   ILE  28           HB       ILE  28 -11.852  -5.071  -5.071
  189   1HG1  ILE  28          1HG1      ILE  28 -14.308  -5.381  -5.381
  190   2HG1  ILE  28          2HG1      ILE  28 -13.937  -5.389  -5.389
  191   1HG2  ILE  28          3HG2      ILE  28 -11.240  -7.840  -7.840
  192   2HG2  ILE  28          1HG2      ILE  28 -12.383  -7.405  -7.405
  193   3HG2  ILE  28          2HG2      ILE  28 -10.861  -6.526  -6.526
  194   1HD1  ILE  28          1HD1      ILE  28 -13.744  -7.994  -7.994
  195   2HD1  ILE  28          2HD1      ILE  28 -15.373  -7.333  -7.333
  196   3HD1  ILE  28          3HD1      ILE  28 -14.411  -7.597  -7.597
  197    H    ILE  29           H        ILE  29 -10.684  -8.666  -8.666
  198    HA   ILE  29           HA       ILE  29  -8.273  -7.099  -7.099
  199    HB   ILE  29           HB       ILE  29  -8.326  -9.954  -9.954
  200   1HG1  ILE  29          1HG1      ILE  29 -10.401  -8.033  -8.033
  201   2HG1  ILE  29          2HG1      ILE  29 -10.650  -9.629  -9.629
  202   1HG2  ILE  29          1HG2      ILE  29  -7.250  -7.480  -7.480
  203   2HG2  ILE  29          2HG2      ILE  29  -7.999  -8.443  -8.443
  204   3HG2  ILE  29          3HG2      ILE  29  -6.716  -9.134  -9.134
  205   1HD1  ILE  29          3HD1      ILE  29  -9.139  -9.189  -9.189
  206   2HD1  ILE  29          1HD1      ILE  29 -10.874  -9.497  -9.497
  207   3HD1  ILE  29          2HD1      ILE  29  -9.747 -10.715 -10.715
  208    H    HIS  30           H        HIS  30  -6.209  -8.267  -8.267
  209    HA   HIS  30           HA       HIS  30  -6.449  -9.366  -9.366
  210   1HB   HIS  30          1HB       HIS  30  -4.058  -7.971  -7.971
  211   2HB   HIS  30          2HB       HIS  30  -4.275  -8.414  -8.414
  212    HD1  HIS  30           HD1      HIS  30  -4.756  -6.342  -6.342
  213    HD2  HIS  30           HD2      HIS  30  -6.687  -6.317  -6.317
  214    HE1  HIS  30           HE1      HIS  30  -6.144  -4.224  -4.224
  215    H    ARG  31           H        ARG  31  -4.776 -10.918 -10.918
  216    HA   ARG  31           HA       ARG  31  -4.074 -12.766 -12.766
  217   1HB   ARG  31          1HB       ARG  31  -3.505 -14.098 -14.098
  218   2HB   ARG  31          2HB       ARG  31  -4.991 -14.268 -14.268
  219   1HG   ARG  31          1HG       ARG  31  -6.071 -12.538 -12.538
  220   2HG   ARG  31          2HG       ARG  31  -4.572 -12.193 -12.193
  221   1HD   ARG  31          1HD       ARG  31  -5.135 -15.003 -15.003
  222   2HD   ARG  31          2HD       ARG  31  -6.563 -14.092 -14.092
  223    HE   ARG  31           HE       ARG  31  -4.354 -14.409 -14.409
  224   1HH1  ARG  31          1HH2      ARG  31  -6.564 -12.041 -12.041
  225   2HH1  ARG  31          2HH2      ARG  31  -5.967 -10.796 -10.796
  226   1HH2  ARG  31          1HH1      ARG  31  -3.331 -12.703 -12.703
  227   2HH2  ARG  31          2HH1      ARG  31  -4.135 -11.171 -11.171
  228    H    GLY  32           H        GLY  32  -1.887 -13.884 -13.884
  229   1HA   GLY  32          1HA       GLY  32   0.416 -13.854 -13.854
  230   2HA   GLY  32          2HA       GLY  32   0.088 -12.582 -12.582
  231    H    LYS  33           H        LYS  33  -1.244 -11.776 -11.776
  232    HA   LYS  33           HA       LYS  33   1.236 -10.420 -10.420
  233   1HB   LYS  33          1HB       LYS  33  -1.243  -9.136  -9.136
  234   2HB   LYS  33          2HB       LYS  33  -0.599  -8.475  -8.475
  235   1HG   LYS  33          1HG       LYS  33   1.698  -8.567  -8.567
  236   2HG   LYS  33          2HG       LYS  33   0.656  -8.552  -8.552
  237   1HD   LYS  33          1HD       LYS  33  -0.034  -6.587  -6.587
  238   2HD   LYS  33          2HD       LYS  33   1.486  -6.295  -6.295
  239   1HE   LYS  33          1HE       LYS  33  -0.493  -7.052  -7.052
  240   2HE   LYS  33          2HE       LYS  33  -1.154  -5.762  -5.762
  241   1HZ   LYS  33          3HZ       LYS  33   1.036  -4.598  -4.598
  242   2HZ   LYS  33          1HZ       LYS  33   1.341  -5.739  -5.739
  243   3HZ   LYS  33          2HZ       LYS  33   0.002  -4.700  -4.700
  244    HA   PRO  34           HA       PRO  34  -0.255 -11.900 -11.900
  245   1HB   PRO  34          1HB       PRO  34   1.251 -10.276 -10.276
  246   2HB   PRO  34          2HB       PRO  34   1.891 -11.695 -11.695
  247   1HG   PRO  34          1HG       PRO  34   2.238  -8.797  -8.797
  248   2HG   PRO  34          2HG       PRO  34   3.332 -10.156 -10.156
  249   1HD   PRO  34          1HD       PRO  34   1.678  -8.964  -8.964
  250   2HD   PRO  34          2HD       PRO  34   2.403 -10.581 -10.581
  251    H    PHE  35           H        PHE  35  -2.349 -11.338 -11.338
  252    HA   PHE  35           HA       PHE  35  -3.155  -8.540  -8.540
  253   1HB   PHE  35          1HB       PHE  35  -4.629 -10.095 -10.095
  254   2HB   PHE  35          2HB       PHE  35  -4.697 -11.146 -11.146
  255    HD1  PHE  35           HD2      PHE  35  -4.893  -7.423  -7.423
  256    HD2  PHE  35           HD1      PHE  35  -6.847 -11.032 -11.032
  257    HE1  PHE  35           HE2      PHE  35  -6.776  -6.093  -6.093
  258    HE2  PHE  35           HE1      PHE  35  -8.737  -9.707  -9.707
  259    HZ   PHE  35           HZ       PHE  35  -8.702  -7.233  -7.233
  260    H    THR  36           H        THR  36  -1.338  -8.986  -8.986
  261    HA   THR  36           HA       THR  36  -2.360 -10.141 -10.141
  262    HB   THR  36           HB       THR  36  -0.099  -8.260  -8.260
  263    HG1  THR  36           HG1      THR  36   1.023 -10.039 -10.039
  264   1HG2  THR  36          3HG2      THR  36  -1.428  -8.663  -8.663
  265   2HG2  THR  36          1HG2      THR  36   0.294  -9.042  -9.042
  266   3HG2  THR  36          2HG2      THR  36  -0.245  -7.445  -7.445
  267    H    LEU  37           H        LEU  37  -4.509  -9.137  -9.137
  268    HA   LEU  37           HA       LEU  37  -4.954  -6.329  -6.329
  269   1HB   LEU  37          1HB       LEU  37  -7.064  -6.833  -6.833
  270   2HB   LEU  37          2HB       LEU  37  -6.664  -8.306  -8.306
  271    HG   LEU  37           HG       LEU  37  -5.495  -8.787  -8.787
  272   1HD1  LEU  37          2HD1      LEU  37  -8.002  -7.140  -7.140
  273   2HD1  LEU  37          3HD1      LEU  37  -7.373  -8.237  -8.237
  274   3HD1  LEU  37          1HD1      LEU  37  -6.406  -6.862  -6.862
  275   1HD2  LEU  37          2HD2      LEU  37  -8.265  -9.429  -9.429
  276   2HD2  LEU  37          3HD2      LEU  37  -6.816 -10.430 -10.430
  277   3HD2  LEU  37          1HD2      LEU  37  -7.601 -10.170 -10.170
  278    H    GLU  38           H        GLU  38  -5.346  -5.018  -5.018
  279    HA   GLU  38           HA       GLU  38  -4.080  -6.014  -6.014
  280   1HB   GLU  38          1HB       GLU  38  -2.856  -3.708  -3.708
  281   2HB   GLU  38          2HB       GLU  38  -2.358  -4.250  -4.250
  282   1HG   GLU  38          1HG       GLU  38  -1.915  -6.527  -6.527
  283   2HG   GLU  38          2HG       GLU  38  -2.185  -5.803  -5.803
  284    H    ALA  39           H        ALA  39  -3.681  -3.774  -3.774
  285    HA   ALA  39           HA       ALA  39  -5.211  -1.520  -1.520
  286   1HB   ALA  39          3HB       ALA  39  -6.921  -3.867  -3.867
  287   2HB   ALA  39          1HB       ALA  39  -7.298  -2.199  -2.199
  288   3HB   ALA  39          2HB       ALA  39  -7.274  -2.682  -2.682
