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
616283 5wrx 36038 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   VAL A   1       3.056  -1.183  -1.293  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       2.892   1.304  -1.411  1.00  0.00      A       
ATOM      4  CG1 VAL A   1       3.757   1.244  -2.661  1.00  0.00      A       
ATOM      5  CG2 VAL A   1       1.953   2.500  -1.460  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       1.397  -0.082  -2.063  1.00  0.00      A       
ATOM      8  HB  VAL A   1       3.542   1.419  -0.556  1.00  0.00      A       
ATOM      9 HG11 VAL A   1       4.519   0.488  -2.535  1.00  0.00      A       
ATOM     10 HG12 VAL A   1       3.141   0.997  -3.513  1.00  0.00      A       
ATOM     11 HG13 VAL A   1       4.226   2.203  -2.821  1.00  0.00      A       
ATOM     12 HG21 VAL A   1       2.404   3.332  -0.940  1.00  0.00      A       
ATOM     13 HG22 VAL A   1       1.771   2.774  -2.489  1.00  0.00      A       
ATOM     14 HG23 VAL A   1       1.018   2.243  -0.986  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       3.059  -1.953  -2.252  1.00  0.00      A       
ATOM     17  C   ALA A   2       4.598  -3.271   1.058  1.00  0.00      A       
ATOM     18  CA  ALA A   2       4.838  -2.409  -0.177  1.00  0.00      A       
ATOM     19  CB  ALA A   2       6.256  -1.858  -0.171  1.00  0.00      A       
ATOM     20  HN  ALA A   2       3.822  -0.674   0.482  1.00  0.00      A       
ATOM     21  HA  ALA A   2       4.719  -3.022  -1.059  1.00  0.00      A       
ATOM     22  HB1 ALA A   2       6.885  -2.491   0.437  1.00  0.00      A       
ATOM     23  HB2 ALA A   2       6.637  -1.835  -1.181  1.00  0.00      A       
ATOM     24  HB3 ALA A   2       6.251  -0.858   0.235  1.00  0.00      A       
ATOM     25  N   ALA A   2       3.872  -1.320  -0.252  1.00  0.00      A       
ATOM     26  O   ALA A   2       4.409  -4.483   0.954  1.00  0.00      A       
ATOM     27  C   ARG A   3       3.176  -2.795   4.218  1.00  0.00      A       
ATOM     28  CA  ARG A   3       4.393  -3.348   3.482  1.00  0.00      A       
ATOM     29  CB  ARG A   3       5.633  -3.240   4.371  1.00  0.00      A       
ATOM     30  CD  ARG A   3       8.100  -3.305   3.894  1.00  0.00      A       
ATOM     31  CG  ARG A   3       6.799  -4.092   3.897  1.00  0.00      A       
ATOM     32  CZ  ARG A   3      10.507  -3.800   3.940  1.00  0.00      A       
ATOM     33  HN  ARG A   3       4.763  -1.671   2.245  1.00  0.00      A       
ATOM     34  HA  ARG A   3       4.217  -4.387   3.249  1.00  0.00      A       
ATOM     35  HB2 ARG A   3       5.956  -2.210   4.396  1.00  0.00      A       
ATOM     36  HB1 ARG A   3       5.372  -3.552   5.371  1.00  0.00      A       
ATOM     37  HD2 ARG A   3       8.236  -2.864   2.918  1.00  0.00      A       
ATOM     38  HD1 ARG A   3       8.033  -2.522   4.635  1.00  0.00      A       
ATOM     39  HE  ARG A   3       9.079  -5.019   4.615  1.00  0.00      A       
ATOM     40  HG2 ARG A   3       6.906  -4.940   4.557  1.00  0.00      A       
ATOM     41  HG1 ARG A   3       6.595  -4.438   2.894  1.00  0.00      A       
ATOM     42 HH11 ARG A   3      10.024  -2.007   3.146  1.00  0.00      A       
