NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
654261 7css cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   CYS A   1      -0.888   2.100  -4.717  1.00  0.00      A       
ATOM      2  CA  CYS A   1      -0.810   3.093  -3.563  1.00  0.00      A       
ATOM      3  CB  CYS A   1      -2.175   3.756  -3.357  1.00  0.00      A       
ATOM      4  HT1 CYS A   1       0.270   4.796  -3.030  1.00  0.00      A       
ATOM      5  HT2 CYS A   1      -0.001   4.649  -4.693  1.00  0.00      A       
ATOM      6  HT3 CYS A   1       1.157   3.676  -3.936  1.00  0.00      A       
ATOM      7  HA  CYS A   1      -0.538   2.559  -2.664  1.00  0.00      A       
ATOM      8  HB2 CYS A   1      -2.499   4.191  -4.291  1.00  0.00      A       
ATOM      9  HB1 CYS A   1      -2.888   3.006  -3.049  1.00  0.00      A       
ATOM     10  N   CYS A   1       0.226   4.125  -3.824  1.00  0.00      A       
ATOM     11  O   CYS A   1      -0.939   2.500  -5.884  1.00  0.00      A       
ATOM     12  SG  CYS A   1      -2.180   5.078  -2.102  1.00  0.00      A       
ATOM     13  C   CYS A   2      -2.413  -0.752  -5.543  1.00  0.00      A       
ATOM     14  CA  CYS A   2      -0.971  -0.263  -5.377  1.00  0.00      A       
ATOM     15  CB  CYS A   2      -0.049  -1.424  -4.982  1.00  0.00      A       
ATOM     16  HN  CYS A   2      -0.853   0.564  -3.430  1.00  0.00      A       
ATOM     17  HA  CYS A   2      -0.635   0.145  -6.319  1.00  0.00      A       
ATOM     18  HB2 CYS A   2      -0.435  -1.892  -4.089  1.00  0.00      A       
ATOM     19  HB1 CYS A   2      -0.033  -2.149  -5.783  1.00  0.00      A       
ATOM     20  N   CYS A   2      -0.897   0.806  -4.379  1.00  0.00      A       
ATOM     21  O   CYS A   2      -2.945  -0.761  -6.657  1.00  0.00      A       
ATOM     22  SG  CYS A   2       1.673  -0.928  -4.646  1.00  0.00      A       
ATOM     23  C   GLU A   3      -5.106  -1.243  -3.102  1.00  0.00      A       
ATOM     24  CA  GLU A   3      -4.420  -1.641  -4.412  1.00  0.00      A       
ATOM     25  CB  GLU A   3      -4.470  -3.167  -4.607  1.00  0.00      A       
ATOM     26  CD  GLU A   3      -4.333  -5.113  -6.212  1.00  0.00      A       
ATOM     27  CG  GLU A   3      -4.278  -3.606  -6.050  1.00  0.00      A       
ATOM     28  HN  GLU A   3      -2.541  -1.127  -3.577  1.00  0.00      A       
ATOM     29  HA  GLU A   3      -4.940  -1.165  -5.231  1.00  0.00      A       
ATOM     30  HB2 GLU A   3      -3.690  -3.619  -4.011  1.00  0.00      A       
ATOM     31  HB1 GLU A   3      -5.426  -3.530  -4.263  1.00  0.00      A       
ATOM     32  HG2 GLU A   3      -5.059  -3.167  -6.653  1.00  0.00      A       
ATOM     33  HG1 GLU A   3      -3.317  -3.256  -6.395  1.00  0.00      A       
ATOM     34  N   GLU A   3      -3.034  -1.157  -4.423  1.00  0.00      A       
ATOM     35  O   GLU A   3      -6.023  -0.416  -3.101  1.00  0.00      A       
ATOM     36  OE1 GLU A   3      -5.439  -5.646  -6.437  1.00  0.00      A       
ATOM     37  OE2 GLU A   3      -3.268  -5.759  -6.115  1.00  0.00      A       
ATOM     38  C   LEU A   4      -4.139  -0.852   0.206  1.00  0.00      A       
