NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
5671 1hry cing 1-original 18 MR format nomenclature mapping


  Entry H atom name         Orig H atom name
  Start of MODEL           1
    1    H    ASP   3           HN       ASP   3  17.888 -10.952  -5.664
    2    HA   ASP   3           HA       ASP   3  17.616  -8.554  -3.897
    3   1HB   ASP   3           HB2      ASP   3  18.049  -8.608  -6.900
    4   2HB   ASP   3           HB1      ASP   3  17.580  -7.170  -5.994
    5    NH1  ARG   4           NH2      ARG   4  16.737  -4.936 -10.824
    6    NH2  ARG   4           NH1      ARG   4  16.221  -2.889 -10.012
    7    H    ARG   4           HN       ARG   4  16.220  -8.508  -7.029
    8    HA   ARG   4           HA       ARG   4  13.539  -8.388  -5.916
    9   1HB   ARG   4           HB2      ARG   4  14.437  -8.583  -8.797
   10   2HB   ARG   4           HB1      ARG   4  12.822  -8.139  -8.248
   11   1HG   ARG   4           HG2      ARG   4  13.437  -5.983  -7.790
   12   2HG   ARG   4           HG1      ARG   4  14.942  -6.484  -7.005
   13   1HD   ARG   4           HD2      ARG   4  16.064  -6.658  -9.108
   14   2HD   ARG   4           HD1      ARG   4  14.561  -6.539 -10.015
   15    HE   ARG   4           HE       ARG   4  14.718  -4.170  -8.542
   16   1HH1  ARG   4          HH21      ARG   4  16.611  -5.928 -10.810
   17   2HH1  ARG   4          HH22      ARG   4  17.377  -4.522 -11.471
   18   1HH2  ARG   4          HH11      ARG   4  15.701  -2.316  -9.380
   19   2HH2  ARG   4          HH12      ARG   4  16.858  -2.471 -10.657
   20    H    VAL   5           HN       VAL   5  12.073  -9.969  -5.800
   21    HA   VAL   5           HA       VAL   5  12.830 -12.685  -6.699
   22    HB   VAL   5           HB       VAL   5  10.360 -11.711  -5.225
   23   1HG1  VAL   5          HG13      VAL   5  11.024 -14.269  -6.389
   24   2HG1  VAL   5          HG12      VAL   5  11.079 -14.453  -4.642
   25   3HG1  VAL   5          HG11      VAL   5   9.615 -13.858  -5.416
   26   1HG2  VAL   5          HG21      VAL   5  13.054 -12.697  -4.254
   27   2HG2  VAL   5          HG23      VAL   5  12.249 -11.178  -3.865
   28   3HG2  VAL   5          HG22      VAL   5  11.626 -12.695  -3.222
   29    H    LYS   6           HN       LYS   6  11.335 -13.845  -8.125
   30    HA   LYS   6           HA       LYS   6  10.379 -12.169 -10.288
   31   1HB   LYS   6           HB2      LYS   6   9.297 -14.698 -10.755
   32   2HB   LYS   6           HB1      LYS   6  10.901 -14.179 -11.269
   33   1HG   LYS   6           HG2      LYS   6  11.953 -15.145  -9.372
   34   2HG   LYS   6           HG1      LYS   6  10.420 -15.334  -8.511
   35   1HD   LYS   6           HD2      LYS   6  10.760 -16.740 -11.155
   36   2HD   LYS   6           HD1      LYS   6  11.571 -17.405  -9.734
   37   1HE   LYS   6           HE2      LYS   6   9.511 -17.679  -8.561
   38   2HE   LYS   6           HE1      LYS   6   8.628 -16.691  -9.726
   39   1HZ   LYS   6           HZ2      LYS   6  10.022 -19.147 -10.576
   40   2HZ   LYS   6           HZ1      LYS   6   8.466 -19.225  -9.900
   41   3HZ   LYS   6           HZ3      LYS   6   8.725 -18.341 -11.323
   42    NH1  ARG   7           NH2      ARG   7  11.044  -9.096 -10.142
   43    NH2  ARG   7           NH1      ARG   7  10.915  -9.096 -12.398
   44    H    ARG   7           HN       ARG   7   8.149 -11.918 -10.949
   45    HA   ARG   7           HA       ARG   7   6.098 -12.696  -8.954
   46   1HB   ARG   7           HB2      ARG   7   5.121 -10.358  -9.107
   47   2HB   ARG   7           HB1      ARG   7   6.616 -10.498  -8.194
   48   1HG   ARG   7           HG2      ARG   7   6.670  -9.757 -11.125
   49   2HG   ARG   7           HG1      ARG   7   6.371  -8.540  -9.900
   50   1HD   ARG   7           HD2      ARG   7   8.579  -8.466  -9.332
   51   2HD   ARG   7           HD1      ARG   7   8.693 -10.213  -9.224
   52    HE   ARG   7           HE       ARG   7   8.528  -9.517 -11.983
   53   1HH1  ARG   7          HH21      ARG   7  10.602  -9.189  -9.249
   54   2HH1  ARG   7          HH22      ARG   7  12.030  -8.942 -10.198
   55   1HH2  ARG   7          HH11      ARG   7  10.373  -9.186 -13.235
   56   2HH2  ARG   7          HH12      ARG   7  11.899  -8.938 -12.455
   57    HA   PRO   8           HA       PRO   8   4.292 -13.576 -12.994
   58   1HB   PRO   8           HB2      PRO   8   1.725 -14.271 -11.995
   59   2HB   PRO   8           HB1      PRO   8   3.054 -15.391 -12.324
   60   1HG   PRO   8           HG2      PRO   8   2.045 -14.443  -9.722
   61   2HG   PRO   8           HG1      PRO   8   3.100 -15.813 -10.076
   62   1HD   PRO   8           HD2      PRO   8   3.895 -13.327  -8.933
   63   2HD   PRO   8           HD1      PRO   8   4.979 -14.606  -9.533
   64    H    MET   9           HN       MET   9   1.839 -12.984 -13.844
   65    HA   MET   9           HA       MET   9   1.733 -10.117 -13.882
   66   1HB   MET   9           HB2      MET   9  -0.448 -12.099 -14.605
   67   2HB   MET   9           HB1      MET   9  -0.336 -10.422 -15.144
   68   1HG   MET   9           HG2      MET   9   1.755 -12.541 -15.720
   69   2HG   MET   9           HG1      MET   9   0.494 -12.057 -16.853
   70   1HE   MET   9           HE3      MET   9   2.312 -11.899 -18.366
   71   2HE   MET   9           HE2      MET   9   3.254 -10.446 -18.678
   72   3HE   MET   9           HE1      MET   9   3.862 -11.657 -17.555
   73    H    ASN  10           HN       ASN  10   0.250  -8.718 -12.799
   74    HA   ASN  10           HA       ASN  10  -0.736  -9.774 -10.223
   75   1HB   ASN  10           HB2      ASN  10  -1.085  -6.957 -11.266
   76   2HB   ASN  10           HB1      ASN  10  -1.046  -7.505  -9.589
   77   1HD2  ASN  10          HD22      ASN  10   2.581  -8.053  -9.725
   78   2HD2  ASN  10          HD21      ASN  10   1.192  -8.874  -9.203
   79    H    ALA  11           HN       ALA  11  -2.933  -9.908  -9.672
   80    HA   ALA  11           HA       ALA  11  -4.829 -10.653 -11.544
   81   1HB   ALA  11           HB2      ALA  11  -4.979 -10.608  -8.946
   82   2HB   ALA  11           HB1      ALA  11  -5.675  -9.001  -9.165
   83   3HB   ALA  11           HB3      ALA  11  -6.469 -10.411  -9.872
   84    H    PHE  12           HN       PHE  12  -3.685  -7.446 -10.903
   85    HA   PHE  12           HA       PHE  12  -5.945  -6.109 -12.177
   86   1HB   PHE  12           HB2      PHE  12  -4.733  -4.832 -10.543
   87   2HB   PHE  12           HB1      PHE  12  -3.195  -5.158 -11.340
   88    HD1  PHE  12           HD1      PHE  12  -6.513  -3.473 -11.836
   89    HD2  PHE  12           HD2      PHE  12  -2.402  -3.743 -13.048
   90    HE1  PHE  12           HE1      PHE  12  -6.784  -1.448 -13.259
   91    HE2  PHE  12           HE2      PHE  12  -2.676  -1.731 -14.479
   92    HZ   PHE  12           HZ       PHE  12  -4.876  -0.580 -14.581
   93    H    ILE  13           HN       ILE  13  -2.503  -6.663 -13.149
   94    HA   ILE  13           HA       ILE  13  -2.973  -5.685 -15.803
   95    HB   ILE  13           HB       ILE  13  -0.778  -7.397 -14.601
   96   1HG1  ILE  13          HG12      ILE  13  -0.709  -4.723 -16.050
   97   2HG1  ILE  13          HG11      ILE  13  -0.985  -4.871 -14.331
   98   1HG2  ILE  13          HG23      ILE  13  -1.426  -6.998 -17.511
   99   2HG2  ILE  13          HG22      ILE  13   0.257  -6.954 -17.047
  100   3HG2  ILE  13          HG21      ILE  13  -0.699  -8.384 -16.716
  101   1HD1  ILE  13          HD13      ILE  13   1.218  -5.983 -14.073
  102   2HD1  ILE  13          HD12      ILE  13   1.524  -5.738 -15.791
  103   3HD1  ILE  13          HD11      ILE  13   1.344  -4.350 -14.728
  104    H    VAL  14           HN       VAL  14  -3.699  -8.753 -14.269
