NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
377176 1g2g cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLY A   1      -4.273   3.406  -3.203  1.00  0.00      A       
ATOM      2  CA  GLY A   1      -5.300   4.313  -3.796  1.00  0.00      A       
ATOM      3  HT1 GLY A   1      -3.926   5.666  -4.553  1.00  0.00      A       
ATOM      4  HT2 GLY A   1      -5.431   5.693  -5.343  1.00  0.00      A       
ATOM      5  HT3 GLY A   1      -4.340   4.418  -5.626  1.00  0.00      A       
ATOM      6  HA2 GLY A   1      -5.621   5.031  -3.054  1.00  0.00      A       
ATOM      7  HA1 GLY A   1      -6.098   3.716  -4.211  1.00  0.00      A       
ATOM      8  N   GLY A   1      -4.707   5.082  -4.914  1.00  0.00      A       
ATOM      9  O   GLY A   1      -3.480   2.794  -3.918  1.00  0.00      A       
ATOM     10  C   CYS A   2      -3.417   1.064  -1.496  1.00  0.00      A       
ATOM     11  CA  CYS A   2      -3.286   2.505  -1.131  1.00  0.00      A       
ATOM     12  CB  CYS A   2      -3.425   2.597   0.411  1.00  0.00      A       
ATOM     13  HN  CYS A   2      -4.941   3.768  -1.294  1.00  0.00      A       
ATOM     14  HA  CYS A   2      -2.317   2.864  -1.444  1.00  0.00      A       
ATOM     15  HB2 CYS A   2      -3.492   3.666   0.678  1.00  0.00      A       
ATOM     16  HB1 CYS A   2      -4.382   2.140   0.740  1.00  0.00      A       
ATOM     17  N   CYS A   2      -4.279   3.275  -1.853  1.00  0.00      A       
ATOM     18  O   CYS A   2      -2.472   0.425  -1.933  1.00  0.00      A       
ATOM     19  SG  CYS A   2      -2.056   1.809   1.340  1.00  0.00      A       
ATOM     20  C   CYS A   3      -4.796  -1.232  -3.029  1.00  0.00      A       
ATOM     21  CA  CYS A   3      -4.958  -0.852  -1.577  1.00  0.00      A       
ATOM     22  CB  CYS A   3      -6.397  -1.190  -1.125  1.00  0.00      A       
ATOM     23  HN  CYS A   3      -5.360   1.117  -0.968  1.00  0.00      A       
ATOM     24  HA  CYS A   3      -4.261  -1.441  -1.001  1.00  0.00      A       
ATOM     25  HB2 CYS A   3      -7.122  -0.722  -1.827  1.00  0.00      A       
ATOM     26  HB1 CYS A   3      -6.551  -2.291  -1.172  1.00  0.00      A       
ATOM     27  N   CYS A   3      -4.643   0.542  -1.352  1.00  0.00      A       
ATOM     28  O   CYS A   3      -4.684  -2.407  -3.368  1.00  0.00      A       
ATOM     29  SG  CYS A   3      -6.736  -0.570   0.557  1.00  0.00      A       
ATOM     30  C   SER A   4      -3.129  -0.477  -5.663  1.00  0.00      A       
ATOM     31  CA  SER A   4      -4.600  -0.400  -5.336  1.00  0.00      A       
ATOM     32  CB  SER A   4      -5.210   0.780  -6.131  1.00  0.00      A       
ATOM     33  HN  SER A   4      -4.909   0.721  -3.638  1.00  0.00      A       
ATOM     34  HA  SER A   4      -5.078  -1.325  -5.631  1.00  0.00      A       
ATOM     35  HB2 SER A   4      -4.571   1.686  -6.055  1.00  0.00      A       
ATOM     36  HB1 SER A   4      -5.301   0.500  -7.203  1.00  0.00      A       
ATOM     37  HG  SER A   4      -6.912   1.693  -6.251  1.00  0.00      A       
ATOM     38  N   SER A   4      -4.778  -0.223  -3.923  1.00  0.00      A       
ATOM     39  O   SER A   4      -2.691  -1.366  -6.389  1.00  0.00      A       
ATOM     40  OG  SER A   4      -6.493   1.113  -5.607  1.00  0.00      A       
ATOM     41  C   ASP A   5      -0.090  -0.393  -4.831  1.00  0.00      A       
ATOM     42  CA  ASP A   5      -0.942   0.630  -5.563  1.00  0.00      A       
