NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type subtype
380062 1i8x 4971 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   VAL A   1      -8.180   4.315   0.208  1.00  0.00      A       
ATOM      2  CA  VAL A   1      -9.166   4.471  -0.945  1.00  0.00      A       
ATOM      3  CB  VAL A   1      -8.491   5.275  -2.074  1.00  0.00      A       
ATOM      4  CG1 VAL A   1      -9.290   5.162  -3.363  1.00  0.00      A       
ATOM      5  CG2 VAL A   1      -8.326   6.731  -1.665  1.00  0.00      A       
ATOM      6  HT1 VAL A   1     -11.147   4.408  -0.296  1.00  0.00      A       
ATOM      7  HT2 VAL A   1     -10.774   5.768  -1.230  1.00  0.00      A       
ATOM      8  HT3 VAL A   1     -10.245   5.673   0.374  1.00  0.00      A       
ATOM      9  HA  VAL A   1      -9.413   3.490  -1.327  1.00  0.00      A       
ATOM     10  HB  VAL A   1      -7.510   4.859  -2.248  1.00  0.00      A       
ATOM     11 HG11 VAL A   1     -10.018   4.369  -3.267  1.00  0.00      A       
ATOM     12 HG12 VAL A   1      -8.622   4.940  -4.182  1.00  0.00      A       
ATOM     13 HG13 VAL A   1      -9.798   6.095  -3.555  1.00  0.00      A       
ATOM     14 HG21 VAL A   1      -7.645   6.796  -0.829  1.00  0.00      A       
ATOM     15 HG22 VAL A   1      -9.286   7.136  -1.380  1.00  0.00      A       
ATOM     16 HG23 VAL A   1      -7.930   7.296  -2.497  1.00  0.00      A       
ATOM     17  N   VAL A   1     -10.420   5.126  -0.493  1.00  0.00      A       
ATOM     18  O   VAL A   1      -8.525   4.545   1.367  1.00  0.00      A       
ATOM     19  C   ILE A   2      -4.753   4.705   0.662  1.00  0.00      A       
ATOM     20  CA  ILE A   2      -5.913   3.739   0.889  1.00  0.00      A       
ATOM     21  CB  ILE A   2      -5.380   2.288   0.889  1.00  0.00      A       
ATOM     22  CD1 ILE A   2      -7.469   0.944   0.327  1.00  0.00      A       
ATOM     23  CG1 ILE A   2      -6.459   1.325   1.386  1.00  0.00      A       
ATOM     24  CG2 ILE A   2      -4.130   2.171   1.751  1.00  0.00      A       
ATOM     25  HN  ILE A   2      -6.737   3.757  -1.060  1.00  0.00      A       
ATOM     26  HA  ILE A   2      -6.350   3.939   1.857  1.00  0.00      A       
ATOM     27  HB  ILE A   2      -5.113   2.027  -0.124  1.00  0.00      A       
ATOM     28 HD11 ILE A   2      -8.106   0.157   0.703  1.00  0.00      A       
ATOM     29 HD12 ILE A   2      -6.953   0.598  -0.556  1.00  0.00      A       
ATOM     30 HD13 ILE A   2      -8.071   1.805   0.077  1.00  0.00      A       
ATOM     31 HG12 ILE A   2      -5.988   0.418   1.734  1.00  0.00      A       
ATOM     32 HG11 ILE A   2      -6.993   1.785   2.205  1.00  0.00      A       
ATOM     33 HG21 ILE A   2      -4.019   3.064   2.347  1.00  0.00      A       
ATOM     34 HG22 ILE A   2      -3.264   2.050   1.117  1.00  0.00      A       
ATOM     35 HG23 ILE A   2      -4.222   1.313   2.402  1.00  0.00      A       
ATOM     36  N   ILE A   2      -6.951   3.924  -0.118  1.00  0.00      A       
ATOM     37  O   ILE A   2      -4.038   4.608  -0.336  1.00  0.00      A       
ATOM     38  C   HIS A   3      -2.347   6.254   2.428  1.00  0.00      A       
ATOM     39  CA  HIS A   3      -3.502   6.620   1.501  1.00  0.00      A       
ATOM     40  CB  HIS A   3      -4.028   8.014   1.848  1.00  0.00      A       
ATOM     41  CD2 HIS A   3      -5.862   8.909   0.243  1.00  0.00      A       
ATOM     42  CE1 HIS A   3      -4.564   9.992  -1.153  1.00  0.00      A       
ATOM     43  CG  HIS A   3      -4.586   8.754   0.671  1.00  0.00      A       
ATOM     44  HN  HIS A   3      -5.178   5.658   2.366  1.00  0.00      A       
ATOM     45  HA  HIS A   3      -3.143   6.623   0.482  1.00  0.00      A       
ATOM     46  HB2 HIS A   3      -4.813   7.922   2.583  1.00  0.00      A       
ATOM     47  HB1 HIS A   3      -3.222   8.603   2.260  1.00  0.00      A       
ATOM     48  HD1 HIS A   3      -2.821   9.523  -0.188  1.00  0.00      A       
ATOM     49  HD2 HIS A   3      -6.748   8.501   0.709  1.00  0.00      A       
ATOM     50  HE1 HIS A   3      -4.221  10.591  -1.983  1.00  0.00      A       
ATOM     51  HE2 HIS A   3      -6.586   9.896  -1.463  1.00  0.00      A       
ATOM     52  N   HIS A   3      -4.574   5.635   1.595  1.00  0.00      A       
