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
381916 1j9v 5109 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ACE A   1      -6.270   4.161  -1.893  1.00  0.00      A       
ATOM      2  CH3 ACE A   1      -7.654   4.663  -1.490  1.00  0.00      A       
ATOM      3  H1  ACE A   1      -7.864   4.506  -0.415  1.00  0.00      A       
ATOM      4  H2  ACE A   1      -7.754   5.745  -1.688  1.00  0.00      A       
ATOM      5  H3  ACE A   1      -8.440   4.148  -2.070  1.00  0.00      A       
ATOM      6  O   ACE A   1      -5.592   4.795  -2.705  1.00  0.00      A       
ATOM      7  C   ILE A   2      -4.760   1.415  -2.820  1.00  0.00      A       
ATOM      8  CA  ILE A   2      -4.554   2.377  -1.610  1.00  0.00      A       
ATOM      9  CB  ILE A   2      -3.947   1.622  -0.369  1.00  0.00      A       
ATOM     10  CD1 ILE A   2      -3.308   3.699   1.137  1.00  0.00      A       
ATOM     11  CG1 ILE A   2      -4.032   2.348   1.008  1.00  0.00      A       
ATOM     12  CG2 ILE A   2      -2.489   1.154  -0.632  1.00  0.00      A       
ATOM     13  HN  ILE A   2      -6.564   2.581  -0.700  1.00  0.00      A       
ATOM     14  HA  ILE A   2      -3.828   3.174  -1.878  1.00  0.00      A       
ATOM     15  HB  ILE A   2      -4.545   0.698  -0.235  1.00  0.00      A       
ATOM     16 HD11 ILE A   2      -3.497   4.157   2.126  1.00  0.00      A       
ATOM     17 HD12 ILE A   2      -2.214   3.586   1.041  1.00  0.00      A       
ATOM     18 HD13 ILE A   2      -3.642   4.422   0.371  1.00  0.00      A       
ATOM     19 HG12 ILE A   2      -5.097   2.501   1.266  1.00  0.00      A       
ATOM     20 HG11 ILE A   2      -3.664   1.671   1.803  1.00  0.00      A       
ATOM     21 HG21 ILE A   2      -2.392   0.587  -1.577  1.00  0.00      A       
ATOM     22 HG22 ILE A   2      -1.780   1.999  -0.700  1.00  0.00      A       
ATOM     23 HG23 ILE A   2      -2.125   0.480   0.163  1.00  0.00      A       
ATOM     24  N   ILE A   2      -5.876   3.012  -1.326  1.00  0.00      A       
ATOM     25  O   ILE A   2      -5.569   0.484  -2.746  1.00  0.00      A       
ATOM     26  C   TRP A   3      -2.691   0.554  -5.651  1.00  0.00      A       
ATOM     27  CA  TRP A   3      -4.136   0.796  -5.145  1.00  0.00      A       
ATOM     28  CB  TRP A   3      -5.067   1.427  -6.219  1.00  0.00      A       
ATOM     29  CD1 TRP A   3      -7.226   2.693  -5.428  1.00  0.00      A       
ATOM     30  CD2 TRP A   3      -7.465   0.491  -5.646  1.00  0.00      A       
ATOM     31  CE2 TRP A   3      -8.676   1.057  -5.175  1.00  0.00      A       
ATOM     32  CE3 TRP A   3      -7.351  -0.913  -5.823  1.00  0.00      A       
ATOM     33  CG  TRP A   3      -6.548   1.515  -5.812  1.00  0.00      A       
ATOM     34  CH2 TRP A   3      -9.655  -1.153  -5.068  1.00  0.00      A       
ATOM     35  CZ2 TRP A   3      -9.785   0.226  -4.889  1.00  0.00      A       
ATOM     36  CZ3 TRP A   3      -8.457  -1.713  -5.529  1.00  0.00      A       
ATOM     37  HN  TRP A   3      -3.409   2.459  -3.876  1.00  0.00      A       
ATOM     38  HA  TRP A   3      -4.577  -0.190  -4.888  1.00  0.00      A       
ATOM     39  HB2 TRP A   3      -4.694   2.429  -6.504  1.00  0.00      A       