  289    H    LEU  40           H        LEU  40  -3.810  -0.706  -0.706
  290    HA   LEU  40           HA       LEU  40  -3.336  -2.230  -2.230
  291   1HB   LEU  40          1HB       LEU  40  -1.929   0.037   0.037
  292   2HB   LEU  40          2HB       LEU  40  -1.579  -0.344  -0.344
  293    HG   LEU  40           HG       LEU  40  -0.386  -2.160  -2.160
  294   1HD1  LEU  40          2HD1      LEU  40  -2.458  -2.788  -2.788
  295   2HD1  LEU  40          3HD1      LEU  40  -1.107  -3.837  -3.837
  296   3HD1  LEU  40          1HD1      LEU  40  -2.365  -3.508  -3.508
  297   1HD2  LEU  40          2HD2      LEU  40  -0.711  -0.893  -0.893
  298   2HD2  LEU  40          3HD2      LEU  40   0.600  -0.640  -0.640
  299   3HD2  LEU  40          1HD2      LEU  40   0.439  -2.190  -2.190
  300    H    PHE  41           H        PHE  41  -2.977  -0.652  -0.652
  301    HA   PHE  41           HA       PHE  41  -4.312   1.839   1.839
  302   1HB   PHE  41          1HB       PHE  41  -6.360   1.041   1.041
  303   2HB   PHE  41          2HB       PHE  41  -6.436   0.847   0.847
  304    HD1  PHE  41           HD2      PHE  41  -6.161  -1.343  -1.343
  305    HD2  PHE  41           HD1      PHE  41  -6.143  -0.891  -0.891
  306    HE1  PHE  41           HE2      PHE  41  -6.476  -3.781  -3.781
  307    HE2  PHE  41           HE1      PHE  41  -6.464  -3.324  -3.324
  308    HZ   PHE  41           HZ       PHE  41  -6.630  -4.775  -4.775
  309    H    ASP  42           H        ASP  42  -4.094   2.700   2.700
  310    HA   ASP  42           HA       ASP  42  -2.526   1.020   1.020
  311   1HB   ASP  42          1HB       ASP  42  -1.822   3.415   3.415
  312   2HB   ASP  42          2HB       ASP  42  -3.077   3.959   3.959
  313    H    ALA  43           H        ALA  43  -3.594   0.059   0.059
  314    HA   ALA  43           HA       ALA  43  -6.259   0.198   0.198
  315   1HB   ALA  43          1HB       ALA  43  -4.073  -1.077  -1.077
  316   2HB   ALA  43          2HB       ALA  43  -4.416   0.018   0.018
  317   3HB   ALA  43          3HB       ALA  43  -5.646  -1.118  -1.118
  318    H    ASN  44           H        ASN  44  -7.517   1.911   1.911
  319    HA   ASN  44           HA       ASN  44  -6.281   4.037   4.037
  320   1HB   ASN  44          1HB       ASN  44  -8.482   5.135   5.135
  321   2HB   ASN  44          2HB       ASN  44  -6.773   5.527   5.527
  322   1HD2  ASN  44          2HD2      ASN  44  -8.424   2.745   2.745
  323   2HD2  ASN  44          1HD2      ASN  44  -9.089   2.938   2.938
  324    H    GLN  45           H        GLN  45  -8.443   1.578   1.578
  325    HA   GLN  45           HA       GLN  45 -10.603   2.924   2.924
  326   1HB   GLN  45          1HB       GLN  45 -11.628   0.704   0.704
  327   2HB   GLN  45          2HB       GLN  45 -11.091   1.052   1.052
  328   1HG   GLN  45          1HG       GLN  45  -8.941  -0.169  -0.169
  329   2HG   GLN  45          2HG       GLN  45  -9.686  -0.680  -0.680
  330   1HE2  GLN  45          2HE2      GLN  45 -12.166  -2.083  -2.083
  331   2HE2  GLN  45          1HE2      GLN  45 -12.137  -0.457  -0.457
  332    H    ASN  46           H        ASN  46 -10.749   0.359   0.359
  333    HA   ASN  46           HA       ASN  46  -8.346   0.587   0.587
  334   1HB   ASN  46          1HB       ASN  46 -10.659   0.870   0.870
  335   2HB   ASN  46          2HB       ASN  46  -9.155   1.786   1.786
  336   1HD2  ASN  46          2HD2      ASN  46 -12.468   3.469   3.469
  337   2HD2  ASN  46          1HD2      ASN  46 -12.481   2.065   2.065
  338    H    THR  47           H        THR  47  -8.673  -1.820  -1.820
  339    HA   THR  47           HA       THR  47 -10.024  -3.389  -3.389
  340    HB   THR  47           HB       THR  47 -11.714  -3.081  -3.081
  341    HG1  THR  47           HG1      THR  47 -11.721  -5.425  -5.425
  342   1HG2  THR  47          1HG2      THR  47  -9.401  -3.253  -3.253
  343   2HG2  THR  47          2HG2      THR  47 -10.469  -4.588  -4.588
  344   3HG2  THR  47          3HG2      THR  47 -11.066  -2.929  -2.929
  345    H    LYS  48           H        LYS  48  -8.415  -4.762  -4.762
  346    HA   LYS  48           HA       LYS  48  -6.159  -5.498  -5.498
  347   1HB   LYS  48          1HB       LYS  48  -6.138  -7.515  -7.515
  348   2HB   LYS  48          2HB       LYS  48  -5.703  -5.897  -5.897
  349   1HG   LYS  48          1HG       LYS  48  -7.875  -5.542  -5.542
  350   2HG   LYS  48          2HG       LYS  48  -8.515  -6.999  -6.999
  351   1HD   LYS  48          1HD       LYS  48  -8.030  -7.422  -7.422
  352   2HD   LYS  48          2HD       LYS  48  -6.947  -8.367  -8.367
  353   1HE   LYS  48          1HE       LYS  48  -5.652  -5.897  -5.897
  354   2HE   LYS  48          2HE       LYS  48  -6.290  -6.324  -6.324
  355   1HZ   LYS  48          3HZ       LYS  48  -4.725  -8.174  -8.174
  356   2HZ   LYS  48          1HZ       LYS  48  -4.052  -7.240  -7.240
  357   3HZ   LYS  48          2HZ       LYS  48  -5.210  -8.430  -8.430
  358    H    THR  49           H        THR  49  -9.417  -6.566  -6.566
  359    HA   THR  49           HA       THR  49  -8.879  -9.177  -9.177
  360    HB   THR  49           HB       THR  49 -11.337  -9.366  -9.366
  361    HG1  THR  49           HG1      THR  49 -12.551  -7.610  -7.610
  362   1HG2  THR  49          2HG2      THR  49 -10.173  -8.333  -8.333
  363   2HG2  THR  49          3HG2      THR  49 -11.781  -9.048  -9.048
  364   3HG2  THR  49          1HG2      THR  49 -10.357 -10.013 -10.013
  365    H    ALA  50           H        ALA  50 -10.895  -9.242  -9.242
  366    HA   ALA  50           HA       ALA  50 -10.933  -7.084  -7.084
  367   1HB   ALA  50          1HB       ALA  50  -8.390  -7.804  -7.804
  368   2HB   ALA  50          2HB       ALA  50  -8.928  -9.110  -9.110
  369   3HB   ALA  50          3HB       ALA  50  -9.136  -7.428  -7.428
  370    H    LYS  51           H        LYS  51 -11.970  -7.733  -7.733
  371    HA   LYS  51           HA       LYS  51 -12.825 -10.598 -10.598
  372   1HB   LYS  51          1HB       LYS  51 -14.491  -8.200  -8.200
  373   2HB   LYS  51          2HB       LYS  51 -15.011  -9.885  -9.885
  374   1HG   LYS  51          1HG       LYS  51 -14.287  -9.794  -9.794
  375   2HG   LYS  51          2HG       LYS  51 -14.524  -8.058  -8.058
  376   1HD   LYS  51          1HD       LYS  51 -16.681  -9.730  -9.730
  377   2HD   LYS  51          2HD       LYS  51 -16.524  -9.824  -9.824
  378   1HE   LYS  51          1HE       LYS  51 -16.520  -7.305  -7.305
  379   2HE   LYS  51          2HE       LYS  51 -16.895  -7.320  -7.320
  380   1HZ   LYS  51          2HZ       LYS  51 -18.736  -8.999  -8.999
  381   2HZ   LYS  51          3HZ       LYS  51 -18.575  -7.998  -7.998
  382   3HZ   LYS  51          1HZ       LYS  51 -18.995  -7.326  -7.326
  383    H    ILE  52           H        ILE  52 -14.120 -10.519 -10.519
  384    HA   ILE  52           HA       ILE  52 -12.571  -9.151  -9.151
  385    HB   ILE  52           HB       ILE  52 -10.853 -10.756 -10.756
  386   1HG1  ILE  52          1HG1      ILE  52 -11.610 -11.583 -11.583
  387   2HG1  ILE  52          2HG1      ILE  52 -11.143  -9.913  -9.913
  388   1HG2  ILE  52          3HG2      ILE  52 -12.811 -12.791 -12.791
  389   2HG2  ILE  52          1HG2      ILE  52 -11.156 -13.153 -13.153
