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
374415 1ee7 4604 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ACE A   1     -13.218  -2.653   0.197  1.00  0.00      A       
ATOM      2  CH3 ACE A   1     -14.634  -2.277   0.471  1.00  0.00      A       
ATOM      3  H1  ACE A   1     -15.093  -3.029   1.111  1.00  0.00      A       
ATOM      4  H2  ACE A   1     -14.662  -1.308   0.970  1.00  0.00      A       
ATOM      5  H3  ACE A   1     -15.182  -2.216  -0.470  1.00  0.00      A       
ATOM      6  O   ACE A   1     -12.296  -1.935   0.580  1.00  0.00      A       
ATOM      7  C   PHE A   2     -10.944  -3.230  -1.592  1.00  0.00      A       
ATOM      8  CA  PHE A   2     -11.733  -4.278  -0.805  1.00  0.00      A       
ATOM      9  CB  PHE A   2     -11.924  -5.519  -1.679  1.00  0.00      A       
ATOM     10  CD1 PHE A   2     -10.206  -7.204  -0.987  1.00  0.00      A       
ATOM     11  CD2 PHE A   2      -9.931  -6.131  -3.066  1.00  0.00      A       
ATOM     12  CE1 PHE A   2      -9.014  -7.942  -1.210  1.00  0.00      A       
ATOM     13  CE2 PHE A   2      -8.739  -6.870  -3.289  1.00  0.00      A       
ATOM     14  CG  PHE A   2     -10.640  -6.314  -1.920  1.00  0.00      A       
ATOM     15  CZ  PHE A   2      -8.305  -7.760  -2.357  1.00  0.00      A       
ATOM     16  HN  PHE A   2     -13.814  -4.366  -0.776  1.00  0.00      A       
ATOM     17  HA  PHE A   2     -11.219  -4.489   0.133  1.00  0.00      A       
ATOM     18  HB2 PHE A   2     -12.661  -6.171  -1.211  1.00  0.00      A       
ATOM     19  HB1 PHE A   2     -12.335  -5.213  -2.642  1.00  0.00      A       
ATOM     20  HD1 PHE A   2     -10.774  -7.351  -0.068  1.00  0.00      A       
ATOM     21  HD2 PHE A   2     -10.278  -5.418  -3.814  1.00  0.00      A       
ATOM     22  HE1 PHE A   2      -8.667  -8.656  -0.463  1.00  0.00      A       
ATOM     23  HE2 PHE A   2      -8.171  -6.723  -4.208  1.00  0.00      A       
ATOM     24  HZ  PHE A   2      -7.390  -8.326  -2.528  1.00  0.00      A       
ATOM     25  N   PHE A   2     -13.059  -3.787  -0.469  1.00  0.00      A       
ATOM     26  O   PHE A   2      -9.740  -3.078  -1.396  1.00  0.00      A       
ATOM     27  C   ABA A   3     -10.429  -0.362  -2.305  1.00  0.00      A       
ATOM     28  CA  ABA A   3     -11.025  -1.412  -3.245  1.00  0.00      A       
ATOM     29  H   ABA A   3     -12.617  -2.682  -2.598  1.00  0.00      A       
ATOM     30  N   ABA A   3     -11.637  -2.505  -2.489  1.00  0.00      A       
ATOM     31  O   ABA A   3      -9.281   0.048  -2.474  1.00  0.00      A       
ATOM     32  C   SER A   4      -9.967   0.331   0.744  1.00  0.00      A       
ATOM     33  CA  SER A   4     -10.790   1.014  -0.349  1.00  0.00      A       
ATOM     34  CB  SER A   4     -11.982   1.751   0.266  1.00  0.00      A       
ATOM     35  HN  SER A   4     -12.162  -0.306  -1.196  1.00  0.00      A       
ATOM     36  HA  SER A   4     -10.175   1.721  -0.906  1.00  0.00      A       
ATOM     37  HB2 SER A   4     -12.617   1.037   0.791  1.00  0.00      A       
ATOM     38  HB1 SER A   4     -11.623   2.464   1.007  1.00  0.00      A       
ATOM     39  HG  SER A   4     -12.478   3.396  -0.759  1.00  0.00      A       
ATOM     40  N   SER A   4     -11.230   0.033  -1.326  1.00  0.00      A       
ATOM     41  O   SER A   4      -9.326   1.000   1.553  1.00  0.00      A       
ATOM     42  OG  SER A   4     -12.752   2.436  -0.718  1.00  0.00      A       
