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
625097 6anf 30333 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   H00 A   1       3.178  -6.249   0.874  1.00  0.00      A       
ATOM      2  CA  H00 A   1       2.092  -7.092   0.234  1.00  0.00      A       
ATOM      3  CB  H00 A   1       0.759  -6.852   0.924  1.00  0.00      A       
ATOM      4  CG  H00 A   1       0.000  -5.700   0.285  1.00  0.00      A       
ATOM      5  HA1 H00 A   1       2.353  -8.137   0.325  1.00  0.00      A       
ATOM      6  HA2 H00 A   1       2.007  -6.832  -0.811  1.00  0.00      A       
ATOM      7  HB1 H00 A   1       0.940  -6.621   1.964  1.00  0.00      A       
ATOM      8  HB2 H00 A   1       0.159  -7.747   0.848  1.00  0.00      A       
ATOM      9  HG1 H00 A   1       0.570  -5.333  -0.556  1.00  0.00      A       
ATOM     10  HG2 H00 A   1      -0.112  -4.911   1.016  1.00  0.00      A       
ATOM     11  O   H00 A   1       3.445  -6.371   2.076  1.00  0.00      A       
ATOM     12  SD  H00 A   1      -1.639  -6.183  -0.293  1.00  0.00      A       
ATOM     13  C   THR A   2       4.262  -3.353   1.322  1.00  0.00      A       
ATOM     14  CA  THR A   2       4.865  -4.534   0.562  1.00  0.00      A       
ATOM     15  CB  THR A   2       5.725  -4.010  -0.613  1.00  0.00      A       
ATOM     16  CG2 THR A   2       6.324  -5.165  -1.396  1.00  0.00      A       
ATOM     17  HN  THR A   2       3.555  -5.348  -0.872  1.00  0.00      A       
ATOM     18  HA  THR A   2       5.496  -5.104   1.229  1.00  0.00      A       
ATOM     19  HB  THR A   2       6.525  -3.405  -0.221  1.00  0.00      A       
ATOM     20  HG1 THR A   2       5.487  -2.815  -2.167  1.00  0.00      A       
ATOM     21 HG21 THR A   2       6.920  -4.779  -2.209  1.00  0.00      A       
ATOM     22 HG22 THR A   2       5.529  -5.778  -1.793  1.00  0.00      A       
ATOM     23 HG23 THR A   2       6.945  -5.760  -0.744  1.00  0.00      A       
ATOM     24  N   THR A   2       3.808  -5.402   0.077  1.00  0.00      A       
ATOM     25  O   THR A   2       3.061  -3.084   1.194  1.00  0.00      A       
ATOM     26  OG1 THR A   2       4.921  -3.211  -1.490  1.00  0.00      A       
ATOM     27  C   PRO A   3       3.836  -0.479   2.011  1.00  0.00      A       
ATOM     28  CA  PRO A   3       4.600  -1.473   2.893  1.00  0.00      A       
ATOM     29  CB  PRO A   3       5.891  -0.827   3.437  1.00  0.00      A       
ATOM     30  CD  PRO A   3       6.475  -2.937   2.445  1.00  0.00      A       
ATOM     31  CG  PRO A   3       7.025  -1.597   2.831  1.00  0.00      A       
ATOM     32  HA  PRO A   3       3.969  -1.769   3.718  1.00  0.00      A       
ATOM     33  HB2 PRO A   3       5.923   0.212   3.142  1.00  0.00      A       
ATOM     34  HB1 PRO A   3       5.901  -0.897   4.515  1.00  0.00      A       
ATOM     35  HD2 PRO A   3       6.991  -3.324   1.582  1.00  0.00      A       
ATOM     36  HD1 PRO A   3       6.552  -3.628   3.271  1.00  0.00      A       
ATOM     37  HG2 PRO A   3       7.394  -1.079   1.960  1.00  0.00      A       