  390   3HG2  ILE  52          2HG2      ILE  52 -12.333 -12.609 -12.609
  391   1HD1  ILE  52          2HD1      ILE  52  -9.431 -12.173 -12.173
  392   2HD1  ILE  52          3HD1      ILE  52  -9.291 -11.638 -11.638
  393   3HD1  ILE  52          1HD1      ILE  52  -8.972 -10.508 -10.508
  394    H    GLU  53           H        GLU  53 -13.297  -9.602  -9.602
  395    HA   GLU  53           HA       GLU  53 -15.321 -11.699 -11.699
  396   1HB   GLU  53          1HB       GLU  53 -16.052  -8.973  -8.973
  397   2HB   GLU  53          2HB       GLU  53 -16.474  -9.343  -9.343
  398   1HG   GLU  53          1HG       GLU  53 -18.070 -10.856 -10.856
  399   2HG   GLU  53          2HG       GLU  53 -17.121 -11.466 -11.466
  400    H    ILE  54           H        ILE  54 -12.823 -11.589 -11.589
  401    HA   ILE  54           HA       ILE  54 -12.862 -10.203 -10.203
  402    HB   ILE  54           HB       ILE  54 -11.003 -12.190 -12.190
  403   1HG1  ILE  54          1HG1      ILE  54  -9.654 -10.430 -10.430
  404   2HG1  ILE  54          2HG1      ILE  54 -10.077  -9.564  -9.564
  405   1HG2  ILE  54          1HG2      ILE  54 -11.195 -11.249 -11.249
  406   2HG2  ILE  54          2HG2      ILE  54  -9.592 -11.436 -11.436
  407   3HG2  ILE  54          3HG2      ILE  54 -10.688 -12.815 -12.815
  408   1HD1  ILE  54          2HD1      ILE  54 -12.267  -8.972  -8.972
  409   2HD1  ILE  54          3HD1      ILE  54 -11.826  -9.821  -9.821
  410   3HD1  ILE  54          1HD1      ILE  54 -10.940  -8.376  -8.376
  411    H    LYS  55           H        LYS  55 -12.942 -11.288 -11.288
  412    HA   LYS  55           HA       LYS  55 -13.492 -14.161 -14.161
  413   1HB   LYS  55          1HB       LYS  55 -15.665 -12.134 -12.134
  414   2HB   LYS  55          2HB       LYS  55 -15.679 -13.625 -13.625
  415   1HG   LYS  55          1HG       LYS  55 -16.329 -14.858 -14.858
  416   2HG   LYS  55          2HG       LYS  55 -15.133 -14.122 -14.122
  417   1HD   LYS  55          1HD       LYS  55 -17.880 -13.058 -13.058
  418   2HD   LYS  55          2HD       LYS  55 -17.295 -13.540 -13.540
  419   1HE   LYS  55          1HE       LYS  55 -15.467 -11.662 -11.662
  420   2HE   LYS  55          2HE       LYS  55 -16.712 -11.048 -11.048
  421   1HZ   LYS  55          2HZ       LYS  55 -18.226 -11.471 -11.471
  422   2HZ   LYS  55          3HZ       LYS  55 -16.765 -11.332 -11.332
  423   3HZ   LYS  55          1HZ       LYS  55 -17.303 -10.049 -10.049
  424    H    ALA  56           H        ALA  56 -11.830 -14.291 -14.291
  425    HA   ALA  56           HA       ALA  56 -12.267 -12.864 -12.864
  426   1HB   ALA  56          3HB       ALA  56  -9.923 -13.174 -13.174
  427   2HB   ALA  56          1HB       ALA  56  -9.683 -14.110 -14.110
  428   3HB   ALA  56          2HB       ALA  56 -10.061 -12.390 -12.390
  429    H    SER  57           H        SER  57 -12.852 -14.181 -14.181
  430    HA   SER  57           HA       SER  57 -12.436 -17.123 -17.123
  431   1HB   SER  57          1HB       SER  57 -14.611 -17.458 -17.458
  432   2HB   SER  57          2HB       SER  57 -14.835 -15.713 -15.713
  433    HG   SER  57           HG       SER  57 -14.583 -17.377 -17.377
  434    H    LEU  58           H        LEU  58 -11.053 -18.010 -18.010
  435    HA   LEU  58           HA       LEU  58 -10.846 -16.713 -16.713
  436   1HB   LEU  58          1HB       LEU  58  -8.842 -16.422 -16.422
  437   2HB   LEU  58          2HB       LEU  58  -8.576 -18.148 -18.148
  438    HG   LEU  58           HG       LEU  58  -7.297 -16.563 -16.563
  439   1HD1  LEU  58          3HD1      LEU  58  -8.484 -19.100 -19.100
  440   2HD1  LEU  58          1HD1      LEU  58  -8.693 -18.231 -18.231
  441   3HD1  LEU  58          2HD1      LEU  58  -7.078 -18.444 -18.444
  442   1HD2  LEU  58          2HD2      LEU  58  -9.397 -15.158 -15.158
  443   2HD2  LEU  58          3HD2      LEU  58  -8.483 -15.622 -15.622
  444   3HD2  LEU  58          1HD2      LEU  58  -9.961 -16.482 -16.482
  445    H    ASP  59           H        ASP  59 -10.547 -18.211 -18.211
  446    HA   ASP  59           HA       ASP  59 -11.993 -20.589 -20.589
  447   1HB   ASP  59          1HB       ASP  59 -11.139 -19.510 -19.510
  448   2HB   ASP  59          2HB       ASP  59  -9.524 -20.108 -20.108
  449    H    GLY  60           H        GLY  60  -8.413 -20.527 -20.527
  450   1HA   GLY  60          1HA       GLY  60  -8.435 -23.143 -23.143
  451   2HA   GLY  60          2HA       GLY  60  -7.043 -22.421 -22.421
  452    H    LEU  61           H        LEU  61  -8.881 -20.292 -20.292
  453    HA   LEU  61           HA       LEU  61  -7.211 -20.844 -20.844
  454   1HB   LEU  61          1HB       LEU  61  -6.445 -18.878 -18.878
  455   2HB   LEU  61          2HB       LEU  61  -7.049 -18.026 -18.026
  456    HG   LEU  61           HG       LEU  61  -4.634 -18.474 -18.474
  457   1HD1  LEU  61          3HD1      LEU  61  -6.694 -19.462 -19.462
  458   2HD1  LEU  61          1HD1      LEU  61  -5.153 -20.290 -20.290
  459   3HD1  LEU  61          2HD1      LEU  61  -5.237 -18.534 -18.534
  460   1HD2  LEU  61          1HD2      LEU  61  -4.812 -20.604 -20.604
  461   2HD2  LEU  61          2HD2      LEU  61  -3.733 -20.678 -20.678
  462   3HD2  LEU  61          3HD2      LEU  61  -5.333 -21.416 -21.416
  463    H    GLU  62           H        GLU  62  -9.475 -21.301 -21.301
  464    HA   GLU  62           HA       GLU  62 -11.391 -19.122 -19.122
  465   1HB   GLU  62          1HB       GLU  62 -11.281 -21.924 -21.924
  466   2HB   GLU  62          2HB       GLU  62 -12.530 -20.813 -20.813
  467   1HG   GLU  62          1HG       GLU  62 -12.821 -20.350 -20.350
  468   2HG   GLU  62          2HG       GLU  62 -12.105 -21.956 -21.956
  469    H    ILE  63           H        ILE  63  -9.693 -17.623 -17.623
  470    HA   ILE  63           HA       ILE  63  -8.911 -18.107 -18.107
  471    HB   ILE  63           HB       ILE  63  -9.933 -15.403 -15.403
  472   1HG1  ILE  63          1HG1      ILE  63  -7.301 -16.743 -16.743
  473   2HG1  ILE  63          2HG1      ILE  63  -8.465 -16.011 -16.011
  474   1HG2  ILE  63          3HG2      ILE  63  -8.552 -16.460 -16.460
  475   2HG2  ILE  63          1HG2      ILE  63  -7.501 -15.306 -15.306
  476   3HG2  ILE  63          2HG2      ILE  63  -9.106 -14.810 -14.810
  477   1HD1  ILE  63          1HD1      ILE  63  -8.018 -13.829 -13.829
  478   2HD1  ILE  63          2HD1      ILE  63  -6.514 -14.642 -14.642
  479   3HD1  ILE  63          3HD1      ILE  63  -6.860 -14.299 -14.299
  480    H    ASP  64           H        ASP  64 -10.074 -17.271 -17.271
  481    HA   ASP  64           HA       ASP  64 -12.869 -16.608 -16.608
  482   1HB   ASP  64          1HB       ASP  64 -12.242 -19.387 -19.387
  483   2HB   ASP  64          2HB       ASP  64 -13.001 -19.161 -19.161
  484    H    VAL  65           H        VAL  65 -13.705 -16.174 -16.174
  485    HA   VAL  65           HA       VAL  65 -11.956 -16.759 -16.759
  486    HB   VAL  65           HB       VAL  65 -12.966 -13.986 -13.986
  487   1HG1  VAL  65          3HG1      VAL  65 -11.562 -15.277 -15.277
  488   2HG1  VAL  65          1HG1      VAL  65 -10.991 -13.673 -13.673
  489   3HG1  VAL  65          2HG1      VAL  65 -12.677 -13.907 -13.907
  490   1HG2  VAL  65          2HG2      VAL  65 -10.449 -15.451 -15.451