ATOM     43  C   ABA A   5      -7.716  -1.840   1.249  1.00  0.00      A       
ATOM     44  CA  ABA A   5      -9.178  -1.793   1.697  1.00  0.00      A       
ATOM     45  H   ABA A   5     -10.533  -1.496   0.073  1.00  0.00      A       
ATOM     46  N   ABA A   5      -9.989  -1.014   0.762  1.00  0.00      A       
ATOM     47  O   ABA A   5      -6.809  -1.637   2.055  1.00  0.00      A       
ATOM     48  C   Div A   6      -5.606  -0.735  -0.657  1.00  0.00      A       
ATOM     49  CA  Div A   6      -6.176  -2.152  -0.696  1.00  0.00      A       
ATOM     50  CB1 Div A   6      -5.190  -3.044   0.124  1.00  0.00      A       
ATOM     51  CB2 Div A   6      -6.303  -2.543  -2.202  1.00  0.00      A       
ATOM     52  CG1 Div A   6      -5.561  -4.547   0.208  1.00  0.00      A       
ATOM     53  H   Div A   6      -8.298  -2.254  -0.661  1.00  0.00      A       
ATOM     54 HB11 Div A   6      -5.135  -2.691   1.154  1.00  0.00      A       
ATOM     55 HB12 Div A   6      -4.209  -2.978  -0.346  1.00  0.00      A       
ATOM     56 HB21 Div A   6      -6.282  -3.621  -2.359  1.00  0.00      A       
ATOM     57 HB22 Div A   6      -5.510  -2.137  -2.829  1.00  0.00      A       
ATOM     58 HB23 Div A   6      -7.255  -2.167  -2.578  1.00  0.00      A       
ATOM     59 HG11 Div A   6      -4.781  -5.166  -0.237  1.00  0.00      A       
ATOM     60 HG12 Div A   6      -5.658  -4.836   1.255  1.00  0.00      A       
ATOM     61 HG13 Div A   6      -6.512  -4.748  -0.284  1.00  0.00      A       
ATOM     62  N   Div A   6      -7.509  -2.098  -0.064  1.00  0.00      A       
ATOM     63  O   Div A   6      -4.438  -0.618  -0.319  1.00  0.00      A       
ATOM     64  C   LEU A   7      -5.144   1.885   0.330  1.00  0.00      A       
ATOM     65  CA  LEU A   7      -5.919   1.643  -0.967  1.00  0.00      A       
ATOM     66  CB  LEU A   7      -7.071   2.625  -1.188  1.00  0.00      A       
ATOM     67  CD1 LEU A   7      -6.445   2.802  -3.624  1.00  0.00      A       
ATOM     68  CD2 LEU A   7      -8.242   4.308  -2.656  1.00  0.00      A       
ATOM     69  CG  LEU A   7      -6.933   3.562  -2.389  1.00  0.00      A       
ATOM     70  HN  LEU A   7      -7.361   0.170  -1.263  1.00  0.00      A       
ATOM     71  HA  LEU A   7      -5.232   1.758  -1.806  1.00  0.00      A       
ATOM     72  HB2 LEU A   7      -7.992   2.054  -1.301  1.00  0.00      A       
ATOM     73  HB1 LEU A   7      -7.181   3.233  -0.289  1.00  0.00      A       
ATOM     74 HD11 LEU A   7      -7.119   2.993  -4.459  1.00  0.00      A       
ATOM     75 HD12 LEU A   7      -5.441   3.137  -3.884  1.00  0.00      A       
ATOM     76 HD13 LEU A   7      -6.427   1.734  -3.409  1.00  0.00      A       
ATOM     77 HD21 LEU A   7      -8.835   4.340  -1.742  1.00  0.00      A       
ATOM     78 HD22 LEU A   7      -8.021   5.325  -2.982  1.00  0.00      A       
ATOM     79 HD23 LEU A   7      -8.803   3.791  -3.435  1.00  0.00      A       
ATOM     80  HG  LEU A   7      -6.178   4.312  -2.153  1.00  0.00      A       
ATOM     81  N   LEU A   7      -6.406   0.275  -0.987  1.00  0.00      A       
ATOM     82  O   LEU A   7      -4.102   2.539   0.322  1.00  0.00      A       
ATOM     83  C   GLN A   8      -3.707   0.771   2.740  1.00  0.00      A       
ATOM     84  CA  GLN A   8      -5.055   1.494   2.715  1.00  0.00      A       
ATOM     85  CB  GLN A   8      -5.972   0.982   3.827  1.00  0.00      A       