ATOM     43 HH12 ARG A   3      11.717  -2.369   3.185  1.00  0.00      A       
ATOM     44 HH21 ARG A   3      11.307  -5.507   4.671  1.00  0.00      A       
ATOM     45 HH22 ARG A   3      12.446  -4.360   4.052  1.00  0.00      A       
ATOM     46  N   ARG A   3       4.608  -2.638   2.226  1.00  0.00      A       
ATOM     47  NE  ARG A   3       9.252  -4.149   4.198  1.00  0.00      A       
ATOM     48  NH1 ARG A   3      10.771  -2.629   3.377  1.00  0.00      A       
ATOM     49  NH2 ARG A   3      11.502  -4.623   4.246  1.00  0.00      A       
ATOM     50  O   ARG A   3       2.121  -3.426   4.255  1.00  0.00      A       
ATOM     51  C   GLY A   4       1.812   0.327   4.925  1.00  0.00      A       
ATOM     52  CA  GLY A   4       2.239  -0.994   5.532  1.00  0.00      A       
ATOM     53  HN  GLY A   4       4.197  -1.154   4.741  1.00  0.00      A       
ATOM     54  HA2 GLY A   4       1.396  -1.668   5.532  1.00  0.00      A       
ATOM     55  HA1 GLY A   4       2.552  -0.824   6.551  1.00  0.00      A       
ATOM     56  N   GLY A   4       3.332  -1.612   4.804  1.00  0.00      A       
ATOM     57  O   GLY A   4       0.921   0.998   5.445  1.00  0.00      A       
ATOM     58  C   TRP A   5       0.634   2.064   2.877  1.00  0.00      A       
ATOM     59  CA  TRP A   5       2.131   1.955   3.144  1.00  0.00      A       
ATOM     60  CB  TRP A   5       2.906   2.059   1.830  1.00  0.00      A       
ATOM     61  CD1 TRP A   5       4.827   3.551   1.023  1.00  0.00      A       
ATOM     62  CD2 TRP A   5       3.247   4.632   2.185  1.00  0.00      A       
ATOM     63  CE2 TRP A   5       4.237   5.559   1.803  1.00  0.00      A       
ATOM     64  CE3 TRP A   5       2.151   5.085   2.925  1.00  0.00      A       
ATOM     65  CG  TRP A   5       3.643   3.355   1.675  1.00  0.00      A       
ATOM     66  CH2 TRP A   5       3.078   7.323   2.863  1.00  0.00      A       
ATOM     67  CZ2 TRP A   5       4.162   6.908   2.138  1.00  0.00      A       
ATOM     68  CZ3 TRP A   5       2.078   6.424   3.257  1.00  0.00      A       
ATOM     69  HN  TRP A   5       3.151   0.126   3.454  1.00  0.00      A       
ATOM     70  HA  TRP A   5       2.429   2.767   3.792  1.00  0.00      A       
ATOM     71  HB2 TRP A   5       3.627   1.257   1.780  1.00  0.00      A       
ATOM     72  HB1 TRP A   5       2.214   1.968   1.005  1.00  0.00      A       
ATOM     73  HD1 TRP A   5       5.385   2.771   0.528  1.00  0.00      A       
ATOM     74  HE1 TRP A   5       5.999   5.265   0.704  1.00  0.00      A       
ATOM     75  HE3 TRP A   5       1.370   4.407   3.237  1.00  0.00      A       
ATOM     76  HH2 TRP A   5       2.981   8.360   3.145  1.00  0.00      A       
ATOM     77  HZ2 TRP A   5       4.924   7.614   1.842  1.00  0.00      A       
ATOM     78  HZ3 TRP A   5       1.239   6.792   3.829  1.00  0.00      A       
ATOM     79  N   TRP A   5       2.450   0.704   3.822  1.00  0.00      A       
ATOM     80  NE1 TRP A   5       5.190   4.874   1.096  1.00  0.00      A       
ATOM     81  O   TRP A   5       0.142   1.595   1.851  1.00  0.00      A       
ATOM     82  C   GLY A   6      -1.893   4.180   3.038  1.00  0.00      A       
ATOM     83  CA  GLY A   6      -1.520   2.844   3.650  1.00  0.00      A       
