NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
13452 1utr cing 1-original 7 MR format nomenclature mapping


  Entry H atom name         Orig H atom name
  Start of MODEL           1
    1    H    ILE   4           HN       ILE   4 105.283  -0.026  11.990
    2    HA   ILE   4           HA       ILE   4 105.565   1.894   9.731
    3    HB   ILE   4           HB       ILE   4 107.774   0.143  10.794
    4   1HD1  ILE   4          HD13      ILE   4 108.373   0.068  12.669
    5   2HD1  ILE   4          HD12      ILE   4 108.429   1.398  13.827
    6   3HD1  ILE   4          HD11      ILE   4 106.959   0.439  13.656
    7    H    CYS   5           HN       CYS   5 105.329  -1.505  10.480
    8    HA   CYS   5           HA       CYS   5 106.450  -2.641   8.150
    9   1HB   CYS   5           HB2      CYS   5 104.641  -3.487  10.263
   10   2HB   CYS   5           HB1      CYS   5 104.186  -4.189   8.711
   11    HG   CYS   5           HG       CYS   5 106.506  -5.104  10.331
   12    HA   PRO   6           HA       PRO   6 102.051  -2.280   6.137
   13   1HB   PRO   6           HB2      PRO   6 100.676  -0.123   7.458
   14   2HB   PRO   6           HB1      PRO   6 100.195  -1.822   7.358
   15   1HG   PRO   6           HG2      PRO   6 101.203  -0.419   9.661
   16   2HG   PRO   6           HG1      PRO   6 100.745  -2.124   9.548
   17   1HD   PRO   6           HD2      PRO   6 103.399  -1.012   9.741
   18   2HD   PRO   6           HD1      PRO   6 102.936  -2.723   9.646
   19    H    GLY   7           HN       GLY   7 102.607   0.953   7.594
   20   1HA   GLY   7           HA2      GLY   7 102.559   2.282   5.039
   21   2HA   GLY   7           HA1      GLY   7 103.112   3.000   6.553
   22    H    PHE   8           HN       PHE   8 104.114   1.072   3.774
   23    HA   PHE   8           HA       PHE   8 106.650   2.196   3.475
   24   1HB   PHE   8           HB2      PHE   8 107.350   1.464   5.630
   25   2HB   PHE   8           HB1      PHE   8 106.635  -0.130   5.404
   26    HD1  PHE   8           HD1      PHE   8 108.995   2.089   3.501
   27    HD2  PHE   8           HD2      PHE   8 108.179  -1.830   5.055
   28    HE1  PHE   8           HE1      PHE   8 111.139   1.271   2.563
   29    HE2  PHE   8           HE2      PHE   8 110.324  -2.649   4.116
   30    HZ   PHE   8           HZ       PHE   8 111.805  -1.097   2.870
   31    H    LEU   9           HN       LEU   9 104.616  -0.655   3.258
   32    HA   LEU   9           HA       LEU   9 106.242  -2.028   1.304
   33   1HB   LEU   9           HB2      LEU   9 104.519  -3.224   2.595
   34   2HB   LEU   9           HB1      LEU   9 103.263  -2.260   1.808
   35    HG   LEU   9           HG       LEU   9 104.948  -3.274  -0.241
   36   1HD1  LEU   9          HD13      LEU   9 104.839  -5.032   2.034
   37   2HD1  LEU   9          HD12      LEU   9 103.924  -5.756   0.711
   38   3HD1  LEU   9          HD11      LEU   9 105.612  -5.305   0.473
   39   1HD2  LEU   9          HD21      LEU   9 102.117  -3.494   0.665
   40   2HD2  LEU   9          HD23      LEU   9 102.761  -3.009  -0.903
   41   3HD2  LEU   9          HD22      LEU   9 102.672  -4.718  -0.477
   42    H    GLN  10           HN       GLN  10 103.630   0.366   1.087
   43    HA   GLN  10           HA       GLN  10 103.130   0.197  -1.697
   44   1HB   GLN  10           HB2      GLN  10 103.279   2.707   0.014
   45   2HB   GLN  10           HB1      GLN  10 102.484   2.580  -1.556
   46   1HG   GLN  10           HG2      GLN  10 101.015   0.780  -0.589
   47   2HG   GLN  10           HG1      GLN  10 101.726   1.121   0.990
   48    H    VAL  11           HN       VAL  11 105.883   1.241   0.083
   49    HA   VAL  11           HA       VAL  11 107.117   2.540  -2.270
   50    HB   VAL  11           HB       VAL  11 108.302   2.064   0.475
   51    H    LEU  12           HN       LEU  12 107.213  -0.433  -0.398
   52    HA   LEU  12           HA       LEU  12 109.718  -1.441  -1.329
   53   1HB   LEU  12           HB2      LEU  12 107.839  -2.378   0.387
   54   2HB   LEU  12           HB1      LEU  12 107.478  -3.372  -1.025
   55    HG   LEU  12           HG       LEU  12 109.825  -4.089  -1.144
   56   1HD1  LEU  12          HD12      LEU  12 110.085  -2.073   1.067
   57   2HD1  LEU  12          HD11      LEU  12 111.178  -3.456   1.026
   58   3HD1  LEU  12          HD13      LEU  12 111.127  -2.332  -0.332
   59   1HD2  LEU  12          HD21      LEU  12 107.961  -4.747   0.883
   60   2HD2  LEU  12          HD23      LEU  12 109.295  -5.740   0.297
   61   3HD2  LEU  12          HD22      LEU  12 109.535  -4.663   1.673
   62    H    GLU  13           HN       GLU  13 106.438  -1.597  -2.691
   63    HA   GLU  13           HA       GLU  13 107.336  -3.093  -5.044
   64   1HB   GLU  13           HB2      GLU  13 104.761  -2.008  -4.016
   65   2HB   GLU  13           HB1      GLU  13 104.904  -2.162  -5.768
   66   1HG   GLU  13           HG2      GLU  13 104.411  -4.347  -5.525
   67   2HG   GLU  13           HG1      GLU  13 105.985  -4.540  -4.753
   68    H    ALA  14           HN       ALA  14 106.149   0.225  -4.414
   69    HA   ALA  14           HA       ALA  14 106.527   1.288  -7.005
   70   1HB   ALA  14           HB1      ALA  14 105.647   2.338  -4.712
   71   2HB   ALA  14           HB3      ALA  14 107.298   2.955  -4.650
   72   3HB   ALA  14           HB2      ALA  14 106.256   3.358  -6.016
   73    H    LEU  15           HN       LEU  15 108.812   0.273  -4.656
   74    HA   LEU  15           HA       LEU  15 111.070   1.784  -5.792
   75   1HB   LEU  15           HB2      LEU  15 111.346   1.518  -3.492
   76   2HB   LEU  15           HB1      LEU  15 110.658  -0.104  -3.493
   77    HG   LEU  15           HG       LEU  15 112.691  -0.929  -4.680
   78   1HD1  LEU  15          HD12      LEU  15 113.684   1.890  -4.180
   79   2HD1  LEU  15          HD11      LEU  15 114.656   0.557  -4.803
   80   3HD1  LEU  15          HD13      LEU  15 113.318   1.194  -5.758
   81   1HD2  LEU  15          HD22      LEU  15 112.416  -0.157  -1.975
   82   2HD2  LEU  15          HD21      LEU  15 113.517  -1.369  -2.630
   83   3HD2  LEU  15          HD23      LEU  15 114.052   0.301  -2.447
   84    H    LEU  16           HN       LEU  16 110.312  -1.701  -5.361
   85    HA   LEU  16           HA       LEU  16 112.256  -2.314  -7.516
   86   1HB   LEU  16           HB2      LEU  16 110.742  -4.415  -6.007
   87   2HB   LEU  16           HB1      LEU  16 112.382  -4.468  -6.648
   88    HG   LEU  16           HG       LEU  16 111.744  -2.514  -4.479
   89   1HD1  LEU  16          HD12      LEU  16 111.139  -5.182  -4.123
   90   2HD1  LEU  16          HD11      LEU  16 112.775  -5.045  -3.478
   91   3HD1  LEU  16          HD13      LEU  16 111.487  -4.025  -2.841
   92   1HD2  LEU  16          HD21      LEU  16 114.175  -4.155  -5.213
   93   2HD2  LEU  16          HD23      LEU  16 113.939  -2.442  -5.556
   94   3HD2  LEU  16          HD22      LEU  16 114.106  -2.992  -3.889
   95    H    LEU  17           HN       LEU  17 108.839  -2.973  -6.676
   96    HA   LEU  17           HA       LEU  17 108.371  -4.097  -9.344
   97   1HB   LEU  17           HB2      LEU  17 106.905  -3.885  -6.761
   98   2HB   LEU  17           HB1      LEU  17 105.946  -4.014  -8.224
   99    HG   LEU  17           HG       LEU  17 108.119  -5.924  -7.336
  100   1HD1  LEU  17          HD12      LEU  17 105.891  -6.053  -6.160
  101   2HD1  LEU  17          HD11      LEU  17 105.150  -6.391  -7.725
  102   3HD1  LEU  17          HD13      LEU  17 106.324  -7.517  -7.044
  103   1HD2  LEU  17          HD23      LEU  17 106.550  -5.635  -9.889
  104   2HD2  LEU  17          HD22      LEU  17 108.269  -5.970  -9.676
  105   3HD2  LEU  17          HD21      LEU  17 107.079  -7.232  -9.359
  106    H    GLY  18           HN       GLY  18 108.978  -1.126  -8.680
  107   1HA   GLY  18           HA2      GLY  18 106.678  -0.046 -10.257
  108   2HA   GLY  18           HA1      GLY  18 107.350   0.855  -8.897
  109    H    SER  19           HN       SER  19 107.399   2.221 -11.182
  110    HA   SER  19           HA       SER  19 110.251   2.038 -12.062
  111   1HB   SER  19           HB2      SER  19 107.954   2.922 -13.826
  112   2HB   SER  19           HB1      SER  19 109.621   2.624 -14.310
  113    HG   SER  19           HG       SER  19 107.698   0.919 -14.396
  114    H    GLU  20           HN       GLU  20 107.401   4.091 -11.588
  115    HA   GLU  20           HA       GLU  20 108.750   6.193 -10.297
  116   1HB   GLU  20           HB2      GLU  20 109.564   6.165 -12.925
  117   2HB   GLU  20           HB1      GLU  20 108.210   7.296 -12.982
  118   1HG   GLU  20           HG2      GLU  20 109.233   8.810 -11.555
  119   2HG   GLU  20           HG1      GLU  20 110.203   7.567 -10.764
  120    H    SER  21           HN       SER  21 107.337   8.054  -9.977
  121    HA   SER  21           HA       SER  21 105.240   9.164  -9.961