ATOM     40  HB1 TRP A   3      -5.006   0.832  -7.151  1.00  0.00      A       
ATOM     41  HD1 TRP A   3      -6.775   3.675  -5.399  1.00  0.00      A       
ATOM     42  HE1 TRP A   3      -9.254   3.095  -4.693  1.00  0.00      A       
ATOM     43  HE3 TRP A   3      -6.429  -1.359  -6.167  1.00  0.00      A       
ATOM     44  HH2 TRP A   3     -10.490  -1.799  -4.841  1.00  0.00      A       
ATOM     45  HZ2 TRP A   3     -10.710   0.644  -4.520  1.00  0.00      A       
ATOM     46  HZ3 TRP A   3      -8.387  -2.783  -5.653  1.00  0.00      A       
ATOM     47  N   TRP A   3      -4.033   1.645  -3.926  1.00  0.00      A       
ATOM     48  NE1 TRP A   3      -8.551   2.430  -5.034  1.00  0.00      A       
ATOM     49  O   TRP A   3      -2.077   1.432  -6.267  1.00  0.00      A       
ATOM     50  C   GLY A   4       0.188  -0.756  -4.585  1.00  0.00      A       
ATOM     51  CA  GLY A   4      -0.774  -1.022  -5.754  1.00  0.00      A       
ATOM     52  HN  GLY A   4      -2.752  -1.269  -4.812  1.00  0.00      A       
ATOM     53  HA2 GLY A   4      -0.754  -2.101  -5.997  1.00  0.00      A       
ATOM     54  HA1 GLY A   4      -0.447  -0.513  -6.683  1.00  0.00      A       
ATOM     55  N   GLY A   4      -2.155  -0.648  -5.367  1.00  0.00      A       
ATOM     56  O   GLY A   4       0.387  -1.633  -3.739  1.00  0.00      A       
ATOM     57  C   Dab A   5       1.646   2.409  -3.315  1.00  0.00      A       
ATOM     58  CA  Dab A   5       1.707   0.867  -3.472  1.00  0.00      A       
ATOM     59  CB  Dab A   5       3.162   0.364  -3.713  1.00  0.00      A       
ATOM     60  CG  Dab A   5       4.041   0.242  -2.436  1.00  0.00      A       
ATOM     61  H   Dab A   5       0.501   1.090  -5.311  1.00  0.00      A       
ATOM     62  HA  Dab A   5       1.334   0.403  -2.537  1.00  0.00      A       
ATOM     63  HB2 Dab A   5       3.140  -0.631  -4.201  1.00  0.00      A       
ATOM     64  HB3 Dab A   5       3.675   1.009  -4.451  1.00  0.00      A       
ATOM     65  HD2 Dab A   5       2.993  -0.355  -0.594  1.00  0.00      A       
ATOM     66  HG2 Dab A   5       5.068  -0.057  -2.713  1.00  0.00      A       
ATOM     67  HG3 Dab A   5       4.145   1.240  -1.969  1.00  0.00      A       
ATOM     68  N   Dab A   5       0.778   0.454  -4.555  1.00  0.00      A       
ATOM     69  ND  Dab A   5       3.506  -0.693  -1.416  1.00  0.00      A       
ATOM     70  O   Dab A   5       1.923   3.153  -4.263  1.00  0.00      A       
ATOM     71  C   SER A   6       2.372   4.694  -0.836  1.00  0.00      A       
ATOM     72  CA  SER A   6       1.197   4.321  -1.786  1.00  0.00      A       
ATOM     73  CB  SER A   6      -0.198   4.638  -1.197  1.00  0.00      A       
ATOM     74  HN  SER A   6       1.208   2.144  -1.382  1.00  0.00      A       
ATOM     75  HA  SER A   6       1.268   4.938  -2.705  1.00  0.00      A       
ATOM     76  HB2 SER A   6      -0.383   4.052  -0.279  1.00  0.00      A       
ATOM     77  HB1 SER A   6      -0.251   5.699  -0.890  1.00  0.00      A       
ATOM     78  HG  SER A   6      -1.053   4.928  -2.905  1.00  0.00      A       
ATOM     79  N   SER A   6       1.294   2.870  -2.103  1.00  0.00      A       
