NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
393838 1qxc cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLY A  25       3.368   6.320   2.540  1.00  0.00      A       
ATOM      2  CA  GLY A  25       3.018   7.750   2.957  1.00  0.00      A       
ATOM      3  HT1 GLY A  25       1.246   8.691   3.514  1.00  0.00      A       
ATOM      4  HA2 GLY A  25       3.522   8.458   2.298  1.00  0.00      A       
ATOM      5  HA1 GLY A  25       3.385   7.938   3.966  1.00  0.00      A       
ATOM      6  N   GLY A  25       1.583   7.970   2.909  1.00  0.00      A       
ATOM      7  O   GLY A  25       3.725   5.494   3.379  1.00  0.00      A       
ATOM      8  C   SER A  26       2.887   4.586  -0.662  1.00  0.00      A       
ATOM      9  CA  SER A  26       3.553   4.755   0.704  1.00  0.00      A       
ATOM     10  CB  SER A  26       3.092   3.652   1.659  1.00  0.00      A       
ATOM     11  HN  SER A  26       2.962   6.749   0.567  1.00  0.00      A       
ATOM     12  HA  SER A  26       4.638   4.723   0.608  1.00  0.00      A       
ATOM     13  HB2 SER A  26       2.950   2.727   1.101  1.00  0.00      A       
ATOM     14  HB1 SER A  26       3.872   3.462   2.397  1.00  0.00      A       
ATOM     15  HG  SER A  26       1.287   4.512   1.712  1.00  0.00      A       
ATOM     16  N   SER A  26       3.254   6.071   1.243  1.00  0.00      A       
ATOM     17  O   SER A  26       1.830   3.967  -0.771  1.00  0.00      A       
ATOM     18  OG  SER A  26       1.881   3.994   2.327  1.00  0.00      A       
ATOM     19  C   ASN A  27       3.765   3.966  -3.789  1.00  0.00      A       
ATOM     20  CA  ASN A  27       3.020   5.066  -3.030  1.00  0.00      A       
ATOM     21  CB  ASN A  27       3.230   6.384  -3.779  1.00  0.00      A       
ATOM     22  CG  ASN A  27       1.932   6.851  -4.441  1.00  0.00      A       
ATOM     23  HN  ASN A  27       4.395   5.649  -1.578  1.00  0.00      A       
ATOM     24  HA  ASN A  27       1.957   4.850  -2.920  1.00  0.00      A       
ATOM     25  HB2 ASN A  27       3.585   7.146  -3.087  1.00  0.00      A       
ATOM     26  HB1 ASN A  27       4.003   6.256  -4.536  1.00  0.00      A       
ATOM     27 HD21 ASN A  27       2.930   8.465  -5.146  1.00  0.00      A       
ATOM     28 HD22 ASN A  27       1.254   8.382  -5.578  1.00  0.00      A       
ATOM     29  N   ASN A  27       3.536   5.147  -1.674  1.00  0.00      A       
ATOM     30  ND2 ASN A  27       2.048   7.994  -5.111  1.00  0.00      A       
ATOM     31  O   ASN A  27       3.230   3.388  -4.734  1.00  0.00      A       
ATOM     32  OD1 ASN A  27       0.895   6.216  -4.350  1.00  0.00      A       
ATOM     33  C   LYS A  28       5.823   1.440  -3.092  1.00  0.00      A       
ATOM     34  CA  LYS A  28       5.811   2.691  -3.973  1.00  0.00      A       
ATOM     35  CB  LYS A  28       7.205   3.241  -4.279  1.00  0.00      A       
ATOM     36  CD  LYS A  28       8.498   3.969  -6.318  1.00  0.00      A       
ATOM     37  CE  LYS A  28       8.160   4.152  -7.799  1.00  0.00      A       
