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
515023 2ldc 17658 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ACE A   0      -3.378  -3.101   7.021  1.00  0.00      A       
ATOM      2  CH3 ACE A   0      -3.064  -4.022   8.182  1.00  0.00      A       
ATOM      3  H1  ACE A   0      -3.375  -5.019   7.927  1.00  0.00      A       
ATOM      4  H2  ACE A   0      -3.600  -3.691   9.061  1.00  0.00      A       
ATOM      5  H3  ACE A   0      -2.000  -4.010   8.374  1.00  0.00      A       
ATOM      6  O   ACE A   0      -4.015  -3.545   6.043  1.00  0.00      A       
ATOM      7  C   HIS A   1      -1.878  -0.504   5.305  1.00  0.00      A       
ATOM      8  CA  HIS A   1      -3.127  -0.743   6.152  1.00  0.00      A       
ATOM      9  CB  HIS A   1      -3.532   0.569   6.834  1.00  0.00      A       
ATOM     10  CD2 HIS A   1      -3.992   2.610   5.322  1.00  0.00      A       
ATOM     11  CE1 HIS A   1      -6.116   2.256   4.943  1.00  0.00      A       
ATOM     12  CG  HIS A   1      -4.338   1.483   5.973  1.00  0.00      A       
ATOM     13  HN  HIS A   1      -2.437  -1.577   7.986  1.00  0.00      A       
ATOM     14  HA  HIS A   1      -3.929  -1.054   5.498  1.00  0.00      A       
ATOM     15  HB2 HIS A   1      -4.118   0.351   7.706  1.00  0.00      A       
ATOM     16  HB1 HIS A   1      -2.640   1.098   7.130  1.00  0.00      A       
ATOM     17  HD1 HIS A   1      -6.218   0.552   6.051  1.00  0.00      A       
ATOM     18  HD2 HIS A   1      -3.012   3.063   5.316  1.00  0.00      A       
ATOM     19  HE1 HIS A   1      -7.134   2.366   4.591  1.00  0.00      A       
ATOM     20  HE2 HIS A   1      -5.195   3.941   4.245  1.00  0.00      A       
ATOM     21  N   HIS A   1      -2.922  -1.807   7.159  1.00  0.00      A       
ATOM     22  ND1 HIS A   1      -5.673   1.286   5.714  1.00  0.00      A       
ATOM     23  NE2 HIS A   1      -5.114   3.074   4.686  1.00  0.00      A       
ATOM     24  O   HIS A   1      -2.019  -0.101   4.139  1.00  0.00      A       
ATOM     25  C   Mk8 A   2       0.696  -1.140   3.788  1.00  0.00      A       
ATOM     26  CA  Mk8 A   2       0.682  -0.502   5.234  1.00  0.00      A       
ATOM     27  CB  Mk8 A   2       1.866  -1.088   6.054  1.00  0.00      A       
ATOM     28  CB1 Mk8 A   2       0.933   1.022   5.233  1.00  0.00      A       
ATOM     29  CD  Mk8 A   2       2.192  -3.547   5.313  1.00  0.00      A       
ATOM     30  CE  Mk8 A   2       3.674  -3.677   4.882  1.00  0.00      A       
ATOM     31  CG  Mk8 A   2       1.806  -2.579   6.444  1.00  0.00      A       
ATOM     32  HB  Mk8 A   2       1.954  -0.512   6.966  1.00  0.00      A       
ATOM     33  HB1 Mk8 A   2       0.063   1.541   4.851  1.00  0.00      A       
ATOM     34 HB1A Mk8 A   2       1.783   1.232   4.604  1.00  0.00      A       
ATOM     35 HB1B Mk8 A   2       1.143   1.353   6.243  1.00  0.00      A       
ATOM     36  HBA Mk8 A   2       2.772  -0.952   5.485  1.00  0.00      A       
ATOM     37  HD  Mk8 A   2       1.614  -3.256   4.456  1.00  0.00      A       
ATOM     38  HDA Mk8 A   2       1.874  -4.531   5.611  1.00  0.00      A       
ATOM     39  HE  Mk8 A   2       4.361  -3.867   5.673  1.00  0.00      A       