ATOM     53  ND1 HIS A   3      -3.798   9.445  -0.226  1.00  0.00      A       
ATOM     54  NE2 HIS A   3      -5.820   9.681  -0.891  1.00  0.00      A       
ATOM     55  O   HIS A   3      -1.182   6.307   2.032  1.00  0.00      A       
ATOM     56  C   CYS A   4      -0.696   6.638   4.914  1.00  0.00      A       
ATOM     57  CA  CYS A   4      -1.684   5.500   4.658  1.00  0.00      A       
ATOM     58  CB  CYS A   4      -0.937   4.241   4.210  1.00  0.00      A       
ATOM     59  HN  CYS A   4      -3.631   5.859   3.909  1.00  0.00      A       
ATOM     60  HA  CYS A   4      -2.206   5.285   5.578  1.00  0.00      A       
ATOM     61  HB2 CYS A   4      -1.343   3.907   3.267  1.00  0.00      A       
ATOM     62  HB1 CYS A   4       0.109   4.478   4.081  1.00  0.00      A       
ATOM     63  N   CYS A   4      -2.683   5.881   3.662  1.00  0.00      A       
ATOM     64  O   CYS A   4      -0.918   7.477   5.787  1.00  0.00      A       
ATOM     65  SG  CYS A   4      -1.050   2.852   5.383  1.00  0.00      A       
ATOM     66  C   ASP A   5       0.985   8.985   3.602  1.00  0.00      A       
ATOM     67  CA  ASP A   5       1.412   7.696   4.297  1.00  0.00      A       
ATOM     68  CB  ASP A   5       2.745   7.211   3.721  1.00  0.00      A       
ATOM     69  CG  ASP A   5       3.934   7.703   4.521  1.00  0.00      A       
ATOM     70  HN  ASP A   5       0.516   5.966   3.470  1.00  0.00      A       
ATOM     71  HA  ASP A   5       1.535   7.892   5.351  1.00  0.00      A       
ATOM     72  HB2 ASP A   5       2.758   6.131   3.719  1.00  0.00      A       
ATOM     73  HB1 ASP A   5       2.843   7.569   2.707  1.00  0.00      A       
ATOM     74  N   ASP A   5       0.393   6.661   4.149  1.00  0.00      A       
ATOM     75  O   ASP A   5       1.746   9.952   3.549  1.00  0.00      A       
ATOM     76  OD1 ASP A   5       3.847   7.718   5.767  1.00  0.00      A       
ATOM     77  OD2 ASP A   5       4.954   8.074   3.902  1.00  0.00      A       
ATOM     78  C   ALA A   6       0.146  10.569   1.223  1.00  0.00      A       
ATOM     79  CA  ALA A   6      -0.767  10.157   2.372  1.00  0.00      A       
ATOM     80  CB  ALA A   6      -0.959  11.314   3.342  1.00  0.00      A       
ATOM     81  HN  ALA A   6      -0.791   8.186   3.143  1.00  0.00      A       
ATOM     82  HA  ALA A   6      -1.735   9.891   1.971  1.00  0.00      A       
ATOM     83  HB1 ALA A   6      -0.398  12.170   2.997  1.00  0.00      A       
ATOM     84  HB2 ALA A   6      -0.608  11.025   4.322  1.00  0.00      A       
ATOM     85  HB3 ALA A   6      -2.007  11.569   3.396  1.00  0.00      A       
ATOM     86  N   ALA A   6      -0.235   8.989   3.069  1.00  0.00      A       
ATOM     87  O   ALA A   6       0.192  11.739   0.841  1.00  0.00      A       
ATOM     88  C   ALA A   7       1.555   8.873  -1.571  1.00  0.00      A       
ATOM     89  CA  ALA A   7       1.788   9.854  -0.428  1.00  0.00      A       
ATOM     90  CB  ALA A   7       3.230   9.772   0.053  1.00  0.00      A       
ATOM     91  HN  ALA A   7       0.791   8.687   1.028  1.00  0.00      A       
ATOM     92  HA  ALA A   7       1.609  10.858  -0.785  1.00  0.00      A       
ATOM     93  HB1 ALA A   7       3.737   8.970  -0.464  1.00  0.00      A       
ATOM     94  HB2 ALA A   7       3.245   9.580   1.116  1.00  0.00      A       
ATOM     95  HB3 ALA A   7       3.732  10.706  -0.151  1.00  0.00      A       
ATOM     96  N   ALA A   7       0.873   9.599   0.677  1.00  0.00      A       
ATOM     97  O   ALA A   7       2.038   9.076  -2.685  1.00  0.00      A       
ATOM     98  C   THR A   8      -0.903   6.253  -2.125  1.00  0.00      A       
ATOM     99  CA  THR A   8       0.514   6.792  -2.289  1.00  0.00      A       
ATOM    100  CB  THR A   8       1.510   5.619  -2.210  1.00  0.00      A       
ATOM    101  CG2 THR A   8       2.201   5.406  -3.548  1.00  0.00      A       
ATOM    102  HN  THR A   8       0.455   7.702  -0.379  1.00  0.00      A       
ATOM    103  HA  THR A   8       0.605   7.249  -3.264  1.00  0.00      A       
ATOM    104  HB  THR A   8       0.965   4.721  -1.956  1.00  0.00      A       
ATOM    105  HG1 THR A   8       2.962   6.683  -1.402  1.00  0.00      A       
