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
425701 2gqe 7158 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   HIS A   1     -16.170   3.626   2.987  1.00  0.00      A       
ATOM      2  CA  HIS A   1     -16.202   5.086   3.429  1.00  0.00      A       
ATOM      3  CB  HIS A   1     -17.338   5.822   2.717  1.00  0.00      A       
ATOM      4  CD2 HIS A   1     -19.164   5.131   4.424  1.00  0.00      A       
ATOM      5  CE1 HIS A   1     -20.834   4.884   3.024  1.00  0.00      A       
ATOM      6  CG  HIS A   1     -18.701   5.412   3.184  1.00  0.00      A       
ATOM      7  HN  HIS A   1     -14.422   5.486   2.354  1.00  0.00      A       
ATOM      8  HA  HIS A   1     -16.371   5.124   4.493  1.00  0.00      A       
ATOM      9  HB2 HIS A   1     -17.234   6.882   2.889  1.00  0.00      A       
ATOM     10  HB1 HIS A   1     -17.276   5.626   1.656  1.00  0.00      A       
ATOM     11  HD1 HIS A   1     -19.753   5.378   1.359  1.00  0.00      A       
ATOM     12  HD2 HIS A   1     -18.597   5.158   5.343  1.00  0.00      A       
ATOM     13  HE1 HIS A   1     -21.815   4.685   2.620  1.00  0.00      A       
ATOM     14  N   HIS A   1     -14.926   5.739   3.155  1.00  0.00      A       
ATOM     15  ND1 HIS A   1     -19.770   5.247   2.330  1.00  0.00      A       
ATOM     16  NE2 HIS A   1     -20.493   4.806   4.298  1.00  0.00      A       
ATOM     17  O   HIS A   1     -15.906   3.325   1.824  1.00  0.00      A       
ATOM     18  C   MET A   2     -15.256   0.918   2.749  1.00  0.00      A       
ATOM     19  CA  MET A   2     -16.442   1.294   3.632  1.00  0.00      A       
ATOM     20  CB  MET A   2     -17.750   0.895   2.946  1.00  0.00      A       
ATOM     21  CE  MET A   2     -18.830   0.035  -0.492  1.00  0.00      A       
ATOM     22  CG  MET A   2     -17.987   1.611   1.626  1.00  0.00      A       
ATOM     23  HN  MET A   2     -16.642   3.025   4.835  1.00  0.00      A       
ATOM     24  HA  MET A   2     -16.362   0.765   4.569  1.00  0.00      A       
ATOM     25  HB2 MET A   2     -17.734  -0.167   2.757  1.00  0.00      A       
ATOM     26  HB1 MET A   2     -18.574   1.123   3.607  1.00  0.00      A       
ATOM     27  HE1 MET A   2     -18.420  -0.865  -0.058  1.00  0.00      A       
ATOM     28  HE2 MET A   2     -19.616  -0.226  -1.185  1.00  0.00      A       
ATOM     29  HE3 MET A   2     -18.051   0.570  -1.014  1.00  0.00      A       
ATOM     30  HG2 MET A   2     -18.055   2.672   1.814  1.00  0.00      A       
ATOM     31  HG1 MET A   2     -17.150   1.417   0.972  1.00  0.00      A       
ATOM     32  N   MET A   2     -16.440   2.724   3.925  1.00  0.00      A       
ATOM     33  O   MET A   2     -15.398   0.155   1.794  1.00  0.00      A       
ATOM     34  SD  MET A   2     -19.500   1.072   0.806  1.00  0.00      A       
ATOM     35  C   VAL A   3     -11.785   0.603   3.206  1.00  0.00      A       
ATOM     36  CA  VAL A   3     -12.876   1.181   2.312  1.00  0.00      A       