ATOM     40  HG  Mk8 A   2       0.817  -2.805   6.772  1.00  0.00      A       
ATOM     41  HGA Mk8 A   2       2.489  -2.739   7.257  1.00  0.00      A       
ATOM     42  HN  Mk8 A   2      -0.631  -1.006   6.854  1.00  0.00      A       
ATOM     43  N   Mk8 A   2      -0.639  -0.722   5.916  1.00  0.00      A       
ATOM     44  O   Mk8 A   2       1.338  -0.619   2.843  1.00  0.00      A       
ATOM     45  C   ILE A   3      -0.777  -2.376   1.360  1.00  0.00      A       
ATOM     46  CA  ILE A   3      -0.067  -3.168   2.455  1.00  0.00      A       
ATOM     47  CB  ILE A   3      -0.791  -4.570   2.668  1.00  0.00      A       
ATOM     48  CD1 ILE A   3      -1.204  -4.721   5.212  1.00  0.00      A       
ATOM     49  CG1 ILE A   3      -0.466  -5.266   4.012  1.00  0.00      A       
ATOM     50  CG2 ILE A   3      -0.388  -5.547   1.563  1.00  0.00      A       
ATOM     51  HN  ILE A   3      -0.422  -2.671   4.489  1.00  0.00      A       
ATOM     52  HA  ILE A   3       0.958  -3.361   2.144  1.00  0.00      A       
ATOM     53  HB  ILE A   3      -1.866  -4.415   2.606  1.00  0.00      A       
ATOM     54 HD11 ILE A   3      -0.540  -4.696   6.055  1.00  0.00      A       
ATOM     55 HD12 ILE A   3      -2.049  -5.356   5.437  1.00  0.00      A       
ATOM     56 HD13 ILE A   3      -1.549  -3.723   4.991  1.00  0.00      A       
ATOM     57 HG12 ILE A   3      -0.724  -6.299   3.930  1.00  0.00      A       
ATOM     58 HG11 ILE A   3       0.591  -5.180   4.205  1.00  0.00      A       
ATOM     59 HG21 ILE A   3      -0.780  -6.528   1.797  1.00  0.00      A       
ATOM     60 HG22 ILE A   3       0.686  -5.590   1.508  1.00  0.00      A       
ATOM     61 HG23 ILE A   3      -0.788  -5.208   0.620  1.00  0.00      A       
ATOM     62  N   ILE A   3       0.003  -2.330   3.686  1.00  0.00      A       
ATOM     63  O   ILE A   3      -0.318  -2.347   0.207  1.00  0.00      A       
ATOM     64  C   LEU A   4      -1.893   0.220   0.220  1.00  0.00      A       
ATOM     65  CA  LEU A   4      -2.746  -0.851   0.920  1.00  0.00      A       
ATOM     66  CB  LEU A   4      -3.847  -0.213   1.798  1.00  0.00      A       
ATOM     67  CD1 LEU A   4      -6.185   0.644   1.974  1.00  0.00      A       
ATOM     68  CD2 LEU A   4      -4.478   2.027   0.822  1.00  0.00      A       
ATOM     69  CG  LEU A   4      -4.949   0.605   1.099  1.00  0.00      A       
ATOM     70  HN  LEU A   4      -2.145  -1.787   2.721  1.00  0.00      A       
ATOM     71  HA  LEU A   4      -3.203  -1.482   0.175  1.00  0.00      A       
ATOM     72  HB2 LEU A   4      -4.328  -1.006   2.341  1.00  0.00      A       
ATOM     73  HB1 LEU A   4      -3.366   0.430   2.517  1.00  0.00      A       
ATOM     74 HD11 LEU A   4      -6.101  -0.096   2.756  1.00  0.00      A       
ATOM     75 HD12 LEU A   4      -7.055   0.435   1.375  1.00  0.00      A       
ATOM     76 HD13 LEU A   4      -6.279   1.625   2.419  1.00  0.00      A       
ATOM     77 HD21 LEU A   4      -3.492   2.004   0.387  1.00  0.00      A       
ATOM     78 HD22 LEU A   4      -4.447   2.583   1.754  1.00  0.00      A       
ATOM     79 HD23 LEU A   4      -5.159   2.508   0.145  1.00  0.00      A       
ATOM     80  HG  LEU A   4      -5.205   0.136   0.163  1.00  0.00      A       