ATOM    106 HG21 THR A   8       2.174   4.357  -3.804  1.00  0.00      A       
ATOM    107 HG22 THR A   8       3.228   5.733  -3.478  1.00  0.00      A       
ATOM    108 HG23 THR A   8       1.692   5.976  -4.310  1.00  0.00      A       
ATOM    109  N   THR A   8       0.811   7.807  -1.286  1.00  0.00      A       
ATOM    110  O   THR A   8      -1.273   5.767  -1.056  1.00  0.00      A       
ATOM    111  OG1 THR A   8       2.490   5.873  -1.196  1.00  0.00      A       
ATOM    112  C   ILE A   9      -3.135   4.375  -3.509  1.00  0.00      A       
ATOM    113  CA  ILE A   9      -3.069   5.860  -3.168  1.00  0.00      A       
ATOM    114  CB  ILE A   9      -3.961   6.645  -4.152  1.00  0.00      A       
ATOM    115  CD1 ILE A   9      -4.245   8.933  -5.240  1.00  0.00      A       
ATOM    116  CG1 ILE A   9      -3.606   8.134  -4.124  1.00  0.00      A       
ATOM    117  CG2 ILE A   9      -5.430   6.437  -3.812  1.00  0.00      A       
ATOM    118  HN  ILE A   9      -1.339   6.737  -4.016  1.00  0.00      A       
ATOM    119  HA  ILE A   9      -3.455   6.007  -2.169  1.00  0.00      A       
ATOM    120  HB  ILE A   9      -3.789   6.259  -5.145  1.00  0.00      A       
ATOM    121 HD11 ILE A   9      -4.826   8.274  -5.868  1.00  0.00      A       
ATOM    122 HD12 ILE A   9      -3.475   9.407  -5.831  1.00  0.00      A       
ATOM    123 HD13 ILE A   9      -4.890   9.689  -4.818  1.00  0.00      A       
ATOM    124 HG12 ILE A   9      -3.933   8.558  -3.186  1.00  0.00      A       
ATOM    125 HG11 ILE A   9      -2.534   8.243  -4.208  1.00  0.00      A       
ATOM    126 HG21 ILE A   9      -5.680   5.393  -3.921  1.00  0.00      A       
ATOM    127 HG22 ILE A   9      -6.041   7.026  -4.480  1.00  0.00      A       
ATOM    128 HG23 ILE A   9      -5.610   6.746  -2.793  1.00  0.00      A       
ATOM    129  N   ILE A   9      -1.692   6.341  -3.192  1.00  0.00      A       
ATOM    130  O   ILE A   9      -2.249   3.844  -4.180  1.00  0.00      A       
ATOM    131  C   CYS A  10      -5.839   1.933  -3.474  1.00  0.00      A       
ATOM    132  CA  CYS A  10      -4.361   2.282  -3.294  1.00  0.00      A       
ATOM    133  CB  CYS A  10      -3.770   1.468  -2.142  1.00  0.00      A       
ATOM    134  HN  CYS A  10      -4.857   4.186  -2.510  1.00  0.00      A       
ATOM    135  HA  CYS A  10      -3.833   2.040  -4.203  1.00  0.00      A       
ATOM    136  HB2 CYS A  10      -4.011   1.953  -1.208  1.00  0.00      A       
ATOM    137  HB1 CYS A  10      -4.204   0.479  -2.150  1.00  0.00      A       
ATOM    138  N   CYS A  10      -4.186   3.708  -3.041  1.00  0.00      A       
ATOM    139  O   CYS A  10      -6.712   2.619  -2.942  1.00  0.00      A       
ATOM    140  SG  CYS A  10      -1.960   1.283  -2.218  1.00  0.00      A       
ATOM    141  C   PRO A  11      -8.221   0.004  -3.181  1.00  0.00      A       
ATOM    142  CA  PRO A  11      -7.524   0.427  -4.467  1.00  0.00      A       
ATOM    143  CB  PRO A  11      -7.382  -0.772  -5.415  1.00  0.00      A       
ATOM    144  CD  PRO A  11      -5.175  -0.026  -4.901  1.00  0.00      A       
ATOM    145  CG  PRO A  11      -6.004  -0.668  -5.975  1.00  0.00      A       
ATOM    146  HA  PRO A  11      -8.101   1.204  -4.948  1.00  0.00      A       
ATOM    147  HB2 PRO A  11      -7.514  -1.689  -4.860  1.00  0.00      A       
ATOM    148  HB1 PRO A  11      -8.128  -0.708  -6.193  1.00  0.00      A       
ATOM    149  HD2 PRO A  11      -4.792  -0.773  -4.221  1.00  0.00      A       
ATOM    150  HD1 PRO A  11      -4.367   0.544  -5.334  1.00  0.00      A       
ATOM    151  HG2 PRO A  11      -5.625  -1.653  -6.204  1.00  0.00      A       
ATOM    152  HG1 PRO A  11      -6.012  -0.052  -6.861  1.00  0.00      A       
ATOM    153  N   PRO A  11      -6.142   0.856  -4.228  1.00  0.00      A       
ATOM    154  O   PRO A  11      -7.613  -0.624  -2.313  1.00  0.00      A       
ATOM    155  C   ASP A  12     -10.321  -1.507  -1.684  1.00  0.00      A       
ATOM    156  CA  ASP A  12     -10.278   0.005  -1.879  1.00  0.00      A       
ATOM    157  CB  ASP A  12     -11.703   0.559  -1.984  1.00  0.00      A       
ATOM    158  CG  ASP A  12     -11.867   1.543  -3.127  1.00  0.00      A       