ATOM     38  CG  LYS A  28       7.646   2.862  -5.695  1.00  0.00      A       
ATOM     39  HN  LYS A  28       5.415   4.185  -2.577  1.00  0.00      A       
ATOM     40  HA  LYS A  28       5.349   2.437  -4.927  1.00  0.00      A       
ATOM     41  HB2 LYS A  28       7.204   4.326  -4.173  1.00  0.00      A       
ATOM     42  HB1 LYS A  28       7.920   2.852  -3.554  1.00  0.00      A       
ATOM     43  HD2 LYS A  28       8.331   4.905  -5.786  1.00  0.00      A       
ATOM     44  HD1 LYS A  28       9.555   3.725  -6.210  1.00  0.00      A       
ATOM     45  HE2 LYS A  28       8.179   3.186  -8.305  1.00  0.00      A       
ATOM     46  HE1 LYS A  28       7.147   4.545  -7.902  1.00  0.00      A       
ATOM     47  HG2 LYS A  28       8.217   1.933  -5.665  1.00  0.00      A       
ATOM     48  HG1 LYS A  28       6.770   2.678  -6.315  1.00  0.00      A       
ATOM     49  HZ1 LYS A  28       9.119   4.985  -9.451  1.00  0.00      A       
ATOM     50  HZ2 LYS A  28       8.916   6.045  -8.231  1.00  0.00      A       
ATOM     51  N   LYS A  28       4.987   3.710  -3.347  1.00  0.00      A       
ATOM     52  NZ  LYS A  28       9.123   5.074  -8.441  1.00  0.00      A       
ATOM     53  O   LYS A  28       5.983   0.326  -3.591  1.00  0.00      A       
ATOM     54  C   GLY A  29       4.224   0.029  -0.644  1.00  0.00      A       
ATOM     55  CA  GLY A  29       5.642   0.569  -0.843  1.00  0.00      A       
ATOM     56  HN  GLY A  29       5.523   2.573  -1.400  1.00  0.00      A       
ATOM     57  HA2 GLY A  29       6.294  -0.231  -1.194  1.00  0.00      A       
ATOM     58  HA1 GLY A  29       6.042   0.911   0.111  1.00  0.00      A       
ATOM     59  N   GLY A  29       5.653   1.664  -1.798  1.00  0.00      A       
ATOM     60  O   GLY A  29       4.034  -1.174  -0.471  1.00  0.00      A       
ATOM     61  C   ALA A  30       1.698  -0.112   0.857  1.00  0.00      A       
ATOM     62  CA  ALA A  30       1.873   0.574  -0.500  1.00  0.00      A       
ATOM     63  CB  ALA A  30       1.430  -0.313  -1.665  1.00  0.00      A       
ATOM     64  HN  ALA A  30       3.431   1.920  -0.816  1.00  0.00      A       
ATOM     65  HA  ALA A  30       1.282   1.490  -0.514  1.00  0.00      A       
ATOM     66  HB1 ALA A  30       0.631   0.181  -2.216  1.00  0.00      A       
ATOM     67  HB2 ALA A  30       2.276  -0.489  -2.329  1.00  0.00      A       
ATOM     68  HB3 ALA A  30       1.069  -1.267  -1.278  1.00  0.00      A       
ATOM     69  N   ALA A  30       3.267   0.944  -0.675  1.00  0.00      A       
ATOM     70  O   ALA A  30       2.133  -1.247   1.043  1.00  0.00      A       
ATOM     71  C   ILE A  31      -0.141  -1.105   3.014  1.00  0.00      A       
ATOM     72  CA  ILE A  31       0.820   0.081   3.101  1.00  0.00      A       
ATOM     73  CB  ILE A  31       0.342   1.192   4.038  1.00  0.00      A       
ATOM     74  CD1 ILE A  31       2.099   1.375   5.837  1.00  0.00      A       
ATOM     75  CG1 ILE A  31       1.522   2.008   4.569  1.00  0.00      A       
