NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
625596 5z5w cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   VAL A   1       3.082   1.159  -1.280  1.00  0.00      A       
ATOM      2  CA  VAL A   1       2.094  -0.002  -1.242  1.00  0.00      A       
ATOM      3  CB  VAL A   1       1.169   0.084  -2.470  1.00  0.00      A       
ATOM      4  CG1 VAL A   1       1.972  -0.056  -3.754  1.00  0.00      A       
ATOM      5  CG2 VAL A   1       0.082  -0.977  -2.394  1.00  0.00      A       
ATOM      6  HT1 VAL A   1       1.807   0.001   0.856  1.00  0.00      A       
ATOM      7  HA  VAL A   1       2.642  -0.931  -1.294  1.00  0.00      A       
ATOM      8  HB  VAL A   1       0.696   1.055  -2.472  1.00  0.00      A       
ATOM      9 HG11 VAL A   1       1.319   0.080  -4.604  1.00  0.00      A       
ATOM     10 HG12 VAL A   1       2.752   0.692  -3.775  1.00  0.00      A       
ATOM     11 HG13 VAL A   1       2.416  -1.040  -3.796  1.00  0.00      A       
ATOM     12 HG21 VAL A   1      -0.871  -0.504  -2.208  1.00  0.00      A       
ATOM     13 HG22 VAL A   1       0.040  -1.517  -3.328  1.00  0.00      A       
ATOM     14 HG23 VAL A   1       0.304  -1.664  -1.590  1.00  0.00      A       
ATOM     15  N   VAL A   1       1.329   0.000   0.000  1.00  0.00      A       
ATOM     16  O   VAL A   1       2.707   2.299  -1.555  1.00  0.00      A       
ATOM     17  C   PHE A   2       6.365   1.656  -2.159  1.00  0.00      A       
ATOM     18  CA  PHE A   2       5.390   1.879  -1.007  1.00  0.00      A       
ATOM     19  CB  PHE A   2       6.146   1.870   0.324  1.00  0.00      A       
ATOM     20  CD1 PHE A   2       4.738   3.553   1.542  1.00  0.00      A       
ATOM     21  CD2 PHE A   2       5.075   1.418   2.548  1.00  0.00      A       
ATOM     22  CE1 PHE A   2       3.961   3.941   2.617  1.00  0.00      A       
ATOM     23  CE2 PHE A   2       4.299   1.800   3.626  1.00  0.00      A       
ATOM     24  CG  PHE A   2       5.303   2.288   1.495  1.00  0.00      A       
ATOM     25  CZ  PHE A   2       3.743   3.064   3.661  1.00  0.00      A       
ATOM     26  HN  PHE A   2       4.585  -0.067  -0.792  1.00  0.00      A       
ATOM     27  HA  PHE A   2       4.915   2.839  -1.134  1.00  0.00      A       
ATOM     28  HB2 PHE A   2       6.508   0.871   0.517  1.00  0.00      A       
ATOM     29  HB1 PHE A   2       6.984   2.546   0.259  1.00  0.00      A       
ATOM     30  HD1 PHE A   2       4.909   4.240   0.725  1.00  0.00      A       
ATOM     31  HD2 PHE A   2       5.511   0.429   2.523  1.00  0.00      A       
ATOM     32  HE1 PHE A   2       3.528   4.930   2.641  1.00  0.00      A       
ATOM     33  HE2 PHE A   2       4.130   1.112   4.441  1.00  0.00      A       
ATOM     34  HZ  PHE A   2       3.136   3.365   4.502  1.00  0.00      A       
ATOM     35  N   PHE A   2       4.347   0.861  -1.004  1.00  0.00      A       
ATOM     36  O   PHE A   2       7.582   1.689  -1.972  1.00  0.00      A       
ATOM     37  C   ARG A   3       6.484   2.338  -5.536  1.00  0.00      A       
ATOM     38  CA  ARG A   3       6.642   1.198  -4.533  1.00  0.00      A       
ATOM     39  CB  ARG A   3       6.265  -0.130  -5.191  1.00  0.00      A       