ATOM     84  HN  GLY A   6       0.361   3.040   4.603  1.00  0.00      A       
ATOM     85  HA2 GLY A   6      -1.892   2.053   3.016  1.00  0.00      A       
ATOM     86  HA1 GLY A   6      -1.987   2.764   4.621  1.00  0.00      A       
ATOM     87  N   GLY A   6      -0.086   2.686   3.806  1.00  0.00      A       
ATOM     88  O   GLY A   6      -2.177   4.265   1.843  1.00  0.00      A       
ATOM     89  C   ARG A   7      -1.048   7.510   3.531  1.00  0.00      A       
ATOM     90  CA  ARG A   7      -2.237   6.563   3.391  1.00  0.00      A       
ATOM     91  CB  ARG A   7      -3.432   7.109   4.175  1.00  0.00      A       
ATOM     92  CD  ARG A   7      -5.845   7.579   3.654  1.00  0.00      A       
ATOM     93  CG  ARG A   7      -4.764   6.514   3.747  1.00  0.00      A       
ATOM     94  CZ  ARG A   7      -7.297   6.960   5.540  1.00  0.00      A       
ATOM     95  HN  ARG A   7      -1.657   5.094   4.801  1.00  0.00      A       
ATOM     96  HA  ARG A   7      -2.504   6.492   2.347  1.00  0.00      A       
ATOM     97  HB2 ARG A   7      -3.288   6.895   5.224  1.00  0.00      A       
ATOM     98  HB1 ARG A   7      -3.479   8.178   4.037  1.00  0.00      A       
ATOM     99  HD2 ARG A   7      -5.399   8.497   3.303  1.00  0.00      A       
ATOM    100  HD1 ARG A   7      -6.595   7.251   2.949  1.00  0.00      A       
ATOM    101  HE  ARG A   7      -6.294   8.678   5.388  1.00  0.00      A       
ATOM    102  HG2 ARG A   7      -4.646   6.051   2.778  1.00  0.00      A       
ATOM    103  HG1 ARG A   7      -5.063   5.770   4.470  1.00  0.00      A       
ATOM    104 HH11 ARG A   7      -7.163   5.572   4.079  1.00  0.00      A       
ATOM    105 HH12 ARG A   7      -8.183   5.148   5.414  1.00  0.00      A       
ATOM    106 HH21 ARG A   7      -7.634   8.132   7.152  1.00  0.00      A       
ATOM    107 HH22 ARG A   7      -8.451   6.606   7.161  1.00  0.00      A       
ATOM    108  N   ARG A   7      -1.893   5.226   3.858  1.00  0.00      A       
ATOM    109  NE  ARG A   7      -6.483   7.825   4.945  1.00  0.00      A       
ATOM    110  NH1 ARG A   7      -7.571   5.798   4.963  1.00  0.00      A       
ATOM    111  NH2 ARG A   7      -7.838   7.257   6.714  1.00  0.00      A       
ATOM    112  O   ARG A   7      -0.357   7.804   2.555  1.00  0.00      A       
ATOM    113  C   LYS A   8       1.153   8.382   6.165  1.00  0.00      A       
ATOM    114  CA  LYS A   8       0.288   8.897   5.019  1.00  0.00      A       
ATOM    115  CB  LYS A   8      -0.246  10.291   5.356  1.00  0.00      A       
ATOM    116  CD  LYS A   8      -0.874  10.070   7.778  1.00  0.00      A       
ATOM    117  CE  LYS A   8      -1.927  10.443   8.810  1.00  0.00      A       
ATOM    118  CG  LYS A   8      -1.384  10.280   6.362  1.00  0.00      A       
ATOM    119  HN  LYS A   8      -1.403   7.713   5.488  1.00  0.00      A       
ATOM    120  HA  LYS A   8       0.893   8.959   4.127  1.00  0.00      A       
ATOM    121  HB2 LYS A   8       0.561  10.884   5.762  1.00  0.00      A       
ATOM    122  HB1 LYS A   8      -0.601  10.757   4.448  1.00  0.00      A       
ATOM    123  HD2 LYS A   8      -0.614   9.030   7.907  1.00  0.00      A       
ATOM    124  HD1 LYS A   8       0.002  10.684   7.931  1.00  0.00      A       