ATOM     76  CG2 ILE A  31      -0.517   0.624   5.169  1.00  0.00      A       
ATOM     77  HN  ILE A  31       0.708   1.529   1.609  1.00  0.00      A       
ATOM     78  HA  ILE A  31       1.776  -0.277   3.487  1.00  0.00      A       
ATOM     79  HB  ILE A  31      -0.288   1.873   3.465  1.00  0.00      A       
ATOM     80 HD11 ILE A  31       3.122   1.724   5.985  1.00  0.00      A       
ATOM     81 HD12 ILE A  31       1.491   1.662   6.695  1.00  0.00      A       
ATOM     82 HD13 ILE A  31       2.096   0.291   5.736  1.00  0.00      A       
ATOM     83 HG12 ILE A  31       2.298   2.072   3.806  1.00  0.00      A       
ATOM     84 HG11 ILE A  31       1.199   3.027   4.781  1.00  0.00      A       
ATOM     85 HG21 ILE A  31       0.084  -0.049   5.780  1.00  0.00      A       
ATOM     86 HG22 ILE A  31      -0.889   1.441   5.788  1.00  0.00      A       
ATOM     87 HG23 ILE A  31      -1.359   0.076   4.746  1.00  0.00      A       
ATOM     88  N   ILE A  31       1.059   0.606   1.768  1.00  0.00      A       
ATOM     89  O   ILE A  31       0.180  -2.204   3.464  1.00  0.00      A       
ATOM     90  C   ILE A  32      -2.156  -2.538   0.907  1.00  0.00      A       
ATOM     91  CA  ILE A  32      -2.313  -1.877   2.277  1.00  0.00      A       
ATOM     92  CB  ILE A  32      -3.708  -1.301   2.527  1.00  0.00      A       
ATOM     93  CD1 ILE A  32      -5.063   0.368   3.844  1.00  0.00      A       
ATOM     94  CG1 ILE A  32      -3.664  -0.194   3.583  1.00  0.00      A       
ATOM     95  CG2 ILE A  32      -4.698  -2.406   2.896  1.00  0.00      A       
ATOM     96  HN  ILE A  32      -1.554   0.052   2.067  1.00  0.00      A       
ATOM     97  HA  ILE A  32      -2.131  -2.627   3.046  1.00  0.00      A       
ATOM     98  HB  ILE A  32      -4.062  -0.849   1.600  1.00  0.00      A       
ATOM     99 HD11 ILE A  32      -5.043   0.988   4.741  1.00  0.00      A       
ATOM    100 HD12 ILE A  32      -5.378   0.972   2.994  1.00  0.00      A       
ATOM    101 HD13 ILE A  32      -5.764  -0.454   3.987  1.00  0.00      A       
ATOM    102 HG12 ILE A  32      -3.247  -0.587   4.509  1.00  0.00      A       
ATOM    103 HG11 ILE A  32      -3.004   0.606   3.248  1.00  0.00      A       
ATOM    104 HG21 ILE A  32      -4.934  -2.344   3.958  1.00  0.00      A       
ATOM    105 HG22 ILE A  32      -5.613  -2.286   2.313  1.00  0.00      A       
ATOM    106 HG23 ILE A  32      -4.256  -3.379   2.679  1.00  0.00      A       
ATOM    107  N   ILE A  32      -1.302  -0.844   2.430  1.00  0.00      A       
ATOM    108  O   ILE A  32      -1.041  -2.827   0.477  1.00  0.00      A       
ATOM    109  C   GLY A  33      -3.925  -4.773  -1.000  1.00  0.00      A       
ATOM    110  CA  GLY A  33      -3.293  -3.381  -1.055  1.00  0.00      A       
ATOM    111  HN  GLY A  33      -4.193  -2.521   0.615  1.00  0.00      A       
ATOM    112  HA2 GLY A  33      -3.845  -2.755  -1.756  1.00  0.00      A       
ATOM    113  HA1 GLY A  33      -2.271  -3.455  -1.428  1.00  0.00      A       