  122   1HB   SER  21           HB2      SER  21 104.967   8.066 -12.329
  123   2HB   SER  21           HB1      SER  21 103.980   6.885 -11.473
  124    HG   SER  21           HG       SER  21 102.593   8.475 -12.042
  125    H    ASN  22           HN       ASN  22 105.218   5.613  -9.692
  126    HA   ASN  22           HA       ASN  22 103.182   5.668  -7.591
  127   1HB   ASN  22           HB2      ASN  22 104.008   3.191  -7.369
  128   2HB   ASN  22           HB1      ASN  22 103.092   3.658  -8.801
  129   1HD2  ASN  22          HD22      ASN  22 105.837   3.236 -11.017
  130   2HD2  ASN  22          HD21      ASN  22 104.263   3.846 -10.838
  131    H    TYR  23           HN       TYR  23 106.692   5.481  -7.848
  132    HA   TYR  23           HA       TYR  23 107.152   4.830  -5.067
  133   1HB   TYR  23           HB2      TYR  23 108.916   4.419  -6.663
  134   2HB   TYR  23           HB1      TYR  23 108.915   6.105  -7.176
  135    HD1  TYR  23           HD1      TYR  23 109.864   3.757  -4.511
  136    HD2  TYR  23           HD2      TYR  23 109.863   7.865  -5.761
  137    HE1  TYR  23           HE1      TYR  23 111.490   4.301  -2.724
  138    HE2  TYR  23           HE2      TYR  23 111.490   8.411  -3.971
  139    HH   TYR  23           HH       TYR  23 112.107   6.474  -1.387
  140    H    GLU  24           HN       GLU  24 107.484   7.917  -6.875
  141    HA   GLU  24           HA       GLU  24 107.877   9.496  -4.502
  142   1HB   GLU  24           HB2      GLU  24 107.222  10.044  -7.368
  143   2HB   GLU  24           HB1      GLU  24 106.870  11.320  -6.201
  144   1HG   GLU  24           HG2      GLU  24 109.197  11.208  -5.378
  145   2HG   GLU  24           HG1      GLU  24 109.550   9.945  -6.557
  146    H    ALA  25           HN       ALA  25 104.984   8.814  -6.483
  147    HA   ALA  25           HA       ALA  25 103.164  10.317  -4.907
  148   1HB   ALA  25           HB1      ALA  25 102.600   9.430  -7.148
  149   2HB   ALA  25           HB3      ALA  25 102.654   7.789  -6.504
  150   3HB   ALA  25           HB2      ALA  25 101.418   8.916  -5.945
  151    H    ALA  26           HN       ALA  26 104.635   7.191  -4.502
  152    HA   ALA  26           HA       ALA  26 102.836   6.228  -2.476
  153   1HB   ALA  26           HB1      ALA  26 105.513   5.414  -3.543
  154   2HB   ALA  26           HB3      ALA  26 105.000   4.763  -1.986
  155   3HB   ALA  26           HB2      ALA  26 104.027   4.472  -3.427
  156    H    LEU  27           HN       LEU  27 105.665   8.264  -2.551
  157    HA   LEU  27           HA       LEU  27 106.148   8.170   0.314
  158   1HB   LEU  27           HB2      LEU  27 107.179   9.800  -2.007
  159   2HB   LEU  27           HB1      LEU  27 107.655  10.131  -0.356
  160    HG   LEU  27           HG       LEU  27 107.849   7.302  -1.229
  161   1HD1  LEU  27          HD13      LEU  27 109.276   9.547  -2.535
  162   2HD1  LEU  27          HD12      LEU  27 110.293   8.204  -2.013
  163   3HD1  LEU  27          HD11      LEU  27 108.958   7.917  -3.129
  164   1HD2  LEU  27          HD23      LEU  27 108.602   8.651   0.996
  165   2HD2  LEU  27          HD22      LEU  27 109.426   7.196   0.433
  166   3HD2  LEU  27          HD21      LEU  27 110.085   8.787   0.049
  167    H    LYS  28           HN       LYS  28 103.960   9.763  -1.753
  168    HA   LYS  28           HA       LYS  28 103.685  12.336  -0.758
  169   1HB   LYS  28           HB2      LYS  28 102.128  10.603  -2.324
  170   2HB   LYS  28           HB1      LYS  28 101.069  11.122  -1.013
  171   1HG   LYS  28           HG2      LYS  28 100.975  13.254  -1.780
  172   2HG   LYS  28           HG1      LYS  28 102.702  13.293  -2.137
  173   1HD   LYS  28           HD2      LYS  28 102.420  12.418  -4.275
  174   2HD   LYS  28           HD1      LYS  28 100.896  11.631  -3.862
  175   1HE   LYS  28           HE2      LYS  28 100.034  14.082  -3.508
  176   2HE   LYS  28           HE1      LYS  28 101.415  14.519  -4.515
  177   1HZ   LYS  28           HZ3      LYS  28  99.817  12.305  -5.484
  178   2HZ   LYS  28           HZ2      LYS  28  99.033  13.812  -5.482
  179   3HZ   LYS  28           HZ1      LYS  28 100.491  13.611  -6.331
  180    HA   PRO  29           HA       PRO  29 100.778  10.645   2.747
  181   1HB   PRO  29           HB2      PRO  29 101.551   7.908   3.227
  182   2HB   PRO  29           HB1      PRO  29  99.968   8.527   2.737
  183   1HG   PRO  29           HG2      PRO  29 101.840   7.062   1.123
  184   2HG   PRO  29           HG1      PRO  29 100.283   7.736   0.624
  185   1HD   PRO  29           HD2      PRO  29 102.928   8.674  -0.059
  186   2HD   PRO  29           HD1      PRO  29 101.366   9.321  -0.598
  187    H    PHE  30           HN       PHE  30 104.085   9.597   2.256
  188    HA   PHE  30           HA       PHE  30 104.694   9.704   5.143
  189   1HB   PHE  30           HB2      PHE  30 106.444   9.190   2.718
  190   2HB   PHE  30           HB1      PHE  30 107.001   9.101   4.391
  191    HD1  PHE  30           HD2      PHE  30 104.987   7.782   5.883
  192    HD2  PHE  30           HD1      PHE  30 106.155   7.060   1.813
  193    HE1  PHE  30           HE2      PHE  30 104.130   5.461   6.048
  194    HE2  PHE  30           HE1      PHE  30 105.298   4.739   1.978
  195    HZ   PHE  30           HZ       PHE  30 104.286   3.939   4.096
  196    H    ASN  31           HN       ASN  31 104.605  11.811   2.475
  197    HA   ASN  31           HA       ASN  31 105.546  13.939   2.079
  198   1HB   ASN  31           HB2      ASN  31 105.094  15.475   3.919
  199   2HB   ASN  31           HB1      ASN  31 103.773  14.314   3.790
  200   1HD2  ASN  31          HD22      ASN  31 104.523  12.711   6.892
  201   2HD2  ASN  31          HD21      ASN  31 103.719  12.535   5.407
  202    HA   PRO  32           HA       PRO  32 109.659  12.655   3.960
  203   1HB   PRO  32           HB2      PRO  32 110.740  12.738   1.299
  204   2HB   PRO  32           HB1      PRO  32 110.541  11.324   2.342
  205   1HG   PRO  32           HG2      PRO  32 109.020  12.001  -0.015
  206   2HG   PRO  32           HG1      PRO  32 108.833  10.585   1.028
  207   1HD   PRO  32           HD2      PRO  32 107.088  12.873   0.829
  208   2HD   PRO  32           HD1      PRO  32 106.908  11.451   1.876
  209    H    ALA  33           HN       ALA  33 111.221  14.254   4.378
  210    HA   ALA  33           HA       ALA  33 110.682  16.949   3.966
  211   1HB   ALA  33           HB3      ALA  33 112.440  15.947   5.500
  212   2HB   ALA  33           HB2      ALA  33 113.484  15.823   4.085
  213   3HB   ALA  33           HB1      ALA  33 112.938  17.405   4.641
  214    H    SER  34           HN       SER  34 112.428  18.408   2.688
  215    HA   SER  34           HA       SER  34 111.858  18.091  -0.083
  216   1HB   SER  34           HB2      SER  34 113.762  19.783   1.497
  217   2HB   SER  34           HB1      SER  34 113.933  19.720  -0.254
  218    HG   SER  34           HG       SER  34 112.342  21.260   0.990
  219    H    ASP  35           HN       ASP  35 115.253  18.393   0.744
  220    HA   ASP  35           HA       ASP  35 116.300  16.817  -1.267
  221   1HB   ASP  35           HB2      ASP  35 117.438  16.666   1.530
  222   2HB   ASP  35           HB1      ASP  35 118.304  16.659  -0.007
  223    H    LEU  36           HN       LEU  36 115.390  15.578   1.991
  224    HA   LEU  36           HA       LEU  36 116.014  12.930   1.810
  225   1HB   LEU  36           HB2      LEU  36 113.388  14.157   2.701
  226   2HB   LEU  36           HB1      LEU  36 113.927  12.542   3.095
  227    HG   LEU  36           HG       LEU  36 115.197  15.144   3.921
  228   1HD1  LEU  36          HD13      LEU  36 113.524  13.094   5.183
  229   2HD1  LEU  36          HD12      LEU  36 114.991  13.442   6.097
  230   3HD1  LEU  36          HD11      LEU  36 113.866  14.742   5.708
  231   1HD2  LEU  36          HD23      LEU  36 116.287  12.323   3.993
  232   2HD2  LEU  36          HD22      LEU  36 117.040  13.761   3.301
  233   3HD2  LEU  36          HD21      LEU  36 116.891  13.599   5.051
  234    H    GLN  37           HN       GLN  37 112.995  14.331   0.508
  235    HA   GLN  37           HA       GLN  37 112.106  11.976  -0.817
  236   1HB   GLN  37           HB2      GLN  37 110.576  13.824  -0.568
  237   2HB   GLN  37           HB1      GLN  37 111.658  14.908  -1.444
  238   1HG   GLN  37           HG2      GLN  37 110.948  14.169  -3.466
  239   2HG   GLN  37           HG1      GLN  37 110.956  12.482  -2.949
  240    H    ASN  38           HN       ASN  38 114.203  14.640  -1.929
  241    HA   ASN  38           HA       ASN  38 114.516  13.957  -4.604
  242   1HB   ASN  38           HB2      ASN  38 116.311  15.377  -4.552
  243   2HB   ASN  38           HB1      ASN  38 115.617  15.817  -3.017
  244   1HD2  ASN  38          HD22      ASN  38 119.012  13.471  -2.990
