NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
373011 1dn3 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLN A   1       7.518  -4.966   4.221  1.00  0.00      A       
ATOM      2  CA  GLN A   1       8.779  -5.340   3.421  1.00  0.00      A       
ATOM      3  CB  GLN A   1       8.488  -6.484   2.441  1.00  0.00      A       
ATOM      4  CD  GLN A   1       7.195  -7.012   0.367  1.00  0.00      A       
ATOM      5  CG  GLN A   1       7.936  -5.913   1.132  1.00  0.00      A       
ATOM      6  HT1 GLN A   1      10.619  -6.265   3.775  1.00  0.00      A       
ATOM      7  HT2 GLN A   1       9.428  -6.628   4.931  1.00  0.00      A       
ATOM      8  HT3 GLN A   1      10.191  -5.111   4.941  1.00  0.00      A       
ATOM      9  HA  GLN A   1       9.150  -4.481   2.884  1.00  0.00      A       
ATOM     10  HB2 GLN A   1       9.400  -7.026   2.240  1.00  0.00      A       
ATOM     11  HB1 GLN A   1       7.759  -7.153   2.875  1.00  0.00      A       
ATOM     12 HE21 GLN A   1       8.345  -6.870  -1.247  1.00  0.00      A       
ATOM     13 HE22 GLN A   1       7.113  -8.035  -1.333  1.00  0.00      A       
ATOM     14  HG2 GLN A   1       7.254  -5.104   1.351  1.00  0.00      A       
ATOM     15  HG1 GLN A   1       8.751  -5.543   0.528  1.00  0.00      A       
ATOM     16  N   GLN A   1       9.834  -5.877   4.336  1.00  0.00      A       
ATOM     17  NE2 GLN A   1       7.583  -7.332  -0.838  1.00  0.00      A       
ATOM     18  O   GLN A   1       6.416  -5.361   3.885  1.00  0.00      A       
ATOM     19  OE1 GLN A   1       6.251  -7.587   0.871  1.00  0.00      A       
ATOM     20  C   ALA A   2       5.613  -2.776   5.390  1.00  0.00      A       
ATOM     21  CA  ALA A   2       6.494  -3.806   6.109  1.00  0.00      A       
ATOM     22  CB  ALA A   2       7.065  -3.192   7.380  1.00  0.00      A       
ATOM     23  HN  ALA A   2       8.572  -3.903   5.532  1.00  0.00      A       
ATOM     24  HA  ALA A   2       5.909  -4.676   6.362  1.00  0.00      A       
ATOM     25  HB1 ALA A   2       6.386  -3.378   8.199  1.00  0.00      A       
ATOM     26  HB2 ALA A   2       7.178  -2.127   7.242  1.00  0.00      A       
ATOM     27  HB3 ALA A   2       8.023  -3.635   7.596  1.00  0.00      A       
ATOM     28  N   ALA A   2       7.675  -4.207   5.280  1.00  0.00      A       
ATOM     29  O   ALA A   2       4.412  -2.940   5.360  1.00  0.00      A       
ATOM     30  C   PRO A   3       4.608  -1.280   2.976  1.00  0.00      A       
ATOM     31  CA  PRO A   3       5.426  -0.692   4.130  1.00  0.00      A       
ATOM     32  CB  PRO A   3       6.473   0.313   3.660  1.00  0.00      A       
ATOM     33  CD  PRO A   3       7.655  -1.437   4.766  1.00  0.00      A       
ATOM     34  CG  PRO A   3       7.737  -0.469   3.616  1.00  0.00      A       
ATOM     35  HA  PRO A   3       4.765  -0.215   4.832  1.00  0.00      A       
ATOM     36  HB2 PRO A   3       6.221   0.687   2.677  1.00  0.00      A       
ATOM     37  HB1 PRO A   3       6.563   1.125   4.364  1.00  0.00      A       
ATOM     38  HD2 PRO A   3       8.230  -2.321   4.550  1.00  0.00      A       
ATOM     39  HD1 PRO A   3       7.984  -0.975   5.683  1.00  0.00      A       