  105    HA   VAL  14           HA       VAL  14  -3.908 -10.428 -16.546
  106    HB   VAL  14           HB       VAL  14  -5.721 -10.269 -14.109
  107   1HG1  VAL  14          HG12      VAL  14  -6.847 -11.405 -16.068
  108   2HG1  VAL  14          HG11      VAL  14  -5.489 -12.524 -16.133
  109   3HG1  VAL  14          HG13      VAL  14  -6.537 -12.486 -14.719
  110   1HG2  VAL  14          HG22      VAL  14  -3.383 -12.040 -14.876
  111   2HG2  VAL  14          HG21      VAL  14  -3.427 -10.862 -13.569
  112   3HG2  VAL  14          HG23      VAL  14  -4.414 -12.317 -13.473
  113    CH2  TRP  15           CH2      TRP  15 -10.101  -6.500 -11.042
  114    H    TRP  15           HN       TRP  15  -6.353  -8.154 -15.198
  115    HA   TRP  15           HA       TRP  15  -8.308  -8.489 -17.216
  116   1HB   TRP  15           HB2      TRP  15  -7.472  -6.052 -15.624
  117   2HB   TRP  15           HB1      TRP  15  -8.731  -5.935 -16.847
  118    HD1  TRP  15           HD1      TRP  15 -10.427  -8.459 -16.399
  119    HE1  TRP  15           HE1      TRP  15 -11.716  -8.834 -14.205
  120    HE3  TRP  15           HE3      TRP  15  -7.818  -5.333 -13.307
  121    HZ2  TRP  15           HZ2      TRP  15 -11.657  -7.933 -11.489
  122    HZ3  TRP  15           HZ3      TRP  15  -8.458  -5.102 -10.916
  123    HH2  TRP  15           HH2      TRP  15 -10.378  -6.395 -10.004
  124    H    SER  16           HN       SER  16  -5.648  -6.124 -17.068
  125    HA   SER  16           HA       SER  16  -5.817  -4.903 -19.495
  126   1HB   SER  16           HB2      SER  16  -3.921  -4.755 -17.736
  127   2HB   SER  16           HB1      SER  16  -3.154  -6.028 -18.676
  128    HG   SER  16           HG       SER  16  -3.510  -4.606 -20.530
  129    NH1  ARG  17           NH2      ARG  17   0.710 -10.225 -21.876
  130    NH2  ARG  17           NH1      ARG  17  -0.365 -11.747 -23.156
  131    H    ARG  17           HN       ARG  17  -4.075  -7.997 -19.073
  132    HA   ARG  17           HA       ARG  17  -3.461  -8.627 -21.682
  133   1HB   ARG  17           HB2      ARG  17  -4.795 -10.564 -19.776
  134   2HB   ARG  17           HB1      ARG  17  -3.732 -10.977 -21.112
  135   1HG   ARG  17           HG2      ARG  17  -2.871  -9.245 -18.782
  136   2HG   ARG  17           HG1      ARG  17  -2.647 -10.984 -18.811
  137   1HD   ARG  17           HD2      ARG  17  -1.387  -8.929 -20.636
  138   2HD   ARG  17           HD1      ARG  17  -0.583 -10.021 -19.527
  139    HE   ARG  17           HE       ARG  17  -2.122 -11.519 -21.461
  140   1HH1  ARG  17          HH21      ARG  17   0.736  -9.639 -21.065
  141   2HH1  ARG  17          HH22      ARG  17   1.497 -10.262 -22.492
  142   1HH2  ARG  17          HH11      ARG  17  -1.163 -12.325 -23.327
  143   2HH2  ARG  17          HH12      ARG  17   0.419 -11.781 -23.775
  144    H    ASP  18           HN       ASP  18  -6.444 -10.114 -20.395
  145    HA   ASP  18           HA       ASP  18  -7.580 -10.296 -23.066
  146   1HB   ASP  18           HB2      ASP  18  -8.886 -10.864 -20.399
  147   2HB   ASP  18           HB1      ASP  18  -9.433 -11.429 -21.978
  148    H    GLN  19           HN       GLN  19  -8.672  -8.472 -20.155
  149    HA   GLN  19           HA       GLN  19 -11.001  -7.336 -21.215
  150   1HB   GLN  19           HB2      GLN  19 -10.204  -7.003 -18.873
  151   2HB   GLN  19           HB1      GLN  19  -8.949  -5.928 -19.478
  152   1HG   GLN  19           HG2      GLN  19 -10.856  -4.639 -18.638
  153   2HG   GLN  19           HG1      GLN  19 -10.675  -4.404 -20.376
  154   1HE2  GLN  19          HE22      GLN  19 -13.908  -6.420 -18.909
  155   2HE2  GLN  19          HE21      GLN  19 -12.574  -6.106 -17.913
  156    NH1  ARG  20           NH2      ARG  20  -3.480  -4.589 -25.137
  157    NH2  ARG  20           NH1      ARG  20  -2.249  -2.796 -25.626
  158    H    ARG  20           HN       ARG  20  -7.781  -5.969 -21.333
  159    HA   ARG  20           HA       ARG  20  -8.286  -3.641 -22.834
  160   1HB   ARG  20           HB2      ARG  20  -6.283  -4.389 -21.587
  161   2HB   ARG  20           HB1      ARG  20  -5.957  -5.514 -22.889
  162   1HG   ARG  20           HG2      ARG  20  -5.529  -3.772 -24.419
  163   2HG   ARG  20           HG1      ARG  20  -6.067  -2.544 -23.269
  164   1HD   ARG  20           HD2      ARG  20  -4.227  -2.856 -21.854
  165   2HD   ARG  20           HD1      ARG  20  -3.904  -4.488 -22.419
  166    HE   ARG  20           HE       ARG  20  -2.768  -2.063 -23.408
  167   1HH1  ARG  20          HH21      ARG  20  -4.037  -5.103 -24.484
  168   2HH1  ARG  20          HH22      ARG  20  -3.291  -4.970 -26.043
  169   1HH2  ARG  20          HH11      ARG  20  -1.858  -1.922 -25.360
  170   2HH2  ARG  20          HH12      ARG  20  -2.040  -3.190 -26.516
  171    NH1  ARG  21           NH2      ARG  21  -5.722  -8.414 -30.720
  172    NH2  ARG  21           NH1      ARG  21  -5.196 -10.608 -30.564
  173    H    ARG  21           HN       ARG  21  -7.532  -6.981 -23.923
  174    HA   ARG  21           HA       ARG  21  -7.194  -6.398 -26.638
  175   1HB   ARG  21           HB2      ARG  21  -6.796  -8.664 -25.946
  176   2HB   ARG  21           HB1      ARG  21  -8.419  -8.822 -25.296
  177   1HG   ARG  21           HG2      ARG  21  -8.299 -10.039 -27.393
  178   2HG   ARG  21           HG1      ARG  21  -9.336  -8.645 -27.633
  179   1HD   ARG  21           HD2      ARG  21  -8.006  -8.141 -29.430
  180   2HD   ARG  21           HD1      ARG  21  -6.749  -7.711 -28.292
  181    HE   ARG  21           HE       ARG  21  -6.692 -10.534 -28.612
  182   1HH1  ARG  21          HH21      ARG  21  -6.211  -7.614 -30.372
  183   2HH1  ARG  21          HH22      ARG  21  -5.127  -8.326 -31.520
  184   1HH2  ARG  21          HH11      ARG  21  -5.284 -11.487 -30.097
  185   2HH2  ARG  21          HH12      ARG  21  -4.603 -10.523 -31.364
  186    H    LYS  22           HN       LYS  22 -10.140  -6.623 -24.706
  187    HA   LYS  22           HA       LYS  22 -12.003  -6.513 -26.893
  188   1HB   LYS  22           HB2      LYS  22 -12.579  -7.090 -24.536
  189   2HB   LYS  22           HB1      LYS  22 -12.253  -5.428 -24.086
  190   1HG   LYS  22           HG2      LYS  22 -14.045  -4.933 -26.029
  191   2HG   LYS  22           HG1      LYS  22 -14.569  -6.554 -25.601
  192   1HD   LYS  22           HD2      LYS  22 -15.840  -5.121 -24.190
  193   2HD   LYS  22           HD1      LYS  22 -14.564  -5.764 -23.160
  194   1HE   LYS  22           HE2      LYS  22 -13.375  -3.725 -23.144
  195   2HE   LYS  22           HE1      LYS  22 -14.167  -3.141 -24.607
  196   1HZ   LYS  22           HZ3      LYS  22 -15.579  -3.621 -22.045
  197   2HZ   LYS  22           HZ2      LYS  22 -14.943  -2.110 -22.502
  198   3HZ   LYS  22           HZ1      LYS  22 -16.179  -2.830 -23.423
  199    H    MET  23           HN       MET  23 -10.534  -3.963 -24.876
  200    HA   MET  23           HA       MET  23 -11.805  -1.758 -26.181
  201   1HB   MET  23           HB2      MET  23 -10.475  -1.787 -23.968
  202   2HB   MET  23           HB1      MET  23  -9.034  -1.650 -24.975
  203   1HG   MET  23           HG2      MET  23  -9.640   0.584 -24.389
  204   2HG   MET  23           HG1      MET  23 -10.152   0.372 -26.065
  205   1HE   MET  23           HE1      MET  23 -10.875   2.535 -24.259
  206   2HE   MET  23           HE3      MET  23 -12.109   2.656 -25.516
  207   3HE   MET  23           HE2      MET  23 -12.573   2.663 -23.821
  208    H    ALA  24           HN       ALA  24  -8.967  -3.671 -26.990
  209    HA   ALA  24           HA       ALA  24  -7.932  -1.816 -28.947
  210   1HB   ALA  24           HB1      ALA  24  -7.368  -4.607 -28.097
  211   2HB   ALA  24           HB3      ALA  24  -6.864  -4.192 -29.735
  212   3HB   ALA  24           HB2      ALA  24  -6.248  -3.274 -28.361