  491   2HG2  VAL  65          3HG2      VAL  65 -11.240 -14.142 -14.142
  492   3HG2  VAL  65          1HG2      VAL  65 -10.270 -13.783 -13.783
  493    HA   PRO  66           HA       PRO  66 -16.500 -17.164 -17.164
  494   1HB   PRO  66          1HB       PRO  66 -16.398 -19.855 -19.855
  495   2HB   PRO  66          2HB       PRO  66 -16.678 -19.190 -19.190
  496   1HG   PRO  66          1HG       PRO  66 -14.221 -20.465 -20.465
  497   2HG   PRO  66          2HG       PRO  66 -14.760 -20.344 -20.344
  498   1HD   PRO  66          1HD       PRO  66 -12.767 -18.742 -18.742
  499   2HD   PRO  66          2HD       PRO  66 -13.524 -18.444 -18.444
  500    H    GLY  67           H        GLY  67 -13.644 -17.294 -17.294
  501   1HA   GLY  67          1HA       GLY  67 -13.925 -16.547 -16.547
  502   2HA   GLY  67          2HA       GLY  67 -14.938 -17.983 -17.983
  503    H    ILE  68           H        ILE  68 -12.040 -17.937 -17.937
  504    HA   ILE  68           HA       ILE  68 -10.936 -20.296 -20.296
  505    HB   ILE  68           HB       ILE  68  -9.485 -17.875 -17.875
  506   1HG1  ILE  68          1HG1      ILE  68 -11.337 -19.686 -19.686
  507   2HG1  ILE  68          2HG1      ILE  68 -10.375 -18.443 -18.443
  508   1HG2  ILE  68          2HG2      ILE  68  -8.014 -19.493 -19.493
  509   2HG2  ILE  68          3HG2      ILE  68  -8.642 -20.780 -20.780
  510   3HG2  ILE  68          1HG2      ILE  68  -7.710 -19.462 -19.462
  511   1HD1  ILE  68          3HD1      ILE  68  -8.475 -20.043 -20.043
  512   2HD1  ILE  68          1HD1      ILE  68  -9.487 -21.285 -21.285
  513   3HD1  ILE  68          2HD1      ILE  68  -9.901 -20.638 -20.638
  514    H    ASP  69           H        ASP  69  -9.917 -16.970 -16.970
  515    HA   ASP  69           HA       ASP  69  -8.361 -17.942 -17.942
  516   1HB   ASP  69          1HB       ASP  69  -7.968 -15.578 -15.578
  517   2HB   ASP  69          2HB       ASP  69  -7.793 -15.854 -15.854
  518    H    THR  70           H        THR  70  -9.030 -16.071 -16.071
  519    HA   THR  70           HA       THR  70 -11.813 -16.897 -16.897
  520    HB   THR  70           HB       THR  70 -10.948 -16.782 -16.782
  521    HG1  THR  70           HG1      THR  70  -8.535 -17.267 -17.267
  522   1HG2  THR  70          1HG2      THR  70 -10.180 -18.815 -18.815
  523   2HG2  THR  70          2HG2      THR  70  -9.540 -18.995 -18.995
  524   3HG2  THR  70          3HG2      THR  70 -11.283 -18.965 -18.965
  525    H    ASN  71           H        ASN  71  -9.747 -14.343 -14.343
  526    HA   ASN  71           HA       ASN  71 -11.640 -12.297 -12.297
  527   1HB   ASN  71          1HB       ASN  71 -10.034 -13.031 -13.031
  528   2HB   ASN  71          2HB       ASN  71 -10.076 -11.309 -11.309
  529   1HD2  ASN  71          2HD2      ASN  71 -13.100 -12.463 -12.463
  530   2HD2  ASN  71          1HD2      ASN  71 -11.456 -12.854 -12.854
  531    H    ALA  72           H        ALA  72 -10.318 -12.448 -12.448
  532    HA   ALA  72           HA       ALA  72  -8.596 -11.575 -11.575
  533   1HB   ALA  72          2HB       ALA  72 -10.068  -9.635  -9.635
  534   2HB   ALA  72          3HB       ALA  72  -8.405  -9.055  -9.055
  535   3HB   ALA  72          1HB       ALA  72  -9.338  -9.458  -9.458
  536    H    CYS  73           H        CYS  73  -7.683 -12.909 -12.909
  537    HA   CYS  73           HA       CYS  73  -5.257 -11.338 -11.338
  538   1HB   CYS  73          1HB       CYS  73  -6.604 -12.322 -12.322
  539   2HB   CYS  73          2HB       CYS  73  -6.370 -13.919 -13.919
  540    H    HIS  74           H        HIS  74  -6.171 -14.658 -14.658
  541    HA   HIS  74           HA       HIS  74  -3.533 -15.573 -15.573
  542   1HB   HIS  74          1HB       HIS  74  -5.854 -16.834 -16.834
  543   2HB   HIS  74          2HB       HIS  74  -5.891 -16.529 -16.529
  544    HD1  HIS  74           HD1      HIS  74  -5.424 -18.937 -18.937
  545    HD2  HIS  74           HD2      HIS  74  -2.529 -17.445 -17.445
  546    HE1  HIS  74           HE1      HIS  74  -3.516 -20.602 -20.602
  547    H    PHE  75           H        PHE  75  -5.477 -13.279 -13.279
  548    HA   PHE  75           HA       PHE  75  -3.952 -13.635 -13.635
  549   1HB   PHE  75          1HB       PHE  75  -6.578 -12.295 -12.295
  550   2HB   PHE  75          2HB       PHE  75  -5.724 -11.962 -11.962
  551    HD1  PHE  75           HD1      PHE  75  -5.460 -13.692 -13.692
  552    HD2  PHE  75           HD2      PHE  75  -7.571 -14.445 -14.445
  553    HE1  PHE  75           HE1      PHE  75  -6.429 -15.748 -15.748
  554    HE2  PHE  75           HE2      PHE  75  -8.532 -16.513 -16.513
  555    HZ   PHE  75           HZ       PHE  75  -7.966 -17.163 -17.163
  556    H    VAL  76           H        VAL  76  -4.473 -11.490 -11.490
  557    HA   VAL  76           HA       VAL  76  -2.422  -9.672  -9.672
  558    HB   VAL  76           HB       VAL  76  -3.944  -8.268  -8.268
  559   1HG1  VAL  76          1HG1      VAL  76  -5.914 -10.085 -10.085
  560   2HG1  VAL  76          2HG1      VAL  76  -6.424  -8.711  -8.711
  561   3HG1  VAL  76          3HG1      VAL  76  -5.498 -10.025 -10.025
  562   1HG2  VAL  76          1HG2      VAL  76  -4.798  -8.076  -8.076
  563   2HG2  VAL  76          2HG2      VAL  76  -3.797  -6.932  -6.932
  564   3HG2  VAL  76          3HG2      VAL  76  -5.519  -7.069  -7.069
  565    H    LYS  77           H        LYS  77  -2.251  -7.699  -7.699
  566    HA   LYS  77           HA       LYS  77  -1.535  -8.787  -8.787
  567   1HB   LYS  77          1HB       LYS  77  -2.143  -5.877  -5.877
  568   2HB   LYS  77          2HB       LYS  77  -1.014  -6.547  -6.547
  569   1HG   LYS  77          1HG       LYS  77  -0.753  -6.594  -6.594
  570   2HG   LYS  77          2HG       LYS  77   0.287  -5.748  -5.748
  571   1HD   LYS  77          1HD       LYS  77  -0.065  -8.758  -8.758
  572   2HD   LYS  77          2HD       LYS  77   1.293  -7.885  -7.885
  573   1HE   LYS  77          1HE       LYS  77   1.185  -6.878  -6.878
  574   2HE   LYS  77          2HE       LYS  77   0.787  -8.582  -8.582
  575   1HZ   LYS  77          1HZ       LYS  77   2.877  -8.423  -8.423
  576   2HZ   LYS  77          2HZ       LYS  77   3.291  -7.431  -7.431
  577   3HZ   LYS  77          3HZ       LYS  77   2.913  -9.068  -9.068
  578    H    CYS  78           H        CYS  78  -3.440  -9.861  -9.861
  579    HA   CYS  78           HA       CYS  78  -6.030  -9.328  -9.328
  580   1HB   CYS  78          1HB       CYS  78  -5.317  -9.756  -9.756
  581   2HB   CYS  78          2HB       CYS  78  -6.121 -10.842 -10.842
  582    HA   PRO  79           HA       PRO  79  -6.068  -6.046  -6.046
  583   1HB   PRO  79          1HB       PRO  79  -3.697  -5.011  -5.011
  584   2HB   PRO  79          2HB       PRO  79  -4.544  -6.359  -6.359
  585   1HG   PRO  79          1HG       PRO  79  -2.103  -6.411  -6.411
  586   2HG   PRO  79          2HG       PRO  79  -2.638  -7.542  -7.542
  587   1HD   PRO  79          1HD       PRO  79  -2.840  -7.962  -7.962
  588   2HD   PRO  79          2HD       PRO  79  -3.668  -8.906  -8.906
  589    H    LEU  80           H        LEU  80  -6.841  -4.606  -4.606
  590    HA   LEU  80           HA       LEU  80  -4.939  -3.203  -3.203
  591   1HB   LEU  80          1HB       LEU  80  -7.955  -3.262  -3.262