ATOM     38  HG1 PRO A   3       7.816  -1.713   3.559  1.00  0.00      A       
ATOM     39  N   PRO A   3       5.070  -2.639   2.145  1.00  0.00      A       
ATOM     40  O   PRO A   3       2.801   0.048   2.418  1.00  0.00      A       
ATOM     41  C   ARG A   4       2.363   0.102  -0.603  1.00  0.00      A       
ATOM     42  CA  ARG A   4       3.666   0.689  -0.121  1.00  0.00      A       
ATOM     43  CB  ARG A   4       4.556   1.027  -1.312  1.00  0.00      A       
ATOM     44  CD  ARG A   4       6.667   2.110  -2.127  1.00  0.00      A       
ATOM     45  CG  ARG A   4       5.801   1.773  -0.924  1.00  0.00      A       
ATOM     46  CZ  ARG A   4       8.378   0.953  -3.482  1.00  0.00      A       
ATOM     47  HN  ARG A   4       5.166  -0.681   0.519  1.00  0.00      A       
ATOM     48  HA  ARG A   4       3.453   1.597   0.424  1.00  0.00      A       
ATOM     49  HB2 ARG A   4       4.847   0.110  -1.802  1.00  0.00      A       
ATOM     50  HB1 ARG A   4       3.995   1.636  -2.006  1.00  0.00      A       
ATOM     51  HD2 ARG A   4       6.051   2.579  -2.879  1.00  0.00      A       
ATOM     52  HD1 ARG A   4       7.439   2.799  -1.816  1.00  0.00      A       
ATOM     53  HE  ARG A   4       6.887   0.055  -2.486  1.00  0.00      A       
ATOM     54  HG2 ARG A   4       5.526   2.685  -0.415  1.00  0.00      A       
ATOM     55  HG1 ARG A   4       6.353   1.132  -0.256  1.00  0.00      A       
ATOM     56 HH11 ARG A   4       8.551   2.976  -3.489  1.00  0.00      A       
ATOM     57 HH12 ARG A   4       9.751   2.125  -4.401  1.00  0.00      A       
ATOM     58 HH21 ARG A   4       8.484  -1.058  -3.693  1.00  0.00      A       
ATOM     59 HH22 ARG A   4       9.709  -0.160  -4.527  1.00  0.00      A       
ATOM     60  N   ARG A   4       4.337  -0.231   0.801  1.00  0.00      A       
ATOM     61  NE  ARG A   4       7.296   0.926  -2.703  1.00  0.00      A       
ATOM     62  NH1 ARG A   4       8.936   2.110  -3.815  1.00  0.00      A       
ATOM     63  NH2 ARG A   4       8.897  -0.176  -3.932  1.00  0.00      A       
ATOM     64  O   ARG A   4       1.326   0.750  -0.539  1.00  0.00      A       
ATOM     65  C   GLN A   5       0.113  -1.878  -0.528  1.00  0.00      A       
ATOM     66  CA  GLN A   5       1.234  -1.839  -1.567  1.00  0.00      A       
ATOM     67  CB  GLN A   5       1.575  -3.267  -1.992  1.00  0.00      A       
ATOM     68  CD  GLN A   5       2.796  -4.805  -3.568  1.00  0.00      A       
ATOM     69  CG  GLN A   5       2.427  -3.369  -3.244  1.00  0.00      A       
ATOM     70  HN  GLN A   5       3.297  -1.592  -1.057  1.00  0.00      A       
ATOM     71  HA  GLN A   5       0.881  -1.296  -2.431  1.00  0.00      A       
ATOM     72  HB2 GLN A   5       2.111  -3.748  -1.186  1.00  0.00      A       
ATOM     73  HB1 GLN A   5       0.652  -3.803  -2.168  1.00  0.00      A       
ATOM     74 HE21 GLN A   5       2.843  -4.379  -5.498  1.00  0.00      A       
ATOM     75 HE22 GLN A   5       3.195  -6.025  -5.074  1.00  0.00      A       