ATOM    125  HE2 LYS A   8      -2.769  10.887   8.302  1.00  0.00      A       
ATOM    126  HE1 LYS A   8      -2.247   9.546   9.320  1.00  0.00      A       
ATOM    127  HG2 LYS A   8      -1.903  11.226   6.315  1.00  0.00      A       
ATOM    128  HG1 LYS A   8      -2.066   9.480   6.111  1.00  0.00      A       
ATOM    129  HZ1 LYS A   8      -1.706  11.134  10.769  1.00  0.00      A       
ATOM    130  HZ2 LYS A   8      -1.759  12.365   9.611  1.00  0.00      A       
ATOM    131  HZ3 LYS A   8      -0.362  11.427   9.783  1.00  0.00      A       
ATOM    132  N   LYS A   8      -0.817   7.984   4.750  1.00  0.00      A       
ATOM    133  NZ  LYS A   8      -1.401  11.410   9.813  1.00  0.00      A       
ATOM    134  O   LYS A   8       1.729   9.165   6.921  1.00  0.00      A       
ATOM    135  C   CYS A   9       3.117   5.543   6.748  1.00  0.00      A       
ATOM    136  CA  CYS A   9       2.036   6.443   7.340  1.00  0.00      A       
ATOM    137  CB  CYS A   9       1.138   5.633   8.277  1.00  0.00      A       
ATOM    138  HN  CYS A   9       0.759   6.490   5.653  1.00  0.00      A       
ATOM    139  HA  CYS A   9       2.511   7.232   7.904  1.00  0.00      A       
ATOM    140  HB2 CYS A   9       0.299   5.249   7.716  1.00  0.00      A       
ATOM    141  HB1 CYS A   9       1.703   4.804   8.677  1.00  0.00      A       
ATOM    142  HG  CYS A   9       0.287   7.824   9.263  1.00  0.00      A       
ATOM    143  N   CYS A   9       1.241   7.062   6.287  1.00  0.00      A       
ATOM    144  O   CYS A   9       3.014   4.317   6.762  1.00  0.00      A       
ATOM    145  SG  CYS A   9       0.481   6.579   9.670  1.00  0.00      A       
ATOM    146  C   PRO A  10       6.134   4.694   6.639  1.00  0.00      A       
ATOM    147  CA  PRO A  10       5.298   5.442   5.606  1.00  0.00      A       
ATOM    148  CB  PRO A  10       6.124   6.551   4.951  1.00  0.00      A       
ATOM    149  CD  PRO A  10       4.366   7.626   6.163  1.00  0.00      A       
ATOM    150  CG  PRO A  10       5.799   7.777   5.732  1.00  0.00      A       
ATOM    151  HA  PRO A  10       4.958   4.749   4.849  1.00  0.00      A       
ATOM    152  HB2 PRO A  10       7.175   6.307   5.016  1.00  0.00      A       
ATOM    153  HB1 PRO A  10       5.837   6.655   3.915  1.00  0.00      A       
ATOM    154  HD2 PRO A  10       4.216   8.068   7.137  1.00  0.00      A       
ATOM    155  HD1 PRO A  10       3.704   8.074   5.437  1.00  0.00      A       
ATOM    156  HG2 PRO A  10       6.445   7.845   6.594  1.00  0.00      A       
ATOM    157  HG1 PRO A  10       5.911   8.651   5.107  1.00  0.00      A       
ATOM    158  N   PRO A  10       4.178   6.166   6.214  1.00  0.00      A       
ATOM    159  O   PRO A  10       6.510   5.252   7.670  1.00  0.00      A       
ATOM    160  C   LEU A  11       8.477   2.097   6.571  1.00  0.00      A       
ATOM    161  CA  LEU A  11       7.214   2.603   7.261  1.00  0.00      A       
ATOM    162  CB  LEU A  11       6.384   1.420   7.762  1.00  0.00      A       
ATOM    163  CD1 LEU A  11       5.241  -0.723   7.140  1.00  0.00      A       
ATOM    164  CD2 LEU A  11       4.228   1.468   6.485  1.00  0.00      A       
ATOM    165  CG  LEU A  11       5.526   0.709   6.714  1.00  0.00      A       