ATOM     37  CB  VAL A   3     -12.341   2.450   1.623  1.00  0.00      A       
ATOM     38  CG1 VAL A   3     -11.517   3.280   2.596  1.00  0.00      A       
ATOM     39  CG2 VAL A   3     -11.521   2.084   0.396  1.00  0.00      A       
ATOM     40  HN  VAL A   3     -14.037   2.061   3.847  1.00  0.00      A       
ATOM     41  HA  VAL A   3     -13.122   0.458   1.548  1.00  0.00      A       
ATOM     42  HB  VAL A   3     -13.184   3.044   1.302  1.00  0.00      A       
ATOM     43 HG11 VAL A   3     -10.467   3.123   2.402  1.00  0.00      A       
ATOM     44 HG12 VAL A   3     -11.756   4.325   2.470  1.00  0.00      A       
ATOM     45 HG13 VAL A   3     -11.745   2.977   3.608  1.00  0.00      A       
ATOM     46 HG21 VAL A   3     -11.264   1.036   0.434  1.00  0.00      A       
ATOM     47 HG22 VAL A   3     -12.100   2.279  -0.496  1.00  0.00      A       
ATOM     48 HG23 VAL A   3     -10.619   2.675   0.374  1.00  0.00      A       
ATOM     49  N   VAL A   3     -14.087   1.461   3.075  1.00  0.00      A       
ATOM     50  O   VAL A   3     -10.617   0.547   2.820  1.00  0.00      A       
ATOM     51  C   ILE A   4     -10.406  -1.512   4.702  1.00  0.00      A       
ATOM     52  CA  ILE A   4     -11.228  -0.403   5.350  1.00  0.00      A       
ATOM     53  CB  ILE A   4     -11.947  -0.969   6.589  1.00  0.00      A       
ATOM     54  CD1 ILE A   4     -13.588  -2.141   5.036  1.00  0.00      A       
ATOM     55  CG1 ILE A   4     -12.674  -2.268   6.235  1.00  0.00      A       
ATOM     56  CG2 ILE A   4     -12.924   0.055   7.148  1.00  0.00      A       
ATOM     57  HN  ILE A   4     -13.117   0.245   4.653  1.00  0.00      A       
ATOM     58  HA  ILE A   4     -10.560   0.383   5.674  1.00  0.00      A       
ATOM     59  HB  ILE A   4     -11.205  -1.174   7.345  1.00  0.00      A       
ATOM     60 HD11 ILE A   4     -14.222  -1.275   5.157  1.00  0.00      A       
ATOM     61 HD12 ILE A   4     -12.995  -2.033   4.141  1.00  0.00      A       
ATOM     62 HD13 ILE A   4     -14.202  -3.027   4.957  1.00  0.00      A       
ATOM     63 HG12 ILE A   4     -11.945  -3.033   6.016  1.00  0.00      A       
ATOM     64 HG11 ILE A   4     -13.272  -2.578   7.079  1.00  0.00      A       
ATOM     65 HG21 ILE A   4     -12.976   0.903   6.482  1.00  0.00      A       
ATOM     66 HG22 ILE A   4     -13.902  -0.392   7.237  1.00  0.00      A       
ATOM     67 HG23 ILE A   4     -12.586   0.381   8.121  1.00  0.00      A       
ATOM     68  N   ILE A   4     -12.173   0.173   4.402  1.00  0.00      A       
ATOM     69  O   ILE A   4     -10.571  -1.812   3.520  1.00  0.00      A       
ATOM     70  C   GLY A   5      -7.231  -2.790   4.857  1.00  0.00      A       
ATOM     71  CA  GLY A   5      -8.688  -3.192   4.972  1.00  0.00      A       
ATOM     72  HN  GLY A   5      -9.434  -1.841   6.422  1.00  0.00      A       
ATOM     73  HA2 GLY A   5      -8.765  -4.042   5.634  1.00  0.00      A       