ATOM     80  O   SER A   6       2.221   4.703   0.390  1.00  0.00      A       
ATOM     81  OG  SER A   6      -1.239   4.380  -2.137  1.00  0.00      A       
ATOM     82  C   GLY A   7       5.792   4.206  -0.645  1.00  0.00      A       
ATOM     83  CA  GLY A   7       4.761   5.346  -0.647  1.00  0.00      A       
ATOM     84  HN  GLY A   7       3.596   4.827  -2.431  1.00  0.00      A       
ATOM     85  HA2 GLY A   7       5.221   6.235  -1.119  1.00  0.00      A       
ATOM     86  HA1 GLY A   7       4.525   5.675   0.385  1.00  0.00      A       
ATOM     87  N   GLY A   7       3.552   4.986  -1.419  1.00  0.00      A       
ATOM     88  O   GLY A   7       6.654   4.155  -1.527  1.00  0.00      A       
ATOM     89  C   LYS A   8       6.020   0.991   1.328  1.00  0.00      A       
ATOM     90  CA  LYS A   8       6.635   2.154   0.490  1.00  0.00      A       
ATOM     91  CB  LYS A   8       8.044   2.612   0.995  1.00  0.00      A       
ATOM     92  CD  LYS A   8       9.583   0.998  -0.350  1.00  0.00      A       
ATOM     93  CE  LYS A   8      10.739  -0.014  -0.259  1.00  0.00      A       
ATOM     94  CG  LYS A   8       9.163   1.543   1.032  1.00  0.00      A       
ATOM     95  HN  LYS A   8       4.844   3.411   0.908  1.00  0.00      A       
ATOM     96  HA  LYS A   8       6.780   1.739  -0.528  1.00  0.00      A       
ATOM     97  HB2 LYS A   8       8.404   3.456   0.377  1.00  0.00      A       
ATOM     98  HB1 LYS A   8       7.941   3.043   2.009  1.00  0.00      A       
ATOM     99  HD2 LYS A   8       8.711   0.522  -0.838  1.00  0.00      A       
ATOM    100  HD1 LYS A   8       9.869   1.846  -1.005  1.00  0.00      A       
ATOM    101  HE2 LYS A   8      11.625   0.453   0.215  1.00  0.00      A       
ATOM    102  HE1 LYS A   8      10.456  -0.863   0.392  1.00  0.00      A       
ATOM    103  HG2 LYS A   8      10.046   1.989   1.528  1.00  0.00      A       
ATOM    104  HG1 LYS A   8       8.857   0.708   1.691  1.00  0.00      A       
ATOM    105  HZ1 LYS A   8      11.876  -1.198  -1.559  1.00  0.00      A       
ATOM    106  HZ2 LYS A   8      10.317  -0.990  -2.057  1.00  0.00      A       
ATOM    107  HZ3 LYS A   8      11.404   0.237  -2.225  1.00  0.00      A       
ATOM    108  N   LYS A   8       5.701   3.310   0.354  1.00  0.00      A       
ATOM    109  NZ  LYS A   8      11.105  -0.520  -1.598  1.00  0.00      A       
ATOM    110  O   LYS A   8       5.775  -0.082   0.768  1.00  0.00      A       
ATOM    111  C   LEU A   9       3.751  -0.316   3.322  1.00  0.00      A       
ATOM    112  CA  LEU A   9       5.232   0.117   3.541  1.00  0.00      A       
ATOM    113  CB  LEU A   9       5.606   0.412   5.028  1.00  0.00      A       
ATOM    114  CD1 LEU A   9       4.865   2.915   5.226  1.00  0.00      A       
ATOM    115  CD2 LEU A   9       3.531   1.120   6.428  1.00  0.00      A       
ATOM    116  CG  LEU A   9       4.916   1.523   5.882  1.00  0.00      A       
ATOM    117  HN  LEU A   9       6.022   2.104   3.013  1.00  0.00      A       
ATOM    118  HA  LEU A   9       5.815  -0.797   3.305  1.00  0.00      A       
ATOM    119  HB2 LEU A   9       5.514  -0.540   5.587  1.00  0.00      A       