ATOM    114  N   GLY A  33      -3.290  -2.759   0.258  1.00  0.00      A       
ATOM    115  O   GLY A  33      -3.267  -5.769  -1.296  1.00  0.00      A       
ATOM    116  C   LEU A  34      -5.158  -7.010   0.393  1.00  0.00      A       
ATOM    117  CA  LEU A  34      -5.922  -6.051  -0.523  1.00  0.00      A       
ATOM    118  CB  LEU A  34      -6.197  -6.621  -1.916  1.00  0.00      A       
ATOM    119  CD1 LEU A  34      -7.897  -5.311  -3.242  1.00  0.00      A       
ATOM    120  CD2 LEU A  34      -8.041  -7.841  -3.128  1.00  0.00      A       
ATOM    121  CG  LEU A  34      -7.650  -6.559  -2.391  1.00  0.00      A       
ATOM    122  HN  LEU A  34      -5.722  -3.983  -0.381  1.00  0.00      A       
ATOM    123  HA  LEU A  34      -6.888  -5.834  -0.068  1.00  0.00      A       
ATOM    124  HB2 LEU A  34      -5.578  -6.084  -2.635  1.00  0.00      A       
ATOM    125  HB1 LEU A  34      -5.875  -7.661  -1.932  1.00  0.00      A       
ATOM    126 HD11 LEU A  34      -8.459  -5.586  -4.135  1.00  0.00      A       
ATOM    127 HD12 LEU A  34      -8.467  -4.584  -2.664  1.00  0.00      A       
ATOM    128 HD13 LEU A  34      -6.941  -4.875  -3.533  1.00  0.00      A       
ATOM    129 HD21 LEU A  34      -7.418  -8.664  -2.779  1.00  0.00      A       
ATOM    130 HD22 LEU A  34      -9.090  -8.069  -2.930  1.00  0.00      A       
ATOM    131 HD23 LEU A  34      -7.896  -7.704  -4.199  1.00  0.00      A       
ATOM    132  HG  LEU A  34      -8.293  -6.483  -1.515  1.00  0.00      A       
ATOM    133  N   LEU A  34      -5.194  -4.798  -0.620  1.00  0.00      A       
ATOM    134  O   LEU A  34      -4.337  -7.797  -0.073  1.00  0.00      A       
ATOM    135  C   MET A  35      -5.650  -9.006   2.953  1.00  0.00      A       
ATOM    136  CA  MET A  35      -4.810  -7.761   2.666  1.00  0.00      A       
ATOM    137  CB  MET A  35      -4.603  -6.974   3.961  1.00  0.00      A       
ATOM    138  CE  MET A  35      -6.697  -5.173   6.804  1.00  0.00      A       
ATOM    139  CG  MET A  35      -5.944  -6.561   4.571  1.00  0.00      A       
ATOM    140  HN  MET A  35      -6.128  -6.269   2.051  1.00  0.00      A       
ATOM    141  HA  MET A  35      -3.857  -8.051   2.221  1.00  0.00      A       
ATOM    142  HB2 MET A  35      -4.046  -7.580   4.674  1.00  0.00      A       
ATOM    143  HB1 MET A  35      -4.003  -6.086   3.759  1.00  0.00      A       
ATOM    144  HE1 MET A  35      -6.106  -4.647   7.553  1.00  0.00      A       
ATOM    145  HE2 MET A  35      -6.809  -4.542   5.923  1.00  0.00      A       
ATOM    146  HE3 MET A  35      -7.681  -5.404   7.214  1.00  0.00      A       
ATOM    147  HG2 MET A  35      -6.186  -5.538   4.281  1.00  0.00      A       
ATOM    148  HG1 MET A  35      -6.740  -7.198   4.186  1.00  0.00      A       
ATOM    149  N   MET A  35      -5.457  -6.912   1.680  1.00  0.00      A       
ATOM    150  OT1 MET A  35      -5.122 -10.116   3.013  1.00  0.00      A       
ATOM    151  SD  MET A  35      -5.870  -6.688   6.350  1.00  0.00      A       
END


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