ATOM     74  HA1 GLY A   5      -9.050  -3.476   3.995  1.00  0.00      A       
ATOM     75  N   GLY A   5      -9.521  -2.121   5.486  1.00  0.00      A       
ATOM     76  O   GLY A   5      -6.379  -3.604   4.501  1.00  0.00      A       
ATOM     77  C   THR A   6      -4.597  -1.975   5.744  1.00  0.00      A       
ATOM     78  CA  THR A   6      -5.580  -1.016   5.082  1.00  0.00      A       
ATOM     79  CB  THR A   6      -5.461   0.367   5.752  1.00  0.00      A       
ATOM     80  CG2 THR A   6      -6.257   1.410   4.984  1.00  0.00      A       
ATOM     81  HN  THR A   6      -7.665  -0.925   5.434  1.00  0.00      A       
ATOM     82  HA  THR A   6      -5.319  -0.910   4.039  1.00  0.00      A       
ATOM     83  HB  THR A   6      -4.420   0.659   5.755  1.00  0.00      A       
ATOM     84  HG1 THR A   6      -5.987   1.185   7.467  1.00  0.00      A       
ATOM     85 HG21 THR A   6      -5.579   2.109   4.517  1.00  0.00      A       
ATOM     86 HG22 THR A   6      -6.906   1.940   5.665  1.00  0.00      A       
ATOM     87 HG23 THR A   6      -6.850   0.923   4.225  1.00  0.00      A       
ATOM     88  N   THR A   6      -6.943  -1.526   5.157  1.00  0.00      A       
ATOM     89  O   THR A   6      -4.887  -2.551   6.792  1.00  0.00      A       
ATOM     90  OG1 THR A   6      -5.931   0.298   7.103  1.00  0.00      A       
ATOM     91  C   TRP A   7      -1.273  -2.233   6.296  1.00  0.00      A       
ATOM     92  CA  TRP A   7      -2.405  -3.029   5.655  1.00  0.00      A       
ATOM     93  CB  TRP A   7      -1.852  -3.923   4.543  1.00  0.00      A       
ATOM     94  CD1 TRP A   7      -2.557  -2.716   2.394  1.00  0.00      A       
ATOM     95  CD2 TRP A   7      -0.341  -2.849   2.692  1.00  0.00      A       
ATOM     96  CE2 TRP A   7      -0.593  -2.169   1.483  1.00  0.00      A       
ATOM     97  CE3 TRP A   7       0.984  -3.050   3.087  1.00  0.00      A       
ATOM     98  CG  TRP A   7      -1.611  -3.190   3.258  1.00  0.00      A       
ATOM     99  CH2 TRP A   7       1.720  -1.904   1.082  1.00  0.00      A       
ATOM    100  CZ2 TRP A   7       0.431  -1.693   0.670  1.00  0.00      A       
ATOM    101  CZ3 TRP A   7       2.000  -2.577   2.279  1.00  0.00      A       
ATOM    102  HN  TRP A   7      -3.260  -1.651   4.292  1.00  0.00      A       
ATOM    103  HA  TRP A   7      -2.864  -3.651   6.410  1.00  0.00      A       
ATOM    104  HB2 TRP A   7      -0.913  -4.348   4.866  1.00  0.00      A       
ATOM    105  HB1 TRP A   7      -2.556  -4.718   4.348  1.00  0.00      A       
ATOM    106  HD1 TRP A   7      -3.621  -2.819   2.543  1.00  0.00      A       
ATOM    107  HE1 TRP A   7      -2.419  -1.683   0.571  1.00  0.00      A       
ATOM    108  HE3 TRP A   7       1.220  -3.566   4.005  1.00  0.00      A       
ATOM    109  HH2 TRP A   7       2.544  -1.551   0.482  1.00  0.00      A       
ATOM    110  HZ2 TRP A   7       0.231  -1.171  -0.255  1.00  0.00      A       
ATOM    111  HZ3 TRP A   7       3.030  -2.722   2.568  1.00  0.00      A       