ATOM     86  CD  GLN A   8      -7.097   1.858   5.908  1.00  0.00      A       
ATOM     87  CG  GLN A   8      -6.790   2.125   4.433  1.00  0.00      A       
ATOM     88  HN  GLN A   8      -6.531   0.815   1.411  1.00  0.00      A       
ATOM     89  HA  GLN A   8      -4.903   2.566   2.842  1.00  0.00      A       
ATOM     90  HB2 GLN A   8      -6.643   0.221   3.429  1.00  0.00      A       
ATOM     91  HB1 GLN A   8      -5.376   0.506   4.605  1.00  0.00      A       
ATOM     92 HE21 GLN A   8      -8.888   2.766   5.651  1.00  0.00      A       
ATOM     93 HE22 GLN A   8      -8.578   2.177   7.250  1.00  0.00      A       
ATOM     94  HG2 GLN A   8      -6.241   3.061   4.335  1.00  0.00      A       
ATOM     95  HG1 GLN A   8      -7.722   2.242   3.879  1.00  0.00      A       
ATOM     96  N   GLN A   8      -5.683   1.345   1.413  1.00  0.00      A       
ATOM     97  NE2 GLN A   8      -8.286   2.304   6.302  1.00  0.00      A       
ATOM     98  O   GLN A   8      -2.764   1.231   3.382  1.00  0.00      A       
ATOM     99  OE1 GLN A   8      -6.305   1.286   6.639  1.00  0.00      A       
ATOM    100  C   GLY A   9      -1.453  -0.540   0.964  1.00  0.00      A       
ATOM    101  CA  GLY A   9      -2.441  -1.139   1.966  1.00  0.00      A       
ATOM    102  HN  GLY A   9      -4.430  -0.716   1.514  1.00  0.00      A       
ATOM    103  HA2 GLY A   9      -1.980  -1.188   2.953  1.00  0.00      A       
ATOM    104  HA1 GLY A   9      -2.683  -2.162   1.677  1.00  0.00      A       
ATOM    105  N   GLY A   9      -3.658  -0.348   2.033  1.00  0.00      A       
ATOM    106  O   GLY A   9      -0.253  -0.482   1.229  1.00  0.00      A       
ATOM    107  C   ABA A  10      -0.410   1.777  -0.597  1.00  0.00      A       
ATOM    108  CA  ABA A  10      -1.150   0.582  -1.202  1.00  0.00      A       
ATOM    109  H   ABA A  10      -2.956  -0.171  -0.345  1.00  0.00      A       
ATOM    110  N   ABA A  10      -1.969  -0.093  -0.195  1.00  0.00      A       
ATOM    111  O   ABA A  10       0.805   1.902  -0.749  1.00  0.00      A       
ATOM    112  C   ABA A  11       0.399   3.290   1.915  1.00  0.00      A       
ATOM    113  CA  ABA A  11      -0.557   3.777   0.824  1.00  0.00      A       
ATOM    114  H   ABA A  11      -2.137   2.487   0.190  1.00  0.00      A       
ATOM    115  N   ABA A  11      -1.152   2.650   0.106  1.00  0.00      A       
ATOM    116  O   ABA A  11       1.370   3.970   2.244  1.00  0.00      A       
ATOM    117  C   ALA A  12       2.083   0.752   2.817  1.00  0.00      A       
ATOM    118  CA  ALA A  12       0.928   1.514   3.470  1.00  0.00      A       
ATOM    119  CB  ALA A  12       0.067   0.617   4.362  1.00  0.00      A       
ATOM    120  HN  ALA A  12      -0.693   1.562   2.162  1.00  0.00      A       
ATOM    121  HA  ALA A  12       1.335   2.324   4.076  1.00  0.00      A       
ATOM    122  HB1 ALA A  12       0.442   0.654   5.385  1.00  0.00      A       
ATOM    123  HB2 ALA A  12      -0.965   0.966   4.340  1.00  0.00      A       
ATOM    124  HB3 ALA A  12       0.112  -0.409   3.996  1.00  0.00      A       
ATOM    125  N   ALA A  12       0.099   2.109   2.436  1.00  0.00      A       
ATOM    126  O   ALA A  12       3.037   0.368   3.490  1.00  0.00      A       
ATOM    127  C   ALA A  13       3.839   0.856  -0.001  1.00  0.00      A       
ATOM    128  CA  ALA A  13       2.978  -0.154   0.761  1.00  0.00      A       
ATOM    129  CB  ALA A  13       2.313  -1.171  -0.169  1.00  0.00      A       