ATOM    159  HN  ASP A  12      -9.926   0.849  -3.791  1.00  0.00      A       
ATOM    160  HA  ASP A  12      -9.792   0.451  -1.024  1.00  0.00      A       
ATOM    161  HB2 ASP A  12     -12.390  -0.259  -2.139  1.00  0.00      A       
ATOM    162  HB1 ASP A  12     -11.954   1.063  -1.062  1.00  0.00      A       
ATOM    163  N   ASP A  12      -9.499   0.350  -3.064  1.00  0.00      A       
ATOM    164  O   ASP A  12     -11.042  -2.214  -2.388  1.00  0.00      A       
ATOM    165  OD1 ASP A  12     -11.978   1.093  -4.287  1.00  0.00      A       
ATOM    166  OD2 ASP A  12     -11.886   2.764  -2.861  1.00  0.00      A       
ATOM    167  C   GLY A  13      -8.082  -3.936  -0.292  1.00  0.00      A       
ATOM    168  CA  GLY A  13      -9.498  -3.419  -0.450  1.00  0.00      A       
ATOM    169  HN  GLY A  13      -8.987  -1.380  -0.197  1.00  0.00      A       
ATOM    170  HA2 GLY A  13     -10.045  -3.616   0.460  1.00  0.00      A       
ATOM    171  HA1 GLY A  13      -9.973  -3.945  -1.264  1.00  0.00      A       
ATOM    172  N   GLY A  13      -9.541  -1.994  -0.723  1.00  0.00      A       
ATOM    173  O   GLY A  13      -7.871  -5.127  -0.067  1.00  0.00      A       
ATOM    174  C   THR A  14      -5.060  -2.703   0.909  1.00  0.00      A       
ATOM    175  CA  THR A  14      -5.704  -3.404  -0.281  1.00  0.00      A       
ATOM    176  CB  THR A  14      -4.911  -3.056  -1.554  1.00  0.00      A       
ATOM    177  CG2 THR A  14      -5.363  -3.913  -2.726  1.00  0.00      A       
ATOM    178  HN  THR A  14      -7.343  -2.102  -0.592  1.00  0.00      A       
ATOM    179  HA  THR A  14      -5.651  -4.472  -0.130  1.00  0.00      A       
ATOM    180  HB  THR A  14      -3.864  -3.248  -1.370  1.00  0.00      A       
ATOM    181  HG1 THR A  14      -4.650  -1.130  -1.209  1.00  0.00      A       
ATOM    182 HG21 THR A  14      -4.586  -3.936  -3.476  1.00  0.00      A       
ATOM    183 HG22 THR A  14      -6.263  -3.494  -3.152  1.00  0.00      A       
ATOM    184 HG23 THR A  14      -5.561  -4.917  -2.382  1.00  0.00      A       
ATOM    185  N   THR A  14      -7.110  -3.036  -0.412  1.00  0.00      A       
ATOM    186  O   THR A  14      -5.500  -1.630   1.323  1.00  0.00      A       
ATOM    187  OG1 THR A  14      -5.082  -1.670  -1.875  1.00  0.00      A       
ATOM    188  C   THR A  15      -1.965  -2.159   2.174  1.00  0.00      A       
ATOM    189  CA  THR A  15      -3.306  -2.752   2.596  1.00  0.00      A       
ATOM    190  CB  THR A  15      -3.065  -3.811   3.689  1.00  0.00      A       
ATOM    191  CG2 THR A  15      -2.237  -4.968   3.150  1.00  0.00      A       
ATOM    192  HN  THR A  15      -3.711  -4.168   1.078  1.00  0.00      A       
ATOM    193  HA  THR A  15      -3.920  -1.967   3.014  1.00  0.00      A       
ATOM    194  HB  THR A  15      -4.021  -4.193   4.016  1.00  0.00      A       
ATOM    195  HG1 THR A  15      -1.657  -2.687   4.496  1.00  0.00      A       
ATOM    196 HG21 THR A  15      -1.312  -5.038   3.703  1.00  0.00      A       
ATOM    197 HG22 THR A  15      -2.020  -4.800   2.106  1.00  0.00      A       
ATOM    198 HG23 THR A  15      -2.792  -5.888   3.258  1.00  0.00      A       
ATOM    199  N   THR A  15      -4.014  -3.316   1.454  1.00  0.00      A       
ATOM    200  O   THR A  15      -1.395  -2.552   1.155  1.00  0.00      A       
ATOM    201  OG1 THR A  15      -2.393  -3.219   4.808  1.00  0.00      A       
ATOM    202  C   CYS A  16       0.969  -1.429   3.169  1.00  0.00      A       
ATOM    203  CA  CYS A  16      -0.191  -0.570   2.679  1.00  0.00      A       
ATOM    204  CB  CYS A  16      -0.126   0.811   3.336  1.00  0.00      A       
ATOM    205  HN  CYS A  16      -1.968  -0.951   3.765  1.00  0.00      A       
ATOM    206  HA  CYS A  16      -0.111  -0.455   1.609  1.00  0.00      A       
ATOM    207  HB2 CYS A  16       0.688   0.824   4.046  1.00  0.00      A       
ATOM    208  HB1 CYS A  16       0.058   1.554   2.574  1.00  0.00      A       
ATOM    209  N   CYS A  16      -1.467  -1.216   2.966  1.00  0.00      A       
ATOM    210  O   CYS A  16       1.144  -1.623   4.372  1.00  0.00      A       
ATOM    211  SG  CYS A  16      -1.642   1.291   4.227  1.00  0.00      A       