ATOM    166  HN  LEU A  11       6.093   3.038   5.519  1.00  0.00      A       
ATOM    167  HA  LEU A  11       7.499   3.215   8.103  1.00  0.00      A       
ATOM    168  HB2 LEU A  11       7.064   0.693   8.180  1.00  0.00      A       
ATOM    169  HB1 LEU A  11       5.727   1.783   8.539  1.00  0.00      A       
ATOM    170 HD11 LEU A  11       5.961  -1.027   7.884  1.00  0.00      A       
ATOM    171 HD12 LEU A  11       5.312  -1.374   6.281  1.00  0.00      A       
ATOM    172 HD13 LEU A  11       4.246  -0.783   7.556  1.00  0.00      A       
ATOM    173 HD21 LEU A  11       4.293   2.441   6.950  1.00  0.00      A       
ATOM    174 HD22 LEU A  11       3.407   0.916   6.919  1.00  0.00      A       
ATOM    175 HD23 LEU A  11       4.062   1.586   5.425  1.00  0.00      A       
ATOM    176  HG  LEU A  11       6.066   0.677   5.778  1.00  0.00      A       
ATOM    177  N   LEU A  11       6.421   3.428   6.356  1.00  0.00      A       
ATOM    178  O   LEU A  11       9.008   1.043   6.920  1.00  0.00      A       
ATOM    179  C   PHE A  12      11.201   3.597   4.921  1.00  0.00      A       
ATOM    180  CA  PHE A  12      10.156   2.487   4.853  1.00  0.00      A       
ATOM    181  CB  PHE A  12       9.811   2.186   3.393  1.00  0.00      A       
ATOM    182  CD1 PHE A  12       8.258   0.307   2.799  1.00  0.00      A       
ATOM    183  CD2 PHE A  12       7.311   2.399   3.441  1.00  0.00      A       
ATOM    184  CE1 PHE A  12       6.991  -0.218   2.628  1.00  0.00      A       
ATOM    185  CE2 PHE A  12       6.042   1.880   3.271  1.00  0.00      A       
ATOM    186  CG  PHE A  12       8.432   1.619   3.207  1.00  0.00      A       
ATOM    187  CZ  PHE A  12       5.881   0.570   2.863  1.00  0.00      A       
ATOM    188  HN  PHE A  12       8.487   3.687   5.358  1.00  0.00      A       
ATOM    189  HA  PHE A  12      10.563   1.598   5.308  1.00  0.00      A       
ATOM    190  HB2 PHE A  12       9.874   3.099   2.820  1.00  0.00      A       
ATOM    191  HB1 PHE A  12      10.520   1.472   3.003  1.00  0.00      A       
ATOM    192  HD1 PHE A  12       9.126  -0.311   2.614  1.00  0.00      A       
ATOM    193  HD2 PHE A  12       7.435   3.424   3.759  1.00  0.00      A       
ATOM    194  HE1 PHE A  12       6.869  -1.243   2.309  1.00  0.00      A       
ATOM    195  HE2 PHE A  12       5.176   2.498   3.456  1.00  0.00      A       
ATOM    196  HZ  PHE A  12       4.890   0.162   2.731  1.00  0.00      A       
ATOM    197  N   PHE A  12       8.954   2.857   5.591  1.00  0.00      A       
ATOM    198  O   PHE A  12      12.036   3.735   4.029  1.00  0.00      A       
ATOM    199  C   GLY A  13      13.170   5.158   7.170  1.00  0.00      A       
ATOM    200  CA  GLY A  13      12.091   5.477   6.155  1.00  0.00      A       
ATOM    201  HN  GLY A  13      10.457   4.231   6.669  1.00  0.00      A       
ATOM    202  HA2 GLY A  13      12.556   5.684   5.203  1.00  0.00      A       
ATOM    203  HA1 GLY A  13      11.555   6.357   6.481  1.00  0.00      A       
ATOM    204  N   GLY A  13      11.145   4.388   5.989  1.00  0.00      A       
ATOM    205  OT1 GLY A  13      14.218   5.803   7.196  1.00  0.00      A       
END


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