ATOM    130  HN  ALA A  13       1.177   0.871   0.972  1.00  0.00      A       
ATOM    131  HA  ALA A  13       3.605  -0.688   1.475  1.00  0.00      A       
ATOM    132  HB1 ALA A  13       2.086  -0.697  -1.124  1.00  0.00      A       
ATOM    133  HB2 ALA A  13       2.989  -2.011  -0.332  1.00  0.00      A       
ATOM    134  HB3 ALA A  13       1.391  -1.531   0.287  1.00  0.00      A       
ATOM    135  N   ALA A  13       1.957   0.556   1.513  1.00  0.00      A       
ATOM    136  O   ALA A  13       4.915   0.515  -0.490  1.00  0.00      A       
ATOM    137  C   ABA A  14       5.573   3.174  -0.256  1.00  0.00      A       
ATOM    138  CA  ABA A  14       4.115   3.190  -0.720  1.00  0.00      A       
ATOM    139  H   ABA A  14       2.470   2.315   0.326  1.00  0.00      A       
ATOM    140  N   ABA A  14       3.354   2.107  -0.096  1.00  0.00      A       
ATOM    141  O   ABA A  14       6.489   3.245  -1.075  1.00  0.00      A       
ATOM    142  C   PRO A  15       7.734   1.655   1.435  1.00  0.00      A       
ATOM    143  CA  PRO A  15       7.079   3.018   1.668  1.00  0.00      A       
ATOM    144  CB  PRO A  15       6.876   3.336   3.141  1.00  0.00      A       
ATOM    145  CD  PRO A  15       4.686   2.976   2.086  1.00  0.00      A       
ATOM    146  CG  PRO A  15       5.403   3.089   3.422  1.00  0.00      A       
ATOM    147  HA  PRO A  15       7.674   3.687   1.223  1.00  0.00      A       
ATOM    148  HB2 PRO A  15       7.505   2.703   3.767  1.00  0.00      A       
ATOM    149  HB1 PRO A  15       7.148   4.369   3.358  1.00  0.00      A       
ATOM    150  HD2 PRO A  15       4.143   2.034   2.006  1.00  0.00      A       
ATOM    151  HD1 PRO A  15       3.957   3.776   1.959  1.00  0.00      A       
ATOM    152  HG2 PRO A  15       5.273   2.176   4.003  1.00  0.00      A       
ATOM    153  HG1 PRO A  15       4.985   3.904   4.012  1.00  0.00      A       
ATOM    154  N   PRO A  15       5.748   3.062   1.087  1.00  0.00      A       
ATOM    155  O   PRO A  15       8.809   1.572   0.844  1.00  0.00      A       
ATOM    156  C   ABA A  16       8.233  -0.904   0.316  1.00  0.00      A       
ATOM    157  CA  ABA A  16       7.542  -0.784   1.676  1.00  0.00      A       
ATOM    158  H   ABA A  16       6.201   0.723   2.379  1.00  0.00      A       
ATOM    159  N   ABA A  16       7.073   0.583   1.907  1.00  0.00      A       
ATOM    160  O   ABA A  16       9.292  -1.521   0.206  1.00  0.00      A       
ATOM    161  C   ABA A  17       9.382   0.774  -2.093  1.00  0.00      A       
ATOM    162  CA  ABA A  17       8.237  -0.240  -2.051  1.00  0.00      A       
ATOM    163  H   ABA A  17       6.770   0.192  -0.559  1.00  0.00      A       
ATOM    164  N   ABA A  17       7.631  -0.293  -0.720  1.00  0.00      A       
ATOM    165  O   ABA A  17      10.484   0.453  -2.535  1.00  0.00      A       
ATOM    166  C   ABA A  18      11.416   2.469  -0.857  1.00  0.00      A       
ATOM    167  CA  ABA A  18      10.146   3.032  -1.497  1.00  0.00      A       
ATOM    168  H   ABA A  18       8.195   2.194  -1.268  1.00  0.00      A       
ATOM    169  N   ABA A  18       9.115   2.001  -1.613  1.00  0.00      A       
ATOM    170  O   ABA A  18      12.501   3.026  -1.026  1.00  0.00      A       
ATOM    171  C   GLN A  19      13.212  -0.040  -0.524  1.00  0.00      A       
ATOM    172  CA  GLN A  19      12.364   0.710   0.505  1.00  0.00      A       