ATOM     76  HG2 GLN A   5       1.876  -2.956  -4.076  1.00  0.00      A       
ATOM     77  HG1 GLN A   5       3.335  -2.803  -3.095  1.00  0.00      A       
ATOM     78  N   GLN A   5       2.422  -1.139  -1.059  1.00  0.00      A       
ATOM     79  NE2 GLN A   5       2.963  -5.099  -4.839  1.00  0.00      A       
ATOM     80  O   GLN A   5      -1.045  -1.652  -0.854  1.00  0.00      A       
ATOM     81  OE1 GLN A   5       2.929  -5.645  -2.672  1.00  0.00      A       
ATOM     82  C   ALA A   6      -1.212  -0.925   2.054  1.00  0.00      A       
ATOM     83  CA  ALA A   6      -0.521  -2.262   1.795  1.00  0.00      A       
ATOM     84  CB  ALA A   6       0.133  -2.776   3.070  1.00  0.00      A       
ATOM     85  HN  ALA A   6       1.420  -2.308   0.926  1.00  0.00      A       
ATOM     86  HA  ALA A   6      -1.266  -2.980   1.488  1.00  0.00      A       
ATOM     87  HB1 ALA A   6       0.622  -3.718   2.870  1.00  0.00      A       
ATOM     88  HB2 ALA A   6      -0.621  -2.916   3.830  1.00  0.00      A       
ATOM     89  HB3 ALA A   6       0.863  -2.057   3.414  1.00  0.00      A       
ATOM     90  N   ALA A   6       0.468  -2.160   0.722  1.00  0.00      A       
ATOM     91  O   ALA A   6      -2.433  -0.864   2.190  1.00  0.00      A       
ATOM     92  C   ARG A   7      -1.763   1.949   1.130  1.00  0.00      A       
ATOM     93  CA  ARG A   7      -0.978   1.478   2.332  1.00  0.00      A       
ATOM     94  CB  ARG A   7       0.136   2.459   2.664  1.00  0.00      A       
ATOM     95  CD  ARG A   7       2.075   2.982   4.167  1.00  0.00      A       
ATOM     96  CG  ARG A   7       0.848   2.116   3.949  1.00  0.00      A       
ATOM     97  CZ  ARG A   7       4.217   3.381   2.997  1.00  0.00      A       
ATOM     98  HN  ARG A   7       0.534   0.036   1.961  1.00  0.00      A       
ATOM     99  HA  ARG A   7      -1.649   1.411   3.176  1.00  0.00      A       
ATOM    100  HB2 ARG A   7       0.858   2.457   1.860  1.00  0.00      A       
ATOM    101  HB1 ARG A   7      -0.284   3.449   2.761  1.00  0.00      A       
ATOM    102  HD2 ARG A   7       1.808   4.015   4.004  1.00  0.00      A       
ATOM    103  HD1 ARG A   7       2.416   2.855   5.184  1.00  0.00      A       
ATOM    104  HE  ARG A   7       3.076   1.738   2.820  1.00  0.00      A       
ATOM    105  HG2 ARG A   7       0.168   2.239   4.779  1.00  0.00      A       
ATOM    106  HG1 ARG A   7       1.152   1.083   3.871  1.00  0.00      A       
ATOM    107 HH11 ARG A   7       3.626   4.922   4.174  1.00  0.00      A       
ATOM    108 HH12 ARG A   7       5.135   5.149   3.362  1.00  0.00      A       
ATOM    109 HH21 ARG A   7       5.086   2.048   1.743  1.00  0.00      A       
ATOM    110 HH22 ARG A   7       5.967   3.511   1.975  1.00  0.00      A       
ATOM    111  N   ARG A   7      -0.432   0.145   2.095  1.00  0.00      A       
ATOM    112  NE  ARG A   7       3.156   2.620   3.254  1.00  0.00      A       
ATOM    113  NH1 ARG A   7       4.335   4.576   3.554  1.00  0.00      A       
ATOM    114  NH2 ARG A   7       5.159   2.945   2.175  1.00  0.00      A       