ATOM     40  CD  ARG A   3       7.888  -1.577  -3.930  1.00  0.00      A       
ATOM     41  CG  ARG A   3       6.427  -1.332  -4.274  1.00  0.00      A       
ATOM     42  CZ  ARG A   3       8.516  -3.533  -5.281  1.00  0.00      A       
ATOM     43  HN  ARG A   3       4.846   1.415  -3.436  1.00  0.00      A       
ATOM     44  HA  ARG A   3       7.674   1.153  -4.218  1.00  0.00      A       
ATOM     45  HB2 ARG A   3       5.233  -0.083  -5.506  1.00  0.00      A       
ATOM     46  HB1 ARG A   3       6.891  -0.279  -6.058  1.00  0.00      A       
ATOM     47  HD2 ARG A   3       8.503  -0.969  -4.577  1.00  0.00      A       
ATOM     48  HD1 ARG A   3       8.055  -1.292  -2.903  1.00  0.00      A       
ATOM     49  HE  ARG A   3       8.328  -3.532  -3.295  1.00  0.00      A       
ATOM     50  HG2 ARG A   3       5.880  -1.152  -3.360  1.00  0.00      A       
ATOM     51  HG1 ARG A   3       6.031  -2.206  -4.768  1.00  0.00      A       
ATOM     52 HH11 ARG A   3       8.184  -1.843  -6.336  1.00  0.00      A       
ATOM     53 HH12 ARG A   3       8.627  -3.229  -7.276  1.00  0.00      A       
ATOM     54 HH21 ARG A   3       9.040  -5.232  -6.243  1.00  0.00      A       
ATOM     55 HH22 ARG A   3       8.912  -5.364  -4.521  1.00  0.00      A       
ATOM     56  N   ARG A   3       5.822   1.429  -3.350  1.00  0.00      A       
ATOM     57  NE  ARG A   3       8.263  -2.978  -4.101  1.00  0.00      A       
ATOM     58  NH1 ARG A   3       8.435  -2.809  -6.389  1.00  0.00      A       
ATOM     59  NH2 ARG A   3       8.850  -4.815  -5.354  1.00  0.00      A       
ATOM     60  O   ARG A   3       5.813   2.190  -6.558  1.00  0.00      A       
ATOM     61  C   LEU A   4       8.390   4.934  -6.737  1.00  0.00      A       
ATOM     62  CA  LEU A   4       7.031   4.639  -6.110  1.00  0.00      A       
ATOM     63  CB  LEU A   4       6.542   5.859  -5.327  1.00  0.00      A       
ATOM     64  CD1 LEU A   4       8.063   7.848  -5.201  1.00  0.00      A       
ATOM     65  CD2 LEU A   4       7.045   6.921  -3.113  1.00  0.00      A       
ATOM     66  CG  LEU A   4       7.596   6.586  -4.491  1.00  0.00      A       
ATOM     67  HN  LEU A   4       7.623   3.531  -4.407  1.00  0.00      A       
ATOM     68  HA  LEU A   4       6.325   4.419  -6.896  1.00  0.00      A       
ATOM     69  HB2 LEU A   4       6.136   6.565  -6.035  1.00  0.00      A       
ATOM     70  HB1 LEU A   4       5.758   5.530  -4.659  1.00  0.00      A       
ATOM     71 HD11 LEU A   4       7.749   7.816  -6.234  1.00  0.00      A       
ATOM     72 HD12 LEU A   4       9.140   7.910  -5.154  1.00  0.00      A       
ATOM     73 HD13 LEU A   4       7.631   8.713  -4.720  1.00  0.00      A       
ATOM     74 HD21 LEU A   4       7.851   7.249  -2.473  1.00  0.00      A       
ATOM     75 HD22 LEU A   4       6.582   6.043  -2.688  1.00  0.00      A       
ATOM     76 HD23 LEU A   4       6.311   7.709  -3.200  1.00  0.00      A       
ATOM     77  HG  LEU A   4       8.453   5.940  -4.362  1.00  0.00      A       
ATOM     78  N   LEU A   4       7.104   3.473  -5.235  1.00  0.00      A       
ATOM     79  O   LEU A   4       8.583   5.977  -7.363  1.00  0.00      A       