  213    H    LEU  25           HN       LEU  25 -10.337  -4.383 -29.078
  214    HA   LEU  25           HA       LEU  25 -10.358  -4.740 -31.925
  215   1HB   LEU  25           HB2      LEU  25 -12.559  -5.094 -29.877
  216   2HB   LEU  25           HB1      LEU  25 -12.676  -5.623 -31.554
  217    HG   LEU  25           HG       LEU  25 -10.519  -6.522 -29.637
  218   1HD1  LEU  25          HD11      LEU  25 -12.965  -7.243 -29.136
  219   2HD1  LEU  25          HD13      LEU  25 -12.810  -8.232 -30.589
  220   3HD1  LEU  25          HD12      LEU  25 -11.731  -8.497 -29.221
  221   1HD2  LEU  25          HD22      LEU  25 -11.178  -7.120 -32.507
  222   2HD2  LEU  25          HD21      LEU  25  -9.604  -6.918 -31.741
  223   3HD2  LEU  25          HD23      LEU  25 -10.506  -8.413 -31.518
  224    H    GLU  26           HN       GLU  26 -12.790  -3.026 -29.956
  225    HA   GLU  26           HA       GLU  26 -13.793  -1.641 -32.315
  226   1HB   GLU  26           HB2      GLU  26 -14.447  -1.487 -29.369
  227   2HB   GLU  26           HB1      GLU  26 -15.267  -0.509 -30.588
  228   1HG   GLU  26           HG2      GLU  26 -15.959  -2.552 -31.775
  229   2HG   GLU  26           HG1      GLU  26 -15.124  -3.538 -30.574
  230    H    ASN  27           HN       ASN  27 -11.430  -0.920 -29.861
  231    HA   ASN  27           HA       ASN  27 -11.205   1.853 -30.983
  232   1HB   ASN  27           HB2      ASN  27 -11.185   1.042 -28.070
  233   2HB   ASN  27           HB1      ASN  27 -10.734   2.621 -28.680
  234   1HD2  ASN  27          HD22      ASN  27 -14.044   3.735 -29.052
  235   2HD2  ASN  27          HD21      ASN  27 -12.390   4.112 -29.146
  236    HA   PRO  28           HA       PRO  28  -7.088  -0.444 -30.584
  237   1HB   PRO  28           HB2      PRO  28  -6.554  -0.232 -33.367
  238   2HB   PRO  28           HB1      PRO  28  -7.037  -1.698 -32.504
  239   1HG   PRO  28           HG2      PRO  28  -8.643  -0.019 -34.317
  240   2HG   PRO  28           HG1      PRO  28  -8.979  -1.655 -33.729
  241   1HD   PRO  28           HD2      PRO  28 -10.262   0.743 -32.866
  242   2HD   PRO  28           HD1      PRO  28 -10.394  -0.861 -32.121
  243    NH1  ARG  29           NH2      ARG  29  -5.113   4.068 -36.710
  244    NH2  ARG  29           NH1      ARG  29  -5.860   2.406 -38.049
  245    H    ARG  29           HN       ARG  29  -8.361   2.553 -31.493
  246    HA   ARG  29           HA       ARG  29  -5.607   3.766 -31.694
  247   1HB   ARG  29           HB2      ARG  29  -8.184   4.751 -32.934
  248   2HB   ARG  29           HB1      ARG  29  -6.613   5.541 -33.052
  249   1HG   ARG  29           HG2      ARG  29  -5.701   3.760 -34.352
  250   2HG   ARG  29           HG1      ARG  29  -7.066   2.701 -33.983
  251   1HD   ARG  29           HD2      ARG  29  -8.569   4.223 -35.199
  252   2HD   ARG  29           HD1      ARG  29  -7.218   5.292 -35.565
  253    HE   ARG  29           HE       ARG  29  -7.982   2.805 -36.909
  254   1HH1  ARG  29          HH21      ARG  29  -5.285   4.752 -36.001
  255   2HH1  ARG  29          HH22      ARG  29  -4.209   4.000 -37.132
  256   1HH2  ARG  29          HH11      ARG  29  -6.604   1.817 -38.364
  257   2HH2  ARG  29          HH12      ARG  29  -4.955   2.336 -38.467
  258    H    MET  30           HN       MET  30  -6.091   3.763 -29.154
  259    HA   MET  30           HA       MET  30  -7.922   5.939 -28.378
  260   1HB   MET  30           HB2      MET  30  -5.873   4.434 -26.707
  261   2HB   MET  30           HB1      MET  30  -7.084   5.553 -26.084
  262   1HG   MET  30           HG2      MET  30  -7.602   2.908 -27.471
  263   2HG   MET  30           HG1      MET  30  -7.898   3.288 -25.777
  264   1HE   MET  30           HE2      MET  30  -9.469   4.803 -24.876
  265   2HE   MET  30           HE1      MET  30  -9.310   6.258 -25.858
  266   3HE   MET  30           HE3      MET  30 -10.890   5.494 -25.646
  267    NH1  ARG  31           NH2      ARG  31  -9.073   9.486 -32.723
  268    NH2  ARG  31           NH1      ARG  31  -8.149  11.174 -33.910
  269    H    ARG  31           HN       ARG  31  -7.365   8.012 -28.359
  270    HA   ARG  31           HA       ARG  31  -4.770   8.953 -29.172
  271   1HB   ARG  31           HB2      ARG  31  -7.228  10.203 -27.969
  272   2HB   ARG  31           HB1      ARG  31  -5.751  11.148 -28.015
  273   1HG   ARG  31           HG2      ARG  31  -7.425  11.436 -29.934
  274   2HG   ARG  31           HG1      ARG  31  -5.733  11.248 -30.346
  275   1HD   ARG  31           HD2      ARG  31  -6.209   8.845 -30.891
  276   2HD   ARG  31           HD1      ARG  31  -7.908   9.130 -30.532
  277    HE   ARG  31           HE       ARG  31  -6.219  10.734 -32.519
  278   1HH1  ARG  31          HH21      ARG  31  -9.002   8.790 -32.011
  279   2HH1  ARG  31          HH22      ARG  31  -9.900   9.550 -33.279
  280   1HH2  ARG  31          HH11      ARG  31  -7.369  11.771 -34.098
  281   2HH2  ARG  31          HH12      ARG  31  -8.980  11.251 -34.458
  282    H    ASN  32           HN       ASN  32  -6.358   9.756 -26.147
  283    HA   ASN  32           HA       ASN  32  -3.776   9.986 -24.788
  284   1HB   ASN  32           HB2      ASN  32  -6.644  10.426 -23.947
  285   2HB   ASN  32           HB1      ASN  32  -5.264  10.699 -22.881
  286   1HD2  ASN  32          HD22      ASN  32  -5.846  13.986 -24.395
  287   2HD2  ASN  32          HD21      ASN  32  -6.536  12.981 -23.216
  288    H    SER  33           HN       SER  33  -4.295   9.282 -22.269
  289    HA   SER  33           HA       SER  33  -4.322   6.325 -22.371
  290   1HB   SER  33           HB2      SER  33  -3.352   8.429 -20.464
  291   2HB   SER  33           HB1      SER  33  -3.757   6.845 -19.803
  292    HG   SER  33           HG       SER  33  -1.894   7.502 -21.838
  293    H    GLU  34           HN       GLU  34  -6.793   6.919 -22.936
  294    HA   GLU  34           HA       GLU  34  -8.438   7.543 -20.599
  295   1HB   GLU  34           HB2      GLU  34  -9.227   6.513 -23.344
  296   2HB   GLU  34           HB1      GLU  34 -10.339   7.132 -22.123
  297   1HG   GLU  34           HG2      GLU  34  -8.829   9.271 -22.186
  298   2HG   GLU  34           HG1      GLU  34  -8.265   8.624 -23.729
  299    H    ILE  35           HN       ILE  35  -7.718   4.647 -22.542
  300    HA   ILE  35           HA       ILE  35  -9.406   2.801 -21.294
  301    HB   ILE  35           HB       ILE  35  -8.219   1.937 -23.087
  302   1HG1  ILE  35          HG12      ILE  35  -8.106   0.450 -20.967
  303   2HG1  ILE  35          HG11      ILE  35  -7.111   0.014 -22.347
  304   1HG2  ILE  35          HG23      ILE  35  -5.907   3.470 -21.962
  305   2HG2  ILE  35          HG22      ILE  35  -5.558   2.080 -22.990
  306   3HG2  ILE  35          HG21      ILE  35  -6.534   3.411 -23.604
  307   1HD1  ILE  35          HD13      ILE  35  -5.695   1.808 -20.463
  308   2HD1  ILE  35          HD12      ILE  35  -6.193   0.298 -19.728
  309   3HD1  ILE  35          HD11      ILE  35  -5.174   0.284 -21.163
  310    H    SER  36           HN       SER  36  -6.887   4.621 -19.911
  311    HA   SER  36           HA       SER  36  -6.295   2.778 -17.719
  312   1HB   SER  36           HB2      SER  36  -5.645   5.710 -18.123
  313   2HB   SER  36           HB1      SER  36  -5.013   4.713 -16.816
  314    HG   SER  36           HG       SER  36  -3.555   4.103 -18.189
  315    H    LYS  37           HN       LYS  37  -7.776   6.048 -17.780
  316    HA   LYS  37           HA       LYS  37  -8.848   5.835 -15.123
  317   1HB   LYS  37           HB2      LYS  37  -9.697   7.595 -17.449
  318   2HB   LYS  37           HB1      LYS  37 -10.308   7.760 -15.807
  319   1HG   LYS  37           HG2      LYS  37  -8.508   9.359 -16.145