ATOM    112  N   TRP A   7      -3.433  -2.140   5.125  1.00  0.00      A       
ATOM    113  NE1 TRP A   7      -1.952  -2.102   1.325  1.00  0.00      A       
ATOM    114  O   TRP A   7      -0.883  -1.179   5.795  1.00  0.00      A       
ATOM    115  C   ASP A   8       1.686  -2.669   7.711  1.00  0.00      A       
ATOM    116  CA  ASP A   8       0.338  -2.081   8.113  1.00  0.00      A       
ATOM    117  CB  ASP A   8       0.143  -2.209   9.626  1.00  0.00      A       
ATOM    118  CG  ASP A   8      -1.318  -2.174  10.026  1.00  0.00      A       
ATOM    119  HN  ASP A   8      -1.105  -3.589   7.756  1.00  0.00      A       
ATOM    120  HA  ASP A   8       0.320  -1.036   7.845  1.00  0.00      A       
ATOM    121  HB2 ASP A   8       0.567  -3.145   9.959  1.00  0.00      A       
ATOM    122  HB1 ASP A   8       0.653  -1.393  10.118  1.00  0.00      A       
ATOM    123  N   ASP A   8      -0.750  -2.744   7.405  1.00  0.00      A       
ATOM    124  O   ASP A   8       1.839  -3.887   7.606  1.00  0.00      A       
ATOM    125  OD1 ASP A   8      -2.150  -1.744   9.199  1.00  0.00      A       
ATOM    126  OD2 ASP A   8      -1.630  -2.579  11.166  1.00  0.00      A       
ATOM    127  C   CYS A   9       4.668  -3.016   8.211  1.00  0.00      A       
ATOM    128  CA  CYS A   9       3.998  -2.227   7.089  1.00  0.00      A       
ATOM    129  CB  CYS A   9       4.858  -1.018   6.717  1.00  0.00      A       
ATOM    130  HN  CYS A   9       2.479  -0.838   7.582  1.00  0.00      A       
ATOM    131  HA  CYS A   9       3.900  -2.867   6.225  1.00  0.00      A       
ATOM    132  HB2 CYS A   9       4.235  -0.276   6.239  1.00  0.00      A       
ATOM    133  HB1 CYS A   9       5.283  -0.598   7.616  1.00  0.00      A       
ATOM    134  N   CYS A   9       2.662  -1.796   7.483  1.00  0.00      A       
ATOM    135  O   CYS A   9       4.132  -3.124   9.313  1.00  0.00      A       
ATOM    136  SG  CYS A   9       6.230  -1.401   5.581  1.00  0.00      A       
ATOM    137  C   ASP A  10       8.072  -3.998   8.859  1.00  0.00      A       
ATOM    138  CA  ASP A  10       6.587  -4.342   8.904  1.00  0.00      A       
ATOM    139  CB  ASP A  10       6.390  -5.840   8.658  1.00  0.00      A       
ATOM    140  CG  ASP A  10       4.930  -6.244   8.689  1.00  0.00      A       
ATOM    141  HN  ASP A  10       6.218  -3.443   7.023  1.00  0.00      A       
ATOM    142  HA  ASP A  10       6.202  -4.095   9.882  1.00  0.00      A       
ATOM    143  HB2 ASP A  10       6.794  -6.094   7.688  1.00  0.00      A       
ATOM    144  HB1 ASP A  10       6.917  -6.395   9.420  1.00  0.00      A       
ATOM    145  N   ASP A  10       5.842  -3.565   7.921  1.00  0.00      A       
ATOM    146  O   ASP A  10       8.900  -4.693   9.447  1.00  0.00      A       
ATOM    147  OD1 ASP A  10       4.229  -6.019   7.680  1.00  0.00      A       
ATOM    148  OD2 ASP A  10       4.488  -6.788   9.722  1.00  0.00      A       