ATOM    212  C   SER A  17       4.183  -2.229   1.965  1.00  0.00      A       
ATOM    213  CA  SER A  17       2.899  -2.784   2.572  1.00  0.00      A       
ATOM    214  CB  SER A  17       2.667  -4.215   2.085  1.00  0.00      A       
ATOM    215  HN  SER A  17       1.566  -1.755   1.287  1.00  0.00      A       
ATOM    216  HA  SER A  17       2.997  -2.791   3.647  1.00  0.00      A       
ATOM    217  HB2 SER A  17       2.982  -4.298   1.055  1.00  0.00      A       
ATOM    218  HB1 SER A  17       3.242  -4.898   2.693  1.00  0.00      A       
ATOM    219  HG  SER A  17       0.756  -3.818   1.917  1.00  0.00      A       
ATOM    220  N   SER A  17       1.757  -1.944   2.231  1.00  0.00      A       
ATOM    221  O   SER A  17       4.222  -1.881   0.786  1.00  0.00      A       
ATOM    222  OG  SER A  17       1.297  -4.568   2.172  1.00  0.00      A       
ATOM    223  C   LEU A  18       7.382  -2.750   1.751  1.00  0.00      A       
ATOM    224  CA  LEU A  18       6.516  -1.633   2.322  1.00  0.00      A       
ATOM    225  CB  LEU A  18       7.255  -0.944   3.472  1.00  0.00      A       
ATOM    226  CD1 LEU A  18       8.014   1.152   4.618  1.00  0.00      A       
ATOM    227  CD2 LEU A  18       7.797   1.107   2.126  1.00  0.00      A       
ATOM    228  CG  LEU A  18       7.233   0.587   3.441  1.00  0.00      A       
ATOM    229  HN  LEU A  18       5.137  -2.441   3.710  1.00  0.00      A       
ATOM    230  HA  LEU A  18       6.325  -0.909   1.544  1.00  0.00      A       
ATOM    231  HB2 LEU A  18       6.813  -1.271   4.402  1.00  0.00      A       
ATOM    232  HB1 LEU A  18       8.286  -1.265   3.451  1.00  0.00      A       
ATOM    233 HD11 LEU A  18       9.048   1.282   4.334  1.00  0.00      A       
ATOM    234 HD12 LEU A  18       7.953   0.469   5.452  1.00  0.00      A       
ATOM    235 HD13 LEU A  18       7.596   2.107   4.903  1.00  0.00      A       
ATOM    236 HD21 LEU A  18       7.053   1.004   1.349  1.00  0.00      A       
ATOM    237 HD22 LEU A  18       8.675   0.537   1.860  1.00  0.00      A       
ATOM    238 HD23 LEU A  18       8.063   2.148   2.234  1.00  0.00      A       
ATOM    239  HG  LEU A  18       6.211   0.927   3.526  1.00  0.00      A       
ATOM    240  N   LEU A  18       5.231  -2.149   2.779  1.00  0.00      A       
ATOM    241  O   LEU A  18       7.473  -3.835   2.326  1.00  0.00      A       
ATOM    242  C   SER A  19      10.282  -3.428   0.603  1.00  0.00      A       
ATOM    243  CA  SER A  19       8.890  -3.445  -0.029  1.00  0.00      A       
ATOM    244  CB  SER A  19       8.985  -3.146  -1.528  1.00  0.00      A       
ATOM    245  HN  SER A  19       7.912  -1.586   0.216  1.00  0.00      A       
ATOM    246  HA  SER A  19       8.455  -4.424   0.109  1.00  0.00      A       
ATOM    247  HB2 SER A  19       8.954  -4.073  -2.081  1.00  0.00      A       
ATOM    248  HB1 SER A  19       8.153  -2.523  -1.822  1.00  0.00      A       
ATOM    249  HG  SER A  19      10.311  -1.732  -1.239  1.00  0.00      A       
ATOM    250  N   SER A  19       8.022  -2.471   0.621  1.00  0.00      A       
ATOM    251  O   SER A  19      10.653  -2.457   1.261  1.00  0.00      A       
ATOM    252  OG  SER A  19      10.192  -2.471  -1.840  1.00  0.00      A       
ATOM    253  C   PRO A  20      13.331  -3.453   0.520  1.00  0.00      A       
ATOM    254  CA  PRO A  20      12.427  -4.593   0.984  1.00  0.00      A       
ATOM    255  CB  PRO A  20      12.952  -5.934   0.458  1.00  0.00      A       
ATOM    256  CD  PRO A  20      10.717  -5.715  -0.343  1.00  0.00      A       
ATOM    257  CG  PRO A  20      11.731  -6.719   0.123  1.00  0.00      A       
ATOM    258  HA  PRO A  20      12.403  -4.613   2.064  1.00  0.00      A       
ATOM    259  HB2 PRO A  20      13.565  -5.765  -0.416  1.00  0.00      A       
ATOM    260  HB1 PRO A  20      13.535  -6.421   1.225  1.00  0.00      A       
ATOM    261  HD2 PRO A  20      10.812  -5.547  -1.406  1.00  0.00      A       
ATOM    262  HD1 PRO A  20       9.718  -6.044  -0.098  1.00  0.00      A       
ATOM    263  HG2 PRO A  20      11.951  -7.424  -0.664  1.00  0.00      A       
ATOM    264  HG1 PRO A  20      11.372  -7.234   1.002  1.00  0.00      A       