ATOM     80  C   LYS A   5      10.819   3.378  -8.416  1.00  0.00      A       
ATOM     81  CA  LYS A   5      10.668   4.167  -7.120  1.00  0.00      A       
ATOM     82  CB  LYS A   5      11.717   3.706  -6.105  1.00  0.00      A       
ATOM     83  CD  LYS A   5      12.874   1.698  -5.137  1.00  0.00      A       
ATOM     84  CE  LYS A   5      12.933   1.854  -3.625  1.00  0.00      A       
ATOM     85  CG  LYS A   5      11.576   2.249  -5.703  1.00  0.00      A       
ATOM     86  HN  LYS A   5       9.113   3.199  -6.058  1.00  0.00      A       
ATOM     87  HA  LYS A   5      10.819   5.215  -7.330  1.00  0.00      A       
ATOM     88  HB2 LYS A   5      12.699   3.847  -6.532  1.00  0.00      A       
ATOM     89  HB1 LYS A   5      11.631   4.313  -5.216  1.00  0.00      A       
ATOM     90  HD2 LYS A   5      12.947   0.648  -5.382  1.00  0.00      A       
ATOM     91  HD1 LYS A   5      13.704   2.231  -5.578  1.00  0.00      A       
ATOM     92  HE2 LYS A   5      13.139   2.887  -3.391  1.00  0.00      A       
ATOM     93  HE1 LYS A   5      11.976   1.574  -3.210  1.00  0.00      A       
ATOM     94  HG2 LYS A   5      10.804   2.165  -4.952  1.00  0.00      A       
ATOM     95  HG1 LYS A   5      11.298   1.670  -6.573  1.00  0.00      A       
ATOM     96  HZ1 LYS A   5      13.682   0.007  -2.998  1.00  0.00      A       
ATOM     97  HZ2 LYS A   5      14.191   1.311  -2.049  1.00  0.00      A       
ATOM     98  HZ3 LYS A   5      14.867   1.065  -3.579  1.00  0.00      A       
ATOM     99  N   LYS A   5       9.328   4.009  -6.567  1.00  0.00      A       
ATOM    100  NZ  LYS A   5      13.992   0.999  -3.021  1.00  0.00      A       
ATOM    101  O   LYS A   5      11.890   3.359  -9.023  1.00  0.00      A       
ATOM    102  C   LYS A   6       8.970   2.647 -11.171  1.00  0.00      A       
ATOM    103  CA  LYS A   6       9.748   1.942 -10.065  1.00  0.00      A       
ATOM    104  CB  LYS A   6       9.151   0.556  -9.810  1.00  0.00      A       
ATOM    105  CD  LYS A   6       8.155  -0.650 -11.775  1.00  0.00      A       
ATOM    106  CE  LYS A   6       7.230  -1.678 -11.142  1.00  0.00      A       
ATOM    107  CG  LYS A   6       9.403  -0.431 -10.936  1.00  0.00      A       
ATOM    108  HN  LYS A   6       8.913   2.784  -8.311  1.00  0.00      A       
ATOM    109  HA  LYS A   6      10.775   1.830 -10.379  1.00  0.00      A       
ATOM    110  HB2 LYS A   6       9.580   0.153  -8.904  1.00  0.00      A       
ATOM    111  HB1 LYS A   6       8.083   0.656  -9.679  1.00  0.00      A       
ATOM    112  HD2 LYS A   6       7.624   0.286 -11.866  1.00  0.00      A       
ATOM    113  HD1 LYS A   6       8.447  -0.997 -12.756  1.00  0.00      A       
ATOM    114  HE2 LYS A   6       7.631  -2.664 -11.325  1.00  0.00      A       
ATOM    115  HE1 LYS A   6       7.188  -1.498 -10.078  1.00  0.00      A       
ATOM    116  HG2 LYS A   6      10.187  -0.047 -11.571  1.00  0.00      A       
ATOM    117  HG1 LYS A   6       9.710  -1.377 -10.512  1.00  0.00      A       
ATOM    118  HZ1 LYS A   6       5.598  -2.509 -12.147  1.00  0.00      A       
ATOM    119  HZ2 LYS A   6       5.797  -0.851 -12.417  1.00  0.00      A       
ATOM    120  HZ3 LYS A   6       5.170  -1.398 -10.945  1.00  0.00      A       