ATOM    149  C   THR A  11       9.926  -0.997   8.346  1.00  0.00      A       
ATOM    150  CA  THR A  11       9.787  -2.482   8.031  1.00  0.00      A       
ATOM    151  CB  THR A  11      10.335  -2.749   6.617  1.00  0.00      A       
ATOM    152  CG2 THR A  11      10.922  -1.480   6.016  1.00  0.00      A       
ATOM    153  HN  THR A  11       7.696  -2.406   7.710  1.00  0.00      A       
ATOM    154  HA  THR A  11      10.379  -3.046   8.737  1.00  0.00      A       
ATOM    155  HB  THR A  11       9.522  -3.084   5.989  1.00  0.00      A       
ATOM    156  HG1 THR A  11      11.811  -3.793   5.829  1.00  0.00      A       
ATOM    157 HG21 THR A  11      10.149  -0.731   5.933  1.00  0.00      A       
ATOM    158 HG22 THR A  11      11.320  -1.698   5.036  1.00  0.00      A       
ATOM    159 HG23 THR A  11      11.713  -1.113   6.652  1.00  0.00      A       
ATOM    160  N   THR A  11       8.402  -2.919   8.156  1.00  0.00      A       
ATOM    161  O   THR A  11      10.915  -0.568   8.940  1.00  0.00      A       
ATOM    162  OG1 THR A  11      11.339  -3.769   6.665  1.00  0.00      A       
ATOM    163  C   CYS A  12       7.795   1.627   9.110  1.00  0.00      A       
ATOM    164  CA  CYS A  12       8.939   1.221   8.185  1.00  0.00      A       
ATOM    165  CB  CYS A  12       8.832   1.981   6.860  1.00  0.00      A       
ATOM    166  HN  CYS A  12       8.166  -0.617   7.476  1.00  0.00      A       
ATOM    167  HA  CYS A  12       9.875   1.473   8.659  1.00  0.00      A       
ATOM    168  HB2 CYS A  12       9.350   2.924   6.952  1.00  0.00      A       
ATOM    169  HB1 CYS A  12       9.294   1.395   6.080  1.00  0.00      A       
ATOM    170  N   CYS A  12       8.929  -0.216   7.945  1.00  0.00      A       
ATOM    171  O   CYS A  12       7.726   2.770   9.566  1.00  0.00      A       
ATOM    172  SG  CYS A  12       7.121   2.339   6.345  1.00  0.00      A       
ATOM    173  C   LEU A  13       4.861   2.028   9.670  1.00  0.00      A       
ATOM    174  CA  LEU A  13       5.759   0.942  10.256  1.00  0.00      A       
ATOM    175  CB  LEU A  13       6.239   1.356  11.648  1.00  0.00      A       
ATOM    176  CD1 LEU A  13       7.888  -0.408  12.319  1.00  0.00      A       
ATOM    177  CD2 LEU A  13       6.486   0.715  14.058  1.00  0.00      A       
ATOM    178  CG  LEU A  13       6.535   0.216  12.622  1.00  0.00      A       
ATOM    179  HN  LEU A  13       7.008  -0.206   8.991  1.00  0.00      A       
ATOM    180  HA  LEU A  13       5.191   0.028  10.337  1.00  0.00      A       
ATOM    181  HB2 LEU A  13       7.144   1.932  11.527  1.00  0.00      A       
ATOM    182  HB1 LEU A  13       5.474   1.979  12.089  1.00  0.00      A       
ATOM    183 HD11 LEU A  13       8.670   0.307  12.528  1.00  0.00      A       
ATOM    184 HD12 LEU A  13       7.929  -0.691  11.278  1.00  0.00      A       
ATOM    185 HD13 LEU A  13       8.027  -1.284  12.935  1.00  0.00      A       