  592   2HB   LEU  80          2HB       LEU  80  -7.110  -2.164  -2.164
  593    HG   LEU  80           HG       LEU  80  -7.908  -4.756  -4.756
  594   1HD1  LEU  80          3HD1      LEU  80  -6.836  -2.525  -2.525
  595   2HD1  LEU  80          1HD1      LEU  80  -5.702  -3.824  -3.824
  596   3HD1  LEU  80          2HD1      LEU  80  -7.409  -4.003  -4.003
  597   1HD2  LEU  80          1HD2      LEU  80  -4.901  -4.693  -4.693
  598   2HD2  LEU  80          2HD2      LEU  80  -6.050  -5.710  -5.710
  599   3HD2  LEU  80          3HD2      LEU  80  -5.782  -5.963  -5.963
  600    H    VAL  81           H        VAL  81  -7.773  -2.184  -2.184
  601    HA   VAL  81           HA       VAL  81  -8.152  -0.176  -0.176
  602    HB   VAL  81           HB       VAL  81  -7.450  -0.807  -0.807
  603   1HG1  VAL  81          3HG1      VAL  81  -6.978  -2.910  -2.910
  604   2HG1  VAL  81          1HG1      VAL  81  -5.279  -2.419  -2.419
  605   3HG1  VAL  81          2HG1      VAL  81  -6.035  -2.692  -2.692
  606   1HG2  VAL  81          2HG2      VAL  81  -4.860   0.320   0.320
  607   2HG2  VAL  81          3HG2      VAL  81  -5.888   0.883   0.883
  608   3HG2  VAL  81          1HG2      VAL  81  -4.880  -0.549  -0.549
  609    H    LYS  82           H        LYS  82  -6.519   1.859   1.859
  610    HA   LYS  82           HA       LYS  82  -5.508   2.822   2.822
  611   1HB   LYS  82          1HB       LYS  82  -5.650   5.072   5.072
  612   2HB   LYS  82          2HB       LYS  82  -7.199   4.214   4.214
  613   1HG   LYS  82          1HG       LYS  82  -5.748   3.318   3.318
  614   2HG   LYS  82          2HG       LYS  82  -5.689   5.084   5.084
  615   1HD   LYS  82          1HD       LYS  82  -8.340   4.330   4.330
  616   2HD   LYS  82          2HD       LYS  82  -7.900   3.378   3.378
  617   1HE   LYS  82          1HE       LYS  82  -8.515   5.231   5.231
  618   2HE   LYS  82          2HE       LYS  82  -6.931   5.844   5.844
  619   1HZ   LYS  82          3HZ       LYS  82  -8.346   6.438   6.438
  620   2HZ   LYS  82          1HZ       LYS  82  -9.568   6.552   6.552
  621   3HZ   LYS  82          2HZ       LYS  82  -8.167   7.502   7.502
  622    H    GLY  83           H        GLY  83  -3.825   1.061   1.061
  623   1HA   GLY  83          1HA       GLY  83  -1.591   2.913   2.913
  624   2HA   GLY  83          2HA       GLY  83  -1.957   1.621   1.621
  625    H    GLN  84           H        GLN  84  -2.315   1.136   1.136
  626    HA   GLN  84           HA       GLN  84   0.327  -0.077  -0.077
  627   1HB   GLN  84          1HB       GLN  84  -0.600  -1.896  -1.896
  628   2HB   GLN  84          2HB       GLN  84  -2.139  -1.774  -1.774
  629   1HG   GLN  84          1HG       GLN  84  -1.303  -3.502  -3.502
  630   2HG   GLN  84          2HG       GLN  84  -0.459  -2.227  -2.227
  631   1HE2  GLN  84          2HE2      GLN  84   1.640  -4.706  -4.706
  632   2HE2  GLN  84          1HE2      GLN  84  -0.057  -4.737  -4.737
  633    H    GLN  85           H        GLN  85   0.869  -0.388  -0.388
  634    HA   GLN  85           HA       GLN  85  -1.171   0.304   0.304
  635   1HB   GLN  85          1HB       GLN  85   1.047   1.689   1.689
  636   2HB   GLN  85          2HB       GLN  85   1.803   0.315   0.315
  637   1HG   GLN  85          1HG       GLN  85   0.255   0.572   0.572
  638   2HG   GLN  85          2HG       GLN  85  -0.507   1.944   1.944
  639   1HE2  GLN  85          2HE2      GLN  85   3.419   2.523   2.523
  640   2HE2  GLN  85          1HE2      GLN  85   2.968   1.040   1.040
  641    H    TYR  86           H        TYR  86  -1.387  -1.242  -1.242
  642    HA   TYR  86           HA       TYR  86   0.497  -3.476  -3.476
  643   1HB   TYR  86          1HB       TYR  86  -0.629  -4.958  -4.958
  644   2HB   TYR  86          2HB       TYR  86  -1.549  -3.583  -3.583
  645    HD1  TYR  86           HD1      TYR  86  -1.419  -5.995  -5.995
  646    HD2  TYR  86           HD2      TYR  86  -3.876  -3.549  -3.549
  647    HE1  TYR  86           HE1      TYR  86  -3.427  -7.049  -7.049
  648    HE2  TYR  86           HE2      TYR  86  -5.891  -4.668  -4.668
  649    HH   TYR  86           HH       TYR  86  -6.499  -6.748  -6.748
  650    H    ASP  87           H        ASP  87  -0.055  -5.033  -5.033
  651    HA   ASP  87           HA       ASP  87  -1.854  -3.701  -3.701
  652   1HB   ASP  87          1HB       ASP  87  -0.161  -4.143  -4.143
  653   2HB   ASP  87          2HB       ASP  87   0.510  -3.165  -3.165
  654    H    ILE  88           H        ILE  88  -3.525  -5.325  -5.325
  655    HA   ILE  88           HA       ILE  88  -3.131  -8.137  -8.137
  656    HB   ILE  88           HB       ILE  88  -5.254  -6.655  -6.655
  657   1HG1  ILE  88          1HG1      ILE  88  -6.480  -8.678  -8.678
  658   2HG1  ILE  88          2HG1      ILE  88  -4.884  -9.348  -9.348
  659   1HG2  ILE  88          2HG2      ILE  88  -4.870  -5.704  -5.704
  660   2HG2  ILE  88          3HG2      ILE  88  -5.716  -7.171  -7.171
  661   3HG2  ILE  88          1HG2      ILE  88  -6.510  -6.019  -6.019
  662   1HD1  ILE  88          2HD1      ILE  88  -5.319  -8.289  -8.289
  663   2HD1  ILE  88          3HD1      ILE  88  -7.014  -8.410  -8.410
  664   3HD1  ILE  88          1HD1      ILE  88  -6.016  -9.864  -9.864
  665    H    LYS  89           H        LYS  89  -4.433  -8.927  -8.927
  666    HA   LYS  89           HA       LYS  89  -3.742  -7.753  -7.753
  667   1HB   LYS  89          1HB       LYS  89  -1.354  -8.569  -8.569
  668   2HB   LYS  89          2HB       LYS  89  -1.464  -9.370  -9.370
  669   1HG   LYS  89          1HG       LYS  89  -2.153  -6.930  -6.930
  670   2HG   LYS  89          2HG       LYS  89  -1.240  -6.446  -6.446
  671   1HD   LYS  89          1HD       LYS  89   0.325  -8.427  -8.427
  672   2HD   LYS  89          2HD       LYS  89  -0.257  -7.405  -7.405
  673   1HE   LYS  89          1HE       LYS  89   0.555  -5.405  -5.405
  674   2HE   LYS  89          2HE       LYS  89   1.082  -6.389  -6.389
  675   1HZ   LYS  89          3HZ       LYS  89   2.054  -6.929  -6.929
  676   2HZ   LYS  89          1HZ       LYS  89   2.800  -5.759  -5.759
  677   3HZ   LYS  89          2HZ       LYS  89   2.747  -7.379  -7.379
  678    H    TYR  90           H        TYR  90  -3.084  -9.426  -9.426
  679    HA   TYR  90           HA       TYR  90  -3.844 -12.239 -12.239
  680   1HB   TYR  90          1HB       TYR  90  -5.734 -10.278 -10.278
  681   2HB   TYR  90          2HB       TYR  90  -5.806 -12.024 -12.024
  682    HD1  TYR  90           HD1      TYR  90  -5.895 -13.542 -13.542
  683    HD2  TYR  90           HD2      TYR  90  -6.751  -9.335  -9.335
  684    HE1  TYR  90           HE1      TYR  90  -7.047 -13.826 -13.826
  685    HE2  TYR  90           HE2      TYR  90  -7.910  -9.616  -9.616
  686    HH   TYR  90           HH       TYR  90  -7.815 -12.657 -12.657
  687    H    THR  91           H        THR  91  -1.611 -12.068 -12.068
  688    HA   THR  91           HA       THR  91  -0.770 -10.942 -10.942
  689    HB   THR  91           HB       THR  91   0.909 -12.717 -12.717
  690    HG1  THR  91           HG1      THR  91   0.668 -14.496 -14.496
  691   1HG2  THR  91          3HG2      THR  91   0.406 -11.076 -11.076
  692   2HG2  THR  91          1HG2      THR  91   0.778 -12.655 -12.655