  245   2HD2  ASN  38          HD21      ASN  38 117.934  13.330  -4.292
  246    H    ALA  39           HN       ALA  39 116.326  12.694  -1.828
  247    HA   ALA  39           HA       ALA  39 117.973  10.887  -3.265
  248   1HB   ALA  39           HB3      ALA  39 116.936  10.910  -0.428
  249   2HB   ALA  39           HB2      ALA  39 118.097   9.721  -1.010
  250   3HB   ALA  39           HB1      ALA  39 118.518  11.429  -1.004
  251    H    GLY  40           HN       GLY  40 114.668  10.594  -2.053
  252   1HA   GLY  40           HA2      GLY  40 114.493   7.733  -2.458
  253   2HA   GLY  40           HA1      GLY  40 113.121   8.826  -2.266
  254    H    THR  41           HN       THR  41 113.996  10.563  -4.512
  255    HA   THR  41           HA       THR  41 112.622   9.194  -6.623
  256    HB   THR  41           HB       THR  41 114.343  11.674  -6.554
  257    HG1  THR  41           HG1      THR  41 112.295  12.556  -7.185
  258    H    GLN  42           HN       GLN  42 116.101  10.027  -6.274
  259    HA   GLN  42           HA       GLN  42 116.966   8.577  -8.521
  260   1HB   GLN  42           HB2      GLN  42 118.177   9.575  -5.984
  261   2HB   GLN  42           HB1      GLN  42 119.078   8.374  -6.886
  262   1HG   GLN  42           HG2      GLN  42 119.691   9.893  -8.439
  263   2HG   GLN  42           HG1      GLN  42 118.015  10.391  -8.669
  264    H    LEU  43           HN       LEU  43 116.442   7.644  -5.156
  265    HA   LEU  43           HA       LEU  43 117.415   5.069  -5.018
  266   1HB   LEU  43           HB2      LEU  43 116.372   5.820  -3.074
  267   2HB   LEU  43           HB1      LEU  43 114.967   6.418  -3.931
  268    HG   LEU  43           HG       LEU  43 114.680   4.297  -2.491
  269   1HD1  LEU  43          HD12      LEU  43 113.251   5.216  -4.545
  270   2HD1  LEU  43          HD11      LEU  43 113.814   3.717  -5.285
  271   3HD1  LEU  43          HD13      LEU  43 112.896   3.664  -3.786
  272   1HD2  LEU  43          HD23      LEU  43 116.780   3.454  -4.146
  273   2HD2  LEU  43          HD22      LEU  43 115.864   2.478  -2.998
  274   3HD2  LEU  43          HD21      LEU  43 115.357   2.564  -4.683
  275    H    LYS  44           HN       LYS  44 114.480   6.190  -6.675
  276    HA   LYS  44           HA       LYS  44 113.622   3.531  -7.456
  277   1HB   LYS  44           HB2      LYS  44 112.110   5.533  -7.320
  278   2HB   LYS  44           HB1      LYS  44 112.925   6.187  -8.741
  279   1HG   LYS  44           HG2      LYS  44 110.967   5.056  -9.542
  280   2HG   LYS  44           HG1      LYS  44 112.340   4.019  -9.933
  281   1HD   LYS  44           HD2      LYS  44 111.865   2.900  -7.635
  282   2HD   LYS  44           HD1      LYS  44 110.285   3.677  -7.757
  283   1HE   LYS  44           HE2      LYS  44 110.210   1.397  -8.692
  284   2HE   LYS  44           HE1      LYS  44 109.924   2.602  -9.948
  285   1HZ   LYS  44           HZ2      LYS  44 112.701   1.968  -9.570
  286   2HZ   LYS  44           HZ1      LYS  44 111.772   0.634 -10.065
  287   3HZ   LYS  44           HZ3      LYS  44 111.791   2.047 -11.002
  288    H    ARG  45           HN       ARG  45 115.459   6.128  -9.061
  289    HA   ARG  45           HA       ARG  45 115.673   4.972 -11.628
  290   1HB   ARG  45           HB2      ARG  45 117.586   6.691 -10.035
  291   2HB   ARG  45           HB1      ARG  45 117.918   6.206 -11.699
  292   1HG   ARG  45           HG2      ARG  45 116.326   7.594 -12.560
  293   2HG   ARG  45           HG1      ARG  45 115.212   7.307 -11.222
  294   1HD   ARG  45           HD2      ARG  45 115.901   9.163 -10.153
  295   2HD   ARG  45           HD1      ARG  45 117.595   8.707 -10.316
  296    HE   ARG  45           HE       ARG  45 116.315  10.742 -11.805
  297   1HH1  ARG  45          HH21      ARG  45 118.277   7.942 -12.370
  298   2HH1  ARG  45          HH22      ARG  45 118.726   8.436 -13.964
  299   1HH2  ARG  45          HH11      ARG  45 116.922  11.388 -13.865
  300   2HH2  ARG  45          HH12      ARG  45 117.973  10.381 -14.805
  301    H    LEU  46           HN       LEU  46 117.958   4.615  -8.887
  302    HA   LEU  46           HA       LEU  46 119.748   2.820 -10.002
  303   1HB   LEU  46           HB2      LEU  46 118.676   2.605  -7.184
  304   2HB   LEU  46           HB1      LEU  46 120.290   2.248  -7.763
  305    HG   LEU  46           HG       LEU  46 119.004   4.944  -7.415
  306   1HD1  LEU  46          HD12      LEU  46 120.686   3.427  -5.824
  307   2HD1  LEU  46          HD11      LEU  46 121.799   4.518  -6.650
  308   3HD1  LEU  46          HD13      LEU  46 120.462   5.172  -5.704
  309   1HD2  LEU  46          HD21      LEU  46 121.188   4.088  -9.278
  310   2HD2  LEU  46          HD23      LEU  46 119.971   5.348  -9.485
  311   3HD2  LEU  46          HD22      LEU  46 121.366   5.632  -8.445
  312    H    VAL  47           HN       VAL  47 116.451   2.270  -8.937
  313    HA   VAL  47           HA       VAL  47 116.678  -0.641  -8.974
  314    HB   VAL  47           HB       VAL  47 114.286   1.219  -8.901
  315    H    ASP  48           HN       ASP  48 115.534   1.879 -11.194
  316    HA   ASP  48           HA       ASP  48 114.803  -0.160 -13.207
  317   1HB   ASP  48           HB2      ASP  48 114.070   2.567 -12.681
  318   2HB   ASP  48           HB1      ASP  48 114.740   2.465 -14.309
  319    H    THR  49           HN       THR  49 117.624   0.420 -12.227
  320    HA   THR  49           HA       THR  49 118.825   1.003 -14.904
  321    HB   THR  49           HB       THR  49 120.849   1.525 -13.152
  322    HG1  THR  49           HG1      THR  49 119.853   1.472 -11.282
  323    H    LEU  50           HN       LEU  50 118.277  -1.353 -12.595
  324    HA   LEU  50           HA       LEU  50 120.800  -2.810 -13.234
  325   1HB   LEU  50           HB2      LEU  50 118.799  -2.966 -10.996
  326   2HB   LEU  50           HB1      LEU  50 119.785  -4.377 -11.378
  327    HG   LEU  50           HG       LEU  50 121.053  -1.667 -11.025
  328   1HD1  LEU  50          HD11      LEU  50 120.027  -3.557  -8.935
  329   2HD1  LEU  50          HD13      LEU  50 121.541  -2.702  -8.638
  330   3HD1  LEU  50          HD12      LEU  50 120.057  -1.794  -8.928
  331   1HD2  LEU  50          HD22      LEU  50 121.934  -4.556 -10.903
  332   2HD2  LEU  50          HD21      LEU  50 122.544  -3.269 -11.945
  333   3HD2  LEU  50          HD23      LEU  50 122.919  -3.262 -10.221
  334    HA   PRO  51           HA       PRO  51 118.889  -5.742 -15.838
  335   1HB   PRO  51           HB2      PRO  51 119.693  -8.087 -14.357
  336   2HB   PRO  51           HB1      PRO  51 120.406  -7.429 -15.836
  337   1HG   PRO  51           HG2      PRO  51 121.514  -7.360 -13.182
  338   2HG   PRO  51           HG1      PRO  51 122.201  -6.669 -14.657
  339   1HD   PRO  51           HD2      PRO  51 121.027  -5.263 -12.432
  340   2HD   PRO  51           HD1      PRO  51 121.712  -4.573 -13.916
  341    H    GLN  52           HN       GLN  52 117.711  -8.196 -15.320
  342    HA   GLN  52           HA       GLN  52 115.339  -7.370 -13.776
  343   1HB   GLN  52           HB2      GLN  52 115.979  -9.674 -15.613
  344   2HB   GLN  52           HB1      GLN  52 114.533  -9.697 -14.602
  345   1HG   GLN  52           HG2      GLN  52 113.882  -7.481 -15.565
  346   2HG   GLN  52           HG1      GLN  52 115.264  -7.590 -16.655
  347    H    GLU  53           HN       GLU  53 117.708 -10.048 -13.736
  348    HA   GLU  53           HA       GLU  53 116.664 -11.365 -11.436
  349   1HB   GLU  53           HB2      GLU  53 119.212 -11.367 -12.941
  350   2HB   GLU  53           HB1      GLU  53 119.354 -11.840 -11.247
  351   1HG   GLU  53           HG2      GLU  53 118.037 -13.720 -11.515
  352   2HG   GLU  53           HG1      GLU  53 117.113 -13.012 -12.840
  353    H    THR  54           HN       THR  54 118.944  -8.634 -11.722
  354    HA   THR  54           HA       THR  54 119.603  -8.556  -8.927
  355    HB   THR  54           HB       THR  54 119.461  -6.072 -10.573
  356    HG1  THR  54           HG1      THR  54 121.639  -6.795 -11.272
  357    H    ARG  55           HN       ARG  55 116.853  -7.506 -10.776
  358    HA   ARG  55           HA       ARG  55 115.783  -5.734  -8.733
  359   1HB   ARG  55           HB2      ARG  55 114.972  -6.723 -11.367
  360   2HB   ARG  55           HB1      ARG  55 113.621  -6.661 -10.234
  361   1HG   ARG  55           HG2      ARG  55 113.897  -4.343  -9.850
  362   2HG   ARG  55           HG1      ARG  55 115.526  -4.339 -10.526
  363   1HD   ARG  55           HD2      ARG  55 114.294  -3.434 -12.289
  364   2HD   ARG  55           HD1      ARG  55 114.311  -5.144 -12.716
  365    HE   ARG  55           HE       ARG  55 112.025  -4.869 -11.175
  366   1HH1  ARG  55          HH21      ARG  55 113.363  -3.330 -13.963
  367   2HH1  ARG  55          HH22      ARG  55 111.821  -2.947 -14.649