ATOM    186 HD21 LEU A  13       7.310   0.294  14.614  1.00  0.00      A       
ATOM    187 HD22 LEU A  13       5.554   0.414  14.513  1.00  0.00      A       
ATOM    188 HD23 LEU A  13       6.560   1.793  14.067  1.00  0.00      A       
ATOM    189  HG  LEU A  13       5.781  -0.551  12.508  1.00  0.00      A       
ATOM    190  N   LEU A  13       6.900   0.684   9.383  1.00  0.00      A       
ATOM    191  O   LEU A  13       4.868   3.169  10.133  1.00  0.00      A       
ATOM    192  C   VAL A  14       1.998   1.884   7.374  1.00  0.00      A       
ATOM    193  CA  VAL A  14       3.183   2.607   8.006  1.00  0.00      A       
ATOM    194  CB  VAL A  14       3.906   3.428   6.923  1.00  0.00      A       
ATOM    195  CG1 VAL A  14       2.900   4.162   6.048  1.00  0.00      A       
ATOM    196  CG2 VAL A  14       4.883   4.405   7.560  1.00  0.00      A       
ATOM    197  HN  VAL A  14       4.128   0.741   8.329  1.00  0.00      A       
ATOM    198  HA  VAL A  14       2.816   3.287   8.760  1.00  0.00      A       
ATOM    199  HB  VAL A  14       4.465   2.748   6.297  1.00  0.00      A       
ATOM    200 HG11 VAL A  14       2.640   3.542   5.203  1.00  0.00      A       
ATOM    201 HG12 VAL A  14       2.013   4.380   6.624  1.00  0.00      A       
ATOM    202 HG13 VAL A  14       3.337   5.085   5.695  1.00  0.00      A       
ATOM    203 HG21 VAL A  14       5.407   4.946   6.786  1.00  0.00      A       
ATOM    204 HG22 VAL A  14       4.342   5.102   8.182  1.00  0.00      A       
ATOM    205 HG23 VAL A  14       5.595   3.862   8.163  1.00  0.00      A       
ATOM    206  N   VAL A  14       4.089   1.665   8.653  1.00  0.00      A       
ATOM    207  O   VAL A  14       2.170   0.895   6.662  1.00  0.00      A       
ATOM    208  C   GLN A  15      -0.681   2.284   5.677  1.00  0.00      A       
ATOM    209  CA  GLN A  15      -0.418   1.789   7.096  1.00  0.00      A       
ATOM    210  CB  GLN A  15      -1.615   2.109   7.991  1.00  0.00      A       
ATOM    211  CD  GLN A  15      -2.803   1.395  10.104  1.00  0.00      A       
ATOM    212  CG  GLN A  15      -1.469   1.589   9.412  1.00  0.00      A       
ATOM    213  HN  GLN A  15       0.723   3.177   8.212  1.00  0.00      A       
ATOM    214  HA  GLN A  15      -0.276   0.719   7.069  1.00  0.00      A       
ATOM    215  HB2 GLN A  15      -1.740   3.181   8.034  1.00  0.00      A       
ATOM    216  HB1 GLN A  15      -2.502   1.668   7.560  1.00  0.00      A       
ATOM    217 HE21 GLN A  15      -2.222   2.561  11.606  1.00  0.00      A       
ATOM    218 HE22 GLN A  15      -3.818   1.912  11.734  1.00  0.00      A       
ATOM    219  HG2 GLN A  15      -0.956   0.638   9.383  1.00  0.00      A       
ATOM    220  HG1 GLN A  15      -0.883   2.295   9.982  1.00  0.00      A       
ATOM    221  N   GLN A  15       0.796   2.386   7.639  1.00  0.00      A       
ATOM    222  NE2 GLN A  15      -2.964   2.018  11.266  1.00  0.00      A       
ATOM    223  O   GLN A  15      -0.293   3.394   5.316  1.00  0.00      A       