  320   2HG   LYS  37           HG1      LYS  37  -7.975   8.124 -15.003
  321   1HD   LYS  37           HD2      LYS  37  -6.501   7.152 -16.524
  322   2HD   LYS  37           HD1      LYS  37  -7.414   7.704 -17.929
  323   1HE   LYS  37           HE2      LYS  37  -5.116   8.856 -17.291
  324   2HE   LYS  37           HE1      LYS  37  -6.460   9.822 -17.896
  325   1HZ   LYS  37           HZ3      LYS  37  -6.997   9.796 -15.290
  326   2HZ   LYS  37           HZ2      LYS  37  -5.302   9.704 -15.236
  327   3HZ   LYS  37           HZ1      LYS  37  -6.062  10.992 -16.041
  328    H    GLN  38           HN       GLN  38  -9.972   4.759 -18.250
  329    HA   GLN  38           HA       GLN  38 -12.742   4.485 -17.572
  330   1HB   GLN  38           HB2      GLN  38 -11.009   3.094 -19.622
  331   2HB   GLN  38           HB1      GLN  38 -12.737   2.781 -19.471
  332   1HG   GLN  38           HG2      GLN  38 -11.672   5.591 -19.782
  333   2HG   GLN  38           HG1      GLN  38 -12.001   4.571 -21.182
  334   1HE2  GLN  38          HE22      GLN  38 -15.244   6.075 -20.933
  335   2HE2  GLN  38          HE21      GLN  38 -13.751   6.169 -21.735
  336    H    LEU  39           HN       LEU  39 -10.035   2.149 -17.437
  337    HA   LEU  39           HA       LEU  39 -11.610  -0.016 -16.476
  338   1HB   LEU  39           HB2      LEU  39  -8.705   0.709 -16.046
  339   2HB   LEU  39           HB1      LEU  39  -9.405  -0.760 -15.387
  340    HG   LEU  39           HG       LEU  39  -9.695  -0.114 -18.315
  341   1HD1  LEU  39          HD11      LEU  39  -7.255  -0.064 -17.675
  342   2HD1  LEU  39          HD13      LEU  39  -7.436  -1.716 -17.084
  343   3HD1  LEU  39          HD12      LEU  39  -7.670  -1.360 -18.794
  344   1HD2  LEU  39          HD22      LEU  39  -9.710  -2.670 -16.689
  345   2HD2  LEU  39          HD21      LEU  39 -11.080  -1.946 -17.526
  346   3HD2  LEU  39          HD23      LEU  39  -9.743  -2.623 -18.447
  347    H    GLY  40           HN       GLY  40 -10.178   2.756 -14.835
  348   1HA   GLY  40           HA2      GLY  40 -10.526   1.942 -12.153
  349   2HA   GLY  40           HA1      GLY  40 -10.660   3.616 -12.697
  350    OH   TYR  41           OH       TYR  41 -20.926   2.160 -14.981
  351    H    TYR  41           HN       TYR  41 -12.856   3.311 -14.467
  352    HA   TYR  41           HA       TYR  41 -15.062   3.509 -12.658
  353   1HB   TYR  41           HB2      TYR  41 -15.295   4.630 -14.747
  354   2HB   TYR  41           HB1      TYR  41 -14.904   3.177 -15.659
  355    HD1  TYR  41           HD1      TYR  41 -17.509   4.920 -13.709
  356    HD2  TYR  41           HD2      TYR  41 -16.529   1.390 -15.980
  357    HE1  TYR  41           HE1      TYR  41 -19.919   4.307 -13.792
  358    HE2  TYR  41           HE2      TYR  41 -18.942   0.778 -16.067
  359    HH   TYR  41           HH       TYR  41 -21.355   2.725 -15.627
  360    H    GLN  42           HN       GLN  42 -13.886   0.834 -14.686
  361    HA   GLN  42           HA       GLN  42 -16.052  -0.967 -14.176
  362   1HB   GLN  42           HB2      GLN  42 -13.161  -1.328 -14.962
  363   2HB   GLN  42           HB1      GLN  42 -14.169  -2.733 -14.630
  364   1HG   GLN  42           HG2      GLN  42 -15.204  -0.614 -16.508
  365   2HG   GLN  42           HG1      GLN  42 -13.996  -1.759 -17.092
  366   1HE2  GLN  42          HE22      GLN  42 -16.201  -4.566 -17.000
  367   2HE2  GLN  42          HE21      GLN  42 -14.569  -4.085 -17.032
  368    CH2  TRP  43           CH2      TRP  43 -10.212  -3.770 -14.377
  369    H    TRP  43           HN       TRP  43 -13.113  -0.207 -12.397
  370    HA   TRP  43           HA       TRP  43 -13.215  -2.344 -10.493
  371   1HB   TRP  43           HB2      TRP  43 -12.142   0.455 -10.174
  372   2HB   TRP  43           HB1      TRP  43 -11.722  -0.940  -9.184
  373    HD1  TRP  43           HD1      TRP  43  -9.399   0.408 -10.555
  374    HE1  TRP  43           HE1      TRP  43  -8.046  -0.707 -12.427
  375    HE3  TRP  43           HE3      TRP  43 -12.810  -3.057 -12.338
  376    HZ2  TRP  43           HZ2      TRP  43  -8.306  -2.771 -14.359
  377    HZ3  TRP  43           HZ3      TRP  43 -12.201  -4.572 -14.149
  378    HH2  TRP  43           HH2      TRP  43  -9.949  -4.435 -15.186
  379    H    LYS  44           HN       LYS  44 -14.693   0.910 -10.390
  380    HA   LYS  44           HA       LYS  44 -15.800   0.459  -7.759
  381   1HB   LYS  44           HB2      LYS  44 -16.599   2.375  -9.970
  382   2HB   LYS  44           HB1      LYS  44 -17.322   2.381  -8.366
  383   1HG   LYS  44           HG2      LYS  44 -15.590   3.631  -7.563
  384   2HG   LYS  44           HG1      LYS  44 -14.455   2.367  -8.017
  385   1HD   LYS  44           HD2      LYS  44 -14.593   3.369 -10.406
  386   2HD   LYS  44           HD1      LYS  44 -15.345   4.765  -9.640
  387   1HE   LYS  44           HE2      LYS  44 -12.755   3.767  -8.474
  388   2HE   LYS  44           HE1      LYS  44 -12.695   4.625 -10.012
  389   1HZ   LYS  44           HZ2      LYS  44 -14.102   5.673  -7.625
  390   2HZ   LYS  44           HZ1      LYS  44 -12.499   6.051  -8.010
  391   3HZ   LYS  44           HZ3      LYS  44 -13.744   6.500  -9.060
  392    H    MET  45           HN       MET  45 -16.446  -0.881 -10.766
  393    HA   MET  45           HA       MET  45 -18.923  -2.162  -9.752
  394   1HB   MET  45           HB2      MET  45 -18.758  -0.823 -12.478
  395   2HB   MET  45           HB1      MET  45 -20.095  -1.820 -11.907
  396   1HG   MET  45           HG2      MET  45 -20.886   0.324 -11.436
  397   2HG   MET  45           HG1      MET  45 -20.128  -0.099  -9.900
  398   1HE   MET  45           HE1      MET  45 -20.863   2.395 -10.213
  399   2HE   MET  45           HE3      MET  45 -19.533   3.553 -10.107
  400   3HE   MET  45           HE2      MET  45 -20.344   3.278 -11.644
  401    H    LEU  46           HN       LEU  46 -17.014  -3.733  -9.614
  402    HA   LEU  46           HA       LEU  46 -15.713  -4.761 -11.921
  403   1HB   LEU  46           HB2      LEU  46 -16.404  -6.043  -9.268
  404   2HB   LEU  46           HB1      LEU  46 -15.386  -6.807 -10.483
  405    HG   LEU  46           HG       LEU  46 -14.703  -4.021  -9.565
  406   1HD1  LEU  46          HD12      LEU  46 -15.002  -5.363  -7.498
  407   2HD1  LEU  46          HD11      LEU  46 -13.910  -6.588  -8.150
  408   3HD1  LEU  46          HD13      LEU  46 -13.304  -4.972  -7.779
  409   1HD2  LEU  46          HD22      LEU  46 -13.102  -6.431 -10.485
  410   2HD2  LEU  46          HD21      LEU  46 -13.464  -5.011 -11.448
  411   3HD2  LEU  46          HD23      LEU  46 -12.406  -4.875 -10.048
  412    H    THR  47           HN       THR  47 -16.376  -6.139 -13.501
  413    HA   THR  47           HA       THR  47 -19.168  -7.049 -13.529
  414    HB   THR  47           HB       THR  47 -18.607  -7.862 -15.799
  415    HG1  THR  47           HG1      THR  47 -16.004  -6.945 -15.155
  416   1HG2  THR  47          HG23      THR  47 -19.150  -5.447 -15.366
  417   2HG2  THR  47          HG22      THR  47 -17.416  -5.124 -15.310
  418   3HG2  THR  47          HG21      THR  47 -18.156  -5.712 -16.799
  419    H    GLU  48           HN       GLU  48 -19.724  -8.946 -12.554
  420    HA   GLU  48           HA       GLU  48 -17.882 -10.846 -11.518
  421   1HB   GLU  48           HB2      GLU  48 -20.757 -11.362 -12.321
  422   2HB   GLU  48           HB1      GLU  48 -19.812 -12.272 -11.141
  423   1HG   GLU  48           HG2      GLU  48 -19.608 -10.248  -9.741
  424   2HG   GLU  48           HG1      GLU  48 -20.560  -9.341 -10.917
  425    H    ALA  49           HN       ALA  49 -19.286 -10.563 -14.707
  426    HA   ALA  49           HA       ALA  49 -18.900 -13.220 -15.637