ATOM     43  CB  ASP A   5      -0.396   2.051  -5.262  1.00  0.00      A       
ATOM     44  CG  ASP A   5       1.054   2.231  -5.726  1.00  0.00      A       
ATOM     45  HN  ASP A   5      -2.665   1.184  -4.521  1.00  0.00      A       
ATOM     46  HA  ASP A   5      -0.912   0.497  -6.632  1.00  0.00      A       
ATOM     47  HB2 ASP A   5      -1.025   2.778  -5.815  1.00  0.00      A       
ATOM     48  HB1 ASP A   5      -0.478   2.267  -4.175  1.00  0.00      A       
ATOM     49  N   ASP A   5      -2.324   0.487  -5.161  1.00  0.00      A       
ATOM     50  O   ASP A   5      -0.133  -0.403  -3.603  1.00  0.00      A       
ATOM     51  OD1 ASP A   5       1.299   2.124  -6.956  1.00  0.00      A       
ATOM     52  OD2 ASP A   5       1.930   2.459  -4.850  1.00  0.00      A       
ATOM     53  C   PRO A   6       2.295  -2.010  -3.704  1.00  0.00      A       
ATOM     54  CA  PRO A   6       1.355  -2.378  -4.819  1.00  0.00      A       
ATOM     55  CB  PRO A   6       2.144  -3.067  -5.939  1.00  0.00      A       
ATOM     56  CD  PRO A   6       0.744  -1.389  -6.929  1.00  0.00      A       
ATOM     57  CG  PRO A   6       1.315  -2.786  -7.194  1.00  0.00      A       
ATOM     58  HA  PRO A   6       0.568  -2.997  -4.414  1.00  0.00      A       
ATOM     59  HB2 PRO A   6       3.147  -2.600  -6.066  1.00  0.00      A       
ATOM     60  HB1 PRO A   6       2.269  -4.152  -5.748  1.00  0.00      A       
ATOM     61  HD2 PRO A   6       1.388  -0.592  -7.358  1.00  0.00      A       
ATOM     62  HD1 PRO A   6      -0.283  -1.319  -7.353  1.00  0.00      A       
ATOM     63  HG2 PRO A   6       1.915  -2.833  -8.124  1.00  0.00      A       
ATOM     64  HG1 PRO A   6       0.480  -3.520  -7.254  1.00  0.00      A       
ATOM     65  N   PRO A   6       0.735  -1.231  -5.471  1.00  0.00      A       
ATOM     66  O   PRO A   6       2.501  -2.822  -2.806  1.00  0.00      A       
ATOM     67  C   ARG A   7       3.242   0.142  -1.544  1.00  0.00      A       
ATOM     68  CA  ARG A   7       3.881  -0.354  -2.810  1.00  0.00      A       
ATOM     69  CB  ARG A   7       4.727   0.806  -3.373  1.00  0.00      A       
ATOM     70  CD  ARG A   7       6.239   1.631  -5.272  1.00  0.00      A       
ATOM     71  CG  ARG A   7       5.420   0.463  -4.704  1.00  0.00      A       
ATOM     72  CZ  ARG A   7       4.810   3.104  -6.765  1.00  0.00      A       
ATOM     73  HN  ARG A   7       2.656  -0.159  -4.486  1.00  0.00      A       
ATOM     74  HA  ARG A   7       4.521  -1.193  -2.570  1.00  0.00      A       
ATOM     75  HB2 ARG A   7       4.072   1.693  -3.519  1.00  0.00      A       
ATOM     76  HB1 ARG A   7       5.510   1.086  -2.632  1.00  0.00      A       
ATOM     77  HD2 ARG A   7       6.992   1.968  -4.528  1.00  0.00      A       
ATOM     78  HD1 ARG A   7       6.764   1.336  -6.205  1.00  0.00      A       
ATOM     79  HE  ARG A   7       4.966   3.287  -4.737  1.00  0.00      A       
ATOM     80  HG2 ARG A   7       6.104  -0.398  -4.536  1.00  0.00      A       
ATOM     81  HG1 ARG A   7       4.669   0.152  -5.463  1.00  0.00      A       
ATOM     82 HH11 ARG A   7       5.799   1.636  -7.810  1.00  0.00      A       
ATOM     83 HH12 ARG A   7       4.780   2.654  -8.771  1.00  0.00      A       
ATOM     84 HH21 ARG A   7       3.666   4.664  -6.064  1.00  0.00      A       
ATOM     85 HH22 ARG A   7       3.554   4.388  -7.769  1.00  0.00      A       