ATOM    224  OE1 GLN A  15      -3.682   0.694   9.600  1.00  0.00      A       
ATOM    225  C   ASN A  16      -2.985   1.189   3.069  1.00  0.00      A       
ATOM    226  CA  ASN A  16      -1.659   1.808   3.500  1.00  0.00      A       
ATOM    227  CB  ASN A  16      -0.540   1.346   2.564  1.00  0.00      A       
ATOM    228  CG  ASN A  16       0.817   1.341   3.243  1.00  0.00      A       
ATOM    229  HN  ASN A  16      -1.628   0.582   5.226  1.00  0.00      A       
ATOM    230  HA  ASN A  16      -1.742   2.882   3.444  1.00  0.00      A       
ATOM    231  HB2 ASN A  16      -0.754   0.343   2.225  1.00  0.00      A       
ATOM    232  HB1 ASN A  16      -0.493   2.008   1.713  1.00  0.00      A       
ATOM    233 HD21 ASN A  16       0.190  -0.033   4.538  1.00  0.00      A       
ATOM    234 HD22 ASN A  16       1.824   0.495   4.734  1.00  0.00      A       
ATOM    235  N   ASN A  16      -1.344   1.453   4.880  1.00  0.00      A       
ATOM    236  ND2 ASN A  16       0.958   0.518   4.276  1.00  0.00      A       
ATOM    237  O   ASN A  16      -3.460   0.226   3.672  1.00  0.00      A       
ATOM    238  OD1 ASN A  16       1.725   2.069   2.844  1.00  0.00      A       
ATOM    239  C   LYS A  17      -4.658  -0.071   0.766  1.00  0.00      A       
ATOM    240  CA  LYS A  17      -4.849   1.251   1.504  1.00  0.00      A       
ATOM    241  CB  LYS A  17      -5.482   2.283   0.568  1.00  0.00      A       
ATOM    242  CD  LYS A  17      -5.704   3.138  -1.783  1.00  0.00      A       
ATOM    243  CE  LYS A  17      -5.023   3.266  -3.138  1.00  0.00      A       
ATOM    244  CG  LYS A  17      -4.891   2.277  -0.831  1.00  0.00      A       
ATOM    245  HN  LYS A  17      -3.151   2.513   1.580  1.00  0.00      A       
ATOM    246  HA  LYS A  17      -5.507   1.089   2.344  1.00  0.00      A       
ATOM    247  HB2 LYS A  17      -6.540   2.080   0.490  1.00  0.00      A       
ATOM    248  HB1 LYS A  17      -5.343   3.267   0.990  1.00  0.00      A       
ATOM    249  HD2 LYS A  17      -6.675   2.689  -1.923  1.00  0.00      A       
ATOM    250  HD1 LYS A  17      -5.819   4.124  -1.354  1.00  0.00      A       
ATOM    251  HE2 LYS A  17      -4.549   2.327  -3.378  1.00  0.00      A       
ATOM    252  HE1 LYS A  17      -5.774   3.490  -3.882  1.00  0.00      A       
ATOM    253  HG2 LYS A  17      -3.882   2.661  -0.789  1.00  0.00      A       
ATOM    254  HG1 LYS A  17      -4.876   1.262  -1.202  1.00  0.00      A       
ATOM    255  HZ1 LYS A  17      -3.659   4.510  -4.113  1.00  0.00      A       
ATOM    256  HZ2 LYS A  17      -3.189   4.071  -2.549  1.00  0.00      A       
ATOM    257  HZ3 LYS A  17      -4.403   5.227  -2.774  1.00  0.00      A       
ATOM    258  N   LYS A  17      -3.579   1.748   2.019  1.00  0.00      A       
ATOM    259  NZ  LYS A  17      -3.997   4.344  -3.144  1.00  0.00      A       
ATOM    260  O   LYS A  17      -3.627  -0.317   0.141  1.00  0.00      A       