ATOM    121  N   LYS A   6       9.738   2.730  -8.838  1.00  0.00      A       
ATOM    122  NZ  LYS A   6       5.852  -1.604 -11.702  1.00  0.00      A       
ATOM    123  O   LYS A   6       9.219   2.425 -12.356  1.00  0.00      A       
ATOM    124  C   TRP A   7       7.718   5.665 -11.889  1.00  0.00      A       
ATOM    125  CA  TRP A   7       7.215   4.234 -11.735  1.00  0.00      A       
ATOM    126  CB  TRP A   7       5.750   4.241 -11.295  1.00  0.00      A       
ATOM    127  CD1 TRP A   7       6.145   5.745  -9.258  1.00  0.00      A       
ATOM    128  CD2 TRP A   7       4.279   6.218 -10.404  1.00  0.00      A       
ATOM    129  CE2 TRP A   7       4.377   7.110  -9.318  1.00  0.00      A       
ATOM    130  CE3 TRP A   7       3.186   6.326 -11.267  1.00  0.00      A       
ATOM    131  CG  TRP A   7       5.420   5.354 -10.347  1.00  0.00      A       
ATOM    132  CH2 TRP A   7       2.363   8.176  -9.936  1.00  0.00      A       
ATOM    133  CZ2 TRP A   7       3.423   8.093  -9.075  1.00  0.00      A       
ATOM    134  CZ3 TRP A   7       2.239   7.302 -11.024  1.00  0.00      A       
ATOM    135  HN  TRP A   7       7.876   3.630  -9.817  1.00  0.00      A       
ATOM    136  HA  TRP A   7       7.292   3.733 -12.689  1.00  0.00      A       
ATOM    137  HB2 TRP A   7       5.119   4.345 -12.164  1.00  0.00      A       
ATOM    138  HB1 TRP A   7       5.526   3.305 -10.802  1.00  0.00      A       
ATOM    139  HD1 TRP A   7       7.068   5.283  -8.944  1.00  0.00      A       
ATOM    140  HE1 TRP A   7       5.849   7.258  -7.831  1.00  0.00      A       
ATOM    141  HE3 TRP A   7       3.073   5.661 -12.111  1.00  0.00      A       
ATOM    142  HH2 TRP A   7       1.599   8.924  -9.784  1.00  0.00      A       
ATOM    143  HZ2 TRP A   7       3.504   8.775  -8.241  1.00  0.00      A       
ATOM    144  HZ3 TRP A   7       1.387   7.401 -11.680  1.00  0.00      A       
ATOM    145  N   TRP A   7       8.028   3.496 -10.776  1.00  0.00      A       
ATOM    146  NE1 TRP A   7       5.523   6.800  -8.634  1.00  0.00      A       
ATOM    147  O   TRP A   7       7.399   6.343 -12.866  1.00  0.00      A       
ATOM    148  C   ILE A   8       9.962   7.666 -12.159  1.00  0.00      A       
ATOM    149  CA  ILE A   8       9.055   7.468 -10.950  1.00  0.00      A       
ATOM    150  CB  ILE A   8       9.850   7.781  -9.668  1.00  0.00      A       
ATOM    151  CD1 ILE A   8      11.990   9.002 -10.307  1.00  0.00      A       
ATOM    152  CG1 ILE A   8      10.569   9.125  -9.804  1.00  0.00      A       
ATOM    153  CG2 ILE A   8      10.846   6.668  -9.378  1.00  0.00      A       
ATOM    154  HN  ILE A   8       8.725   5.529 -10.168  1.00  0.00      A       
ATOM    155  HA  ILE A   8       8.229   8.161 -11.015  1.00  0.00      A       
ATOM    156  HB  ILE A   8       9.156   7.833  -8.844  1.00  0.00      A       
ATOM    157 HD11 ILE A   8      12.641   8.735  -9.487  1.00  0.00      A       
ATOM    158 HD12 ILE A   8      12.038   8.236 -11.067  1.00  0.00      A       
ATOM    159 HD13 ILE A   8      12.307   9.945 -10.725  1.00  0.00      A       
ATOM    160 HG12 ILE A   8      10.025   9.749 -10.495  1.00  0.00      A       