ATOM     39  CA  LEU A   4      -5.187  -1.552  -0.660  1.00  0.00      A       
ATOM     40  CB  LEU A   4      -5.649  -2.847   0.028  1.00  0.00      A       
ATOM     41  CD1 LEU A   4      -6.630  -5.126  -0.348  1.00  0.00      A       
ATOM     42  CD2 LEU A   4      -8.116  -3.119  -0.416  1.00  0.00      A       
ATOM     43  CG  LEU A   4      -6.721  -3.654  -0.719  1.00  0.00      A       
ATOM     44  HN  LEU A   4      -3.941  -2.510  -2.081  1.00  0.00      A       
ATOM     45  HA  LEU A   4      -6.033  -0.895  -0.780  1.00  0.00      A       
ATOM     46  HB2 LEU A   4      -4.785  -3.481   0.165  1.00  0.00      A       
ATOM     47  HB1 LEU A   4      -6.040  -2.589   1.001  1.00  0.00      A       
ATOM     48 HD11 LEU A   4      -6.769  -5.238   0.718  1.00  0.00      A       
ATOM     49 HD12 LEU A   4      -5.659  -5.508  -0.625  1.00  0.00      A       
ATOM     50 HD13 LEU A   4      -7.397  -5.678  -0.871  1.00  0.00      A       
ATOM     51 HD21 LEU A   4      -8.850  -3.703  -0.953  1.00  0.00      A       
ATOM     52 HD22 LEU A   4      -8.182  -2.087  -0.727  1.00  0.00      A       
ATOM     53 HD23 LEU A   4      -8.307  -3.189   0.644  1.00  0.00      A       
ATOM     54  HG  LEU A   4      -6.548  -3.566  -1.783  1.00  0.00      A       
ATOM     55  N   LEU A   4      -4.650  -1.841  -1.994  1.00  0.00      A       
ATOM     56  O   LEU A   4      -4.479  -0.168   1.176  1.00  0.00      A       
ATOM     57  C   CYS A   5      -1.405   0.935   0.013  1.00  0.00      A       
ATOM     58  CA  CYS A   5      -1.733  -0.439   0.551  1.00  0.00      A       
ATOM     59  CB  CYS A   5      -0.500  -1.353   0.469  1.00  0.00      A       
ATOM     60  HN  CYS A   5      -2.682  -1.599  -0.938  1.00  0.00      A       
ATOM     61  HA  CYS A   5      -2.011  -0.313   1.576  1.00  0.00      A       
ATOM     62  HB2 CYS A   5      -0.358  -1.654  -0.557  1.00  0.00      A       
ATOM     63  HB1 CYS A   5       0.367  -0.795   0.793  1.00  0.00      A       
ATOM     64  N   CYS A   5      -2.864  -1.035  -0.162  1.00  0.00      A       
ATOM     65  O   CYS A   5      -1.009   1.093  -1.148  1.00  0.00      A       
ATOM     66  SG  CYS A   5      -0.588  -2.875   1.477  1.00  0.00      A       
ATOM     67  C   CYS A   6      -0.113   3.841   1.311  1.00  0.00      A       
ATOM     68  CA  CYS A   6      -1.321   3.301   0.528  1.00  0.00      A       
ATOM     69  CB  CYS A   6      -2.569   4.155   0.762  1.00  0.00      A       
ATOM     70  HN  CYS A   6      -1.930   1.726   1.775  1.00  0.00      A       
ATOM     71  HA  CYS A   6      -1.087   3.297  -0.515  1.00  0.00      A       
ATOM     72  HB2 CYS A   6      -3.208   3.657   1.476  1.00  0.00      A       
ATOM     73  HB1 CYS A   6      -2.271   5.110   1.160  1.00  0.00      A       
ATOM     74  N   CYS A   6      -1.593   1.928   0.878  1.00  0.00      A       
ATOM     75  O   CYS A   6      -0.044   5.030   1.649  1.00  0.00      A       
ATOM     76  SG  CYS A   6      -3.554   4.456  -0.742  1.00  0.00      A       
ATOM     77  C   ASN A   7       3.190   3.687   1.333  1.00  0.00      A       
ATOM     78  CA  ASN A   7       2.063   3.268   2.302  1.00  0.00      A       