  427   1HB   ALA  49           HB2      ALA  49 -18.800 -10.535 -17.023
  428   2HB   ALA  49           HB1      ALA  49 -18.626 -12.053 -17.906
  429   3HB   ALA  49           HB3      ALA  49 -20.119 -11.711 -17.029
  430    H    GLU  50           HN       GLU  50 -16.626 -10.663 -15.007
  431    HA   GLU  50           HA       GLU  50 -14.438 -12.128 -16.409
  432   1HB   GLU  50           HB2      GLU  50 -14.819  -9.321 -15.397
  433   2HB   GLU  50           HB1      GLU  50 -13.197  -9.927 -15.739
  434   1HG   GLU  50           HG2      GLU  50 -14.116  -8.785 -17.711
  435   2HG   GLU  50           HG1      GLU  50 -13.922 -10.508 -18.039
  436    H    LYS  51           HN       LYS  51 -15.573 -11.308 -13.193
  437    HA   LYS  51           HA       LYS  51 -13.075 -11.649 -11.815
  438   1HB   LYS  51           HB2      LYS  51 -15.897 -12.055 -10.806
  439   2HB   LYS  51           HB1      LYS  51 -14.465 -11.913  -9.791
  440   1HG   LYS  51           HG2      LYS  51 -14.076  -9.636 -10.615
  441   2HG   LYS  51           HG1      LYS  51 -15.456  -9.779 -11.698
  442   1HD   LYS  51           HD2      LYS  51 -16.423  -8.685  -9.861
  443   2HD   LYS  51           HD1      LYS  51 -16.807 -10.358  -9.524
  444   1HE   LYS  51           HE2      LYS  51 -14.246  -9.930  -8.357
  445   2HE   LYS  51           HE1      LYS  51 -15.227  -8.531  -7.923
  446   1HZ   LYS  51           HZ3      LYS  51 -16.269 -11.283  -7.695
  447   2HZ   LYS  51           HZ2      LYS  51 -15.370 -10.566  -6.446
  448   3HZ   LYS  51           HZ1      LYS  51 -16.839  -9.873  -6.946
  449    CH2  TRP  52           CH2      TRP  52 -17.550 -21.312 -13.149
  450    H    TRP  52           HN       TRP  52 -15.834 -13.788 -11.251
  451    HA   TRP  52           HA       TRP  52 -14.546 -15.909 -10.188
  452   1HB   TRP  52           HB2      TRP  52 -16.931 -15.925 -10.381
  453   2HB   TRP  52           HB1      TRP  52 -16.856 -16.102 -12.121
  454    HD1  TRP  52           HD1      TRP  52 -15.197 -17.965  -9.165
  455    HE1  TRP  52           HE1      TRP  52 -15.454 -20.501  -9.560
  456    HE3  TRP  52           HE3      TRP  52 -17.771 -17.924 -13.592
  457    HZ2  TRP  52           HZ2      TRP  52 -16.584 -22.273 -11.470
  458    HZ3  TRP  52           HZ3      TRP  52 -18.427 -20.063 -14.680
  459    HH2  TRP  52           HH2      TRP  52 -17.837 -22.238 -13.625
  460    HA   PRO  53           HA       PRO  53 -13.635 -18.082 -14.522
  461   1HB   PRO  53           HB2      PRO  53 -12.622 -15.823 -16.093
  462   2HB   PRO  53           HB1      PRO  53 -13.799 -17.063 -16.549
  463   1HG   PRO  53           HG2      PRO  53 -14.312 -14.323 -15.724
  464   2HG   PRO  53           HG1      PRO  53 -15.480 -15.526 -16.288
  465   1HD   PRO  53           HD2      PRO  53 -15.307 -14.549 -13.662
  466   2HD   PRO  53           HD1      PRO  53 -16.146 -16.023 -14.161
  467    H    PHE  54           HN       PHE  54 -11.514 -15.170 -14.619
  468    HA   PHE  54           HA       PHE  54  -9.233 -16.942 -14.304
  469   1HB   PHE  54           HB2      PHE  54  -7.849 -15.062 -14.747
  470   2HB   PHE  54           HB1      PHE  54  -9.251 -14.967 -15.808
  471    HD1  PHE  54           HD1      PHE  54  -7.791 -13.665 -12.633
  472    HD2  PHE  54           HD2      PHE  54 -10.729 -13.106 -15.737
  473    HE1  PHE  54           HE1      PHE  54  -8.267 -11.379 -11.774
  474    HE2  PHE  54           HE2      PHE  54 -11.207 -10.825 -14.875
  475    HZ   PHE  54           HZ       PHE  54  -9.964  -9.967 -12.905
  476    H    PHE  55           HN       PHE  55 -11.026 -15.247 -11.844
  477    HA   PHE  55           HA       PHE  55  -8.792 -14.772 -10.095
  478   1HB   PHE  55           HB2      PHE  55 -11.736 -15.014  -9.676
  479   2HB   PHE  55           HB1      PHE  55 -10.719 -15.213  -8.256
  480    HD1  PHE  55           HD1      PHE  55 -11.189 -12.857 -11.188
  481    HD2  PHE  55           HD2      PHE  55 -10.033 -13.337  -7.067
  482    HE1  PHE  55           HE1      PHE  55 -11.002 -10.393 -10.943
  483    HE2  PHE  55           HE2      PHE  55  -9.820 -10.876  -6.839
  484    HZ   PHE  55           HZ       PHE  55 -10.304  -9.402  -8.779
  485    H    GLN  56           HN       GLN  56 -10.786 -17.690 -10.570
  486    HA   GLN  56           HA       GLN  56  -9.817 -19.187  -8.391
  487   1HB   GLN  56           HB2      GLN  56 -10.695 -19.962 -11.167
  488   2HB   GLN  56           HB1      GLN  56 -10.112 -21.191 -10.045
  489   1HG   GLN  56           HG2      GLN  56 -11.989 -21.071  -8.720
  490   2HG   GLN  56           HG1      GLN  56 -12.118 -19.320  -8.878
  491   1HE2  GLN  56          HE22      GLN  56 -13.854 -19.685 -12.122
  492   2HE2  GLN  56          HE21      GLN  56 -12.482 -18.873 -11.543
  493    H    GLU  57           HN       GLU  57  -8.370 -18.865 -11.638
  494    HA   GLU  57           HA       GLU  57  -6.099 -20.524 -11.024
  495   1HB   GLU  57           HB2      GLU  57  -6.601 -20.175 -13.331
  496   2HB   GLU  57           HB1      GLU  57  -6.608 -18.422 -13.141
  497   1HG   GLU  57           HG2      GLU  57  -4.250 -18.327 -12.900
  498   2HG   GLU  57           HG1      GLU  57  -4.129 -20.059 -12.591
  499    H    ALA  58           HN       ALA  58  -6.411 -16.955 -11.198
  500    HA   ALA  58           HA       ALA  58  -3.832 -16.235 -10.431
  501   1HB   ALA  58           HB2      ALA  58  -6.504 -14.981  -9.831
  502   2HB   ALA  58           HB1      ALA  58  -5.006 -14.233  -9.282
  503   3HB   ALA  58           HB3      ALA  58  -5.294 -14.471 -11.006
  504    H    GLN  59           HN       GLN  59  -6.251 -17.762  -8.435
  505    HA   GLN  59           HA       GLN  59  -5.244 -16.931  -5.883
  506   1HB   GLN  59           HB2      GLN  59  -6.768 -19.385  -6.773
  507   2HB   GLN  59           HB1      GLN  59  -6.311 -19.133  -5.094
  508   1HG   GLN  59           HG2      GLN  59  -7.745 -16.931  -6.572
  509   2HG   GLN  59           HG1      GLN  59  -8.667 -18.301  -5.955
  510   1HE2  GLN  59          HE22      GLN  59  -6.999 -15.653  -3.307
  511   2HE2  GLN  59          HE21      GLN  59  -6.492 -15.650  -4.927
  512    H    LYS  60           HN       LYS  60  -4.691 -20.030  -7.625
  513    HA   LYS  60           HA       LYS  60  -2.650 -20.832  -5.790
  514   1HB   LYS  60           HB2      LYS  60  -2.103 -22.582  -7.461
  515   2HB   LYS  60           HB1      LYS  60  -3.811 -22.507  -7.048
  516   1HG   LYS  60           HG2      LYS  60  -4.372 -21.438  -9.099
  517   2HG   LYS  60           HG1      LYS  60  -2.681 -21.074  -9.456
  518   1HD   LYS  60           HD2      LYS  60  -2.164 -23.370  -9.858
  519   2HD   LYS  60           HD1      LYS  60  -3.686 -23.910  -9.154
  520   1HE   LYS  60           HE2      LYS  60  -4.896 -22.722 -11.004
  521   2HE   LYS  60           HE1      LYS  60  -3.330 -22.373 -11.740
  522   1HZ   LYS  60           HZ2      LYS  60  -2.957 -24.886 -11.521
  523   2HZ   LYS  60           HZ1      LYS  60  -4.640 -24.983 -11.345
  524   3HZ   LYS  60           HZ3      LYS  60  -3.976 -24.331 -12.758
  525    H    LEU  61           HN       LEU  61  -2.367 -19.090  -8.936
  526    HA   LEU  61           HA       LEU  61   0.407 -19.273  -9.335
  527   1HB   LEU  61           HB2      LEU  61  -1.497 -16.954  -9.691
  528   2HB   LEU  61           HB1      LEU  61   0.220 -16.689  -9.934
  529    HG   LEU  61           HG       LEU  61  -1.166 -17.199 -12.003
  530   1HD1  LEU  61          HD11      LEU  61   1.411 -18.489 -11.209
  531   2HD1  LEU  61          HD13      LEU  61   0.662 -19.072 -12.694
  532   3HD1  LEU  61          HD12      LEU  61   1.066 -17.368 -12.518
  533   1HD2  LEU  61          HD23      LEU  61  -1.136 -20.008 -10.845