  368   1HH2  ARG  55          HH11      ARG  55 110.009  -4.373 -12.062
  369   2HH2  ARG  55          HH12      ARG  55 109.925  -3.536 -13.576
  370    H    ILE  56           HN       ILE  56 114.675  -8.950  -9.887
  371    HA   ILE  56           HA       ILE  56 113.027  -9.476  -7.621
  372    HB   ILE  56           HB       ILE  56 114.456 -11.344  -9.539
  373   1HD1  ILE  56          HD11      ILE  56 113.752 -11.301 -11.326
  374   2HD1  ILE  56          HD13      ILE  56 112.136 -11.960 -11.581
  375   3HD1  ILE  56          HD12      ILE  56 112.430 -10.234 -11.799
  376    H    ASN  57           HN       ASN  57 116.440  -9.355  -7.949
  377    HA   ASN  57           HA       ASN  57 116.977 -11.257  -5.843
  378   1HB   ASN  57           HB2      ASN  57 118.567  -9.287  -7.449
  379   2HB   ASN  57           HB1      ASN  57 119.250  -9.973  -5.989
  380   1HD2  ASN  57          HD22      ASN  57 118.109 -12.971  -8.484
  381   2HD2  ASN  57          HD21      ASN  57 116.974 -11.864  -7.875
  382    H    ILE  58           HN       ILE  58 117.549  -7.694  -5.966
  383    HA   ILE  58           HA       ILE  58 117.823  -7.377  -3.194
  384    HB   ILE  58           HB       ILE  58 116.899  -5.519  -5.390
  385   1HD1  ILE  58          HD12      ILE  58 119.114  -6.068  -2.483
  386   2HD1  ILE  58          HD11      ILE  58 119.679  -7.148  -3.757
  387   3HD1  ILE  58          HD13      ILE  58 120.614  -5.712  -3.339
  388    H    VAL  59           HN       VAL  59 114.917  -7.878  -5.087
  389    HA   VAL  59           HA       VAL  59 113.135  -7.032  -2.912
  390    HB   VAL  59           HB       VAL  59 112.545  -8.674  -5.402
  391    H    LYS  60           HN       LYS  60 114.386  -9.967  -4.322
  392    HA   LYS  60           HA       LYS  60 113.065 -11.707  -2.336
  393   1HB   LYS  60           HB2      LYS  60 114.942 -12.280  -4.652
  394   2HB   LYS  60           HB1      LYS  60 114.127 -13.512  -3.716
  395   1HG   LYS  60           HG2      LYS  60 112.743 -11.371  -5.339
  396   2HG   LYS  60           HG1      LYS  60 112.883 -13.076  -5.776
  397   1HD   LYS  60           HD2      LYS  60 111.805 -13.503  -3.441
  398   2HD   LYS  60           HD1      LYS  60 111.293 -11.819  -3.560
  399   1HE   LYS  60           HE2      LYS  60 110.313 -12.368  -5.824
  400   2HE   LYS  60           HE1      LYS  60 110.650 -14.066  -5.486
  401   1HZ   LYS  60           HZ3      LYS  60 109.342 -12.870  -3.284
  402   2HZ   LYS  60           HZ2      LYS  60 108.439 -12.605  -4.699
  403   3HZ   LYS  60           HZ1      LYS  60 108.847 -14.187  -4.231
  404    H    LEU  61           HN       LEU  61 115.551  -9.673  -2.235
  405    HA   LEU  61           HA       LEU  61 117.449 -11.435  -0.768
  406   1HB   LEU  61           HB2      LEU  61 118.386 -10.238  -2.673
  407   2HB   LEU  61           HB1      LEU  61 117.652  -8.761  -2.146
  408    HG   LEU  61           HG       LEU  61 120.245  -9.528  -1.633
  409   1HD1  LEU  61          HD11      LEU  61 118.379  -7.431  -0.951
  410   2HD1  LEU  61          HD13      LEU  61 119.695  -7.594   0.210
  411   3HD1  LEU  61          HD12      LEU  61 120.051  -7.320  -1.492
  412   1HD2  LEU  61          HD23      LEU  61 118.971 -10.954   0.266
  413   2HD2  LEU  61          HD22      LEU  61 120.548 -10.212   0.526
  414   3HD2  LEU  61          HD21      LEU  61 119.090  -9.397   1.088
  415    H    THR  62           HN       THR  62 115.832  -8.269  -0.712
  416    HA   THR  62           HA       THR  62 116.713  -7.455   1.820
  417    HB   THR  62           HB       THR  62 113.996  -6.911   0.554
  418    HG1  THR  62           HG1      THR  62 115.019  -5.633  -0.722
  419    H    GLU  63           HN       GLU  63 114.525  -9.948   0.912
  420    HA   GLU  63           HA       GLU  63 113.092 -10.025   3.470
  421   1HB   GLU  63           HB2      GLU  63 113.173 -11.817   1.037
  422   2HB   GLU  63           HB1      GLU  63 112.319 -12.293   2.505
  423   1HG   GLU  63           HG2      GLU  63 111.291  -9.846   2.272
  424   2HG   GLU  63           HG1      GLU  63 111.692 -10.100   0.573
  425    H    LYS  64           HN       LYS  64 115.666 -11.870   1.854
  426    HA   LYS  64           HA       LYS  64 116.020 -13.769   3.986
  427   1HB   LYS  64           HB2      LYS  64 117.321 -13.098   1.469
  428   2HB   LYS  64           HB1      LYS  64 118.504 -13.467   2.724
  429   1HG   LYS  64           HG2      LYS  64 118.090 -15.625   2.094
  430   2HG   LYS  64           HG1      LYS  64 116.709 -15.448   3.178
  431   1HD   LYS  64           HD2      LYS  64 115.203 -15.101   1.415
  432   2HD   LYS  64           HD1      LYS  64 116.478 -14.626   0.292
  433   1HE   LYS  64           HE2      LYS  64 115.592 -16.917  -0.169
  434   2HE   LYS  64           HE1      LYS  64 117.315 -16.914   0.207
  435   1HZ   LYS  64           HZ1      LYS  64 115.949 -17.128   2.616
  436   2HZ   LYS  64           HZ3      LYS  64 115.221 -18.232   1.553
  437   3HZ   LYS  64           HZ2      LYS  64 116.893 -18.314   1.848
  438    H    ILE  65           HN       ILE  65 117.146 -10.494   3.434
  439    HA   ILE  65           HA       ILE  65 119.162 -10.640   5.553
  440    HB   ILE  65           HB       ILE  65 119.301  -9.136   3.508
  441   1HD1  ILE  65          HD12      ILE  65 119.614  -6.593   3.852
  442   2HD1  ILE  65          HD11      ILE  65 119.903  -6.001   5.488
  443   3HD1  ILE  65          HD13      ILE  65 121.238  -6.648   4.535
  444    H    LEU  66           HN       LEU  66 115.943  -9.187   5.131
  445    HA   LEU  66           HA       LEU  66 115.901  -8.344   7.941
  446   1HB   LEU  66           HB2      LEU  66 114.294  -7.885   5.478
  447   2HB   LEU  66           HB1      LEU  66 113.471  -7.734   7.021
  448    HG   LEU  66           HG       LEU  66 116.093  -6.448   7.025
  449   1HD1  LEU  66          HD11      LEU  66 114.110  -5.834   4.879
  450   2HD1  LEU  66          HD13      LEU  66 114.912  -4.475   5.666
  451   3HD1  LEU  66          HD12      LEU  66 115.869  -5.712   4.850
  452   1HD2  LEU  66          HD23      LEU  66 113.253  -5.789   7.761
  453   2HD2  LEU  66          HD22      LEU  66 114.672  -5.891   8.803
  454   3HD2  LEU  66          HD21      LEU  66 114.469  -4.514   7.721
  455    H    THR  67           HN       THR  67 113.415 -10.002   5.972
  456    HA   THR  67           HA       THR  67 112.568 -11.493   8.364
  457    HB   THR  67           HB       THR  67 110.863 -10.575   6.838
  458    HG1  THR  67           HG1      THR  67 110.488 -12.563   7.957
  459    H    SER  68           HN       SER  68 115.022 -12.377   8.022
  460    HA   SER  68           HA       SER  68 115.327 -14.511   6.098
  461   1HB   SER  68           HB2      SER  68 117.433 -14.807   7.019
  462   2HB   SER  68           HB1      SER  68 117.109 -13.150   7.518
  463    HG   SER  68           HG       SER  68 117.564 -14.039   9.405
  464    HA   PRO  69           HA       PRO  69 112.609 -17.261   8.379
  465   1HB   PRO  69           HB2      PRO  69 113.403 -19.383   6.602
  466   2HB   PRO  69           HB1      PRO  69 111.875 -18.492   6.619
  467   1HG   PRO  69           HG2      PRO  69 114.012 -18.280   4.695
  468   2HG   PRO  69           HG1      PRO  69 112.483 -17.392   4.720
  469   1HD   PRO  69           HD2      PRO  69 115.114 -16.383   5.317
  470   2HD   PRO  69           HD1      PRO  69 113.574 -15.500   5.361
  471    H    LEU  70           HN       LEU  70 113.295 -20.007   8.546
  472    HA   LEU  70           HA       LEU  70 114.647 -21.456   9.802
  473   1HB   LEU  70           HB2      LEU  70 116.731 -19.554   8.705
  474   2HB   LEU  70           HB1      LEU  70 117.144 -20.968   9.675
  475    HG   LEU  70           HG       LEU  70 115.605 -22.236   7.955
  476   1HD1  LEU  70          HD11      LEU  70 115.506 -19.620   6.928
  477   2HD1  LEU  70          HD13      LEU  70 116.582 -20.502   5.845
  478   3HD1  LEU  70          HD12      LEU  70 114.944 -21.089   6.131
  479   1HD2  LEU  70          HD23      LEU  70 118.430 -21.525   8.014
  480   2HD2  LEU  70          HD22      LEU  70 117.678 -23.074   7.633
  481   3HD2  LEU  70          HD21      LEU  70 117.883 -21.859   6.371
  482    H    CYS  71           HN       CYS  71 116.750 -21.035  11.521
  483    HA   CYS  71           HA       CYS  71 115.620 -20.076  13.866
  484   1HB   CYS  71           HB2      CYS  71 118.061 -19.542  14.547
  485   2HB   CYS  71           HB1      CYS  71 117.688 -21.203  14.088
  486    HG   CYS  71           HG       CYS  71 118.566 -19.705  11.638
  487    H    ILE   4           HN       ILE   4 111.550  -8.337  13.296
  488    HA   ILE   4           HA       ILE   4 113.911  -8.889  11.568
  489    HB   ILE   4           HB       ILE   4 111.532  -7.227  10.760
  490   1HD1  ILE   4          HD13      ILE   4 109.653  -7.815  10.816