ATOM     79  CB  ASN A   7       2.462   2.020   3.084  1.00  0.00      A       
ATOM     80  CG  ASN A   7       2.761   2.248   4.542  1.00  0.00      A       
ATOM     81  HN  ASN A   7       0.741   2.028   1.250  1.00  0.00      A       
ATOM     82  HA  ASN A   7       1.848   4.072   2.985  1.00  0.00      A       
ATOM     83  HB2 ASN A   7       1.659   1.320   3.040  1.00  0.00      A       
ATOM     84  HB1 ASN A   7       3.324   1.583   2.625  1.00  0.00      A       
ATOM     85 HD21 ASN A   7       3.307   0.350   4.684  1.00  0.00      A       
ATOM     86 HD22 ASN A   7       3.393   1.273   6.123  1.00  0.00      A       
ATOM     87  N   ASN A   7       0.850   2.948   1.567  1.00  0.00      A       
ATOM     88  ND2 ASN A   7       3.203   1.186   5.185  1.00  0.00      A       
ATOM     89  O   ASN A   7       3.077   3.435   0.129  1.00  0.00      A       
ATOM     90  OD1 ASN A   7       2.586   3.341   5.087  1.00  0.00      A       
ATOM     91  C   PRO A   8       6.392   3.616   0.631  1.00  0.00      A       
ATOM     92  CA  PRO A   8       5.419   4.760   0.961  1.00  0.00      A       
ATOM     93  CB  PRO A   8       6.110   5.865   1.795  1.00  0.00      A       
ATOM     94  CD  PRO A   8       4.563   4.714   3.219  1.00  0.00      A       
ATOM     95  CG  PRO A   8       5.299   6.009   3.050  1.00  0.00      A       
ATOM     96  HA  PRO A   8       5.051   5.172   0.039  1.00  0.00      A       
ATOM     97  HB2 PRO A   8       7.128   5.563   2.011  1.00  0.00      A       
ATOM     98  HB1 PRO A   8       6.117   6.789   1.238  1.00  0.00      A       
ATOM     99  HD2 PRO A   8       5.187   3.983   3.711  1.00  0.00      A       
ATOM    100  HD1 PRO A   8       3.641   4.854   3.762  1.00  0.00      A       
ATOM    101  HG2 PRO A   8       5.955   6.184   3.893  1.00  0.00      A       
ATOM    102  HG1 PRO A   8       4.596   6.820   2.945  1.00  0.00      A       
ATOM    103  N   PRO A   8       4.300   4.330   1.823  1.00  0.00      A       
ATOM    104  O   PRO A   8       7.589   3.830   0.400  1.00  0.00      A       
ATOM    105  C   ALA A   9       5.645   0.077  -0.234  1.00  0.00      A       
ATOM    106  CA  ALA A   9       6.582   1.171   0.295  1.00  0.00      A       
ATOM    107  CB  ALA A   9       7.320   0.673   1.539  1.00  0.00      A       
ATOM    108  HN  ALA A   9       4.872   2.341   0.751  1.00  0.00      A       
ATOM    109  HA  ALA A   9       7.316   1.400  -0.465  1.00  0.00      A       
ATOM    110  HB1 ALA A   9       7.976   1.450   1.903  1.00  0.00      A       
ATOM    111  HB2 ALA A   9       7.901  -0.201   1.287  1.00  0.00      A       
ATOM    112  HB3 ALA A   9       6.602   0.419   2.305  1.00  0.00      A       
ATOM    113  N   ALA A   9       5.835   2.404   0.590  1.00  0.00      A       
ATOM    114  O   ALA A   9       6.093  -1.018  -0.591  1.00  0.00      A       
ATOM    115  C   CYS A  10       3.138  -1.761   0.166  1.00  0.00      A       
ATOM    116  CA  CYS A  10       3.269  -0.533  -0.758  1.00  0.00      A       
ATOM    117  CB  CYS A  10       3.508  -0.961  -2.224  1.00  0.00      A       