ATOM    265  N   PRO A  20      11.074  -4.504   0.419  1.00  0.00      A       
ATOM    266  O   PRO A  20      14.419  -3.253   1.060  1.00  0.00      A       
ATOM    267  C   TYR A  21      12.940  -0.269  -0.747  1.00  0.00      A       
ATOM    268  CA  TYR A  21      13.643  -1.595  -1.025  1.00  0.00      A       
ATOM    269  CB  TYR A  21      13.855  -1.771  -2.533  1.00  0.00      A       
ATOM    270  CD1 TYR A  21      14.370  -4.243  -2.650  1.00  0.00      A       
ATOM    271  CD2 TYR A  21      12.499  -3.425  -3.880  1.00  0.00      A       
ATOM    272  CE1 TYR A  21      14.111  -5.524  -3.099  1.00  0.00      A       
ATOM    273  CE2 TYR A  21      12.233  -4.703  -4.333  1.00  0.00      A       
ATOM    274  CG  TYR A  21      13.570  -3.173  -3.031  1.00  0.00      A       
ATOM    275  CZ  TYR A  21      13.042  -5.749  -3.940  1.00  0.00      A       
ATOM    276  HN  TYR A  21      12.001  -2.923  -0.875  1.00  0.00      A       
ATOM    277  HA  TYR A  21      14.605  -1.587  -0.534  1.00  0.00      A       
ATOM    278  HB2 TYR A  21      13.202  -1.093  -3.063  1.00  0.00      A       
ATOM    279  HB1 TYR A  21      14.881  -1.535  -2.774  1.00  0.00      A       
ATOM    280  HD1 TYR A  21      15.207  -4.064  -1.990  1.00  0.00      A       
ATOM    281  HD2 TYR A  21      11.867  -2.604  -4.186  1.00  0.00      A       
ATOM    282  HE1 TYR A  21      14.745  -6.342  -2.791  1.00  0.00      A       
ATOM    283  HE2 TYR A  21      11.396  -4.879  -4.992  1.00  0.00      A       
ATOM    284  HH  TYR A  21      13.506  -7.602  -4.150  1.00  0.00      A       
ATOM    285  N   TYR A  21      12.874  -2.712  -0.485  1.00  0.00      A       
ATOM    286  O   TYR A  21      13.151   0.719  -1.452  1.00  0.00      A       
ATOM    287  OH  TYR A  21      12.780  -7.023  -4.390  1.00  0.00      A       
ATOM    288  C   GLY A  22      10.431   1.407  -0.437  1.00  0.00      A       
ATOM    289  CA  GLY A  22      11.380   0.947   0.651  1.00  0.00      A       
ATOM    290  HN  GLY A  22      11.981  -1.075   0.812  1.00  0.00      A       
ATOM    291  HA2 GLY A  22      10.810   0.753   1.549  1.00  0.00      A       
ATOM    292  HA1 GLY A  22      12.091   1.735   0.851  1.00  0.00      A       
ATOM    293  N   GLY A  22      12.105  -0.257   0.288  1.00  0.00      A       
ATOM    294  O   GLY A  22      10.468   2.565  -0.853  1.00  0.00      A       
ATOM    295  C   VAL A  23       7.188   0.503  -1.467  1.00  0.00      A       
ATOM    296  CA  VAL A  23       8.607   0.813  -1.936  1.00  0.00      A       
ATOM    297  CB  VAL A  23       8.895   0.028  -3.231  1.00  0.00      A       
ATOM    298  CG1 VAL A  23       7.999   0.512  -4.362  1.00  0.00      A       
ATOM    299  CG2 VAL A  23      10.362   0.149  -3.615  1.00  0.00      A       
ATOM    300  HN  VAL A  23       9.595  -0.406  -0.518  1.00  0.00      A       
ATOM    301  HA  VAL A  23       8.682   1.869  -2.152  1.00  0.00      A       
ATOM    302  HB  VAL A  23       8.677  -1.014  -3.052  1.00  0.00      A       
ATOM    303 HG11 VAL A  23       7.700   1.532  -4.173  1.00  0.00      A       
ATOM    304 HG12 VAL A  23       7.122  -0.116  -4.419  1.00  0.00      A       
ATOM    305 HG13 VAL A  23       8.540   0.461  -5.295  1.00  0.00      A       
ATOM    306 HG21 VAL A  23      10.886   0.722  -2.864  1.00  0.00      A       
ATOM    307 HG22 VAL A  23      10.445   0.648  -4.570  1.00  0.00      A       
ATOM    308 HG23 VAL A  23      10.798  -0.836  -3.686  1.00  0.00      A       
ATOM    309  N   VAL A  23       9.576   0.498  -0.894  1.00  0.00      A       
ATOM    310  O   VAL A  23       6.845  -0.654  -1.222  1.00  0.00      A       
ATOM    311  C   TRP A  24       4.132   0.751  -1.983  1.00  0.00      A       
ATOM    312  CA  TRP A  24       4.991   1.381  -0.891  1.00  0.00      A       
ATOM    313  CB  TRP A  24       4.401   2.733  -0.485  1.00  0.00      A       
ATOM    314  CD1 TRP A  24       5.948   4.295   0.830  1.00  0.00      A       
ATOM    315  CD2 TRP A  24       4.732   2.917   2.109  1.00  0.00      A       
ATOM    316  CE2 TRP A  24       5.532   3.717   2.946  1.00  0.00      A       
ATOM    317  CE3 TRP A  24       3.881   1.973   2.691  1.00  0.00      A       