  693   3HG2  THR  91          2HG2      THR  91   1.930 -11.872 -11.872
  694    H    TRP  92           H        TRP  92  -0.060 -12.588 -12.588
  695    HA   TRP  92           HA       TRP  92  -2.209 -14.381 -14.381
  696   1HB   TRP  92          1HB       TRP  92  -3.045 -11.955 -11.955
  697   2HB   TRP  92          2HB       TRP  92  -1.886 -11.874 -11.874
  698    HD1  TRP  92           HD1      TRP  92  -2.110 -14.171 -14.171
  699    HE1  TRP  92           HE1      TRP  92  -4.297 -15.058 -15.058
  700    HE3  TRP  92           HE3      TRP  92  -5.493 -12.119 -12.119
  701    HZ2  TRP  92           HZ2      TRP  92  -7.100 -14.907 -14.907
  702    HZ3  TRP  92           HZ3      TRP  92  -7.917 -12.511 -12.511
  703    HH2  TRP  92           HH2      TRP  92  -8.729 -13.906 -13.906
  704    H    ASN  93           H        ASN  93  -0.528 -15.869 -15.869
  705    HA   ASN  93           HA       ASN  93   1.672 -15.098 -15.098
  706   1HB   ASN  93          1HB       ASN  93   1.644 -17.082 -17.082
  707   2HB   ASN  93          2HB       ASN  93   0.649 -17.914 -17.914
  708   1HD2  ASN  93          2HD2      ASN  93   4.102 -18.870 -18.870
  709   2HD2  ASN  93          1HD2      ASN  93   2.974 -19.198 -19.198
  710    H    VAL  94           H        VAL  94   0.973 -14.364 -14.364
  711    HA   VAL  94           HA       VAL  94  -1.261 -15.824 -15.824
  712    HB   VAL  94           HB       VAL  94  -0.059 -13.116 -13.116
  713   1HG1  VAL  94          3HG1      VAL  94  -1.056 -14.836 -14.836
  714   2HG1  VAL  94          1HG1      VAL  94  -1.799 -13.243 -13.243
  715   3HG1  VAL  94          2HG1      VAL  94  -0.049 -13.398 -13.398
  716   1HG2  VAL  94          1HG2      VAL  94  -2.654 -14.415 -14.415
  717   2HG2  VAL  94          2HG2      VAL  94  -1.982 -12.900 -12.900
  718   3HG2  VAL  94          3HG2      VAL  94  -2.750 -12.955 -12.955
  719    HA   PRO  95           HA       PRO  95   1.764 -17.812 -17.812
  720   1HB   PRO  95          1HB       PRO  95  -0.056 -19.687 -19.687
  721   2HB   PRO  95          2HB       PRO  95   0.850 -19.851 -19.851
  722   1HG   PRO  95          1HG       PRO  95  -2.012 -19.175 -19.175
  723   2HG   PRO  95          2HG       PRO  95  -1.229 -19.897 -19.897
  724   1HD   PRO  95          1HD       PRO  95  -2.035 -17.196 -17.196
  725   2HD   PRO  95          2HD       PRO  95  -1.002 -17.863 -17.863
  726    H    LYS  96           H        LYS  96  -1.316 -18.462 -18.462
  727    HA   LYS  96           HA       LYS  96  -0.953 -16.270 -16.270
  728   1HB   LYS  96          1HB       LYS  96  -0.905 -19.188 -19.188
  729   2HB   LYS  96          2HB       LYS  96  -2.044 -18.312 -18.312
  730   1HG   LYS  96          1HG       LYS  96   0.515 -16.923 -16.923
  731   2HG   LYS  96          2HG       LYS  96   0.693 -18.539 -18.539
  732   1HD   LYS  96          1HD       LYS  96  -1.220 -17.952 -17.952
  733   2HD   LYS  96          2HD       LYS  96  -1.061 -16.288 -16.288
  734   1HE   LYS  96          1HE       LYS  96   1.473 -17.587 -17.587
  735   2HE   LYS  96          2HE       LYS  96   0.328 -17.302 -17.302
  736   1HZ   LYS  96          3HZ       LYS  96   0.169 -14.986 -14.986
  737   2HZ   LYS  96          1HZ       LYS  96   1.312 -15.273 -15.273
  738   3HZ   LYS  96          2HZ       LYS  96   1.764 -15.400 -15.400
  739    H    ILE  97           H        ILE  97  -2.983 -18.861 -18.861
  740    HA   ILE  97           HA       ILE  97  -5.217 -18.937 -18.937
  741    HB   ILE  97           HB       ILE  97  -5.008 -15.928 -15.928
  742   1HG1  ILE  97          1HG1      ILE  97  -4.420 -17.142 -17.142
  743   2HG1  ILE  97          2HG1      ILE  97  -3.337 -17.840 -17.840
  744   1HG2  ILE  97          1HG2      ILE  97  -6.854 -17.981 -17.981
  745   2HG2  ILE  97          2HG2      ILE  97  -6.358 -16.764 -16.764
  746   3HG2  ILE  97          3HG2      ILE  97  -7.142 -16.271 -16.271
  747   1HD1  ILE  97          3HD1      ILE  97  -3.791 -14.885 -14.885
  748   2HD1  ILE  97          1HD1      ILE  97  -2.750 -15.540 -15.540
  749   3HD1  ILE  97          2HD1      ILE  97  -2.358 -15.817 -15.817
  750    H    ALA  98           H        ALA  98  -4.357 -17.759 -17.759
  751    HA   ALA  98           HA       ALA  98  -5.602 -17.286 -17.286
  752   1HB   ALA  98          1HB       ALA  98  -6.688 -19.509 -19.509
  753   2HB   ALA  98          2HB       ALA  98  -8.078 -18.499 -18.499
  754   3HB   ALA  98          3HB       ALA  98  -6.982 -19.034 -19.034
  755    HA   PRO  99           HA       PRO  99  -8.362 -13.912 -13.912
  756   1HB   PRO  99          1HB       PRO  99 -10.142 -14.203 -14.203
  757   2HB   PRO  99          2HB       PRO  99  -8.452 -13.743 -13.743
  758   1HG   PRO  99          1HG       PRO  99  -9.788 -16.386 -16.386
  759   2HG   PRO  99          2HG       PRO  99  -8.488 -15.655 -15.655
  760   1HD   PRO  99          1HD       PRO  99  -8.101 -17.631 -17.631
  761   2HD   PRO  99          2HD       PRO  99  -6.827 -16.520 -16.520
  762    H    LYS 100           H        LYS 100 -10.398 -13.422 -13.422
  763    HA   LYS 100           HA       LYS 100 -12.367 -13.883 -13.883
  764   1HB   LYS 100          1HB       LYS 100 -12.427 -15.898 -15.898
  765   2HB   LYS 100          2HB       LYS 100 -13.833 -15.523 -15.523
  766   1HG   LYS 100          1HG       LYS 100 -12.299 -13.588 -13.588
  767   2HG   LYS 100          2HG       LYS 100 -13.909 -14.230 -14.230
  768   1HD   LYS 100          1HD       LYS 100 -13.797 -13.037 -13.037
  769   2HD   LYS 100          2HD       LYS 100 -13.279 -11.882 -11.882
  770   1HE   LYS 100          1HE       LYS 100 -15.372 -11.695 -11.695
  771   2HE   LYS 100          2HE       LYS 100 -15.623 -13.440 -13.440
  772   1HZ   LYS 100          1HZ       LYS 100 -15.548 -12.484 -12.484
  773   2HZ   LYS 100          2HZ       LYS 100 -16.650 -11.540 -11.540
  774   3HZ   LYS 100          3HZ       LYS 100 -16.834 -13.227 -13.227
  775    H    SER 101           H        SER 101 -12.795 -14.957 -14.957
  776    HA   SER 101           HA       SER 101 -11.432 -17.584 -17.584
  777   1HB   SER 101          1HB       SER 101 -10.687 -15.819 -15.819
  778   2HB   SER 101          2HB       SER 101 -12.355 -15.514 -15.514
  779    HG   SER 101           HG       SER 101 -11.765 -16.934 -16.934
  780    H    GLU 102           H        GLU 102 -12.657 -19.295 -19.295
  781    HA   GLU 102           HA       GLU 102 -15.267 -19.701 -19.701
  782   1HB   GLU 102          1HB       GLU 102 -13.540 -20.843 -20.843
  783   2HB   GLU 102          2HB       GLU 102 -15.260 -20.991 -20.991
  784   1HG   GLU 102          1HG       GLU 102 -15.668 -22.354 -22.354
  785   2HG   GLU 102          2HG       GLU 102 -14.375 -21.638 -21.638
  786    H    ASN 103           H        ASN 103 -14.169 -17.804 -17.804
  787    HA   ASN 103           HA       ASN 103 -16.545 -16.277 -16.277
  788   1HB   ASN 103          1HB       ASN 103 -17.257 -18.687 -18.687
  789   2HB   ASN 103          2HB       ASN 103 -16.471 -18.161 -18.161
  790   1HD2  ASN 103          2HD2      ASN 103 -20.169 -16.892 -16.892
  791   2HD2  ASN 103          1HD2      ASN 103 -19.462 -18.250 -18.250
  792    H    VAL 104           H        VAL 104 -16.454 -14.766 -14.766
  793    HA   VAL 104           HA       VAL 104 -14.142 -14.940 -14.940