ATOM     81  N   LEU A   4      -1.899  -1.704   1.779  1.00  0.00      A       
ATOM     82  O   LEU A   4      -2.190   0.587  -0.928  1.00  0.00      A       
ATOM     83  C   HIS A   5       1.195   1.116  -0.395  1.00  0.00      A       
ATOM     84  CA  HIS A   5       0.116   1.706   0.506  1.00  0.00      A       
ATOM     85  CB  HIS A   5       0.723   2.397   1.715  1.00  0.00      A       
ATOM     86  CD2 HIS A   5      -0.780   4.180   2.852  1.00  0.00      A       
ATOM     87  CE1 HIS A   5      -0.209   5.907   1.629  1.00  0.00      A       
ATOM     88  CG  HIS A   5       0.148   3.756   1.956  1.00  0.00      A       
ATOM     89  HN  HIS A   5      -0.715   0.315   1.860  1.00  0.00      A       
ATOM     90  HA  HIS A   5      -0.442   2.436  -0.065  1.00  0.00      A       
ATOM     91  HB2 HIS A   5       0.520   1.797   2.591  1.00  0.00      A       
ATOM     92  HB1 HIS A   5       1.794   2.496   1.581  1.00  0.00      A       
ATOM     93  HD1 HIS A   5       1.134   4.890   0.457  1.00  0.00      A       
ATOM     94  HD2 HIS A   5      -1.286   3.577   3.597  1.00  0.00      A       
ATOM     95  HE1 HIS A   5      -0.158   6.907   1.236  1.00  0.00      A       
ATOM     96  HE2 HIS A   5      -1.563   6.102   3.156  1.00  0.00      A       
ATOM     97  N   HIS A   5      -0.839   0.685   0.961  1.00  0.00      A       
ATOM     98  ND1 HIS A   5       0.484   4.867   1.200  1.00  0.00      A       
ATOM     99  NE2 HIS A   5      -0.983   5.514   2.625  1.00  0.00      A       
ATOM    100  O   HIS A   5       1.392   1.628  -1.495  1.00  0.00      A       
ATOM    101  C   Mk8 A   6       2.406  -1.155  -2.071  1.00  0.00      A       
ATOM    102  CA  Mk8 A   6       2.975  -0.721  -0.682  1.00  0.00      A       
ATOM    103  CB  Mk8 A   6       3.402  -2.042   0.058  1.00  0.00      A       
ATOM    104  CB1 Mk8 A   6       4.217   0.210  -0.878  1.00  0.00      A       
ATOM    105  CD  Mk8 A   6       3.482  -3.328   2.261  1.00  0.00      A       
ATOM    106  CE  Mk8 A   6       4.216  -3.588   3.604  1.00  0.00      A       
ATOM    107  CG  Mk8 A   6       3.643  -1.968   1.584  1.00  0.00      A       
ATOM    108  HB  Mk8 A   6       4.320  -2.388  -0.394  1.00  0.00      A       
ATOM    109  HB1 Mk8 A   6       4.118   1.071  -0.234  1.00  0.00      A       
ATOM    110 HB1A Mk8 A   6       4.265   0.535  -1.905  1.00  0.00      A       
ATOM    111 HB1B Mk8 A   6       5.114  -0.332  -0.625  1.00  0.00      A       
ATOM    112  HBA Mk8 A   6       2.638  -2.789  -0.114  1.00  0.00      A       
ATOM    113  HD  Mk8 A   6       3.806  -4.080   1.548  1.00  0.00      A       
ATOM    114  HDA Mk8 A   6       2.436  -3.476   2.445  1.00  0.00      A       
ATOM    115  HE  Mk8 A   6       5.276  -3.713   3.527  1.00  0.00      A       
ATOM    116  HG  Mk8 A   6       2.935  -1.276   2.012  1.00  0.00      A       
ATOM    117  HGA Mk8 A   6       4.645  -1.613   1.754  1.00  0.00      A       
ATOM    118  HN  Mk8 A   6       1.647  -0.324   0.970  1.00  0.00      A       
ATOM    119  N   Mk8 A   6       1.888   0.009   0.084  1.00  0.00      A       
ATOM    120  O   Mk8 A   6       3.179  -1.564  -2.980  1.00  0.00      A       
ATOM    121  C   LEU A   7       0.120  -0.277  -4.353  1.00  0.00      A       