ATOM    118  HN  CYS A  10       4.060   1.292  -0.001  1.00  0.00      A       
ATOM    119  HA  CYS A  10       2.337   0.013  -0.712  1.00  0.00      A       
ATOM    120  HB2 CYS A  10       3.637  -0.078  -2.832  1.00  0.00      A       
ATOM    121  HB1 CYS A  10       4.405  -1.560  -2.274  1.00  0.00      A       
ATOM    122  N   CYS A  10       4.329   0.394  -0.289  1.00  0.00      A       
ATOM    123  O   CYS A  10       2.862  -2.880  -0.288  1.00  0.00      A       
ATOM    124  SG  CYS A  10       2.147  -1.935  -2.947  1.00  0.00      A       
ATOM    125  C   THR A  11       2.381  -2.126   3.687  1.00  0.00      A       
ATOM    126  CA  THR A  11       3.227  -2.584   2.482  1.00  0.00      A       
ATOM    127  CB  THR A  11       4.640  -3.029   2.954  1.00  0.00      A       
ATOM    128  CG2 THR A  11       4.634  -4.482   3.422  1.00  0.00      A       
ATOM    129  HN  THR A  11       3.514  -0.610   1.763  1.00  0.00      A       
ATOM    130  HA  THR A  11       2.740  -3.432   2.023  1.00  0.00      A       
ATOM    131  HB  THR A  11       4.941  -2.402   3.780  1.00  0.00      A       
ATOM    132  HG1 THR A  11       6.477  -2.857   2.252  1.00  0.00      A       
ATOM    133 HG21 THR A  11       5.627  -4.760   3.743  1.00  0.00      A       
ATOM    134 HG22 THR A  11       4.326  -5.121   2.608  1.00  0.00      A       
ATOM    135 HG23 THR A  11       3.946  -4.591   4.247  1.00  0.00      A       
ATOM    136  N   THR A  11       3.317  -1.525   1.472  1.00  0.00      A       
ATOM    137  O   THR A  11       2.668  -2.477   4.839  1.00  0.00      A       
ATOM    138  OG1 THR A  11       5.589  -2.887   1.888  1.00  0.00      A       
ATOM    139  C   GLY A  12      -1.016  -0.884   4.004  1.00  0.00      A       
ATOM    140  CA  GLY A  12       0.434  -0.859   4.438  1.00  0.00      A       
ATOM    141  HN  GLY A  12       1.145  -1.135   2.460  1.00  0.00      A       
ATOM    142  HA2 GLY A  12       0.548  -1.470   5.320  1.00  0.00      A       
ATOM    143  HA1 GLY A  12       0.705   0.150   4.680  1.00  0.00      A       
ATOM    144  N   GLY A  12       1.324  -1.359   3.397  1.00  0.00      A       
ATOM    145  O   GLY A  12      -1.568   0.141   3.594  1.00  0.00      A       
ATOM    146  C   CYS A  13      -3.933  -2.262   4.931  1.00  0.00      A       
ATOM    147  CA  CYS A  13      -3.015  -2.273   3.710  1.00  0.00      A       
ATOM    148  CB  CYS A  13      -3.160  -3.593   2.943  1.00  0.00      A       
ATOM    149  HN  CYS A  13      -1.108  -2.821   4.450  1.00  0.00      A       
ATOM    150  HA  CYS A  13      -3.298  -1.460   3.056  1.00  0.00      A       
ATOM    151  HB2 CYS A  13      -2.641  -4.371   3.482  1.00  0.00      A       
ATOM    152  HB1 CYS A  13      -4.208  -3.847   2.877  1.00  0.00      A       
ATOM    153  N   CYS A  13      -1.620  -2.065   4.100  1.00  0.00      A       
ATOM    154  OT1 CYS A  13      -4.830  -1.394   4.986  1.00  0.00      A       
ATOM    155  OT2 CYS A  13      -3.743  -3.114   5.828  1.00  0.00      A       
ATOM    156  SG  CYS A  13      -2.489  -3.554   1.247  1.00  0.00      A       
END


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