  534   2HD2  LEU  61          HD22      LEU  61  -2.552 -18.999 -11.113
  535   3HD2  LEU  61          HD21      LEU  61  -1.616 -19.579 -12.482
  536    H    GLN  62           HN       GLN  62  -1.242 -16.890  -7.304
  537    HA   GLN  62           HA       GLN  62   1.097 -15.785  -6.124
  538   1HB   GLN  62           HB2      GLN  62  -1.799 -15.625  -5.791
  539   2HB   GLN  62           HB1      GLN  62  -1.015 -15.609  -4.214
  540   1HG   GLN  62           HG2      GLN  62   0.492 -13.773  -5.082
  541   2HG   GLN  62           HG1      GLN  62  -0.516 -13.718  -6.535
  542   1HE2  GLN  62          HE22      GLN  62  -1.866 -12.043  -3.092
  543   2HE2  GLN  62          HE21      GLN  62  -0.354 -12.813  -3.157
  544    H    ALA  63           HN       ALA  63  -1.117 -18.287  -4.882
  545    HA   ALA  63           HA       ALA  63   0.055 -18.813  -2.421
  546   1HB   ALA  63           HB3      ALA  63  -2.020 -19.869  -3.482
  547   2HB   ALA  63           HB2      ALA  63  -0.916 -21.031  -4.221
  548   3HB   ALA  63           HB1      ALA  63  -1.031 -20.918  -2.464
  549    H    MET  64           HN       MET  64   1.056 -20.341  -5.517
  550    HA   MET  64           HA       MET  64   3.035 -22.016  -4.320
  551   1HB   MET  64           HB2      MET  64   2.981 -20.863  -7.118
  552   2HB   MET  64           HB1      MET  64   3.949 -22.241  -6.590
  553   1HG   MET  64           HG2      MET  64   1.750 -23.314  -5.847
  554   2HG   MET  64           HG1      MET  64   0.940 -22.041  -6.763
  555   1HE   MET  64           HE3      MET  64   0.484 -22.051  -9.103
  556   2HE   MET  64           HE2      MET  64   0.579 -23.530 -10.048
  557   3HE   MET  64           HE1      MET  64  -0.261 -23.536  -8.504
  558    H    HIS  65           HN       HIS  65   3.741 -19.161  -6.350
  559    HA   HIS  65           HA       HIS  65   6.443 -18.941  -5.600
  560   1HB   HIS  65           HB2      HIS  65   4.631 -16.608  -6.239
  561   2HB   HIS  65           HB1      HIS  65   6.365 -16.745  -6.554
  562    HD1  HIS  65           HD1      HIS  65   4.003 -16.426  -8.738
  563    HD2  HIS  65           HD2      HIS  65   6.080 -19.909  -7.810
  564    HE1  HIS  65           HE1      HIS  65   3.767 -17.956 -10.747
  565    NH1  ARG  66           NH2      ARG  66   3.312 -11.897  -0.185
  566    NH2  ARG  66           NH1      ARG  66   3.140 -10.740  -2.116
  567    H    ARG  66           HN       ARG  66   3.571 -17.689  -3.966
  568    HA   ARG  66           HA       ARG  66   4.902 -15.978  -2.121
  569   1HB   ARG  66           HB2      ARG  66   2.313 -17.519  -2.070
  570   2HB   ARG  66           HB1      ARG  66   2.844 -16.692  -0.614
  571   1HG   ARG  66           HG2      ARG  66   2.799 -15.208  -3.242
  572   2HG   ARG  66           HG1      ARG  66   1.310 -15.414  -2.312
  573   1HD   ARG  66           HD2      ARG  66   2.087 -14.115  -0.543
  574   2HD   ARG  66           HD1      ARG  66   3.772 -14.466  -0.863
  575    HE   ARG  66           HE       ARG  66   2.777 -12.988  -3.071
  576   1HH1  ARG  66          HH21      ARG  66   3.293 -12.768   0.308
  577   2HH1  ARG  66          HH22      ARG  66   3.484 -11.051   0.302
  578   1HH2  ARG  66          HH11      ARG  66   2.992 -10.722  -3.104
  579   2HH2  ARG  66          HH12      ARG  66   3.301  -9.889  -1.619
  580    H    GLU  67           HN       GLU  67   4.016 -19.389  -1.875
  581    HA   GLU  67           HA       GLU  67   5.016 -19.755   0.769
  582   1HB   GLU  67           HB2      GLU  67   4.568 -21.720  -1.491
  583   2HB   GLU  67           HB1      GLU  67   4.839 -22.177   0.192
  584   1HG   GLU  67           HG2      GLU  67   2.664 -20.172  -0.387
  585   2HG   GLU  67           HG1      GLU  67   2.354 -21.862  -0.785
  586    H    LYS  68           HN       LYS  68   6.690 -19.366  -2.198
  587    HA   LYS  68           HA       LYS  68   9.069 -20.900  -1.326
  588   1HB   LYS  68           HB2      LYS  68   8.456 -19.157  -3.723
  589   2HB   LYS  68           HB1      LYS  68  10.082 -19.754  -3.406
  590   1HG   LYS  68           HG2      LYS  68   9.320 -22.055  -3.534
  591   2HG   LYS  68           HG1      LYS  68   7.642 -21.529  -3.695
  592   1HD   LYS  68           HD2      LYS  68   7.984 -20.662  -5.856
  593   2HD   LYS  68           HD1      LYS  68   9.731 -20.555  -5.647
  594   1HE   LYS  68           HE2      LYS  68   8.572 -22.534  -7.068
  595   2HE   LYS  68           HE1      LYS  68  10.065 -22.779  -6.164
  596   1HZ   LYS  68           HZ1      LYS  68   8.749 -23.571  -4.292
  597   2HZ   LYS  68           HZ3      LYS  68   7.322 -23.356  -5.184
  598   3HZ   LYS  68           HZ2      LYS  68   8.469 -24.506  -5.681
  599    OH   TYR  69           OH       TYR  69  12.589 -17.539  -5.735
  600    H    TYR  69           HN       TYR  69   7.819 -17.665  -1.102
  601    HA   TYR  69           HA       TYR  69  10.448 -16.705   0.005
  602   1HB   TYR  69           HB2      TYR  69   8.468 -15.266  -1.780
  603   2HB   TYR  69           HB1      TYR  69   9.893 -14.536  -1.081
  604    HD1  TYR  69           HD2      TYR  69  12.206 -15.505  -1.654
  605    HD2  TYR  69           HD1      TYR  69   8.604 -16.582  -3.740
  606    HE1  TYR  69           HE2      TYR  69  13.561 -16.422  -3.532
  607    HE2  TYR  69           HE1      TYR  69   9.945 -17.506  -5.609
  608    HH   TYR  69           HH       TYR  69  13.302 -16.924  -5.921
  609    HA   PRO  70           HA       PRO  70   6.589 -16.149   2.811
  610   1HB   PRO  70           HB2      PRO  70   8.274 -17.145   4.973
  611   2HB   PRO  70           HB1      PRO  70   6.763 -17.823   4.350
  612   1HG   PRO  70           HG2      PRO  70   9.468 -18.788   3.900
  613   2HG   PRO  70           HG1      PRO  70   7.950 -19.505   3.340
  614   1HD   PRO  70           HD2      PRO  70   9.905 -18.188   1.723
  615   2HD   PRO  70           HD1      PRO  70   8.288 -18.714   1.216
  616    H    ASN  71           HN       ASN  71   9.826 -15.871   4.339
  617    HA   ASN  71           HA       ASN  71   9.068 -13.247   5.391
  618   1HB   ASN  71           HB2      ASN  71  11.752 -14.609   5.627
  619   2HB   ASN  71           HB1      ASN  71  11.068 -13.377   6.690
  620   1HD2  ASN  71          HD22      ASN  71   9.061 -15.673   8.510
  621   2HD2  ASN  71          HD21      ASN  71   9.390 -14.035   8.205
  622    OH   TYR  72           OH       TYR  72  16.100 -10.160  -2.098
  623    H    TYR  72           HN       TYR  72  10.599 -14.204   2.477
  624    HA   TYR  72           HA       TYR  72  12.455 -11.965   2.348
  625   1HB   TYR  72           HB2      TYR  72  12.449 -14.112   0.891
  626   2HB   TYR  72           HB1      TYR  72  11.232 -13.278  -0.056
  627    HD1  TYR  72           HD2      TYR  72  11.727 -11.123  -1.189
  628    HD2  TYR  72           HD1      TYR  72  14.770 -13.427   0.812
  629    HE1  TYR  72           HE2      TYR  72  13.487  -9.818  -2.367
  630    HE2  TYR  72           HE1      TYR  72  16.531 -12.123  -0.366
  631    HH   TYR  72           HH       TYR  72  16.937 -10.617  -1.978
  632    H    LYS  73           HN       LYS  73  11.857  -9.854   2.146
  633    HA   LYS  73           HA       LYS  73   9.191  -9.252   0.880
  634   1HB   LYS  73           HB2      LYS  73  10.579  -7.703   3.075
  635   2HB   LYS  73           HB1      LYS  73   8.968  -7.408   2.416
  636   1HG   LYS  73           HG2      LYS  73   8.621  -9.986   3.112
  637   2HG   LYS  73           HG1      LYS  73   9.910  -9.586   4.248
  638   1HD   LYS  73           HD2      LYS  73   8.258  -7.424   4.609
  639   2HD   LYS  73           HD1      LYS  73   7.076  -8.661   4.176
  640   1HE   LYS  73           HE2      LYS  73   7.276  -8.824   6.532