ATOM    115  O   ARG A   7      -2.828   2.549   1.263  1.00  0.00      A       
ATOM    116  C   ALA A   8      -3.239   1.291  -1.400  1.00  0.00      A       
ATOM    117  CA  ALA A   8      -1.902   2.012  -1.289  1.00  0.00      A       
ATOM    118  CB  ALA A   8      -1.018   1.678  -2.480  1.00  0.00      A       
ATOM    119  HN  ALA A   8      -0.367   1.195  -0.062  1.00  0.00      A       
ATOM    120  HA  ALA A   8      -2.078   3.078  -1.281  1.00  0.00      A       
ATOM    121  HB1 ALA A   8      -0.843   0.613  -2.510  1.00  0.00      A       
ATOM    122  HB2 ALA A   8      -0.075   2.195  -2.385  1.00  0.00      A       
ATOM    123  HB3 ALA A   8      -1.510   1.988  -3.390  1.00  0.00      A       
ATOM    124  N   ALA A   8      -1.238   1.658  -0.043  1.00  0.00      A       
ATOM    125  O   ALA A   8      -4.247   1.882  -1.800  1.00  0.00      A       
ATOM    126  C   ALA A   9      -5.461  -0.242  -0.052  1.00  0.00      A       
ATOM    127  CA  ALA A   9      -4.457  -0.782  -1.053  1.00  0.00      A       
ATOM    128  CB  ALA A   9      -4.139  -2.239  -0.751  1.00  0.00      A       
ATOM    129  HN  ALA A   9      -2.402  -0.404  -0.747  1.00  0.00      A       
ATOM    130  HA  ALA A   9      -4.882  -0.723  -2.045  1.00  0.00      A       
ATOM    131  HB1 ALA A   9      -3.467  -2.625  -1.503  1.00  0.00      A       
ATOM    132  HB2 ALA A   9      -5.051  -2.816  -0.750  1.00  0.00      A       
ATOM    133  HB3 ALA A   9      -3.669  -2.308   0.219  1.00  0.00      A       
ATOM    134  N   ALA A   9      -3.245   0.016  -1.033  1.00  0.00      A       
ATOM    135  O   ALA A   9      -6.649  -0.145  -0.344  1.00  0.00      A       
ATOM    136  C   ARG A  10      -6.427   1.994   1.735  1.00  0.00      A       
ATOM    137  CA  ARG A  10      -5.806   0.672   2.173  1.00  0.00      A       
ATOM    138  CB  ARG A  10      -4.977   0.878   3.435  1.00  0.00      A       
ATOM    139  CD  ARG A  10      -4.919   1.388   5.877  1.00  0.00      A       
ATOM    140  CG  ARG A  10      -5.785   1.312   4.637  1.00  0.00      A       
ATOM    141  CZ  ARG A  10      -3.344  -0.088   7.090  1.00  0.00      A       
ATOM    142  HN  ARG A  10      -4.012   0.006   1.299  1.00  0.00      A       
ATOM    143  HA  ARG A  10      -6.593  -0.036   2.382  1.00  0.00      A       
ATOM    144  HB2 ARG A  10      -4.479  -0.048   3.680  1.00  0.00      A       
ATOM    145  HB1 ARG A  10      -4.231   1.634   3.239  1.00  0.00      A       
ATOM    146  HD2 ARG A  10      -4.141   2.118   5.713  1.00  0.00      A       
ATOM    147  HD1 ARG A  10      -5.531   1.692   6.713  1.00  0.00      A       
ATOM    148  HE  ARG A  10      -4.631  -0.683   5.675  1.00  0.00      A       
ATOM    149  HG2 ARG A  10      -6.214   2.285   4.443  1.00  0.00      A       
ATOM    150  HG1 ARG A  10      -6.571   0.591   4.797  1.00  0.00      A       
ATOM    151 HH11 ARG A  10      -3.235   1.863   7.640  1.00  0.00      A       
ATOM    152 HH12 ARG A  10      -2.154   0.807   8.478  1.00  0.00      A       