ATOM    120  HB1 LEU A   9       6.696   0.607   5.066  1.00  0.00      A       
ATOM    121 HD11 LEU A   9       4.199   2.937   4.343  1.00  0.00      A       
ATOM    122 HD12 LEU A   9       4.495   3.685   5.929  1.00  0.00      A       
ATOM    123 HD13 LEU A   9       5.867   3.244   4.893  1.00  0.00      A       
ATOM    124 HD21 LEU A   9       3.561   0.139   6.936  1.00  0.00      A       
ATOM    125 HD22 LEU A   9       3.162   1.850   7.172  1.00  0.00      A       
ATOM    126 HD23 LEU A   9       2.762   1.055   5.639  1.00  0.00      A       
ATOM    127  HG  LEU A   9       5.554   1.637   6.779  1.00  0.00      A       
ATOM    128  N   LEU A   9       5.791   1.175   2.647  1.00  0.00      A       
ATOM    129  O   LEU A   9       3.447  -1.497   3.514  1.00  0.00      A       
ATOM    130  C   ILE A  10       1.214  -0.168   1.210  1.00  0.00      A       
ATOM    131  CA  ILE A  10       1.405   0.284   2.697  1.00  0.00      A       
ATOM    132  CB  ILE A  10       0.476   1.436   3.227  1.00  0.00      A       
ATOM    133  CD1 ILE A  10      -1.447  -0.074   4.176  1.00  0.00      A       
ATOM    134  CG1 ILE A  10      -1.038   1.079   3.244  1.00  0.00      A       
ATOM    135  CG2 ILE A  10       0.664   2.805   2.529  1.00  0.00      A       
ATOM    136  HN  ILE A  10       3.236   1.538   2.775  1.00  0.00      A       
ATOM    137  HA  ILE A  10       1.152  -0.577   3.349  1.00  0.00      A       
ATOM    138  HB  ILE A  10       0.755   1.608   4.285  1.00  0.00      A       
ATOM    139 HD11 ILE A  10      -1.123   0.106   5.217  1.00  0.00      A       
ATOM    140 HD12 ILE A  10      -2.546  -0.197   4.192  1.00  0.00      A       
ATOM    141 HD13 ILE A  10      -1.023  -1.041   3.853  1.00  0.00      A       
ATOM    142 HG12 ILE A  10      -1.626   1.967   3.548  1.00  0.00      A       
ATOM    143 HG11 ILE A  10      -1.379   0.850   2.220  1.00  0.00      A       
ATOM    144 HG21 ILE A  10       1.716   3.142   2.558  1.00  0.00      A       
ATOM    145 HG22 ILE A  10       0.359   2.776   1.468  1.00  0.00      A       
ATOM    146 HG23 ILE A  10       0.068   3.601   3.013  1.00  0.00      A       
ATOM    147  N   ILE A  10       2.844   0.603   2.929  1.00  0.00      A       
ATOM    148  O   ILE A  10       1.125   0.650   0.290  1.00  0.00      A       
ATOM    149  C   ASP A  11      -0.170  -3.119  -0.275  1.00  0.00      A       
ATOM    150  CA  ASP A  11       1.041  -2.138  -0.326  1.00  0.00      A       
ATOM    151  CB  ASP A  11       2.405  -2.808  -0.720  1.00  0.00      A       
ATOM    152  CG  ASP A  11       3.351  -2.009  -1.646  1.00  0.00      A       
ATOM    153  HN  ASP A  11       1.234  -2.058   1.865  1.00  0.00      A       
ATOM    154  HA  ASP A  11       0.826  -1.384  -1.110  1.00  0.00      A       
ATOM    155  HB2 ASP A  11       2.972  -3.143   0.170  1.00  0.00      A       
ATOM    156  HB1 ASP A  11       2.194  -3.753  -1.257  1.00  0.00      A       
ATOM    157  N   ASP A  11       1.189  -1.499   1.009  1.00  0.00      A       
ATOM    158  O   ASP A  11      -0.004  -4.325  -0.064  1.00  0.00      A       
ATOM    159  OD1 ASP A  11       3.896  -2.586  -2.591  1.00  0.00      A       
ATOM    160  C   THR A  12      -3.657  -2.797  -1.490  1.00  0.00      A       