  641   2HE   LYS  73           HE1      LYS  73   8.283 -10.129   5.929
  642   1HZ   LYS  73           HZ2      LYS  73   9.933  -7.965   5.954
  643   2HZ   LYS  73           HZ1      LYS  73   9.040  -7.798   7.383
  644   3HZ   LYS  73           HZ3      LYS  73   9.917  -9.216   7.097
  645    OH   TYR  74           OH       TYR  74   6.818  -7.746  -5.732
  646    H    TYR  74           HN       TYR  74   9.056  -6.952   0.111
  647    HA   TYR  74           HA       TYR  74  11.093  -6.447  -1.815
  648   1HB   TYR  74           HB2      TYR  74   8.821  -4.786  -0.702
  649   2HB   TYR  74           HB1      TYR  74   9.954  -4.106  -1.874
  650    HD1  TYR  74           HD2      TYR  74  10.129  -5.036  -4.162
  651    HD2  TYR  74           HD1      TYR  74   7.256  -6.560  -1.336
  652    HE1  TYR  74           HE2      TYR  74   8.973  -6.232  -5.998
  653    HE2  TYR  74           HE1      TYR  74   6.094  -7.763  -3.179
  654    HH   TYR  74           HH       TYR  74   7.483  -8.007  -6.375
  655    NH1  ARG  75           NH2      ARG  75  18.906  -4.104   1.217
  656    NH2  ARG  75           NH1      ARG  75  19.027  -4.219   3.471
  657    H    ARG  75           HN       ARG  75  12.431  -4.393  -1.830
  658    HA   ARG  75           HA       ARG  75  13.341  -3.613   0.908
  659   1HB   ARG  75           HB2      ARG  75  14.577  -5.607  -0.307
  660   2HB   ARG  75           HB1      ARG  75  15.322  -4.332  -1.260
  661   1HG   ARG  75           HG2      ARG  75  16.601  -3.563   0.507
  662   2HG   ARG  75           HG1      ARG  75  15.383  -3.963   1.715
  663   1HD   ARG  75           HD2      ARG  75  15.921  -6.386   1.385
  664   2HD   ARG  75           HD1      ARG  75  17.212  -5.921   0.280
  665    HE   ARG  75           HE       ARG  75  17.203  -5.823   3.206
  666   1HH1  ARG  75          HH21      ARG  75  18.490  -4.402   0.358
  667   2HH1  ARG  75          HH22      ARG  75  19.675  -3.466   1.203
  668   1HH2  ARG  75          HH11      ARG  75  18.702  -4.603   4.336
  669   2HH2  ARG  75          HH12      ARG  75  19.790  -3.576   3.464
  670   1H5*    G   1           H5'      GUA 201   3.425   8.492   1.402
  671   2H5*    G   1          H5''      GUA 201   4.265   9.352   0.100
  672    H4*    G   1           H4'      GUA 201   5.936   8.067   1.126
  673    H3*    G   1           H3'      GUA 201   4.945   7.032  -1.454
  674   1H2*    G   1           H2'      GUA 201   5.356   4.826  -1.146
  675   2H2*    G   1          H2''      GUA 201   6.915   5.187  -0.374
  676    H1*    G   1           H1'      GUA 201   6.004   4.692   1.641
  677    H8     G   1           H8       GUA 201   2.806   5.187  -0.459
  678    H1     G   1           H1       GUA 201   3.108  -0.363   2.623
  679   1H2     G   1           HN'      GUA 201   6.178   0.808   3.829
  680   2H2     G   1          HN''      GUA 201   5.005  -0.491   3.814
  681    H5T    G   1           H5T      GUA 201   2.157   7.778  -0.076
  682   1H5*    C   2           H5'      CYT 202   9.660   6.100  -1.076
  683   2H5*    C   2          H5''      CYT 202  10.129   5.983  -2.783
  684    H4*    C   2           H4'      CYT 202  10.767   4.014  -1.297
  685    H3*    C   2           H3'      CYT 202   9.454   3.913  -3.954
  686   1H2*    C   2           H2'      CYT 202   8.358   1.948  -3.666
  687   2H2*    C   2          H2''      CYT 202   9.849   1.194  -3.035
  688    H1*    C   2           H1'      CYT 202   9.122   1.398  -0.887
  689   1H4     C   2           HN'      CYT 202   2.519   1.378  -2.067
  690   2H4     C   2          HN''      CYT 202   2.879  -0.071  -1.153
  691    H5     C   2           H5       CYT 202   4.213   2.986  -2.735
  692    H6     C   2           H6       CYT 202   6.614   3.513  -2.670
  693   1H5*    A   3           H5'      ADE 203  12.444   0.033  -3.818
  694   2H5*    A   3          H5''      ADE 203  13.198   0.422  -5.375
  695    H4*    A   3           H4'      ADE 203  12.631  -1.930  -5.342
  696    H3*    A   3           H3'      ADE 203  11.313  -0.088  -7.229
  697   1H2*    A   3           H2'      ADE 203   9.338  -1.157  -7.480
  698   2H2*    A   3          H2''      ADE 203  10.174  -2.729  -7.613
  699    H1*    A   3           H1'      ADE 203   9.531  -3.246  -5.510
  700    H8     A   3           H8       ADE 203   8.729   0.526  -5.628
  701   1H6     A   3           HN'      ADE 203   4.074   0.264  -4.256
  702   2H6     A   3          HN''      ADE 203   3.055  -1.090  -3.812
  703    H2     A   3           H2       ADE 203   5.542  -4.821  -4.122
  704   1H5*    C   4           H5'      CYT 204  11.784  -4.345  -8.514
  705   2H5*    C   4          H5''      CYT 204  12.385  -4.440 -10.181
  706    H4*    C   4           H4'      CYT 204  10.673  -6.113  -9.909
  707    H3*    C   4           H3'      CYT 204  10.179  -3.798 -11.687
  708   1H2*    C   4           H2'      CYT 204   7.922  -3.738 -11.528
  709   2H2*    C   4          H2''      CYT 204   7.835  -5.505 -11.755
  710    H1*    C   4           H1'      CYT 204   7.483  -5.818  -9.531
  711   1H4     C   4           HN'      CYT 204   5.188   0.268  -7.869
  712   2H4     C   4          HN''      CYT 204   3.848  -0.851  -7.710
  713    H5     C   4           H5       CYT 204   7.421  -0.417  -8.612
  714    H6     C   4           H6       CYT 204   8.763  -2.327  -9.402
  715   1H5*    A   5           H5'      ADE 205   8.774  -7.908 -13.430
  716   2H5*    A   5          H5''      ADE 205   8.802  -7.850 -15.199
  717    H4*    A   5           H4'      ADE 205   6.672  -8.764 -14.053
  718    H3*    A   5           H3'      ADE 205   5.490  -8.237 -15.929
  719   1H2*    A   5           H2'      ADE 205   6.030  -5.304 -15.826
  720   2H2*    A   5          H2''      ADE 205   4.489  -6.174 -16.060
  721    H1*    A   5           H1'      ADE 205   4.180  -6.477 -13.806
  722    H8     A   5           H8       ADE 205   7.194  -4.050 -13.894
  723   1H6     A   5           HN'      ADE 205   4.943  -0.155 -12.010
  724   2H6     A   5          HN''      ADE 205   3.290   0.105 -11.488
  725    H2     A   5           H2       ADE 205   1.041  -3.736 -12.155
  726   1H5*    A   6           H5'      ADE 206   4.408  -8.476 -18.028
  727   2H5*    A   6          H5''      ADE 206   5.348  -8.243 -19.515
  728    H4*    A   6           H4'      ADE 206   2.840  -8.307 -19.848
  729    H3*    A   6           H3'      ADE 206   4.731  -6.363 -20.922
  730   1H2*    A   6           H2'      ADE 206   3.536  -4.439 -20.795
  731   2H2*    A   6          H2''      ADE 206   2.116  -5.257 -21.502
  732    H1*    A   6           H1'      ADE 206   1.131  -5.232 -19.454
  733    H8     A   6           H8       ADE 206   4.812  -4.341 -18.706
  734   1H6     A   6           HN'      ADE 206   2.589   0.092 -15.059
  735   2H6     A   6          HN''      ADE 206   4.052  -0.633 -15.691
  736    H2     A   6           H2       ADE 206  -0.896  -2.181 -16.743
  737   1H5*    A   7           H5'      ADE 207   0.953  -6.736 -22.897
  738   2H5*    A   7          H5''      ADE 207   0.963  -6.830 -24.669
  739    H4*    A   7           H4'      ADE 207  -0.814  -5.356 -24.050
  740    H3*    A   7           H3'      ADE 207   1.569  -4.214 -25.395
  741   1H2*    A   7           H2'      ADE 207   1.483  -2.148 -24.497
  742   2H2*    A   7          H2''      ADE 207  -0.242  -2.058 -24.869
  743    H1*    A   7           H1'      ADE 207  -0.830  -2.453 -22.722
  744    H8     A   7           H8       ADE 207   2.976  -2.990 -22.575
  745   1H6     A   7           HN'      ADE 207   3.116   1.795 -18.711
  746   2H6     A   7          HN''      ADE 207   4.090   0.586 -19.518
  747    H2     A   7           H2       ADE 207  -1.159   1.129 -19.932