ATOM     86  N   ARG A   7       2.876  -0.792  -3.748  1.00  0.00      A       
ATOM     87  NE  ARG A   7       5.309   2.784  -5.532  1.00  0.00      A       
ATOM     88  NH1 ARG A   7       5.159   2.401  -7.881  1.00  0.00      A       
ATOM     89  NH2 ARG A   7       3.937   4.150  -6.877  1.00  0.00      A       
ATOM     90  O   ARG A   7       3.931   0.419  -0.563  1.00  0.00      A       
ATOM     91  C   CYS A   8       0.245  -0.510  -0.048  1.00  0.00      A       
ATOM     92  CA  CYS A   8       1.126   0.661  -0.403  1.00  0.00      A       
ATOM     93  CB  CYS A   8       0.293   1.936  -0.696  1.00  0.00      A       
ATOM     94  HN  CYS A   8       1.400   0.100  -2.401  1.00  0.00      A       
ATOM     95  HA  CYS A   8       1.786   0.852   0.433  1.00  0.00      A       
ATOM     96  HB2 CYS A   8       0.976   2.654  -1.201  1.00  0.00      A       
ATOM     97  HB1 CYS A   8      -0.504   1.696  -1.427  1.00  0.00      A       
ATOM     98  N   CYS A   8       1.903   0.276  -1.553  1.00  0.00      A       
ATOM     99  O   CYS A   8      -0.025  -0.752   1.123  1.00  0.00      A       
ATOM    100  SG  CYS A   8      -0.371   2.802   0.774  1.00  0.00      A       
ATOM    101  C   ALA A   9      -0.927  -3.383   0.107  1.00  0.00      A       
ATOM    102  CA  ALA A   9      -1.206  -2.344  -0.934  1.00  0.00      A       
ATOM    103  CB  ALA A   9      -1.441  -3.097  -2.257  1.00  0.00      A       
ATOM    104  HN  ALA A   9      -0.056  -1.027  -2.012  1.00  0.00      A       
ATOM    105  HA  ALA A   9      -2.123  -1.848  -0.658  1.00  0.00      A       
ATOM    106  HB1 ALA A   9      -0.528  -3.648  -2.568  1.00  0.00      A       
ATOM    107  HB2 ALA A   9      -1.721  -2.383  -3.060  1.00  0.00      A       
ATOM    108  HB3 ALA A   9      -2.275  -3.825  -2.152  1.00  0.00      A       
ATOM    109  N   ALA A   9      -0.211  -1.296  -1.053  1.00  0.00      A       
ATOM    110  O   ALA A   9      -1.858  -3.946   0.670  1.00  0.00      A       
ATOM    111  C   TRP A  10       0.380  -4.101   2.831  1.00  0.00      A       
ATOM    112  CA  TRP A  10       0.758  -4.587   1.450  1.00  0.00      A       
ATOM    113  CB  TRP A  10       2.287  -4.867   1.438  1.00  0.00      A       
ATOM    114  CD1 TRP A  10       3.423  -2.685   0.621  1.00  0.00      A       
ATOM    115  CD2 TRP A  10       3.825  -3.196   2.767  1.00  0.00      A       
ATOM    116  CE2 TRP A  10       4.468  -1.977   2.462  1.00  0.00      A       
ATOM    117  CE3 TRP A  10       3.891  -3.745   4.044  1.00  0.00      A       
ATOM    118  CG  TRP A  10       3.167  -3.634   1.565  1.00  0.00      A       
ATOM    119  CH2 TRP A  10       5.266  -1.842   4.715  1.00  0.00      A       
ATOM    120  CZ2 TRP A  10       5.200  -1.293   3.427  1.00  0.00      A       
ATOM    121  CZ3 TRP A  10       4.619  -3.049   5.020  1.00  0.00      A       
ATOM    122  HN  TRP A  10       1.090  -3.173  -0.054  1.00  0.00      A       
ATOM    123  HA  TRP A  10       0.232  -5.515   1.271  1.00  0.00      A       
ATOM    124  HB2 TRP A  10       2.533  -5.581   2.255  1.00  0.00      A       
ATOM    125  HB1 TRP A  10       2.538  -5.363   0.476  1.00  0.00      A       
ATOM    126  HD1 TRP A  10       3.032  -2.697  -0.383  1.00  0.00      A       
ATOM    127  HE1 TRP A  10       4.351  -0.826   0.666  1.00  0.00      A       
ATOM    128  HE3 TRP A  10       3.392  -4.668   4.297  1.00  0.00      A       