  794    HB   VAL 104           HB       VAL 104 -14.161 -12.362 -12.362
  795   1HG1  VAL 104          1HG1      VAL 104 -12.510 -13.616 -13.616
  796   2HG1  VAL 104          2HG1      VAL 104 -11.768 -14.117 -14.117
  797   3HG1  VAL 104          3HG1      VAL 104 -11.942 -12.402 -12.402
  798   1HG2  VAL 104          3HG2      VAL 104 -14.630 -14.045 -14.045
  799   2HG2  VAL 104          1HG2      VAL 104 -13.112 -13.164 -13.164
  800   3HG2  VAL 104          2HG2      VAL 104 -13.103 -14.823 -14.823
  801    H    VAL 105           H        VAL 105 -14.154 -13.135 -13.135
  802    HA   VAL 105           HA       VAL 105 -16.267 -11.218 -11.218
  803    HB   VAL 105           HB       VAL 105 -16.897 -13.932 -13.932
  804   1HG1  VAL 105          2HG1      VAL 105 -17.118 -11.594 -11.594
  805   2HG1  VAL 105          3HG1      VAL 105 -18.073 -13.068 -13.068
  806   3HG1  VAL 105          1HG1      VAL 105 -16.314 -13.139 -13.139
  807   1HG2  VAL 105          3HG2      VAL 105 -18.368 -11.350 -11.350
  808   2HG2  VAL 105          1HG2      VAL 105 -18.432 -12.858 -12.858
  809   3HG2  VAL 105          2HG2      VAL 105 -19.198 -12.753 -12.753
  810    H    VAL 106           H        VAL 106 -15.196  -9.687  -9.687
  811    HA   VAL 106           HA       VAL 106 -13.372 -10.642 -10.642
  812    HB   VAL 106           HB       VAL 106 -13.393  -8.022  -8.022
  813   1HG1  VAL 106          1HG1      VAL 106 -12.229  -8.763  -8.763
  814   2HG1  VAL 106          2HG1      VAL 106 -10.951  -8.446  -8.446
  815   3HG1  VAL 106          3HG1      VAL 106 -12.163  -7.211  -7.211
  816   1HG2  VAL 106          2HG2      VAL 106 -12.625 -10.094 -10.094
  817   2HG2  VAL 106          3HG2      VAL 106 -11.388  -8.849  -8.849
  818   3HG2  VAL 106          1HG2      VAL 106 -11.360 -10.270 -10.270
  819    H    THR 107           H        THR 107 -13.477  -9.633  -9.633
  820    HA   THR 107           HA       THR 107 -15.277  -7.448  -7.448
  821    HB   THR 107           HB       THR 107 -16.102 -10.139 -10.139
  822    HG1  THR 107           HG1      THR 107 -17.675 -10.184 -10.184
  823   1HG2  THR 107          1HG2      THR 107 -17.293  -7.363  -7.363
  824   2HG2  THR 107          2HG2      THR 107 -18.244  -8.789  -8.789
  825   3HG2  THR 107          3HG2      THR 107 -16.863  -8.329  -8.329
  826    H    VAL 108           H        VAL 108 -15.097  -6.888  -6.888
  827    HA   VAL 108           HA       VAL 108 -13.454  -8.519  -8.519
  828    HB   VAL 108           HB       VAL 108 -12.190  -6.386  -6.386
  829   1HG1  VAL 108          1HG1      VAL 108 -11.388  -6.940  -6.940
  830   2HG1  VAL 108          2HG1      VAL 108 -10.473  -5.966  -5.966
  831   3HG1  VAL 108          3HG1      VAL 108 -12.061  -5.427  -5.427
  832   1HG2  VAL 108          2HG2      VAL 108 -11.584  -9.121  -9.121
  833   2HG2  VAL 108          3HG2      VAL 108 -11.291  -8.418  -8.418
  834   3HG2  VAL 108          1HG2      VAL 108 -10.212  -8.045  -8.045
  835    H    LYS 109           H        LYS 109 -12.948  -7.398  -7.398
  836    HA   LYS 109           HA       LYS 109 -13.845  -4.813  -4.813
  837   1HB   LYS 109          1HB       LYS 109 -16.105  -5.319  -5.319
  838   2HB   LYS 109          2HB       LYS 109 -15.897  -6.993  -6.993
  839   1HG   LYS 109          1HG       LYS 109 -16.077  -6.462  -6.462
  840   2HG   LYS 109          2HG       LYS 109 -15.164  -4.966  -4.966
  841   1HD   LYS 109          1HD       LYS 109 -17.456  -4.402  -4.402
  842   2HD   LYS 109          2HD       LYS 109 -17.158  -3.934  -3.934
  843   1HE   LYS 109          1HE       LYS 109 -18.075  -6.287  -6.287
  844   2HE   LYS 109          2HE       LYS 109 -18.722  -6.291  -6.291
  845   1HZ   LYS 109          2HZ       LYS 109 -19.187  -3.905  -3.905
  846   2HZ   LYS 109          3HZ       LYS 109 -20.055  -5.301  -5.301
  847   3HZ   LYS 109          1HZ       LYS 109 -20.196  -4.662  -4.662
  848    H    LEU 110           H        LEU 110 -12.848  -4.381  -4.381
  849    HA   LEU 110           HA       LEU 110 -12.151  -6.680  -6.680
  850   1HB   LEU 110          1HB       LEU 110 -10.268  -5.325  -5.325
  851   2HB   LEU 110          2HB       LEU 110 -10.731  -4.013  -4.013
  852    HG   LEU 110           HG       LEU 110 -10.451  -5.604  -5.604
  853   1HD1  LEU 110          3HD1      LEU 110  -9.293  -7.338  -7.338
  854   2HD1  LEU 110          1HD1      LEU 110  -9.081  -7.646  -7.646
  855   3HD1  LEU 110          2HD1      LEU 110 -10.691  -7.710  -7.710
  856   1HD2  LEU 110          2HD2      LEU 110  -8.186  -4.845  -4.845
  857   2HD2  LEU 110          3HD2      LEU 110  -8.645  -4.121  -4.121
  858   3HD2  LEU 110          1HD2      LEU 110  -7.863  -5.702  -5.702
  859    H    ILE 111           H        ILE 111 -13.221  -6.643  -6.643
  860    HA   ILE 111           HA       ILE 111 -14.276  -4.014  -4.014
  861    HB   ILE 111           HB       ILE 111 -15.529  -6.686  -6.686
  862   1HG1  ILE 111          1HG1      ILE 111 -16.319  -4.840  -4.840
  863   2HG1  ILE 111          2HG1      ILE 111 -15.290  -6.255  -6.255
  864   1HG2  ILE 111          1HG2      ILE 111 -16.002  -4.253  -4.253
  865   2HG2  ILE 111          2HG2      ILE 111 -17.064  -4.153  -4.153
  866   3HG2  ILE 111          3HG2      ILE 111 -17.276  -5.451  -5.451
  867   1HD1  ILE 111          1HD1      ILE 111 -17.382  -7.284  -7.284
  868   2HD1  ILE 111          2HD1      ILE 111 -18.192  -6.105  -6.105
  869   3HD1  ILE 111          3HD1      ILE 111 -17.229  -7.394  -7.394
  870    H    GLY 112           H        GLY 112 -13.124  -3.467  -3.467
  871   1HA   GLY 112          1HA       GLY 112 -11.926  -5.546  -5.546
  872   2HA   GLY 112          2HA       GLY 112 -11.822  -3.806  -3.806
  873    H    ASP 113           H        ASP 113 -13.165  -2.935  -2.935
  874    HA   ASP 113           HA       ASP 113 -15.612  -4.423  -4.423
  875   1HB   ASP 113          1HB       ASP 113 -13.339  -4.701  -4.701
  876   2HB   ASP 113          2HB       ASP 113 -14.065  -3.281  -3.281
  877    H    ASN 114           H        ASN 114 -14.305  -1.693  -1.693
  878    HA   ASN 114           HA       ASN 114 -16.185  -0.003  -0.003
  879   1HB   ASN 114          1HB       ASN 114 -13.698   1.045   1.045
  880   2HB   ASN 114          2HB       ASN 114 -14.677   1.820   1.820
  881   1HD2  ASN 114          2HD2      ASN 114 -12.070  -1.167  -1.167
  882   2HD2  ASN 114          1HD2      ASN 114 -12.602  -1.083  -1.083
  883    H    GLY 115           H        GLY 115 -15.134  -1.143  -1.143
  884   1HA   GLY 115          1HA       GLY 115 -17.379  -0.223  -0.223
  885   2HA   GLY 115          2HA       GLY 115 -16.106   0.976   0.976
  886    H    VAL 116           H        VAL 116 -15.814   0.448   0.448
  887    HA   VAL 116           HA       VAL 116 -14.797  -2.312  -2.312
  888    HB   VAL 116           HB       VAL 116 -16.550  -1.980  -1.980
  889   1HG1  VAL 116          3HG1      VAL 116 -15.671   0.882   0.882
  890   2HG1  VAL 116          1HG1      VAL 116 -16.554   0.342   0.342
  891   3HG1  VAL 116          2HG1      VAL 116 -17.289   0.200   0.200
  892   1HG2  VAL 116          2HG2      VAL 116 -14.158  -2.313  -2.313
  893   2HG2  VAL 116          3HG2      VAL 116 -15.527  -1.961  -1.961