ATOM    161 HG11 ILE A   8      10.599   9.607  -8.837  1.00  0.00      A       
ATOM    162 HG21 ILE A   8      11.479   6.517 -10.241  1.00  0.00      A       
ATOM    163 HG22 ILE A   8      11.456   6.943  -8.530  1.00  0.00      A       
ATOM    164 HG23 ILE A   8      10.313   5.755  -9.158  1.00  0.00      A       
ATOM    165  N   ILE A   8       8.507   6.117 -10.920  1.00  0.00      A       
ATOM    166  O   ILE A   8       9.933   8.714 -12.804  1.00  0.00      A       
ATOM    167  C   GLN A   9      10.927   6.994 -14.889  1.00  0.00      A       
ATOM    168  CA  GLN A   9      11.682   6.715 -13.594  1.00  0.00      A       
ATOM    169  CB  GLN A   9      12.465   5.406 -13.718  1.00  0.00      A       
ATOM    170  CD  GLN A   9      14.823   4.532 -13.962  1.00  0.00      A       
ATOM    171  CG  GLN A   9      13.909   5.515 -13.256  1.00  0.00      A       
ATOM    172  HN  GLN A   9      10.744   5.843 -11.909  1.00  0.00      A       
ATOM    173  HA  GLN A   9      12.376   7.522 -13.415  1.00  0.00      A       
ATOM    174  HB2 GLN A   9      11.974   4.650 -13.124  1.00  0.00      A       
ATOM    175  HB1 GLN A   9      12.463   5.096 -14.753  1.00  0.00      A       
ATOM    176 HE21 GLN A   9      15.477   2.657 -13.878  1.00  0.00      A       
ATOM    177 HE22 GLN A   9      14.360   3.117 -12.644  1.00  0.00      A       
ATOM    178  HG2 GLN A   9      14.262   6.516 -13.453  1.00  0.00      A       
ATOM    179  HG1 GLN A   9      13.948   5.322 -12.194  1.00  0.00      A       
ATOM    180  N   GLN A   9      10.767   6.652 -12.461  1.00  0.00      A       
ATOM    181  NE2 GLN A   9      14.895   3.312 -13.442  1.00  0.00      A       
ATOM    182  O   GLN A   9      11.508   7.450 -15.874  1.00  0.00      A       
ATOM    183  OE1 GLN A   9      15.457   4.866 -14.963  1.00  0.00      A       
ATOM    184  C   LYS A  10       7.939   8.193 -15.887  1.00  0.00      A       
ATOM    185  CA  LYS A  10       8.791   6.938 -16.055  1.00  0.00      A       
ATOM    186  CB  LYS A  10       7.889   5.726 -16.301  1.00  0.00      A       
ATOM    187  CD  LYS A  10       7.513   6.203 -18.739  1.00  0.00      A       
ATOM    188  CE  LYS A  10       8.449   6.257 -19.936  1.00  0.00      A       
ATOM    189  CG  LYS A  10       7.978   5.180 -17.715  1.00  0.00      A       
ATOM    190  HN  LYS A  10       9.221   6.355 -14.066  1.00  0.00      A       
ATOM    191  HA  LYS A  10       9.441   7.071 -16.906  1.00  0.00      A       
ATOM    192  HB2 LYS A  10       8.169   4.940 -15.615  1.00  0.00      A       
ATOM    193  HB1 LYS A  10       6.864   6.010 -16.111  1.00  0.00      A       
ATOM    194  HD2 LYS A  10       6.525   5.934 -19.081  1.00  0.00      A       
ATOM    195  HD1 LYS A  10       7.482   7.177 -18.272  1.00  0.00      A       
ATOM    196  HE2 LYS A  10       8.542   5.265 -20.350  1.00  0.00      A       
ATOM    197  HE1 LYS A  10       8.025   6.918 -20.678  1.00  0.00      A       
ATOM    198  HG2 LYS A  10       9.003   4.915 -17.927  1.00  0.00      A       
ATOM    199  HG1 LYS A  10       7.354   4.300 -17.791  1.00  0.00      A       
ATOM    200  HZ1 LYS A  10      10.068   6.392 -18.623  1.00  0.00      A       