ATOM    122  CA  LEU A   7       0.279  -1.467  -3.407  1.00  0.00      A       
ATOM    123  CB  LEU A   7      -1.113  -2.048  -3.037  1.00  0.00      A       
ATOM    124  CD1 LEU A   7      -1.371  -4.247  -4.300  1.00  0.00      A       
ATOM    125  CD2 LEU A   7      -3.358  -2.792  -3.914  1.00  0.00      A       
ATOM    126  CG  LEU A   7      -1.855  -2.802  -4.164  1.00  0.00      A       
ATOM    127  HN  LEU A   7       0.520  -0.783  -1.415  1.00  0.00      A       
ATOM    128  HA  LEU A   7       0.859  -2.235  -3.911  1.00  0.00      A       
ATOM    129  HB2 LEU A   7      -0.991  -2.725  -2.202  1.00  0.00      A       
ATOM    130  HB1 LEU A   7      -1.747  -1.234  -2.721  1.00  0.00      A       
ATOM    131 HD11 LEU A   7      -1.980  -4.758  -5.029  1.00  0.00      A       
ATOM    132 HD12 LEU A   7      -1.457  -4.750  -3.349  1.00  0.00      A       
ATOM    133 HD13 LEU A   7      -0.344  -4.256  -4.618  1.00  0.00      A       
ATOM    134 HD21 LEU A   7      -3.615  -1.985  -3.239  1.00  0.00      A       
ATOM    135 HD22 LEU A   7      -3.647  -3.731  -3.478  1.00  0.00      A       
ATOM    136 HD23 LEU A   7      -3.881  -2.654  -4.852  1.00  0.00      A       
ATOM    137  HG  LEU A   7      -1.667  -2.295  -5.108  1.00  0.00      A       
ATOM    138  N   LEU A   7       1.030  -1.089  -2.192  1.00  0.00      A       
ATOM    139  O   LEU A   7       0.229  -0.458  -5.587  1.00  0.00      A       
ATOM    140  C   LEU A   8       0.930   2.823  -4.964  1.00  0.00      A       
ATOM    141  CA  LEU A   8      -0.376   2.198  -4.488  1.00  0.00      A       
ATOM    142  CB  LEU A   8      -1.137   3.220  -3.615  1.00  0.00      A       
ATOM    143  CD1 LEU A   8      -2.785   3.626  -1.783  1.00  0.00      A       
ATOM    144  CD2 LEU A   8      -3.628   2.752  -3.934  1.00  0.00      A       
ATOM    145  CG  LEU A   8      -2.452   2.738  -2.961  1.00  0.00      A       
ATOM    146  HN  LEU A   8      -0.228   0.956  -2.769  1.00  0.00      A       
ATOM    147  HA  LEU A   8      -0.980   1.972  -5.343  1.00  0.00      A       
ATOM    148  HB2 LEU A   8      -0.476   3.550  -2.827  1.00  0.00      A       
ATOM    149  HB1 LEU A   8      -1.371   4.076  -4.237  1.00  0.00      A       
ATOM    150 HD11 LEU A   8      -2.659   3.073  -0.866  1.00  0.00      A       
ATOM    151 HD12 LEU A   8      -3.808   3.963  -1.865  1.00  0.00      A       
ATOM    152 HD13 LEU A   8      -2.125   4.480  -1.784  1.00  0.00      A       
ATOM    153 HD21 LEU A   8      -4.558   2.842  -3.387  1.00  0.00      A       
ATOM    154 HD22 LEU A   8      -3.631   1.834  -4.499  1.00  0.00      A       
ATOM    155 HD23 LEU A   8      -3.521   3.587  -4.605  1.00  0.00      A       
ATOM    156  HG  LEU A   8      -2.326   1.724  -2.595  1.00  0.00      A       
ATOM    157  N   LEU A   8      -0.161   0.933  -3.747  1.00  0.00      A       
ATOM    158  O   LEU A   8       0.968   3.409  -6.058  1.00  0.00      A       
ATOM    159  C   GLN A   9       4.099   2.456  -5.364  1.00  0.00      A       
ATOM    160  CA  GLN A   9       3.340   3.250  -4.329  1.00  0.00      A       
ATOM    161  CB  GLN A   9       4.133   3.279  -3.015  1.00  0.00      A       