ATOM    173  CB  GLN A  19      11.882  -0.232   1.610  1.00  0.00      A       
ATOM    174  CD  GLN A  19      12.061   1.427   3.501  1.00  0.00      A       
ATOM    175  CG  GLN A  19      11.118   0.535   2.691  1.00  0.00      A       
ATOM    176  HN  GLN A  19      10.358   0.919  -0.014  1.00  0.00      A       
ATOM    177  HA  GLN A  19      12.949   1.514   0.952  1.00  0.00      A       
ATOM    178  HB2 GLN A  19      11.240  -1.002   1.182  1.00  0.00      A       
ATOM    179  HB1 GLN A  19      12.736  -0.742   2.057  1.00  0.00      A       
ATOM    180 HE21 GLN A  19      11.297   3.033   2.535  1.00  0.00      A       
ATOM    181 HE22 GLN A  19      12.528   3.386   3.701  1.00  0.00      A       
ATOM    182  HG2 GLN A  19      10.342   1.146   2.228  1.00  0.00      A       
ATOM    183  HG1 GLN A  19      10.616  -0.168   3.355  1.00  0.00      A       
ATOM    184  N   GLN A  19      11.243   1.365  -0.147  1.00  0.00      A       
ATOM    185  NE2 GLN A  19      11.953   2.723   3.222  1.00  0.00      A       
ATOM    186  O   GLN A  19      14.435   0.091  -0.540  1.00  0.00      A       
ATOM    187  OE1 GLN A  19      12.835   0.968   4.325  1.00  0.00      A       
ATOM    188  C   TPL A  20      13.705  -0.830  -3.639  1.00  0.00      A       
ATOM    189  CA  TPL A  20      13.336  -1.651  -2.375  1.00  0.00      A       
ATOM    190  CB1 TPL A  20      12.479  -2.881  -2.783  1.00  0.00      A       
ATOM    191  CD1 TPL A  20      10.348  -3.743  -1.648  1.00  0.00      A       
ATOM    192  CD2 TPL A  20      12.059  -3.276  -0.188  1.00  0.00      A       
ATOM    193  CE2 TPL A  20      10.933  -3.723   0.474  1.00  0.00      A       
ATOM    194  CE3 TPL A  20      13.234  -2.927   0.474  1.00  0.00      A       
ATOM    195  CG  TPL A  20      11.616  -3.300  -1.628  1.00  0.00      A       
ATOM    196  CH2 TPL A  20      12.082  -3.498   2.552  1.00  0.00      A       
ATOM    197  CZ2 TPL A  20      10.910  -3.846   1.863  1.00  0.00      A       
ATOM    198  CZ3 TPL A  20      13.222  -3.043   1.870  1.00  0.00      A       
ATOM    199  H   TPL A  20      11.588  -0.964  -1.408  1.00  0.00      A       
ATOM    200  HA  TPL A  20      14.295  -1.970  -1.933  1.00  0.00      A       
ATOM    201  HB1 TPL A  20      13.106  -3.749  -3.033  1.00  0.00      A       
ATOM    202  HB2 TPL A  20      11.870  -2.633  -3.667  1.00  0.00      A       
ATOM    203  HC1 TPL A  20      12.885  -0.130  -3.871  1.00  0.00      A       
ATOM    204  HC2 TPL A  20      13.847  -1.511  -4.496  1.00  0.00      A       
ATOM    205  HD1 TPL A  20       9.746  -3.872  -2.547  1.00  0.00      A       
ATOM    206  HE1 TPL A  20       9.021  -4.329  -0.168  1.00  0.00      A       
ATOM    207  HE3 TPL A  20      14.109  -2.585  -0.067  1.00  0.00      A       
ATOM    208  HH2 TPL A  20      12.106  -3.581   3.633  1.00  0.00      A       
ATOM    209  HXT TPL A  20      15.167  -0.100  -2.463  1.00  0.00      A       
ATOM    210  HZ2 TPL A  20      10.026  -4.196   2.384  1.00  0.00      A       
ATOM    211  HZ3 TPL A  20      14.112  -2.779   2.432  1.00  0.00      A       
ATOM    212  N   TPL A  20      12.581  -0.848  -1.410  1.00  0.00      A       
ATOM    213  NE1 TPL A  20       9.960  -3.986  -0.421  1.00  0.00      A       
ATOM    214  OXT TPL A  20      14.912  -0.092  -3.380  1.00  0.00      A       
END


Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Tuesday, May 14, 2024 5:09:11 PM GMT (wattos1)