  748   1H5*    C   8           H5'      CYT 208  -2.725  -2.494 -27.934
  749   2H5*    C   8          H5''      CYT 208  -1.906  -1.349 -29.004
  750    H4*    C   8           H4'      CYT 208  -3.840  -0.625 -27.214
  751    H3*    C   8           H3'      CYT 208  -1.544   0.873 -28.408
  752   1H2*    C   8           H2'      CYT 208  -1.577   2.574 -26.884
  753   2H2*    C   8          H2''      CYT 208  -3.341   2.428 -26.639
  754    H1*    C   8           H1'      CYT 208  -2.904   1.297 -24.711
  755   1H4     C   8           HN'      CYT 208   3.008   2.752 -22.697
  756   2H4     C   8          HN''      CYT 208   3.655   1.394 -23.596
  757    H5     C   8           H5       CYT 208   2.307   0.003 -25.094
  758    H6     C   8           H6       CYT 208   0.080  -0.291 -26.041
  759    H3T    C   8           H3T      CYT 208  -3.465   2.184 -28.970
  760   1H5*    G   9           H5'      GUA 209   4.320  12.596 -20.278
  761   2H5*    G   9          H5''      GUA 209   3.821  13.305 -18.728
  762    H4*    G   9           H4'      GUA 209   1.817  12.947 -19.965
  763    H3*    G   9           H3'      GUA 209   0.642  11.859 -18.344
  764   1H2*    G   9           H2'      GUA 209   2.379   9.428 -18.218
  765   2H2*    G   9          H2''      GUA 209   0.607   9.566 -18.378
  766    H1*    G   9           H1'      GUA 209   0.740   9.666 -20.663
  767    H8     G   9           H8       GUA 209   4.513   9.301 -19.895
  768    H1     G   9           H1       GUA 209   1.847   4.193 -22.581
  769   1H2     G   9           HN'      GUA 209  -1.132   5.995 -22.389
  770   2H2     G   9          HN''      GUA 209  -0.341   4.507 -22.854
  771    H5T    G   9           H5T      GUA 209   5.320  11.683 -18.368
  772   1H5*    T  10           H5'      THY 210  -0.184  10.918 -16.384
  773   2H5*    T  10          H5''      THY 210   0.151  10.532 -14.686
  774    H4*    T  10           H4'      THY 210  -1.885   9.401 -15.792
  775    H3*    T  10           H3'      THY 210   0.214   8.151 -14.089
  776   1H2*    T  10           H2'      THY 210  -0.128   6.004 -14.757
  777   2H2*    T  10          H2''      THY 210  -1.895   6.242 -14.813
  778    H1*    T  10           H1'      THY 210  -1.803   6.436 -17.077
  779    H3     T  10           H3       THY 210   0.906   3.132 -18.666
  780   1H5M    T  10           H51      THY 210   4.593   5.580 -16.585
  781   2H5M    T  10           H52      THY 210   4.035   7.240 -16.902
  782   3H5M    T  10           H53      THY 210   4.567   6.207 -18.249
  783    H6     T  10           H6       THY 210   1.745   7.374 -16.535
  784   1H5*    T  11           H5'      THY 211  -3.824   7.027 -13.775
  785   2H5*    T  11          H5''      THY 211  -4.555   6.860 -12.168
  786    H4*    T  11           H4'      THY 211  -5.409   5.103 -13.567
  787    H3*    T  11           H3'      THY 211  -3.552   4.381 -11.356
  788   1H2*    T  11           H2'      THY 211  -3.063   2.285 -12.097
  789   2H2*    T  11          H2''      THY 211  -4.721   2.042 -12.716
  790    H1*    T  11           H1'      THY 211  -3.960   2.459 -14.824
  791    H3     T  11           H3       THY 211   0.112   0.519 -15.483
  792   1H5M    T  11           H51      THY 211   1.986   3.700 -12.408
  793   2H5M    T  11           H52      THY 211   0.810   5.035 -12.496
  794   3H5M    T  11           H53      THY 211   1.936   4.747 -13.846
  795    H6     T  11           H6       THY 211  -1.357   4.455 -13.117
  796   1H5*    T  12           H5'      THY 212  -6.788   1.793 -10.955
  797   2H5*    T  12          H5''      THY 212  -7.374   1.444  -9.317
  798    H4*    T  12           H4'      THY 212  -6.599  -0.591 -10.473
  799    H3*    T  12           H3'      THY 212  -5.461   0.358  -7.914
  800   1H2*    T  12           H2'      THY 212  -3.377  -0.511  -8.174
  801   2H2*    T  12          H2''      THY 212  -4.097  -2.094  -8.584
  802    H1*    T  12           H1'      THY 212  -3.775  -1.763 -10.814
  803    H3     T  12           H3       THY 212   0.620  -0.979 -11.581
  804   1H5M    T  12           H51      THY 212   0.242   2.840  -8.621
  805   2H5M    T  12           H52      THY 212  -1.410   3.372  -9.016
  806   3H5M    T  12           H53      THY 212  -0.102   3.572 -10.206
  807    H6     T  12           H6       THY 212  -2.826   1.568  -9.400
  808   1H5*    G  13           H5'      GUA 213  -6.055  -4.002  -8.342
  809   2H5*    G  13          H5''      GUA 213  -7.067  -4.668  -7.045
  810    H4*    G  13           H4'      GUA 213  -5.442  -6.339  -7.483
  811    H3*    G  13           H3'      GUA 213  -5.339  -4.933  -4.960
  812   1H2*    G  13           H2'      GUA 213  -2.795  -6.171  -4.902
  813   2H2*    G  13          H2''      GUA 213  -3.141  -4.428  -4.830
  814    H1*    G  13           H1'      GUA 213  -2.072  -6.002  -7.042
  815    H8     G  13           H8       GUA 213  -3.237  -2.391  -6.305
  816    H1     G  13           H1       GUA 213   2.902  -2.947  -7.879
  817   1H2     G  13           HN'      GUA 213   3.398  -5.083  -8.302
  818   2H2     G  13          HN''      GUA 213   2.203  -6.356  -8.192
  819   1H5*    T  14           H5'      THY 214  -3.117  -8.871  -4.864
  820   2H5*    T  14          H5''      THY 214  -3.448  -9.743  -3.355
  821    H4*    T  14           H4'      THY 214  -1.079  -9.858  -3.796
  822    H3*    T  14           H3'      THY 214  -2.031  -8.242  -1.481
  823   1H2*    T  14           H2'      THY 214  -0.218  -6.893  -1.343
  824   2H2*    T  14          H2''      THY 214   0.873  -8.294  -1.506
  825    H1*    T  14           H1'      THY 214   1.225  -7.862  -3.712
  826    H3     T  14           H3       THY 214   2.697  -3.602  -4.075
  827   1H5M    T  14           H51      THY 214  -2.575  -3.285  -2.989
  828   2H5M    T  14           H52      THY 214  -1.581  -1.854  -3.329
  829   3H5M    T  14           H53      THY 214  -1.575  -2.581  -1.708
  830    H6     T  14           H6       THY 214  -1.571  -5.479  -2.919
  831   1H5*    G  15           H5'      GUA 215   1.669 -10.163  -0.299
  832   2H5*    G  15          H5''      GUA 215   1.384 -11.165   1.131
  833    H4*    G  15           H4'      GUA 215   3.419 -10.158   1.644
  834    H3*    G  15           H3'      GUA 215   1.171  -8.750   2.927
  835   1H2*    G  15           H2'      GUA 215   2.134  -6.701   3.091
  836   2H2*    G  15          H2''      GUA 215   3.703  -7.424   3.529
  837    H1*    G  15           H1'      GUA 215   4.458  -6.986   1.430
  838    H8     G  15           H8       GUA 215   0.673  -6.672   0.767
  839    H1     G  15           H1       GUA 215   4.058  -1.537  -0.839
  840   1H2     G  15           HN'      GUA 215   6.227  -1.853  -0.364
  841   2H2     G  15          HN''      GUA 215   6.813  -3.341   0.346
  842   1H5*    C  16           H5'      CYT 216   5.036  -8.797   5.783
  843   2H5*    C  16          H5''      CYT 216   4.288  -8.917   7.384
  844    H4*    C  16           H4'      CYT 216   5.988  -7.140   7.327
  845    H3*    C  16           H3'      CYT 216   3.128  -6.524   7.865
  846   1H2*    C  16           H2'      CYT 216   3.282  -4.285   7.477
  847   2H2*    C  16          H2''      CYT 216   4.911  -4.208   8.206
  848    H1*    C  16           H1'      CYT 216   5.832  -4.170   6.125
  849   1H4     C  16           HN'      CYT 216   1.556  -1.440   2.184
  850   2H4     C  16          HN''      CYT 216   0.484  -2.819   2.306
  851    H5     C  16           H5       CYT 216   0.961  -4.756   3.686
  852    H6     C  16           H6       CYT 216   2.582  -5.766   5.234
  853    H3T    C  16           H3T      CYT 216   4.884  -7.328   9.324
   
  No H/Q in entry =         853



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