ATOM     40  HG2 PRO A   3       7.811  -1.001   2.679  1.00  0.00      A       
ATOM     41  HG1 PRO A   3       8.583   0.183   3.748  1.00  0.00      A       
ATOM     42  N   PRO A   3       6.219  -1.738   4.831  1.00  0.00      A       
ATOM     43  O   PRO A   3       3.737  -0.626   2.441  1.00  0.00      A       
ATOM     44  C   ALA A   4       2.539  -3.140   2.037  1.00  0.00      A       
ATOM     45  CA  ALA A   4       3.998  -3.138   1.556  1.00  0.00      A       
ATOM     46  CB  ALA A   4       4.519  -4.566   1.398  1.00  0.00      A       
ATOM     47  HN  ALA A   4       5.505  -3.055   3.086  1.00  0.00      A       
ATOM     48  HA  ALA A   4       4.098  -2.592   0.633  1.00  0.00      A       
ATOM     49  HB1 ALA A   4       5.495  -4.544   0.940  1.00  0.00      A       
ATOM     50  HB2 ALA A   4       3.840  -5.129   0.774  1.00  0.00      A       
ATOM     51  HB3 ALA A   4       4.586  -5.034   2.369  1.00  0.00      A       
ATOM     52  N   ALA A   4       4.830  -2.522   2.623  1.00  0.00      A       
ATOM     53  O   ALA A   4       1.614  -3.054   1.252  1.00  0.00      A       
ATOM     54  C   TYR A   5       0.318  -1.828   3.680  1.00  0.00      A       
ATOM     55  CA  TYR A   5       0.962  -3.201   3.911  1.00  0.00      A       
ATOM     56  CB  TYR A   5       1.137  -3.513   5.418  1.00  0.00      A       
ATOM     57  CD1 TYR A   5      -0.209  -1.652   6.492  1.00  0.00      A       
ATOM     58  CD2 TYR A   5       2.189  -1.702   6.841  1.00  0.00      A       
ATOM     59  CE1 TYR A   5      -0.296  -0.497   7.278  1.00  0.00      A       
ATOM     60  CE2 TYR A   5       2.101  -0.548   7.625  1.00  0.00      A       
ATOM     61  CG  TYR A   5       1.036  -2.257   6.271  1.00  0.00      A       
ATOM     62  CZ  TYR A   5       0.859   0.056   7.844  1.00  0.00      A       
ATOM     63  HN  TYR A   5       3.112  -3.269   3.946  1.00  0.00      A       
ATOM     64  HA  TYR A   5       0.369  -3.966   3.450  1.00  0.00      A       
ATOM     65  HB2 TYR A   5       0.372  -4.207   5.726  1.00  0.00      A       
ATOM     66  HB1 TYR A   5       2.106  -3.967   5.573  1.00  0.00      A       
ATOM     67  HD1 TYR A   5      -1.100  -2.076   6.054  1.00  0.00      A       
ATOM     68  HD2 TYR A   5       3.146  -2.166   6.678  1.00  0.00      A       
ATOM     69  HE1 TYR A   5      -1.254  -0.032   7.445  1.00  0.00      A       
ATOM     70  HE2 TYR A   5       2.995  -0.123   8.059  1.00  0.00      A       
ATOM     71  HH  TYR A   5       0.352   0.957   9.452  1.00  0.00      A       
ATOM     72  N   TYR A   5       2.342  -3.216   3.341  1.00  0.00      A       
ATOM     73  O   TYR A   5      -0.855  -1.727   3.370  1.00  0.00      A       
ATOM     74  OH  TYR A   5       0.771   1.195   8.620  1.00  0.00      A       
ATOM     75  C   LYS A   6       0.535   0.962   2.130  1.00  0.00      A       
ATOM     76  CA  LYS A   6       0.518   0.596   3.621  1.00  0.00      A       
ATOM     77  CB  LYS A   6       1.403   1.554   4.441  1.00  0.00      A       
ATOM     78  CD  LYS A   6       3.724   2.478   4.724  1.00  0.00      A       
ATOM     79  CE  LYS A   6       3.815   2.172   6.224  1.00  0.00      A       