ATOM    153 HH21 ARG A  10      -3.205  -2.082   6.771  1.00  0.00      A       
ATOM    154 HH22 ARG A  10      -2.135  -1.453   7.970  1.00  0.00      A       
ATOM    155  N   ARG A  10      -4.971   0.123   1.123  1.00  0.00      A       
ATOM    156  NE  ARG A  10      -4.302   0.096   6.183  1.00  0.00      A       
ATOM    157  NH1 ARG A  10      -2.874   0.941   7.790  1.00  0.00      A       
ATOM    158  NH2 ARG A  10      -2.857  -1.299   7.294  1.00  0.00      A       
ATOM    159  O   ARG A  10      -7.600   2.254   1.990  1.00  0.00      A       
ATOM    160  C   ALA A  11      -7.174   3.946  -0.488  1.00  0.00      A       
ATOM    161  CA  ALA A  11      -6.098   4.110   0.584  1.00  0.00      A       
ATOM    162  CB  ALA A  11      -4.930   4.925   0.047  1.00  0.00      A       
ATOM    163  HN  ALA A  11      -4.698   2.556   0.905  1.00  0.00      A       
ATOM    164  HA  ALA A  11      -6.522   4.642   1.423  1.00  0.00      A       
ATOM    165  HB1 ALA A  11      -4.505   4.424  -0.810  1.00  0.00      A       
ATOM    166  HB2 ALA A  11      -4.178   5.025   0.815  1.00  0.00      A       
ATOM    167  HB3 ALA A  11      -5.279   5.904  -0.244  1.00  0.00      A       
ATOM    168  N   ALA A  11      -5.633   2.819   1.067  1.00  0.00      A       
ATOM    169  O   ALA A  11      -8.078   4.774  -0.604  1.00  0.00      A       
ATOM    170  C   ALA A  12      -9.277   1.896  -1.768  1.00  0.00      A       
ATOM    171  CA  ALA A  12      -8.047   2.616  -2.315  1.00  0.00      A       
ATOM    172  CB  ALA A  12      -7.407   1.807  -3.432  1.00  0.00      A       
ATOM    173  HN  ALA A  12      -6.336   2.250  -1.122  1.00  0.00      A       
ATOM    174  HA  ALA A  12      -8.356   3.569  -2.721  1.00  0.00      A       
ATOM    175  HB1 ALA A  12      -6.536   2.328  -3.801  1.00  0.00      A       
ATOM    176  HB2 ALA A  12      -8.116   1.679  -4.236  1.00  0.00      A       
ATOM    177  HB3 ALA A  12      -7.113   0.839  -3.053  1.00  0.00      A       
ATOM    178  N   ALA A  12      -7.079   2.876  -1.261  1.00  0.00      A       
ATOM    179  O   ALA A  12     -10.405   2.187  -2.161  1.00  0.00      A       
ATOM    180  C   DAL A  13     -10.053  -1.257  -0.598  1.00  0.00      A       
ATOM    181  CA  DAL A  13     -10.149   0.223  -0.247  1.00  0.00      A       
ATOM    182  CB  DAL A  13     -10.159   0.408   1.261  1.00  0.00      A       
ATOM    183  H   DAL A  13      -8.137   0.805  -0.550  1.00  0.00      A       
ATOM    184  HA  DAL A  13     -11.076   0.614  -0.639  1.00  0.00      A       
ATOM    185  HB1 DAL A  13     -11.005  -0.114   1.682  1.00  0.00      A       
ATOM    186  HB2 DAL A  13     -10.231   1.460   1.494  1.00  0.00      A       
ATOM    187  HB3 DAL A  13      -9.246   0.009   1.678  1.00  0.00      A       
ATOM    188  N   DAL A  13      -9.059   0.980  -0.843  1.00  0.00      A       
ATOM    189  O   DAL A  13     -11.047  -1.979  -0.563  1.00  0.00      A       
ATOM    190  C   CYS A  14      -8.250  -3.896  -0.035  1.00  0.00      A       