ATOM    129  HH2 TRP A  10       5.821  -1.326   5.484  1.00  0.00      A       
ATOM    130  HZ2 TRP A  10       5.697  -0.360   3.211  1.00  0.00      A       
ATOM    131  HZ3 TRP A  10       4.683  -3.451   6.021  1.00  0.00      A       
ATOM    132  N   TRP A  10       0.355  -3.647   0.422  1.00  0.00      A       
ATOM    133  NE1 TRP A  10       4.188  -1.678   1.148  1.00  0.00      A       
ATOM    134  O   TRP A  10       0.215  -4.898   3.750  1.00  0.00      A       
ATOM    135  C   ARG A  11      -1.579  -2.253   4.468  1.00  0.00      A       
ATOM    136  CA  ARG A  11      -0.093  -2.147   4.265  1.00  0.00      A       
ATOM    137  CB  ARG A  11       0.257  -0.638   4.286  1.00  0.00      A       
ATOM    138  CD  ARG A  11       1.942   1.181   3.672  1.00  0.00      A       
ATOM    139  CG  ARG A  11       1.696  -0.325   3.841  1.00  0.00      A       
ATOM    140  CZ  ARG A  11       3.619   2.607   2.450  1.00  0.00      A       
ATOM    141  HN  ARG A  11       0.337  -2.126   2.232  1.00  0.00      A       
ATOM    142  HA  ARG A  11       0.431  -2.675   5.049  1.00  0.00      A       
ATOM    143  HB2 ARG A  11      -0.424  -0.093   3.592  1.00  0.00      A       
ATOM    144  HB1 ARG A  11       0.089  -0.233   5.308  1.00  0.00      A       
ATOM    145  HD2 ARG A  11       1.111   1.634   3.090  1.00  0.00      A       
ATOM    146  HD1 ARG A  11       2.030   1.684   4.658  1.00  0.00      A       
ATOM    147  HE  ARG A  11       3.748   0.573   2.648  1.00  0.00      A       
ATOM    148  HG2 ARG A  11       2.418  -0.755   4.568  1.00  0.00      A       
ATOM    149  HG1 ARG A  11       1.874  -0.816   2.857  1.00  0.00      A       
ATOM    150 HH11 ARG A  11       2.096   3.674   3.326  1.00  0.00      A       
ATOM    151 HH12 ARG A  11       3.229   4.627   2.429  1.00  0.00      A       
ATOM    152 HH21 ARG A  11       5.242   1.871   1.427  1.00  0.00      A       
ATOM    153 HH22 ARG A  11       5.058   3.591   1.351  1.00  0.00      A       
ATOM    154  N   ARG A  11       0.232  -2.767   3.003  1.00  0.00      A       
ATOM    155  NE  ARG A  11       3.212   1.380   2.899  1.00  0.00      A       
ATOM    156  NH1 ARG A  11       2.916   3.736   2.757  1.00  0.00      A       
ATOM    157  NH2 ARG A  11       4.745   2.700   1.683  1.00  0.00      A       
ATOM    158  O   ARG A  11      -2.075  -2.302   5.590  1.00  0.00      A       
ATOM    159  C   CYS A  12      -4.071  -3.906   3.495  1.00  0.00      A       
ATOM    160  CA  CYS A  12      -3.747  -2.410   3.305  1.00  0.00      A       
ATOM    161  CB  CYS A  12      -4.348  -1.871   1.974  1.00  0.00      A       
ATOM    162  HN  CYS A  12      -1.848  -2.268   2.455  1.00  0.00      A       
ATOM    163  HA  CYS A  12      -4.165  -1.863   4.139  1.00  0.00      A       
ATOM    164  HB2 CYS A  12      -4.083  -0.793   1.899  1.00  0.00      A       
ATOM    165  HB1 CYS A  12      -3.862  -2.393   1.124  1.00  0.00      A       
ATOM    166  N   CYS A  12      -2.314  -2.271   3.337  1.00  0.00      A       
ATOM    167  O   CYS A  12      -4.820  -4.275   4.405  1.00  0.00      A       
ATOM    168  SG  CYS A  12      -6.156  -2.059   1.815  1.00  0.00      A       
ATOM    169  HN1 NH2 A  13      -3.650  -5.755   2.732  1.00  0.00      A       
ATOM    170  HN2 NH2 A  13      -2.881  -4.440   1.886  1.00  0.00      A       
ATOM    171  N   NH2 A  13      -3.500  -4.776   2.615  1.00  0.00      A       
END


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