ATOM     80  CG  LYS A   6       2.873   1.414   4.027  1.00  0.00      A       
ATOM     81  HN  LYS A   6       2.026  -0.888   4.076  1.00  0.00      A       
ATOM     82  HA  LYS A   6      -0.493   0.628   3.993  1.00  0.00      A       
ATOM     83  HB2 LYS A   6       1.079   2.570   4.272  1.00  0.00      A       
ATOM     84  HB1 LYS A   6       1.304   1.319   5.491  1.00  0.00      A       
ATOM     85  HD2 LYS A   6       4.717   2.474   4.297  1.00  0.00      A       
ATOM     86  HD1 LYS A   6       3.275   3.447   4.582  1.00  0.00      A       
ATOM     87  HE2 LYS A   6       2.868   2.377   6.706  1.00  0.00      A       
ATOM     88  HE1 LYS A   6       4.103   1.144   6.381  1.00  0.00      A       
ATOM     89  HG2 LYS A   6       3.229   0.436   4.306  1.00  0.00      A       
ATOM     90  HG1 LYS A   6       2.957   1.535   2.958  1.00  0.00      A       
ATOM     91  HZ1 LYS A   6       4.797   3.154   7.780  1.00  0.00      A       
ATOM     92  HZ2 LYS A   6       4.760   4.032   6.326  1.00  0.00      A       
ATOM     93  HZ3 LYS A   6       5.812   2.709   6.496  1.00  0.00      A       
ATOM     94  N   LYS A   6       1.082  -0.774   3.829  1.00  0.00      A       
ATOM     95  NZ  LYS A   6       4.876   3.086   6.745  1.00  0.00      A       
ATOM     96  O   LYS A   6      -0.280   1.739   1.671  1.00  0.00      A       
ATOM     97  C   LYS A   7       0.255   0.119  -0.781  1.00  0.00      A       
ATOM     98  CA  LYS A   7       1.494   0.702  -0.094  1.00  0.00      A       
ATOM     99  CB  LYS A   7       2.767   0.021  -0.608  1.00  0.00      A       
ATOM    100  CD  LYS A   7       3.896   1.117  -2.551  1.00  0.00      A       
ATOM    101  CE  LYS A   7       4.815  -0.015  -3.023  1.00  0.00      A       
ATOM    102  CG  LYS A   7       3.787   1.084  -1.025  1.00  0.00      A       
ATOM    103  HN  LYS A   7       2.084  -0.235   1.758  1.00  0.00      A       
ATOM    104  HA  LYS A   7       1.550   1.767  -0.256  1.00  0.00      A       
ATOM    105  HB2 LYS A   7       3.188  -0.595   0.174  1.00  0.00      A       
ATOM    106  HB1 LYS A   7       2.525  -0.597  -1.459  1.00  0.00      A       
ATOM    107  HD2 LYS A   7       2.914   0.990  -2.984  1.00  0.00      A       
ATOM    108  HD1 LYS A   7       4.307   2.065  -2.861  1.00  0.00      A       
ATOM    109  HE2 LYS A   7       5.632  -0.148  -2.327  1.00  0.00      A       
ATOM    110  HE1 LYS A   7       4.257  -0.933  -3.129  1.00  0.00      A       
ATOM    111  HG2 LYS A   7       3.467   2.051  -0.665  1.00  0.00      A       
ATOM    112  HG1 LYS A   7       4.750   0.844  -0.601  1.00  0.00      A       
ATOM    113  HZ1 LYS A   7       5.953  -0.307  -4.743  1.00  0.00      A       
ATOM    114  HZ2 LYS A   7       5.865   1.313  -4.241  1.00  0.00      A       
ATOM    115  HZ3 LYS A   7       4.532   0.581  -5.000  1.00  0.00      A       
ATOM    116  N   LYS A   7       1.443   0.397   1.369  1.00  0.00      A       
ATOM    117  NZ  LYS A   7       5.329   0.427  -4.352  1.00  0.00      A       
ATOM    118  O   LYS A   7      -0.407   0.785  -1.555  1.00  0.00      A       
ATOM    119  C   ALA A   8      -2.541  -0.980  -0.715  1.00  0.00      A       