  491   2HD1  ILE   4          HD12      ILE   4 109.031  -9.437  10.513
  492   3HD1  ILE   4          HD11      ILE   4 109.537  -8.976  12.138
  493    H    CYS   5           HN       CYS   5 112.384  -6.402  13.478
  494    HA   CYS   5           HA       CYS   5 113.548  -4.084  12.360
  495   1HB   CYS   5           HB2      CYS   5 112.290  -4.825  14.875
  496   2HB   CYS   5           HB1      CYS   5 113.605  -3.678  15.129
  497    HG   CYS   5           HG       CYS   5 110.948  -2.938  14.018
  498    HA   PRO   6           HA       PRO   6 117.284  -4.790  15.373
  499   1HB   PRO   6           HB2      PRO   6 117.387  -7.605  15.970
  500   2HB   PRO   6           HB1      PRO   6 117.187  -6.258  17.099
  501   1HG   PRO   6           HG2      PRO   6 115.194  -8.168  16.281
  502   2HG   PRO   6           HG1      PRO   6 114.994  -6.803  17.388
  503   1HD   PRO   6           HD2      PRO   6 113.997  -7.059  14.694
  504   2HD   PRO   6           HD1      PRO   6 113.781  -5.699  15.814
  505    H    GLY   7           HN       GLY   7 116.744  -8.014  13.891
  506   1HA   GLY   7           HA2      GLY   7 119.329  -8.033  12.619
  507   2HA   GLY   7           HA1      GLY   7 118.008  -9.147  12.264
  508    H    PHE   8           HN       PHE   8 119.376  -5.994  11.467
  509    HA   PHE   8           HA       PHE   8 118.854  -6.078   8.728
  510   1HB   PHE   8           HB2      PHE   8 116.500  -6.200   9.068
  511   2HB   PHE   8           HB1      PHE   8 116.539  -4.956  10.315
  512    HD1  PHE   8           HD1      PHE   8 117.779  -5.313   6.786
  513    HD2  PHE   8           HD2      PHE   8 115.668  -2.908   9.649
  514    HE1  PHE   8           HE1      PHE   8 117.405  -3.581   5.053
  515    HE2  PHE   8           HE2      PHE   8 115.294  -1.173   7.916
  516    HZ   PHE   8           HZ       PHE   8 116.162  -1.511   5.617
  517    H    LEU   9           HN       LEU   9 119.092  -4.154  11.653
  518    HA   LEU   9           HA       LEU   9 119.647  -1.653  10.316
  519   1HB   LEU   9           HB2      LEU   9 118.950  -1.709  12.678
  520   2HB   LEU   9           HB1      LEU   9 120.448  -2.547  13.099
  521    HG   LEU   9           HG       LEU   9 121.163  -0.293  11.526
  522   1HD1  LEU   9          HD13      LEU   9 118.761   0.167  13.042
  523   2HD1  LEU   9          HD12      LEU   9 120.074   1.097  13.762
  524   3HD1  LEU   9          HD11      LEU   9 119.673   1.312  12.059
  525   1HD2  LEU   9          HD21      LEU   9 121.561  -1.330  14.293
  526   2HD2  LEU   9          HD23      LEU   9 122.757  -0.864  13.084
  527   3HD2  LEU   9          HD22      LEU   9 121.934   0.374  14.033
  528    H    GLN  10           HN       GLN  10 121.669  -4.352  11.426
  529    HA   GLN  10           HA       GLN  10 124.208  -3.129  11.133
  530   1HB   GLN  10           HB2      GLN  10 123.419  -5.971  10.389
  531   2HB   GLN  10           HB1      GLN  10 125.064  -5.403  10.675
  532   1HG   GLN  10           HG2      GLN  10 124.356  -4.730  12.993
  533   2HG   GLN  10           HG1      GLN  10 122.802  -5.506  12.688
  534    H    VAL  11           HN       VAL  11 121.797  -3.996   8.836
  535    HA   VAL  11           HA       VAL  11 123.643  -3.705   6.544
  536    HB   VAL  11           HB       VAL  11 120.651  -4.164   6.526
  537    H    LEU  12           HN       LEU  12 121.139  -1.975   8.303
  538    HA   LEU  12           HA       LEU  12 120.546   0.020   6.348
  539   1HB   LEU  12           HB2      LEU  12 119.630  -0.487   8.849
  540   2HB   LEU  12           HB1      LEU  12 120.699   0.873   9.192
  541    HG   LEU  12           HG       LEU  12 119.569   2.219   7.476
  542   1HD1  LEU  12          HD12      LEU  12 118.161  -0.390   6.996
  543   2HD1  LEU  12          HD11      LEU  12 117.316   1.121   6.663
  544   3HD1  LEU  12          HD13      LEU  12 118.823   0.749   5.825
  545   1HD2  LEU  12          HD21      LEU  12 118.464   1.341   9.930
  546   2HD2  LEU  12          HD23      LEU  12 118.091   2.832   9.065
  547   3HD2  LEU  12          HD22      LEU  12 117.130   1.382   8.778
  548    H    GLU  13           HN       GLU  13 123.089  -0.205   8.821
  549    HA   GLU  13           HA       GLU  13 124.266   2.364   8.045
  550   1HB   GLU  13           HB2      GLU  13 124.828   0.239  10.053
  551   2HB   GLU  13           HB1      GLU  13 126.213   1.182   9.501
  552   1HG   GLU  13           HG2      GLU  13 125.583   2.788  10.951
  553   2HG   GLU  13           HG1      GLU  13 124.183   3.071   9.916
  554    H    ALA  14           HN       ALA  14 125.213  -1.078   7.775
  555    HA   ALA  14           HA       ALA  14 127.566  -0.730   6.247
  556   1HB   ALA  14           HB1      ALA  14 126.302  -2.888   7.187
  557   2HB   ALA  14           HB3      ALA  14 125.712  -2.957   5.527
  558   3HB   ALA  14           HB2      ALA  14 127.445  -3.003   5.849
  559    H    LEU  15           HN       LEU  15 124.274  -0.236   5.417
  560    HA   LEU  15           HA       LEU  15 124.700  -0.359   2.506
  561   1HB   LEU  15           HB2      LEU  15 122.544  -1.065   3.043
  562   2HB   LEU  15           HB1      LEU  15 122.370   0.111   4.342
  563    HG   LEU  15           HG       LEU  15 122.256   1.928   2.635
  564   1HD1  LEU  15          HD12      LEU  15 122.219  -0.398   0.693
  565   2HD1  LEU  15          HD11      LEU  15 121.935   1.291   0.273
  566   3HD1  LEU  15          HD13      LEU  15 123.518   0.782   0.860
  567   1HD2  LEU  15          HD22      LEU  15 120.297   0.002   3.301
  568   2HD2  LEU  15          HD21      LEU  15 120.022   1.642   2.712
  569   3HD2  LEU  15          HD23      LEU  15 120.119   0.299   1.572
  570    H    LEU  16           HN       LEU  16 123.645   2.189   4.808
  571    HA   LEU  16           HA       LEU  16 124.455   4.225   2.809
  572   1HB   LEU  16           HB2      LEU  16 123.217   4.904   5.453
  573   2HB   LEU  16           HB1      LEU  16 123.033   5.710   3.897
  574    HG   LEU  16           HG       LEU  16 122.033   2.909   4.198
  575   1HD1  LEU  16          HD12      LEU  16 121.215   4.842   5.989
  576   2HD1  LEU  16          HD11      LEU  16 119.994   4.919   4.719
  577   3HD1  LEU  16          HD13      LEU  16 120.310   3.396   5.548
  578   1HD2  LEU  16          HD21      LEU  16 121.120   5.336   2.642
  579   2HD2  LEU  16          HD23      LEU  16 122.016   3.963   1.990
  580   3HD2  LEU  16          HD22      LEU  16 120.363   3.745   2.565
  581    H    LEU  17           HN       LEU  17 125.036   3.419   6.248
  582    HA   LEU  17           HA       LEU  17 127.184   5.412   6.381
  583   1HB   LEU  17           HB2      LEU  17 125.686   3.666   8.272
  584   2HB   LEU  17           HB1      LEU  17 127.311   4.141   8.728
  585    HG   LEU  17           HG       LEU  17 125.051   6.006   7.971
  586   1HD1  LEU  17          HD12      LEU  17 124.982   4.948  10.261
  587   2HD1  LEU  17          HD11      LEU  17 126.538   5.707  10.595
  588   3HD1  LEU  17          HD13      LEU  17 125.118   6.706  10.284
  589   1HD2  LEU  17          HD23      LEU  17 127.993   6.425   8.452
  590   2HD2  LEU  17          HD22      LEU  17 126.964   7.119   7.199
  591   3HD2  LEU  17          HD21      LEU  17 126.846   7.702   8.859
  592    H    GLY  18           HN       GLY  18 127.221   2.774   4.746
  593   1HA   GLY  18           HA2      GLY  18 129.880   1.878   5.780
  594   2HA   GLY  18           HA1      GLY  18 128.691   0.711   5.198
  595    H    SER  19           HN       SER  19 131.015   0.573   3.905
  596    HA   SER  19           HA       SER  19 130.470   1.947   1.306
  597   1HB   SER  19           HB2      SER  19 133.231   1.302   2.372
  598   2HB   SER  19           HB1      SER  19 132.830   2.253   0.945
  599    HG   SER  19           HG       SER  19 133.243   3.179   3.308
  600    H    GLU  20           HN       GLU  20 131.905  -0.838   2.965
  601    HA   GLU  20           HA       GLU  20 130.831  -2.797   1.259
  602   1HB   GLU  20           HB2      GLU  20 132.708  -1.380  -0.171
  603   2HB   GLU  20           HB1      GLU  20 133.675  -2.710   0.469
  604   1HG   GLU  20           HG2      GLU  20 132.457  -4.325  -0.664
  605   2HG   GLU  20           HG1      GLU  20 130.998  -3.336  -0.717
  606    H    SER  21           HN       SER  21 131.718  -4.931   1.735
  607    HA   SER  21           HA       SER  21 132.942  -6.492   3.036
  608   1HB   SER  21           HB2      SER  21 134.756  -4.596   3.075
  609   2HB   SER  21           HB1      SER  21 134.114  -4.259   4.681
  610    HG   SER  21           HG       SER  21 135.666  -5.764   4.999
  611    H    ASN  22           HN       ASN  22 131.685  -3.602   4.693
  612    HA   ASN  22           HA       ASN  22 130.800  -5.167   7.002
  613   1HB   ASN  22           HB2      ASN  22 129.529  -2.920   7.452
  614   2HB   ASN  22           HB1      ASN  22 131.284  -2.954   7.618