ATOM    318  CG  TRP A  24       5.013   3.303   0.758  1.00  0.00      A       
ATOM    319  CH2 TRP A  24       4.663   2.669   4.876  1.00  0.00      A       
ATOM    320  CZ2 TRP A  24       5.506   3.601   4.334  1.00  0.00      A       
ATOM    321  CZ3 TRP A  24       3.856   1.859   4.068  1.00  0.00      A       
ATOM    322  HN  TRP A  24       6.703   2.442  -1.543  1.00  0.00      A       
ATOM    323  HA  TRP A  24       4.995   0.728  -0.032  1.00  0.00      A       
ATOM    324  HB2 TRP A  24       4.555   3.440  -1.285  1.00  0.00      A       
ATOM    325  HB1 TRP A  24       3.341   2.617  -0.312  1.00  0.00      A       
ATOM    326  HD1 TRP A  24       6.369   4.798  -0.028  1.00  0.00      A       
ATOM    327  HE1 TRP A  24       6.911   5.219   2.453  1.00  0.00      A       
ATOM    328  HE3 TRP A  24       3.251   1.339   2.084  1.00  0.00      A       
ATOM    329  HH2 TRP A  24       4.611   2.545   5.948  1.00  0.00      A       
ATOM    330  HZ2 TRP A  24       6.122   4.218   4.971  1.00  0.00      A       
ATOM    331  HZ3 TRP A  24       3.205   1.135   4.536  1.00  0.00      A       
ATOM    332  N   TRP A  24       6.370   1.543  -1.337  1.00  0.00      A       
ATOM    333  NE1 TRP A  24       6.266   4.550   2.143  1.00  0.00      A       
ATOM    334  O   TRP A  24       4.008   1.298  -3.080  1.00  0.00      A       
ATOM    335  C   TYR A  25       1.426  -1.628  -1.946  1.00  0.00      A       
ATOM    336  CA  TYR A  25       2.682  -1.095  -2.628  1.00  0.00      A       
ATOM    337  CB  TYR A  25       3.447  -2.237  -3.306  1.00  0.00      A       
ATOM    338  CD1 TYR A  25       3.091  -4.401  -2.049  1.00  0.00      A       
ATOM    339  CD2 TYR A  25       5.177  -3.277  -1.788  1.00  0.00      A       
ATOM    340  CE1 TYR A  25       3.515  -5.398  -1.191  1.00  0.00      A       
ATOM    341  CE2 TYR A  25       5.609  -4.272  -0.930  1.00  0.00      A       
ATOM    342  CG  TYR A  25       3.913  -3.324  -2.361  1.00  0.00      A       
ATOM    343  CZ  TYR A  25       4.775  -5.328  -0.634  1.00  0.00      A       
ATOM    344  HN  TYR A  25       3.668  -0.780  -0.783  1.00  0.00      A       
ATOM    345  HA  TYR A  25       2.384  -0.380  -3.382  1.00  0.00      A       
ATOM    346  HB2 TYR A  25       2.810  -2.696  -4.046  1.00  0.00      A       
ATOM    347  HB1 TYR A  25       4.320  -1.829  -3.797  1.00  0.00      A       
ATOM    348  HD1 TYR A  25       2.105  -4.453  -2.487  1.00  0.00      A       
ATOM    349  HD2 TYR A  25       5.828  -2.448  -2.020  1.00  0.00      A       
ATOM    350  HE1 TYR A  25       2.862  -6.226  -0.960  1.00  0.00      A       
ATOM    351  HE2 TYR A  25       6.596  -4.217  -0.494  1.00  0.00      A       
ATOM    352  HH  TYR A  25       5.161  -7.168  -0.228  1.00  0.00      A       
ATOM    353  N   TYR A  25       3.535  -0.397  -1.674  1.00  0.00      A       
ATOM    354  O   TYR A  25       1.422  -1.886  -0.741  1.00  0.00      A       
ATOM    355  OH  TYR A  25       5.202  -6.320   0.219  1.00  0.00      A       
ATOM    356  C   CYS A  26      -0.984  -3.799  -2.292  1.00  0.00      A       
ATOM    357  CA  CYS A  26      -0.909  -2.278  -2.204  1.00  0.00      A       
ATOM    358  CB  CYS A  26      -2.073  -1.650  -2.972  1.00  0.00      A       
ATOM    359  HN  CYS A  26       0.428  -1.555  -3.676  1.00  0.00      A       
ATOM    360  HA  CYS A  26      -0.976  -1.987  -1.167  1.00  0.00      A       
ATOM    361  HB2 CYS A  26      -2.377  -2.318  -3.765  1.00  0.00      A       
ATOM    362  HB1 CYS A  26      -2.902  -1.501  -2.296  1.00  0.00      A       
ATOM    363  N   CYS A  26       0.360  -1.784  -2.726  1.00  0.00      A       
ATOM    364  O   CYS A  26      -0.801  -4.380  -3.362  1.00  0.00      A       
ATOM    365  SG  CYS A  26      -1.678  -0.041  -3.729  1.00  0.00      A       
ATOM    366  C   SER A  27      -2.785  -6.319  -0.744  1.00  0.00      A       
ATOM    367  CA  SER A  27      -1.360  -5.890  -1.097  1.00  0.00      A       
ATOM    368  CB  SER A  27      -0.377  -6.447  -0.066  1.00  0.00      A       
ATOM    369  HN  SER A  27      -1.394  -3.914  -0.338  1.00  0.00      A       
ATOM    370  HA  SER A  27      -1.107  -6.281  -2.071  1.00  0.00      A       