ATOM    201  HZ2 LYS A  10       9.805   7.794 -19.533  1.00  0.00      A       
ATOM    202  HZ3 LYS A  10      10.506   6.435 -20.257  1.00  0.00      A       
ATOM    203  N   LYS A  10       9.627   6.717 -14.882  1.00  0.00      A       
ATOM    204  NZ  LYS A  10       9.802   6.754 -19.561  1.00  0.00      A       
ATOM    205  O   LYS A  10       7.722   8.940 -16.840  1.00  0.00      A       
ATOM    206  C   VAL A  11       7.460  10.863 -14.398  1.00  0.00      A       
ATOM    207  CA  VAL A  11       6.633   9.582 -14.374  1.00  0.00      A       
ATOM    208  CB  VAL A  11       5.947   9.453 -13.001  1.00  0.00      A       
ATOM    209  CG1 VAL A  11       5.199  10.731 -12.655  1.00  0.00      A       
ATOM    210  CG2 VAL A  11       5.009   8.255 -12.986  1.00  0.00      A       
ATOM    211  HN  VAL A  11       7.666   7.785 -13.949  1.00  0.00      A       
ATOM    212  HA  VAL A  11       5.866   9.647 -15.132  1.00  0.00      A       
ATOM    213  HB  VAL A  11       6.710   9.294 -12.254  1.00  0.00      A       
ATOM    214 HG11 VAL A  11       4.680  10.601 -11.716  1.00  0.00      A       
ATOM    215 HG12 VAL A  11       5.902  11.547 -12.569  1.00  0.00      A       
ATOM    216 HG13 VAL A  11       4.484  10.952 -13.433  1.00  0.00      A       
ATOM    217 HG21 VAL A  11       4.862   7.900 -13.995  1.00  0.00      A       
ATOM    218 HG22 VAL A  11       5.440   7.469 -12.385  1.00  0.00      A       
ATOM    219 HG23 VAL A  11       4.057   8.549 -12.566  1.00  0.00      A       
ATOM    220  N   VAL A  11       7.459   8.417 -14.668  1.00  0.00      A       
ATOM    221  O   VAL A  11       6.930  11.952 -14.616  1.00  0.00      A       
ATOM    222  C   ILE A  12       9.706  12.539 -15.537  1.00  0.00      A       
ATOM    223  CA  ILE A  12       9.664  11.869 -14.168  1.00  0.00      A       
ATOM    224  CB  ILE A  12      11.093  11.460 -13.764  1.00  0.00      A       
ATOM    225  CD1 ILE A  12      12.690  12.832 -12.335  1.00  0.00      A       
ATOM    226  CG1 ILE A  12      11.992  12.694 -13.670  1.00  0.00      A       
ATOM    227  CG2 ILE A  12      11.659  10.460 -14.762  1.00  0.00      A       
ATOM    228  HN  ILE A  12       9.125   9.829 -14.003  1.00  0.00      A       
ATOM    229  HA  ILE A  12       9.296  12.580 -13.442  1.00  0.00      A       
ATOM    230  HB  ILE A  12      11.047  10.981 -12.798  1.00  0.00      A       
ATOM    231 HD11 ILE A  12      13.689  12.424 -12.408  1.00  0.00      A       
ATOM    232 HD12 ILE A  12      12.748  13.876 -12.064  1.00  0.00      A       
ATOM    233 HD13 ILE A  12      12.136  12.293 -11.581  1.00  0.00      A       
ATOM    234 HG12 ILE A  12      12.750  12.639 -14.436  1.00  0.00      A       
ATOM    235 HG11 ILE A  12      11.393  13.580 -13.824  1.00  0.00      A       
ATOM    236 HG21 ILE A  12      10.899   9.735 -15.015  1.00  0.00      A       
ATOM    237 HG22 ILE A  12      11.971  10.981 -15.655  1.00  0.00      A       
ATOM    238 HG23 ILE A  12      12.507   9.955 -14.324  1.00  0.00      A       
ATOM    239  N   ILE A  12       8.762  10.723 -14.171  1.00  0.00      A       
ATOM    240  OT1 ILE A  12       9.897  13.750 -15.642  1.00  0.00      A       
END


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