ATOM    120  CA  ALA A   8      -1.275  -1.758  -1.102  1.00  0.00      A       
ATOM    121  CB  ALA A   8      -1.317  -3.174  -0.518  1.00  0.00      A       
ATOM    122  HN  ALA A   8       0.481  -1.626   0.149  1.00  0.00      A       
ATOM    123  HA  ALA A   8      -1.173  -1.804  -2.175  1.00  0.00      A       
ATOM    124  HB1 ALA A   8      -0.604  -3.798  -1.034  1.00  0.00      A       
ATOM    125  HB2 ALA A   8      -2.309  -3.583  -0.639  1.00  0.00      A       
ATOM    126  HB3 ALA A   8      -1.069  -3.137   0.534  1.00  0.00      A       
ATOM    127  N   ALA A   8      -0.069  -1.119  -0.487  1.00  0.00      A       
ATOM    128  O   ALA A   8      -3.375  -0.683  -1.551  1.00  0.00      A       
ATOM    129  C   ALA A   9      -3.968   1.463   0.260  1.00  0.00      A       
ATOM    130  CA  ALA A   9      -3.884   0.123   1.001  1.00  0.00      A       
ATOM    131  CB  ALA A   9      -3.675   0.351   2.499  1.00  0.00      A       
ATOM    132  HN  ALA A   9      -1.989  -0.893   1.196  1.00  0.00      A       
ATOM    133  HA  ALA A   9      -4.780  -0.453   0.838  1.00  0.00      A       
ATOM    134  HB1 ALA A   9      -3.685  -0.598   3.014  1.00  0.00      A       
ATOM    135  HB2 ALA A   9      -4.468   0.977   2.882  1.00  0.00      A       
ATOM    136  HB3 ALA A   9      -2.724   0.838   2.661  1.00  0.00      A       
ATOM    137  N   ALA A   9      -2.681  -0.644   0.547  1.00  0.00      A       
ATOM    138  O   ALA A   9      -5.031   1.886  -0.150  1.00  0.00      A       
ATOM    139  C   LYS A  10      -3.318   3.247  -2.083  1.00  0.00      A       
ATOM    140  CA  LYS A  10      -2.854   3.439  -0.636  1.00  0.00      A       
ATOM    141  CB  LYS A  10      -1.404   3.928  -0.596  1.00  0.00      A       
ATOM    142  CD  LYS A  10       0.273   5.175   0.769  1.00  0.00      A       
ATOM    143  CE  LYS A  10       0.447   6.259   1.838  1.00  0.00      A       
ATOM    144  CG  LYS A  10      -1.214   4.856   0.603  1.00  0.00      A       
ATOM    145  HN  LYS A  10      -2.006   1.761   0.424  1.00  0.00      A       
ATOM    146  HA  LYS A  10      -3.494   4.143  -0.128  1.00  0.00      A       
ATOM    147  HB2 LYS A  10      -0.740   3.080  -0.506  1.00  0.00      A       
ATOM    148  HB1 LYS A  10      -1.180   4.466  -1.505  1.00  0.00      A       
ATOM    149  HD2 LYS A  10       0.800   4.281   1.072  1.00  0.00      A       
ATOM    150  HD1 LYS A  10       0.674   5.529  -0.169  1.00  0.00      A       
ATOM    151  HE2 LYS A  10      -0.345   6.189   2.571  1.00  0.00      A       
ATOM    152  HE1 LYS A  10       1.410   6.164   2.314  1.00  0.00      A       
ATOM    153  HG2 LYS A  10      -1.765   5.771   0.440  1.00  0.00      A       
ATOM    154  HG1 LYS A  10      -1.578   4.370   1.496  1.00  0.00      A       
ATOM    155  HZ1 LYS A  10       1.122   7.597   0.388  1.00  0.00      A       
ATOM    156  HZ2 LYS A  10       0.475   8.342   1.771  1.00  0.00      A       
ATOM    157  HZ3 LYS A  10      -0.558   7.628   0.625  1.00  0.00      A       
ATOM    158  N   LYS A  10      -2.850   2.127   0.084  1.00  0.00      A       
ATOM    159  NZ  LYS A  10       0.365   7.553   1.100  1.00  0.00      A       