ATOM    162  CD  GLN A   9       4.324   4.130  -0.644  1.00  0.00      A       
ATOM    163  CG  GLN A   9       3.491   4.115  -1.909  1.00  0.00      A       
ATOM    164  HN  GLN A   9       1.834   2.212  -3.260  1.00  0.00      A       
ATOM    165  HA  GLN A   9       3.232   4.257  -4.691  1.00  0.00      A       
ATOM    166  HB2 GLN A   9       4.237   2.265  -2.653  1.00  0.00      A       
ATOM    167  HB1 GLN A   9       5.115   3.680  -3.211  1.00  0.00      A       
ATOM    168 HE21 GLN A   9       4.530   6.103  -0.757  1.00  0.00      A       
ATOM    169 HE22 GLN A   9       5.288   5.353   0.593  1.00  0.00      A       
ATOM    170  HG2 GLN A   9       3.370   5.131  -2.260  1.00  0.00      A       
ATOM    171  HG1 GLN A   9       2.520   3.694  -1.675  1.00  0.00      A       
ATOM    172  N   GLN A   9       1.989   2.693  -4.095  1.00  0.00      A       
ATOM    173  NE2 GLN A   9       4.759   5.315  -0.231  1.00  0.00      A       
ATOM    174  O   GLN A   9       4.905   3.038  -6.119  1.00  0.00      A       
ATOM    175  OE1 GLN A   9       4.585   3.083  -0.049  1.00  0.00      A       
ATOM    176  C   ASP A  10       3.933   0.355  -7.714  1.00  0.00      A       
ATOM    177  CA  ASP A  10       4.436   0.145  -6.292  1.00  0.00      A       
ATOM    178  CB  ASP A  10       4.117  -1.272  -5.833  1.00  0.00      A       
ATOM    179  CG  ASP A  10       4.921  -2.316  -6.582  1.00  0.00      A       
ATOM    180  HN  ASP A  10       3.161   0.780  -4.729  1.00  0.00      A       
ATOM    181  HA  ASP A  10       5.513   0.291  -6.262  1.00  0.00      A       
ATOM    182  HB2 ASP A  10       4.346  -1.356  -4.786  1.00  0.00      A       
ATOM    183  HB1 ASP A  10       3.063  -1.471  -5.998  1.00  0.00      A       
ATOM    184  N   ASP A  10       3.819   1.115  -5.371  1.00  0.00      A       
ATOM    185  O   ASP A  10       4.740   0.412  -8.655  1.00  0.00      A       
ATOM    186  OD1 ASP A  10       4.780  -2.399  -7.821  1.00  0.00      A       
ATOM    187  OD2 ASP A  10       5.694  -3.047  -5.933  1.00  0.00      A       
ATOM    188  C   SER A  11       2.343   1.975  -9.775  1.00  0.00      A       
ATOM    189  CA  SER A  11       1.847   0.706  -9.093  1.00  0.00      A       
ATOM    190  CB  SER A  11       0.343   0.812  -8.849  1.00  0.00      A       
ATOM    191  HN  SER A  11       2.035   0.436  -7.001  1.00  0.00      A       
ATOM    192  HA  SER A  11       2.041  -0.136  -9.744  1.00  0.00      A       
ATOM    193  HB2 SER A  11      -0.144   0.983  -9.788  1.00  0.00      A       
ATOM    194  HB1 SER A  11      -0.014  -0.104  -8.423  1.00  0.00      A       
ATOM    195  HG  SER A  11      -0.609   2.474  -8.401  1.00  0.00      A       
ATOM    196  N   SER A  11       2.563   0.481  -7.823  1.00  0.00      A       
ATOM    197  O   SER A  11       2.856   1.926 -10.887  1.00  0.00      A       
ATOM    198  OG  SER A  11       0.018   1.880  -7.972  1.00  0.00      A       
ATOM    199  HN1 NH2 A  12       2.068   2.995  -8.087  1.00  0.00      A       
ATOM    200  HN2 NH2 A  12       2.680   3.900  -9.433  1.00  0.00      A       
ATOM    201  N   NH2 A  12       2.365   3.068  -9.022  1.00  0.00      A       
END


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