ATOM    371  HB2 SER A  27       0.535  -5.869  -0.092  1.00  0.00      A       
ATOM    372  HB1 SER A  27      -0.816  -6.382   0.918  1.00  0.00      A       
ATOM    373  HG  SER A  27      -0.629  -8.127  -1.043  1.00  0.00      A       
ATOM    374  N   SER A  27      -1.257  -4.436  -1.157  1.00  0.00      A       
ATOM    375  O   SER A  27      -3.293  -5.977   0.323  1.00  0.00      A       
ATOM    376  OG  SER A  27      -0.064  -7.803  -0.337  1.00  0.00      A       
ATOM    377  C   PRO A  28      -4.918  -8.527  -0.247  1.00  0.00      A       
ATOM    378  CA  PRO A  28      -4.826  -7.539  -1.405  1.00  0.00      A       
ATOM    379  CB  PRO A  28      -5.205  -8.222  -2.722  1.00  0.00      A       
ATOM    380  CD  PRO A  28      -2.931  -7.531  -2.940  1.00  0.00      A       
ATOM    381  CG  PRO A  28      -3.907  -8.597  -3.347  1.00  0.00      A       
ATOM    382  HA  PRO A  28      -5.496  -6.711  -1.221  1.00  0.00      A       
ATOM    383  HB2 PRO A  28      -5.813  -9.092  -2.518  1.00  0.00      A       
ATOM    384  HB1 PRO A  28      -5.755  -7.531  -3.343  1.00  0.00      A       
ATOM    385  HD2 PRO A  28      -1.940  -7.946  -2.835  1.00  0.00      A       
ATOM    386  HD1 PRO A  28      -2.931  -6.725  -3.659  1.00  0.00      A       
ATOM    387  HG2 PRO A  28      -3.586  -9.561  -2.979  1.00  0.00      A       
ATOM    388  HG1 PRO A  28      -4.009  -8.621  -4.422  1.00  0.00      A       
ATOM    389  N   PRO A  28      -3.453  -7.074  -1.638  1.00  0.00      A       
ATOM    390  O   PRO A  28      -4.058  -9.394  -0.087  1.00  0.00      A       
ATOM    391  C   PHE A  29      -7.641  -9.688   1.806  1.00  0.00      A       
ATOM    392  CA  PHE A  29      -6.177  -9.269   1.702  1.00  0.00      A       
ATOM    393  CB  PHE A  29      -5.736  -8.578   2.995  1.00  0.00      A       
ATOM    394  CD1 PHE A  29      -7.641  -7.189   3.861  1.00  0.00      A       
ATOM    395  CD2 PHE A  29      -5.803  -6.074   2.828  1.00  0.00      A       
ATOM    396  CE1 PHE A  29      -8.259  -5.973   4.081  1.00  0.00      A       
ATOM    397  CE2 PHE A  29      -6.417  -4.855   3.045  1.00  0.00      A       
ATOM    398  CG  PHE A  29      -6.407  -7.254   3.232  1.00  0.00      A       
ATOM    399  CZ  PHE A  29      -7.646  -4.805   3.673  1.00  0.00      A       
ATOM    400  HN  PHE A  29      -6.618  -7.679   0.377  1.00  0.00      A       
ATOM    401  HA  PHE A  29      -5.573 -10.152   1.554  1.00  0.00      A       
ATOM    402  HB2 PHE A  29      -5.964  -9.219   3.833  1.00  0.00      A       
ATOM    403  HB1 PHE A  29      -4.670  -8.409   2.958  1.00  0.00      A       
ATOM    404  HD1 PHE A  29      -8.121  -8.102   4.181  1.00  0.00      A       
ATOM    405  HD2 PHE A  29      -4.842  -6.112   2.338  1.00  0.00      A       
ATOM    406  HE1 PHE A  29      -9.221  -5.936   4.571  1.00  0.00      A       
ATOM    407  HE2 PHE A  29      -5.936  -3.943   2.725  1.00  0.00      A       
ATOM    408  HZ  PHE A  29      -8.128  -3.853   3.843  1.00  0.00      A       
ATOM    409  N   PHE A  29      -5.968  -8.389   0.558  1.00  0.00      A       
ATOM    410  O   PHE A  29      -8.508  -9.120   1.142  1.00  0.00      A       
ATOM    411  C   SER A  30      -9.383 -11.945   4.153  1.00  0.00      A       
ATOM    412  CA  SER A  30      -9.265 -11.182   2.837  1.00  0.00      A       
ATOM    413  CB  SER A  30      -9.669 -12.086   1.672  1.00  0.00      A       
ATOM    414  HN  SER A  30      -7.172 -11.096   3.145  1.00  0.00      A       
ATOM    415  HA  SER A  30      -9.927 -10.330   2.868  1.00  0.00      A       
ATOM    416  HB2 SER A  30      -9.440 -11.592   0.739  1.00  0.00      A       
ATOM    417  HB1 SER A  30      -9.119 -13.014   1.732  1.00  0.00      A       
ATOM    418  HG  SER A  30     -11.475 -11.859   2.398  1.00  0.00      A       
ATOM    419  N   SER A  30      -7.907 -10.685   2.644  1.00  0.00      A       
ATOM    420  OT1 SER A  30     -10.424 -11.801   4.828  1.00  0.00      A       
ATOM    421  OT2 SER A  30      -8.434 -12.680   4.497  1.00  0.00      A       
ATOM    422  OG  SER A  30     -11.056 -12.375   1.705  1.00  0.00      A       
END


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