ATOM    160  O   LYS A  10      -4.156   3.978  -2.571  1.00  0.00      A       
ATOM    161  C   LYS A  11      -4.718   1.788  -4.253  1.00  0.00      A       
ATOM    162  CA  LYS A  11      -3.203   2.015  -4.185  1.00  0.00      A       
ATOM    163  CB  LYS A  11      -2.445   0.758  -4.621  1.00  0.00      A       
ATOM    164  CD  LYS A  11      -1.166   1.816  -6.499  1.00  0.00      A       
ATOM    165  CE  LYS A  11       0.158   1.665  -7.258  1.00  0.00      A       
ATOM    166  CG  LYS A  11      -1.051   1.149  -5.124  1.00  0.00      A       
ATOM    167  HN  LYS A  11      -2.114   1.682  -2.347  1.00  0.00      A       
ATOM    168  HA  LYS A  11      -2.922   2.850  -4.808  1.00  0.00      A       
ATOM    169  HB2 LYS A  11      -2.350   0.085  -3.781  1.00  0.00      A       
ATOM    170  HB1 LYS A  11      -2.987   0.267  -5.415  1.00  0.00      A       
ATOM    171  HD2 LYS A  11      -1.961   1.346  -7.061  1.00  0.00      A       
ATOM    172  HD1 LYS A  11      -1.388   2.865  -6.371  1.00  0.00      A       
ATOM    173  HE2 LYS A  11       0.983   1.990  -6.639  1.00  0.00      A       
ATOM    174  HE1 LYS A  11       0.299   0.640  -7.566  1.00  0.00      A       
ATOM    175  HG2 LYS A  11      -0.598   1.838  -4.425  1.00  0.00      A       
ATOM    176  HG1 LYS A  11      -0.438   0.264  -5.205  1.00  0.00      A       
ATOM    177  HZ1 LYS A  11       0.922   2.550  -8.983  1.00  0.00      A       
ATOM    178  HZ2 LYS A  11      -0.203   3.515  -8.152  1.00  0.00      A       
ATOM    179  HZ3 LYS A  11      -0.732   2.186  -9.070  1.00  0.00      A       
ATOM    180  N   LYS A  11      -2.785   2.262  -2.768  1.00  0.00      A       
ATOM    181  NZ  LYS A  11       0.026   2.545  -8.456  1.00  0.00      A       
ATOM    182  O   LYS A  11      -5.376   2.230  -5.176  1.00  0.00      A       
ATOM    183  C   LEU A  12      -7.484   2.235  -3.151  1.00  0.00      A       
ATOM    184  CA  LEU A  12      -6.757   0.891  -3.264  1.00  0.00      A       
ATOM    185  CB  LEU A  12      -7.030   0.030  -2.030  1.00  0.00      A       
ATOM    186  CD1 LEU A  12      -6.374  -2.103  -0.916  1.00  0.00      A       
ATOM    187  CD2 LEU A  12      -7.415  -2.148  -3.188  1.00  0.00      A       
ATOM    188  CG  LEU A  12      -6.477  -1.377  -2.256  1.00  0.00      A       
ATOM    189  HN  LEU A  12      -4.728   0.791  -2.527  1.00  0.00      A       
ATOM    190  HA  LEU A  12      -7.061   0.369  -4.157  1.00  0.00      A       
ATOM    191  HB2 LEU A  12      -6.550   0.473  -1.169  1.00  0.00      A       
ATOM    192  HB1 LEU A  12      -8.094  -0.027  -1.858  1.00  0.00      A       
ATOM    193 HD11 LEU A  12      -5.833  -1.486  -0.214  1.00  0.00      A       
ATOM    194 HD12 LEU A  12      -5.849  -3.037  -1.052  1.00  0.00      A       
ATOM    195 HD13 LEU A  12      -7.365  -2.298  -0.535  1.00  0.00      A       
ATOM    196 HD21 LEU A  12      -7.132  -3.189  -3.201  1.00  0.00      A       
ATOM    197 HD22 LEU A  12      -7.342  -1.742  -4.187  1.00  0.00      A       
ATOM    198 HD23 LEU A  12      -8.431  -2.054  -2.834  1.00  0.00      A       
ATOM    199  HG  LEU A  12      -5.496  -1.309  -2.705  1.00  0.00      A       