  894   3HG2  VAL 116          1HG2      VAL 116 -14.406  -0.677  -0.677
  895    H    LEU 117           H        LEU 117 -12.616  -2.212  -2.212
  896    HA   LEU 117           HA       LEU 117 -10.902  -0.015  -0.015
  897   1HB   LEU 117          1HB       LEU 117 -10.275  -2.923  -2.923
  898   2HB   LEU 117          2HB       LEU 117  -9.084  -1.666  -1.666
  899    HG   LEU 117           HG       LEU 117 -11.220  -1.802  -1.802
  900   1HD1  LEU 117          1HD1      LEU 117 -10.929  -4.235  -4.235
  901   2HD1  LEU 117          2HD1      LEU 117  -9.255  -4.105  -4.105
  902   3HD1  LEU 117          3HD1      LEU 117 -10.572  -3.893  -3.893
  903   1HD2  LEU 117          3HD2      LEU 117  -8.299  -1.382  -1.382
  904   2HD2  LEU 117          1HD2      LEU 117  -9.471  -0.575  -0.575
  905   3HD2  LEU 117          2HD2      LEU 117  -8.821  -2.148  -2.148
  906    H    ALA 118           H        ALA 118 -11.612  -2.479  -2.479
  907    HA   ALA 118           HA       ALA 118 -10.907  -0.435  -0.435
  908   1HB   ALA 118          3HB       ALA 118  -9.695  -3.186  -3.186
  909   2HB   ALA 118          1HB       ALA 118  -9.676  -2.298  -2.298
  910   3HB   ALA 118          2HB       ALA 118  -8.859  -1.637  -1.637
  911    H    CYS 119           H        CYS 119 -11.264  -1.738  -1.738
  912    HA   CYS 119           HA       CYS 119 -13.327  -3.686  -3.686
  913   1HB   CYS 119          1HB       CYS 119 -15.104  -2.443  -2.443
  914   2HB   CYS 119          2HB       CYS 119 -14.213  -0.929  -0.929
  915    H    ALA 120           H        ALA 120 -14.048  -4.018  -4.018
  916    HA   ALA 120           HA       ALA 120 -13.243  -2.315  -2.315
  917   1HB   ALA 120          2HB       ALA 120 -10.991  -3.147  -3.147
  918   2HB   ALA 120          3HB       ALA 120 -11.529  -4.787  -4.787
  919   3HB   ALA 120          1HB       ALA 120 -11.389  -3.596  -3.596
  920    H    ILE 121           H        ILE 121 -14.616  -2.859  -2.859
  921    HA   ILE 121           HA       ILE 121 -15.391  -5.720  -5.720
  922    HB   ILE 121           HB       ILE 121 -17.344  -3.400  -3.400
  923   1HG1  ILE 121          1HG1      ILE 121 -17.935  -5.392  -5.392
  924   2HG1  ILE 121          2HG1      ILE 121 -16.218  -5.019  -5.019
  925   1HG2  ILE 121          3HG2      ILE 121 -17.478  -6.012  -6.012
  926   2HG2  ILE 121          1HG2      ILE 121 -18.560  -5.975  -5.975
  927   3HG2  ILE 121          2HG2      ILE 121 -18.751  -4.795  -4.795
  928   1HD1  ILE 121          2HD1      ILE 121 -18.172  -2.763  -2.763
  929   2HD1  ILE 121          3HD1      ILE 121 -18.012  -3.558  -3.558
  930   3HD1  ILE 121          1HD1      ILE 121 -16.611  -2.788  -2.788
  931    H    ALA 122           H        ALA 122 -15.362  -6.337  -6.337
  932    HA   ALA 122           HA       ALA 122 -15.242  -4.161  -4.161
  933   1HB   ALA 122          2HB       ALA 122 -13.334  -6.029  -6.029
  934   2HB   ALA 122          3HB       ALA 122 -14.334  -6.903  -6.903
  935   3HB   ALA 122          1HB       ALA 122 -13.637  -5.343  -5.343
  936    H    THR 123           H        THR 123 -17.596  -4.146  -4.146
  937    HA   THR 123           HA       THR 123 -19.369  -6.224  -6.224
  938    HB   THR 123           HB       THR 123 -19.586  -3.987  -3.987
  939    HG1  THR 123           HG1      THR 123 -20.138  -2.592  -2.592
  940   1HG2  THR 123          1HG2      THR 123 -21.285  -5.930  -5.930
  941   2HG2  THR 123          2HG2      THR 123 -21.760  -4.421  -4.421
  942   3HG2  THR 123          3HG2      THR 123 -21.764  -4.543  -4.543
  943    H    HIS 124           H        HIS 124 -19.125  -8.031  -8.031
  944    HA   HIS 124           HA       HIS 124 -18.713  -9.415  -9.415
  945   1HB   HIS 124          1HB       HIS 124 -19.476  -6.794  -6.794
  946   2HB   HIS 124          2HB       HIS 124 -18.908  -8.113  -8.113
  947    HD1  HIS 124           HD1      HIS 124 -21.888  -6.875  -6.875
  948    HD2  HIS 124           HD2      HIS 124 -20.510 -10.601 -10.601
  949    HE1  HIS 124           HE1      HIS 124 -23.902  -8.411  -8.411
  950    H    GLY 125           H        GLY 125 -17.047  -9.969  -9.969
  951   1HA   GLY 125          1HA       GLY 125 -14.838  -8.151  -8.151
  952   2HA   GLY 125          2HA       GLY 125 -14.430  -9.377  -9.377
  953    H    LYS 126           H        LYS 126 -14.563  -8.754  -8.754
  954    HA   LYS 126           HA       LYS 126 -14.575 -11.686 -11.686
  955   1HB   LYS 126          1HB       LYS 126 -15.628  -9.306  -9.306
  956   2HB   LYS 126          2HB       LYS 126 -14.905 -10.574 -10.574
  957   1HG   LYS 126          1HG       LYS 126 -16.479 -12.168 -12.168
  958   2HG   LYS 126          2HG       LYS 126 -16.867 -11.318 -11.318
  959   1HD   LYS 126          1HD       LYS 126 -18.025  -9.570  -9.570
  960   2HD   LYS 126          2HD       LYS 126 -17.536 -10.284 -10.284
  961   1HE   LYS 126          1HE       LYS 126 -18.973 -12.118 -12.118
  962   2HE   LYS 126          2HE       LYS 126 -19.081 -11.922 -11.922
  963   1HZ   LYS 126          2HZ       LYS 126 -20.221  -9.755  -9.755
  964   2HZ   LYS 126          3HZ       LYS 126 -20.327 -10.240 -10.240
  965   3HZ   LYS 126          1HZ       LYS 126 -21.103 -11.145 -11.145
  966    H    ILE 127           H        ILE 127 -12.748 -12.552 -12.552
  967    HA   ILE 127           HA       ILE 127 -10.372 -10.857 -10.857
  968    HB   ILE 127           HB       ILE 127 -10.925 -13.815 -13.815
  969   1HG1  ILE 127          1HG1      ILE 127  -8.984 -13.652 -13.652
  970   2HG1  ILE 127          2HG1      ILE 127  -9.575 -11.995 -11.995
  971   1HG2  ILE 127          1HG2      ILE 127  -8.560 -12.222 -12.222
  972   2HG2  ILE 127          2HG2      ILE 127  -8.283 -13.809 -13.809
  973   3HG2  ILE 127          3HG2      ILE 127  -9.299 -13.656 -13.656
  974   1HD1  ILE 127          1HD1      ILE 127 -11.825 -13.771 -13.771
  975   2HD1  ILE 127          2HD1      ILE 127 -10.710 -14.354 -14.354
  976   3HD1  ILE 127          3HD1      ILE 127 -11.341 -12.709 -12.709
  977    H    ARG 128           H        ARG 128  -9.199 -10.676 -10.676
  978    HA   ARG 128           HA       ARG 128  -9.324 -11.572 -11.572
  979   1HB   ARG 128          1HB       ARG 128 -11.585 -11.952 -11.952
  980   2HB   ARG 128          2HB       ARG 128 -12.042 -10.416 -10.416
  981   1HG   ARG 128          1HG       ARG 128 -10.394  -9.934  -9.934
  982   2HG   ARG 128          2HG       ARG 128 -11.740 -10.985 -10.985
  983   1HD   ARG 128          1HD       ARG 128 -12.699  -8.915  -8.915
  984   2HD   ARG 128          2HD       ARG 128 -11.809  -8.178  -8.178
  985    HE   ARG 128           HE       ARG 128 -14.253  -9.842  -9.842
  986   1HH1  ARG 128          1HH2      ARG 128 -13.314 -10.675 -10.675
  987   2HH1  ARG 128          2HH2      ARG 128 -13.361  -9.339  -9.339
  988   1HH2  ARG 128          1HH1      ARG 128 -13.619  -6.948  -6.948
  989   2HH2  ARG 128          2HH1      ARG 128 -13.534  -7.229  -7.229
  990    H    ASP 129           H        ASP 129 -11.116  -8.566  -8.566
  991    HA   ASP 129           HA       ASP 129  -8.897  -6.781  -6.781
  992   1HB   ASP 129          1HB       ASP 129  -8.447  -7.800  -7.800
  993   2HB   ASP 129          2HB       ASP 129  -9.972  -7.100  -7.100


Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Friday, March 29, 2024 2:19:56 PM GMT (wattos1)