  615   1HD2  ASN  22          HD22      ASN  22 131.851  -0.819   4.836
  616   2HD2  ASN  22          HD21      ASN  22 132.563  -1.874   5.959
  617    H    TYR  23           HN       TYR  23 129.436  -3.872   4.022
  618    HA   TYR  23           HA       TYR  23 126.678  -4.408   4.708
  619   1HB   TYR  23           HB2      TYR  23 127.148  -2.842   2.932
  620   2HB   TYR  23           HB1      TYR  23 128.077  -4.050   2.046
  621    HD1  TYR  23           HD1      TYR  23 124.709  -2.952   3.030
  622    HD2  TYR  23           HD2      TYR  23 126.973  -5.891   0.867
  623    HE1  TYR  23           HE1      TYR  23 122.638  -3.727   1.915
  624    HE2  TYR  23           HE2      TYR  23 124.899  -6.667  -0.250
  625    HH   TYR  23           HH       TYR  23 121.864  -5.980   0.815
  626    H    GLU  24           HN       GLU  24 128.973  -6.137   2.552
  627    HA   GLU  24           HA       GLU  24 127.242  -8.408   2.198
  628   1HB   GLU  24           HB2      GLU  24 130.127  -7.804   1.699
  629   2HB   GLU  24           HB1      GLU  24 129.659  -9.503   1.769
  630   1HG   GLU  24           HG2      GLU  24 127.912  -9.092   0.072
  631   2HG   GLU  24           HG1      GLU  24 128.393  -7.397  -0.009
  632    H    ALA  25           HN       ALA  25 129.988  -7.800   4.399
  633    HA   ALA  25           HA       ALA  25 129.878 -10.301   5.735
  634   1HB   ALA  25           HB1      ALA  25 131.773  -8.726   5.968
  635   2HB   ALA  25           HB3      ALA  25 130.722  -7.601   6.827
  636   3HB   ALA  25           HB2      ALA  25 131.113  -9.164   7.544
  637    H    ALA  26           HN       ALA  26 127.980  -7.396   5.974
  638    HA   ALA  26           HA       ALA  26 126.758  -7.993   8.507
  639   1HB   ALA  26           HB1      ALA  26 126.262  -6.054   6.280
  640   2HB   ALA  26           HB3      ALA  26 124.971  -6.335   7.448
  641   3HB   ALA  26           HB2      ALA  26 126.538  -5.737   7.993
  642    H    LEU  27           HN       LEU  27 126.184  -8.866   5.181
  643    HA   LEU  27           HA       LEU  27 123.506  -9.907   5.627
  644   1HB   LEU  27           HB2      LEU  27 125.510  -9.967   3.371
  645   2HB   LEU  27           HB1      LEU  27 123.993 -10.837   3.290
  646    HG   LEU  27           HG       LEU  27 123.826  -7.994   4.121
  647   1HD1  LEU  27          HD13      LEU  27 124.971  -8.908   1.545
  648   2HD1  LEU  27          HD12      LEU  27 123.690  -7.701   1.420
  649   3HD1  LEU  27          HD11      LEU  27 125.139  -7.355   2.365
  650   1HD2  LEU  27          HD23      LEU  27 121.998  -9.900   3.521
  651   2HD2  LEU  27          HD22      LEU  27 121.692  -8.177   3.299
  652   3HD2  LEU  27          HD21      LEU  27 122.196  -9.166   1.929
  653    H    LYS  28           HN       LYS  28 126.685 -10.986   6.201
  654    HA   LYS  28           HA       LYS  28 126.709 -13.690   5.586
  655   1HB   LYS  28           HB2      LYS  28 128.214 -11.984   7.228
  656   2HB   LYS  28           HB1      LYS  28 127.711 -13.311   8.275
  657   1HG   LYS  28           HG2      LYS  28 129.027 -14.811   7.199
  658   2HG   LYS  28           HG1      LYS  28 128.590 -14.183   5.609
  659   1HD   LYS  28           HD2      LYS  28 130.278 -12.581   5.625
  660   2HD   LYS  28           HD1      LYS  28 130.361 -12.539   7.386
  661   1HE   LYS  28           HE2      LYS  28 131.150 -15.027   7.143
  662   2HE   LYS  28           HE1      LYS  28 131.533 -14.553   5.488
  663   1HZ   LYS  28           HZ3      LYS  28 132.409 -12.712   7.546
  664   2HZ   LYS  28           HZ2      LYS  28 133.189 -14.221   7.551
  665   3HZ   LYS  28           HZ1      LYS  28 133.217 -13.252   6.156
  666    HA   PRO  29           HA       PRO  29 124.495 -14.645   9.804
  667   1HB   PRO  29           HB2      PRO  29 122.952 -12.307  10.487
  668   2HB   PRO  29           HB1      PRO  29 124.240 -13.078  11.423
  669   1HG   PRO  29           HG2      PRO  29 124.370 -10.578  10.013
  670   2HG   PRO  29           HG1      PRO  29 125.670 -11.383  10.901
  671   1HD   PRO  29           HD2      PRO  29 125.374 -11.109   8.041
  672   2HD   PRO  29           HD1      PRO  29 126.702 -11.876   8.933
  673    H    PHE  30           HN       PHE  30 123.168 -12.574   7.309
  674    HA   PHE  30           HA       PHE  30 120.475 -13.757   7.565
  675   1HB   PHE  30           HB2      PHE  30 121.629 -11.744   5.611
  676   2HB   PHE  30           HB1      PHE  30 119.936 -12.241   5.651
  677    HD1  PHE  30           HD2      PHE  30 119.158 -12.366   8.372
  678    HD2  PHE  30           HD1      PHE  30 121.903  -9.620   6.536
  679    HE1  PHE  30           HE2      PHE  30 118.713 -10.719  10.171
  680    HE2  PHE  30           HE1      PHE  30 121.458  -7.972   8.335
  681    HZ   PHE  30           HZ       PHE  30 119.863  -8.522  10.153
  682    H    ASN  31           HN       ASN  31 123.401 -14.399   5.954
  683    HA   ASN  31           HA       ASN  31 123.949 -15.758   4.103
  684   1HB   ASN  31           HB2      ASN  31 123.026 -18.004   4.335
  685   2HB   ASN  31           HB1      ASN  31 123.373 -17.348   5.935
  686   1HD2  ASN  31          HD22      ASN  31 119.938 -17.131   6.886
  687   2HD2  ASN  31          HD21      ASN  31 121.502 -16.564   7.226
  688    HA   PRO  32           HA       PRO  32 120.181 -14.296   1.702
  689   1HB   PRO  32           HB2      PRO  32 122.000 -12.879  -0.013
  690   2HB   PRO  32           HB1      PRO  32 120.785 -12.196   1.077
  691   1HG   PRO  32           HG2      PRO  32 123.653 -12.177   1.401
  692   2HG   PRO  32           HG1      PRO  32 122.434 -11.488   2.481
  693   1HD   PRO  32           HD2      PRO  32 124.031 -13.853   2.902
  694   2HD   PRO  32           HD1      PRO  32 122.803 -13.159   3.981
  695    H    ALA  33           HN       ALA  33 119.610 -15.381  -0.213
  696    HA   ALA  33           HA       ALA  33 120.983 -17.647  -1.057
  697   1HB   ALA  33           HB3      ALA  33 118.618 -16.958  -1.677
  698   2HB   ALA  33           HB2      ALA  33 119.332 -15.927  -2.915
  699   3HB   ALA  33           HB1      ALA  33 119.557 -17.673  -2.987
  700    H    SER  34           HN       SER  34 121.736 -17.814  -3.551
  701    HA   SER  34           HA       SER  34 124.251 -16.491  -3.715
  702   1HB   SER  34           HB2      SER  34 122.570 -18.069  -5.630
  703   2HB   SER  34           HB1      SER  34 123.969 -17.194  -6.248
  704    HG   SER  34           HG       SER  34 124.052 -19.514  -5.215
  705    H    ASP  35           HN       ASP  35 122.156 -16.122  -6.503
  706    HA   ASP  35           HA       ASP  35 122.953 -13.593  -7.274
  707   1HB   ASP  35           HB2      ASP  35 120.032 -14.363  -7.381
  708   2HB   ASP  35           HB1      ASP  35 120.961 -13.428  -8.552
  709    H    LEU  36           HN       LEU  36 120.215 -14.240  -5.025
  710    HA   LEU  36           HA       LEU  36 119.324 -11.729  -4.444
  711   1HB   LEU  36           HB2      LEU  36 120.067 -13.929  -2.493
  712   2HB   LEU  36           HB1      LEU  36 119.026 -12.573  -2.130
  713    HG   LEU  36           HG       LEU  36 118.527 -14.776  -4.121
  714   1HD1  LEU  36          HD13      LEU  36 117.586 -14.079  -1.434
  715   2HD1  LEU  36          HD12      LEU  36 116.268 -14.347  -2.575
  716   3HD1  LEU  36          HD11      LEU  36 117.468 -15.610  -2.301
  717   1HD2  LEU  36          HD23      LEU  36 117.169 -12.094  -3.786
  718   2HD2  LEU  36          HD22      LEU  36 117.848 -12.790  -5.257
  719   3HD2  LEU  36          HD21      LEU  36 116.376 -13.466  -4.560
  720    H    GLN  37           HN       GLN  37 122.156 -13.226  -2.859
  721    HA   GLN  37           HA       GLN  37 122.984 -10.902  -1.445
  722   1HB   GLN  37           HB2      GLN  37 123.977 -13.026  -0.883
  723   2HB   GLN  37           HB1      GLN  37 124.568 -13.248  -2.530
  724   1HG   GLN  37           HG2      GLN  37 126.384 -11.937  -2.178
  725   2HG   GLN  37           HG1      GLN  37 125.449 -10.730  -1.295
  726    H    ASN  38           HN       ASN  38 123.795 -12.065  -4.719
  727    HA   ASN  38           HA       ASN  38 125.738 -10.216  -5.447
  728   1HB   ASN  38           HB2      ASN  38 125.325 -10.922  -7.586
  729   2HB   ASN  38           HB1      ASN  38 124.448 -12.172  -6.752
  730   1HD2  ASN  38          HD22      ASN  38 122.263  -9.202  -8.602
  731   2HD2  ASN  38          HD21      ASN  38 123.800  -8.823  -7.992
  732    H    ALA  39           HN       ALA  39 122.217  -9.836  -5.642
  733    HA   ALA  39           HA       ALA  39 122.195  -7.190  -6.658
  734   1HB   ALA  39           HB3      ALA  39 120.239  -8.761  -4.977
  735   2HB   ALA  39           HB2      ALA  39 119.882  -7.156  -5.607
  736   3HB   ALA  39           HB1      ALA  39 120.191  -8.486  -6.717
  737    H    GLY  40           HN       GLY  40 122.516  -8.438  -3.369