ATOM    161  CA  THR A  12      -2.653  -3.385  -0.452  1.00  0.00      A       
ATOM    162  CB  THR A  12      -3.246  -3.487   0.991  1.00  0.00      A       
ATOM    163  CG2 THR A  12      -3.712  -2.174   1.655  1.00  0.00      A       
ATOM    164  HN  THR A  12      -1.438  -1.562  -0.424  1.00  0.00      A       
ATOM    165  HA  THR A  12      -2.410  -4.421  -0.767  1.00  0.00      A       
ATOM    166  HB  THR A  12      -2.471  -3.930   1.645  1.00  0.00      A       
ATOM    167  HG1 THR A  12      -5.061  -3.931   0.531  1.00  0.00      A       
ATOM    168 HG21 THR A  12      -2.889  -1.440   1.727  1.00  0.00      A       
ATOM    169 HG22 THR A  12      -4.533  -1.693   1.092  1.00  0.00      A       
ATOM    170 HG23 THR A  12      -4.078  -2.352   2.682  1.00  0.00      A       
ATOM    171  N   THR A  12      -1.395  -2.585  -0.466  1.00  0.00      A       
ATOM    172  O   THR A  12      -3.817  -1.578  -1.594  1.00  0.00      A       
ATOM    173  OG1 THR A  12      -4.351  -4.385   0.990  1.00  0.00      A       
ATOM    174  C   THR A  13      -6.777  -3.107  -2.583  1.00  0.00      A       
ATOM    175  CA  THR A  13      -5.371  -3.234  -3.251  1.00  0.00      A       
ATOM    176  CB  THR A  13      -5.367  -4.161  -4.506  1.00  0.00      A       
ATOM    177  CG2 THR A  13      -4.086  -4.086  -5.354  1.00  0.00      A       
ATOM    178  HN  THR A  13      -4.144  -4.659  -2.077  1.00  0.00      A       
ATOM    179  HA  THR A  13      -5.099  -2.229  -3.637  1.00  0.00      A       
ATOM    180  HB  THR A  13      -6.197  -3.845  -5.168  1.00  0.00      A       
ATOM    181  HG1 THR A  13      -6.427  -5.528  -3.659  1.00  0.00      A       
ATOM    182 HG21 THR A  13      -3.900  -3.061  -5.722  1.00  0.00      A       
ATOM    183 HG22 THR A  13      -3.193  -4.404  -4.784  1.00  0.00      A       
ATOM    184 HG23 THR A  13      -4.156  -4.741  -6.243  1.00  0.00      A       
ATOM    185  N   THR A  13      -4.363  -3.670  -2.234  1.00  0.00      A       
ATOM    186  O   THR A  13      -7.620  -4.006  -2.675  1.00  0.00      A       
ATOM    187  OG1 THR A  13      -5.598  -5.520  -4.146  1.00  0.00      A       
ATOM    188  C   ALA A  14      -8.333  -0.137  -0.991  1.00  0.00      A       
ATOM    189  CA  ALA A  14      -8.267  -1.667  -1.189  1.00  0.00      A       
ATOM    190  CB  ALA A  14      -8.353  -2.409   0.162  1.00  0.00      A       
ATOM    191  HN  ALA A  14      -6.221  -1.303  -1.911  1.00  0.00      A       
ATOM    192  H'' ALA A  14      -9.368   1.463  -1.709  1.00  0.00      A       
ATOM    193  HA  ALA A  14      -9.124  -1.984  -1.816  1.00  0.00      A       
ATOM    194  HB1 ALA A  14      -9.291  -2.171   0.697  1.00  0.00      A       
ATOM    195  HB2 ALA A  14      -8.337  -3.507   0.024  1.00  0.00      A       
ATOM    196  HB3 ALA A  14      -7.515  -2.152   0.838  1.00  0.00      A       
ATOM    197  N   ALA A  14      -7.001  -1.972  -1.894  1.00  0.00      A       
ATOM    198  OT1 ALA A  14      -7.585   0.479  -0.219  1.00  0.00      A       
ATOM    199  OT2 ALA A  14      -9.309   0.436  -1.782  1.00  0.00      A       
END


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