ATOM    200  N   LEU A  12      -5.278   1.123  -3.269  1.00  0.00      A       
ATOM    201  O   LEU A  12      -8.512   2.448  -3.765  1.00  0.00      A       
ATOM    202  C   ALA A  13      -7.275   5.345  -3.480  1.00  0.00      A       
ATOM    203  CA  ALA A  13      -7.574   4.490  -2.237  1.00  0.00      A       
ATOM    204  CB  ALA A  13      -6.933   5.105  -0.990  1.00  0.00      A       
ATOM    205  HN  ALA A  13      -6.101   2.949  -1.910  1.00  0.00      A       
ATOM    206  HA  ALA A  13      -8.638   4.388  -2.095  1.00  0.00      A       
ATOM    207  HB1 ALA A  13      -5.871   4.906  -0.995  1.00  0.00      A       
ATOM    208  HB2 ALA A  13      -7.376   4.672  -0.106  1.00  0.00      A       
ATOM    209  HB3 ALA A  13      -7.098   6.173  -0.990  1.00  0.00      A       
ATOM    210  N   ALA A  13      -6.939   3.146  -2.382  1.00  0.00      A       
ATOM    211  O   ALA A  13      -8.027   6.238  -3.821  1.00  0.00      A       
ATOM    212  C   GLU A  14      -6.320   5.106  -6.648  1.00  0.00      A       
ATOM    213  CA  GLU A  14      -5.831   5.845  -5.389  1.00  0.00      A       
ATOM    214  CB  GLU A  14      -4.297   5.928  -5.392  1.00  0.00      A       
ATOM    215  CD  GLU A  14      -3.903   8.061  -4.133  1.00  0.00      A       
ATOM    216  CG  GLU A  14      -3.793   6.536  -4.078  1.00  0.00      A       
ATOM    217  HN  GLU A  14      -5.600   4.337  -3.866  1.00  0.00      A       
ATOM    218  HA  GLU A  14      -6.254   6.836  -5.344  1.00  0.00      A       
ATOM    219  HB2 GLU A  14      -3.887   4.936  -5.507  1.00  0.00      A       
ATOM    220  HB1 GLU A  14      -3.975   6.546  -6.218  1.00  0.00      A       
ATOM    221  HG2 GLU A  14      -4.385   6.162  -3.257  1.00  0.00      A       
ATOM    222  HG1 GLU A  14      -2.761   6.258  -3.930  1.00  0.00      A       
ATOM    223  N   GLU A  14      -6.185   5.066  -4.160  1.00  0.00      A       
ATOM    224  O   GLU A  14      -5.784   5.285  -7.726  1.00  0.00      A       
ATOM    225  OE1 GLU A  14      -3.016   8.679  -4.698  1.00  0.00      A       
ATOM    226  OE2 GLU A  14      -4.870   8.584  -3.605  1.00  0.00      A       
ATOM    227  C   SER A  15      -8.505   4.482  -8.708  1.00  0.00      A       
ATOM    228  CA  SER A  15      -7.852   3.521  -7.702  1.00  0.00      A       
ATOM    229  CB  SER A  15      -8.894   2.553  -7.135  1.00  0.00      A       
ATOM    230  HN  SER A  15      -7.743   4.145  -5.639  1.00  0.00      A       
ATOM    231  HA  SER A  15      -7.055   2.966  -8.172  1.00  0.00      A       
ATOM    232  HB2 SER A  15      -8.473   2.015  -6.302  1.00  0.00      A       
ATOM    233  HB1 SER A  15      -9.758   3.112  -6.800  1.00  0.00      A       
ATOM    234  HG  SER A  15      -9.746   2.107  -8.831  1.00  0.00      A       
ATOM    235  N   SER A  15      -7.330   4.275  -6.517  1.00  0.00      A       
ATOM    236  OT1 SER A  15      -9.220   5.372  -8.273  1.00  0.00      A       
ATOM    237  OT2 SER A  15      -8.281   4.307  -9.896  1.00  0.00      A       
ATOM    238  OG  SER A  15      -9.277   1.625  -8.145  1.00  0.00      A       
END


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