ATOM    191  CA  CYS A  14      -8.642  -3.099  -1.277  1.00  0.00      A       
ATOM    192  CB  CYS A  14      -7.568  -3.226  -2.360  1.00  0.00      A       
ATOM    193  HN  CYS A  14      -8.097  -1.085  -0.961  1.00  0.00      A       
ATOM    194  HA  CYS A  14      -9.572  -3.491  -1.658  1.00  0.00      A       
ATOM    195  HB2 CYS A  14      -6.627  -3.467  -1.890  1.00  0.00      A       
ATOM    196  HB1 CYS A  14      -7.841  -4.031  -3.026  1.00  0.00      A       
ATOM    197  N   CYS A  14      -8.860  -1.705  -0.938  1.00  0.00      A       
ATOM    198  O   CYS A  14      -7.065  -4.040   0.282  1.00  0.00      A       
ATOM    199  SG  CYS A  14      -7.340  -1.729  -3.348  1.00  0.00      A       
ATOM    200  HN1 NH2 A  15     -10.072  -3.874   0.719  1.00  0.00      A       
ATOM    201  HN2 NH2 A  15      -9.211  -5.354   0.885  1.00  0.00      A       
ATOM    202  N   NH2 A  15      -9.243  -4.397   0.677  1.00  0.00      A       
TER
ATOM    203  CB1 B0i B 101      -1.203  -7.217  -1.709  1.00  0.00      B       
ATOM    204  CB2 B0i B 101      -6.467  -2.395  -4.782  1.00  0.00      B       
ATOM    205  CD1 B0i B 101      -2.028  -5.319  -3.116  1.00  0.00      B       
ATOM    206  CD2 B0i B 101      -0.712  -7.006  -4.158  1.00  0.00      B       
ATOM    207  CD3 B0i B 101      -4.233  -3.514  -4.543  1.00  0.00      B       
ATOM    208  CD4 B0i B 101      -4.307  -1.131  -4.583  1.00  0.00      B       
ATOM    209  CE1 B0i B 101      -2.136  -4.652  -4.323  1.00  0.00      B       
ATOM    210  CE2 B0i B 101      -0.815  -6.348  -5.367  1.00  0.00      B       
ATOM    211  CE3 B0i B 101      -2.857  -3.473  -4.406  1.00  0.00      B       
ATOM    212  CE4 B0i B 101      -2.931  -1.083  -4.446  1.00  0.00      B       
ATOM    213  CG1 B0i B 101      -1.317  -6.498  -3.020  1.00  0.00      B       
ATOM    214  CG2 B0i B 101      -4.972  -2.345  -4.632  1.00  0.00      B       
ATOM    215  CZ1 B0i B 101      -1.527  -5.169  -5.450  1.00  0.00      B       
ATOM    216  CZ2 B0i B 101      -2.205  -2.255  -4.357  1.00  0.00      B       
ATOM    217  H1  B0i B 101      -0.182  -7.540  -1.599  1.00  0.00      B       
ATOM    218  H2  B0i B 101      -6.761  -3.425  -4.923  1.00  0.00      B       
ATOM    219 HB11 B0i B 101      -1.856  -8.077  -1.731  1.00  0.00      B       
ATOM    220 HB21 B0i B 101      -6.740  -1.819  -5.653  1.00  0.00      B       
ATOM    221  HD1 B0i B 101      -2.497  -4.923  -2.230  1.00  0.00      B       
ATOM    222  HD2 B0i B 101      -0.155  -7.928  -4.094  1.00  0.00      B       
ATOM    223  HD3 B0i B 101      -4.741  -4.466  -4.580  1.00  0.00      B       
ATOM    224  HD4 B0i B 101      -4.872  -0.214  -4.652  1.00  0.00      B       
ATOM    225  HE2 B0i B 101      -0.338  -6.755  -6.247  1.00  0.00      B       
ATOM    226  HE4 B0i B 101      -2.426  -0.129  -4.408  1.00  0.00      B       
ATOM    227  HZ1 B0i B 101      -1.609  -4.653  -6.395  1.00  0.00      B       
ATOM    228  HZ2 B0i B 101      -1.131  -2.221  -4.250  1.00  0.00      B       
END


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