  738   1HA   GLY  40           HA2      GLY  40 122.104  -5.880  -2.078
  739   2HA   GLY  40           HA1      GLY  40 122.857  -7.293  -1.335
  740    H    THR  41           HN       THR  41 124.895  -7.526  -3.485
  741    HA   THR  41           HA       THR  41 126.891  -5.834  -2.313
  742    HB   THR  41           HB       THR  41 126.808  -7.468  -4.851
  743    HG1  THR  41           HG1      THR  41 128.493  -8.537  -3.673
  744    H    GLN  42           HN       GLN  42 125.323  -5.680  -5.543
  745    HA   GLN  42           HA       GLN  42 126.436  -3.208  -6.282
  746   1HB   GLN  42           HB2      GLN  42 124.039  -4.820  -7.030
  747   2HB   GLN  42           HB1      GLN  42 124.064  -3.139  -7.526
  748   1HG   GLN  42           HG2      GLN  42 125.563  -3.567  -9.158
  749   2HG   GLN  42           HG1      GLN  42 126.634  -4.378  -8.015
  750    H    LEU  43           HN       LEU  43 123.527  -4.050  -4.465
  751    HA   LEU  43           HA       LEU  43 122.235  -1.639  -4.122
  752   1HB   LEU  43           HB2      LEU  43 121.252  -3.436  -3.011
  753   2HB   LEU  43           HB1      LEU  43 122.767  -3.978  -2.321
  754    HG   LEU  43           HG       LEU  43 121.048  -2.894  -0.733
  755   1HD1  LEU  43          HD12      LEU  43 123.688  -3.188  -0.507
  756   2HD1  LEU  43          HD11      LEU  43 123.636  -1.425  -0.536
  757   3HD1  LEU  43          HD13      LEU  43 122.745  -2.308   0.696
  758   1HD2  LEU  43          HD23      LEU  43 121.297  -0.837  -2.622
  759   2HD2  LEU  43          HD22      LEU  43 120.434  -0.780  -1.085
  760   3HD2  LEU  43          HD21      LEU  43 122.115  -0.260  -1.171
  761    H    LYS  44           HN       LYS  44 125.251  -2.718  -2.589
  762    HA   LYS  44           HA       LYS  44 125.515  -0.367  -0.909
  763   1HB   LYS  44           HB2      LYS  44 126.642  -2.568  -0.465
  764   2HB   LYS  44           HB1      LYS  44 127.688  -2.259  -1.852
  765   1HG   LYS  44           HG2      LYS  44 128.892  -1.518   0.085
  766   2HG   LYS  44           HG1      LYS  44 128.324  -0.065  -0.739
  767   1HD   LYS  44           HD2      LYS  44 126.248  -0.265   0.813
  768   2HD   LYS  44           HD1      LYS  44 127.267  -1.332   1.781
  769   1HE   LYS  44           HE2      LYS  44 127.430   0.994   2.583
  770   2HE   LYS  44           HE1      LYS  44 128.976   0.441   1.939
  771   1HZ   LYS  44           HZ2      LYS  44 127.258   1.623  -0.040
  772   2HZ   LYS  44           HZ1      LYS  44 127.695   2.702   1.198
  773   3HZ   LYS  44           HZ3      LYS  44 128.897   1.921   0.293
  774    H    ARG  45           HN       ARG  45 126.837  -1.330  -4.075
  775    HA   ARG  45           HA       ARG  45 128.594   0.844  -4.479
  776   1HB   ARG  45           HB2      ARG  45 126.906  -0.758  -6.412
  777   2HB   ARG  45           HB1      ARG  45 128.037   0.482  -6.954
  778   1HG   ARG  45           HG2      ARG  45 129.868  -0.782  -6.455
  779   2HG   ARG  45           HG1      ARG  45 129.131  -1.452  -4.999
  780   1HD   ARG  45           HD2      ARG  45 128.463  -3.298  -6.097
  781   2HD   ARG  45           HD1      ARG  45 127.729  -2.345  -7.384
  782    HE   ARG  45           HE       ARG  45 130.148  -3.792  -7.617
  783   1HH1  ARG  45          HH21      ARG  45 128.958  -0.591  -8.215
  784   2HH1  ARG  45          HH22      ARG  45 130.265  -0.179  -9.269
  785   1HH2  ARG  45          HH11      ARG  45 131.825  -3.256  -9.005
  786   2HH2  ARG  45          HH12      ARG  45 131.875  -1.681  -9.724
  787    H    LEU  46           HN       LEU  46 125.160   0.607  -5.486
  788    HA   LEU  46           HA       LEU  46 124.805   3.144  -6.539
  789   1HB   LEU  46           HB2      LEU  46 122.810   1.773  -4.728
  790   2HB   LEU  46           HB1      LEU  46 122.496   2.803  -6.110
  791    HG   LEU  46           HG       LEU  46 123.547  -0.015  -6.104
  792   1HD1  LEU  46          HD12      LEU  46 121.016   1.064  -6.416
  793   2HD1  LEU  46          HD11      LEU  46 121.553   0.825  -8.078
  794   3HD1  LEU  46          HD13      LEU  46 121.520  -0.537  -6.958
  795   1HD2  LEU  46          HD21      LEU  46 123.932   2.169  -8.117
  796   2HD2  LEU  46          HD23      LEU  46 125.006   0.836  -7.694
  797   3HD2  LEU  46          HD22      LEU  46 123.595   0.543  -8.711
  798    H    VAL  47           HN       VAL  47 125.175   2.181  -3.185
  799    HA   VAL  47           HA       VAL  47 124.258   4.736  -2.108
  800    HB   VAL  47           HB       VAL  47 125.781   2.426  -0.869
  801    H    ASP  48           HN       ASP  48 127.381   3.238  -2.876
  802    HA   ASP  48           HA       ASP  48 128.819   5.644  -1.930
  803   1HB   ASP  48           HB2      ASP  48 129.486   2.882  -2.355
  804   2HB   ASP  48           HB1      ASP  48 130.551   3.880  -3.345
  805    H    THR  49           HN       THR  49 126.926   5.541  -4.309
  806    HA   THR  49           HA       THR  49 128.852   6.576  -6.350
  807    HB   THR  49           HB       THR  49 126.632   5.952  -7.805
  808    HG1  THR  49           HG1      THR  49 125.456   4.885  -6.400
  809    H    LEU  50           HN       LEU  50 126.437   7.401  -4.188
  810    HA   LEU  50           HA       LEU  50 125.457   9.655  -5.878
  811   1HB   LEU  50           HB2      LEU  50 124.378   8.219  -3.468
  812   2HB   LEU  50           HB1      LEU  50 123.862   9.873  -3.795
  813    HG   LEU  50           HG       LEU  50 123.799   7.786  -5.966
  814   1HD1  LEU  50          HD11      LEU  50 121.915   8.173  -3.666
  815   2HD1  LEU  50          HD13      LEU  50 121.252   7.757  -5.247
  816   3HD1  LEU  50          HD12      LEU  50 122.410   6.681  -4.465
  817   1HD2  LEU  50          HD22      LEU  50 122.469  10.442  -5.411
  818   2HD2  LEU  50          HD21      LEU  50 123.467   9.987  -6.793
  819   3HD2  LEU  50          HD23      LEU  50 121.838   9.331  -6.627
  820    HA   PRO  51           HA       PRO  51 127.651  12.734  -3.701
  821   1HB   PRO  51           HB2      PRO  51 125.356  14.309  -2.933
  822   2HB   PRO  51           HB1      PRO  51 126.497  14.608  -4.251
  823   1HG   PRO  51           HG2      PRO  51 123.774  13.705  -4.469
  824   2HG   PRO  51           HG1      PRO  51 124.933  13.967  -5.779
  825   1HD   PRO  51           HD2      PRO  51 123.959  11.452  -4.762
  826   2HD   PRO  51           HD1      PRO  51 125.126  11.719  -6.073
  827    H    GLN  52           HN       GLN  52 127.009  14.246  -1.472
  828    HA   GLN  52           HA       GLN  52 126.967  12.173   0.624
  829   1HB   GLN  52           HB2      GLN  52 127.581  15.124   0.570
  830   2HB   GLN  52           HB1      GLN  52 127.343  14.278   2.100
  831   1HG   GLN  52           HG2      GLN  52 129.092  12.630   1.406
  832   2HG   GLN  52           HG1      GLN  52 129.387  13.604  -0.035
  833    H    GLU  53           HN       GLU  53 125.119  15.121  -0.203
  834    HA   GLU  53           HA       GLU  53 123.232  14.923   1.921
  835   1HB   GLU  53           HB2      GLU  53 123.403  16.331  -0.676
  836   2HB   GLU  53           HB1      GLU  53 121.761  16.029  -0.107
  837   1HG   GLU  53           HG2      GLU  53 122.014  17.359   1.766
  838   2HG   GLU  53           HG1      GLU  53 123.752  17.072   1.863
  839    H    THR  54           HN       THR  54 123.280  13.394  -1.304
  840    HA   THR  54           HA       THR  54 120.635  12.290  -1.103
  841    HB   THR  54           HB       THR  54 122.823  10.863  -2.543
  842    HG1  THR  54           HG1      THR  54 122.259  12.420  -4.280
  843    H    ARG  55           HN       ARG  55 123.714  11.411   0.251
  844    HA   ARG  55           HA       ARG  55 122.957   8.694   0.963
  845   1HB   ARG  55           HB2      ARG  55 125.265  10.457   1.338
  846   2HB   ARG  55           HB1      ARG  55 124.908   9.513   2.784
  847   1HG   ARG  55           HG2      ARG  55 125.134   7.455   1.640
  848   2HG   ARG  55           HG1      ARG  55 125.003   8.224   0.058
  849   1HD   ARG  55           HD2      ARG  55 127.304   7.870   0.207
  850   2HD   ARG  55           HD1      ARG  55 127.162   9.516   0.822
  851    HE   ARG  55           HE       ARG  55 126.925   7.937   3.088
  852   1HH1  ARG  55          HH21      ARG  55 129.165   8.249   0.477
  853   2HH1  ARG  55          HH22      ARG  55 130.534   7.776   1.425
  854   1HH2  ARG  55          HH11      ARG  55 128.704   7.318   4.333
  855   2HH2  ARG  55          HH12      ARG  55 130.274   7.250   3.605
  856    H    ILE  56           HN       ILE  56 123.485  11.611   2.993
  857    HA   ILE  56           HA       ILE  56 122.120  10.579   5.274
  858    HB   ILE  56           HB       ILE  56 122.586  13.427   4.333
  859   1HD1  ILE  56          HD11      ILE  56 124.426  13.970   4.404
  860   2HD1  ILE  56          HD13      ILE  56 125.155  14.170   5.998
  861   3HD1  ILE  56          HD12      ILE  56 125.716  12.887   4.926
  862    H    ASN  57           HN       ASN  57 120.947  11.616   2.221
  863    HA   ASN  57           HA       ASN  57 118.365  12.460   3.200
  864   1HB   ASN  57           HB2      ASN  57 119.614  11.958   0.522
  865   2HB   ASN  57           HB1      ASN  57 117.873  12.097   0.659
  866   1HD2  ASN  57          HD22      ASN  57 119.620  15.408   2.239
  867   2HD2  ASN  57          HD21      ASN  57 119.920  13.870   2.891
  868    H    ILE  58           HN       ILE  58 119.260   9.656   1.110
  869    HA   ILE  58           HA       ILE  58 116.873   8.246   1.527
  870    HB   ILE  58           HB       ILE  58 119.687   7.365   0.870
  871   1HD1  ILE  58          HD12      ILE  58 116.087   7.200   0.056
  872   2HD1  ILE  58          HD11      ILE  58 116.611   8.841  -0.315
  873   3HD1  ILE  58          HD13      ILE  58 116.265   7.709  -1.622
  874    H    VAL  59           HN       VAL  59 119.605   8.656   3.682
  875    HA   VAL  59           HA       VAL  59 118.775   6.462   5.448
  876    HB   VAL  59           HB       VAL  59 120.673   8.780   5.963
  877    H    LYS  60           HN       LYS  60 118.575   9.940   5.272
  878    HA   LYS  60           HA       LYS  60 116.952  10.158   7.728
  879   1HB   LYS  60           HB2      LYS  60 117.939  12.212   5.723
  880   2HB   LYS  60           HB1      LYS  60 117.137  12.608   7.226
  881   1HG   LYS  60           HG2      LYS  60 119.747  11.101   7.000
  882   2HG   LYS  60           HG1      LYS  60 119.561  12.782   7.507
  883   1HD   LYS  60           HD2      LYS  60 117.917  11.802   9.277
  884   2HD   LYS  60           HD1      LYS  60 118.732  10.275   8.938
  885   1HE   LYS  60           HE2      LYS  60 120.927  11.453   9.371
  886   2HE   LYS  60           HE1      LYS  60 119.997  12.844   9.928
  887   1HZ   LYS  60           HZ3      LYS  60 119.041  10.476  11.141
  888   2HZ   LYS  60           HZ2      LYS  60 120.716  10.611  11.391
  889   3HZ   LYS  60           HZ1      LYS  60 119.678  11.867  11.873
  890    H    LEU  61           HN       LEU  61 116.375   9.112   4.746
  891    HA   LEU  61           HA       LEU  61 113.786  10.516   4.323
  892   1HB   LEU  61           HB2      LEU  61 115.348  10.611   2.455
  893   2HB   LEU  61           HB1      LEU  61 115.651   8.910   2.581
  894    HG   LEU  61           HG       LEU  61 113.860  10.093   0.856
  895   1HD1  LEU  61          HD11      LEU  61 114.703   7.467   1.717
  896   2HD1  LEU  61          HD13      LEU  61 113.094   7.479   0.998
  897   3HD1  LEU  61          HD12      LEU  61 114.469   8.099   0.090
  898   1HD2  LEU  61          HD23      LEU  61 112.381  10.095   3.111
  899   2HD2  LEU  61          HD22      LEU  61 111.690   9.811   1.515
  900   3HD2  LEU  61          HD21      LEU  61 112.084   8.446   2.558
  901    H    THR  62           HN       THR  62 115.366   7.331   4.322
  902    HA   THR  62           HA       THR  62 113.063   5.783   3.936
  903    HB   THR  62           HB       THR  62 115.483   5.084   5.648
  904    HG1  THR  62           HG1      THR  62 116.497   4.860   3.851
  905    H    GLU  63           HN       GLU  63 114.062   7.660   6.637
  906    HA   GLU  63           HA       GLU  63 112.487   6.181   8.620
  907   1HB   GLU  63           HB2      GLU  63 113.999   8.799   8.647
  908   2HB   GLU  63           HB1      GLU  63 112.982   8.306  10.002
  909   1HG   GLU  63           HG2      GLU  63 114.343   6.032   9.733
  910   2HG   GLU  63           HG1      GLU  63 115.541   7.113   9.020
  911    H    LYS  64           HN       LYS  64 112.203   9.210   6.778
  912    HA   LYS  64           HA       LYS  64 109.679   9.988   7.920
  913   1HB   LYS  64           HB2      LYS  64 111.451  10.906   5.801
  914   2HB   LYS  64           HB1      LYS  64 109.760  11.011   5.312
  915   1HG   LYS  64           HG2      LYS  64 109.847  13.001   6.435
  916   2HG   LYS  64           HG1      LYS  64 109.577  11.970   7.842
  917   1HD   LYS  64           HD2      LYS  64 111.835  12.013   8.471
  918   2HD   LYS  64           HD1      LYS  64 112.374  12.475   6.856
  919   1HE   LYS  64           HE2      LYS  64 112.485  14.365   8.487
  920   2HE   LYS  64           HE1      LYS  64 111.415  14.700   7.125
  921   1HZ   LYS  64           HZ1      LYS  64 109.896  13.423   9.068
  922   2HZ   LYS  64           HZ3      LYS  64 110.795  14.616   9.871
  923   3HZ   LYS  64           HZ2      LYS  64 109.793  15.044   8.568
  924    H    ILE  65           HN       ILE  65 110.614   7.777   5.364
  925    HA   ILE  65           HA       ILE  65 107.889   7.558   4.315
  926    HB   ILE  65           HB       ILE  65 110.008   7.221   2.951
  927   1HD1  ILE  65          HD12      ILE  65 110.321   5.003   1.664
  928   2HD1  ILE  65          HD11      ILE  65 108.976   3.863   1.624
  929   3HD1  ILE  65          HD13      ILE  65 109.015   5.220   0.500
  930    H    LEU  66           HN       LEU  66 110.074   5.572   6.297
  931    HA   LEU  66           HA       LEU  66 107.946   3.606   6.762
  932   1HB   LEU  66           HB2      LEU  66 110.877   3.832   7.227
  933   2HB   LEU  66           HB1      LEU  66 109.966   2.784   8.301
  934    HG   LEU  66           HG       LEU  66 109.195   2.455   5.503
  935   1HD1  LEU  66          HD11      LEU  66 112.066   2.299   6.311
  936   2HD1  LEU  66          HD13      LEU  66 111.443   1.033   5.253
  937   3HD1  LEU  66          HD12      LEU  66 111.360   2.721   4.750
  938   1HD2  LEU  66          HD23      LEU  66 109.998   0.744   7.842
  939   2HD2  LEU  66          HD22      LEU  66 108.463   0.785   6.973
  940   3HD2  LEU  66          HD21      LEU  66 109.876   0.033   6.233
  941    H    THR  67           HN       THR  67 110.221   5.157   9.046
  942    HA   THR  67           HA       THR  67 108.119   5.122  11.106
  943    HB   THR  67           HB       THR  67 110.429   4.517  11.719
  944    HG1  THR  67           HG1      THR  67 109.059   5.603  13.232
  945    H    SER  68           HN       SER  68 107.083   6.739   9.309
  946    HA   SER  68           HA       SER  68 107.966   9.486   9.440
  947   1HB   SER  68           HB2      SER  68 106.179   9.947   8.038
  948   2HB   SER  68           HB1      SER  68 106.378   8.225   7.728
  949    HG   SER  68           HG       SER  68 104.313   8.284   8.267
  950    HA   PRO  69           HA       PRO  69 106.404  10.026  13.614
  951   1HB   PRO  69           HB2      PRO  69 106.954  12.842  13.365
  952   2HB   PRO  69           HB1      PRO  69 107.864  11.631  14.279
  953   1HG   PRO  69           HG2      PRO  69 108.633  12.921  11.817
  954   2HG   PRO  69           HG1      PRO  69 109.538  11.710  12.735
  955   1HD   PRO  69           HD2      PRO  69 108.177  11.358  10.222
  956   2HD   PRO  69           HD1      PRO  69 109.068  10.140  11.157
  957    H    LEU  70           HN       LEU  70 105.163  12.484  14.286
  958    HA   LEU  70           HA       LEU  70 103.082  13.557  14.131
  959   1HB   LEU  70           HB2      LEU  70 103.662  13.033  11.206
  960   2HB   LEU  70           HB1      LEU  70 102.244  13.928  11.754
  961    HG   LEU  70           HG       LEU  70 104.010  15.312  13.131
  962   1HD1  LEU  70          HD11      LEU  70 105.689  13.512  11.772
  963   2HD1  LEU  70          HD13      LEU  70 105.886  15.051  10.935
  964   3HD1  LEU  70          HD12      LEU  70 106.185  14.947  12.669
  965   1HD2  LEU  70          HD23      LEU  70 102.936  15.507  10.430
  966   2HD2  LEU  70          HD22      LEU  70 103.138  16.771  11.642
  967   3HD2  LEU  70          HD21      LEU  70 104.477  16.352  10.574
  968    H    CYS  71           HN       CYS  71 100.824  13.056  12.645
  969    HA   CYS  71           HA       CYS  71  99.601  10.880  13.852
  970   1HB   CYS  71           HB2      CYS  71  98.114  10.837  11.732
  971   2HB   CYS  71           HB1      CYS  71  98.182  12.342  12.650
  972    HG   CYS  71           HG       CYS  71 100.322  12.404  10.545
  973    H3   PCB   1           H3       PCB   1 118.399  -2.876  -1.904
  974    H6   PCB   1           H6       PCB   1 117.164  -0.531   2.292
  975   1HM   PCB   1          1HM       PCB   1 117.334  -5.296   1.222
  976   2HM   PCB   1          2HM       PCB   1 118.529  -6.571   1.025
  977   3HM   PCB   1          3HM       PCB   1 117.657  -5.953  -0.378
  978    H3'  PCB   1           H3'      PCB   1 116.836   4.024  -0.576
  979    H6'  PCB   1           H6'      PCB   1 114.485  -0.174   0.639
  980   1HM'  PCB   1          1HM'      PCB   1 113.933   4.392   2.284
  981   2HM'  PCB   1          2HM'      PCB   1 113.207   5.910   1.773
  982   3HM'  PCB   1          3HM'      PCB   1 114.961   5.749   1.844
   
  No H/Q in entry =         982


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