ATOM    261  C   PRO A  18      -5.717  -2.143  -1.337  1.00  0.00      A       
ATOM    262  CA  PRO A  18      -5.642  -2.253   0.183  1.00  0.00      A       
ATOM    263  CB  PRO A  18      -6.889  -2.954   0.729  1.00  0.00      A       
ATOM    264  CD  PRO A  18      -6.934  -0.716   1.568  1.00  0.00      A       
ATOM    265  CG  PRO A  18      -7.812  -1.847   1.107  1.00  0.00      A       
ATOM    266  HA  PRO A  18      -4.762  -2.813   0.458  1.00  0.00      A       
ATOM    267  HB2 PRO A  18      -7.317  -3.583  -0.039  1.00  0.00      A       
ATOM    268  HB1 PRO A  18      -6.622  -3.554   1.587  1.00  0.00      A       
ATOM    269  HD2 PRO A  18      -7.371   0.234   1.297  1.00  0.00      A       
ATOM    270  HD1 PRO A  18      -6.777  -0.770   2.635  1.00  0.00      A       
ATOM    271  HG2 PRO A  18      -8.393  -1.546   0.250  1.00  0.00      A       
ATOM    272  HG1 PRO A  18      -8.461  -2.168   1.909  1.00  0.00      A       
ATOM    273  N   PRO A  18      -5.675  -0.942   0.839  1.00  0.00      A       
ATOM    274  O   PRO A  18      -5.523  -3.126  -2.049  1.00  0.00      A       
ATOM    275  C   GLU A  19      -4.733  -0.372  -3.854  1.00  0.00      A       
ATOM    276  CA  GLU A  19      -6.100  -0.701  -3.259  1.00  0.00      A       
ATOM    277  CB  GLU A  19      -7.079   0.440  -3.542  1.00  0.00      A       
ATOM    278  CD  GLU A  19      -9.009  -0.857  -2.555  1.00  0.00      A       
ATOM    279  CG  GLU A  19      -8.271   0.468  -2.601  1.00  0.00      A       
ATOM    280  HN  GLU A  19      -6.144  -0.192  -1.205  1.00  0.00      A       
ATOM    281  HA  GLU A  19      -6.471  -1.604  -3.720  1.00  0.00      A       
ATOM    282  HB2 GLU A  19      -6.555   1.380  -3.453  1.00  0.00      A       
ATOM    283  HB1 GLU A  19      -7.448   0.340  -4.553  1.00  0.00      A       
ATOM    284  HG2 GLU A  19      -7.923   0.702  -1.607  1.00  0.00      A       
ATOM    285  HG1 GLU A  19      -8.957   1.234  -2.930  1.00  0.00      A       
ATOM    286  N   GLU A  19      -5.999  -0.939  -1.824  1.00  0.00      A       
ATOM    287  O   GLU A  19      -4.583  -0.267  -5.071  1.00  0.00      A       
ATOM    288  OE1 GLU A  19      -8.340  -1.911  -2.592  1.00  0.00      A       
ATOM    289  OE2 GLU A  19     -10.255  -0.839  -2.481  1.00  0.00      A       
ATOM    290  C   ALA A  20      -1.594  -1.164  -3.714  1.00  0.00      A       
ATOM    291  CA  ALA A  20      -2.387   0.106  -3.423  1.00  0.00      A       
ATOM    292  CB  ALA A  20      -1.674   0.945  -2.372  1.00  0.00      A       
ATOM    293  HN  ALA A  20      -3.924  -0.306  -2.027  1.00  0.00      A       
ATOM    294  HA  ALA A  20      -2.456   0.690  -4.329  1.00  0.00      A       
ATOM    295  HB1 ALA A  20      -2.199   1.881  -2.244  1.00  0.00      A       
ATOM    296  HB2 ALA A  20      -1.658   0.410  -1.434  1.00  0.00      A       
ATOM    297  HB3 ALA A  20      -0.662   1.139  -2.694  1.00  0.00      A       
ATOM    298  N   ALA A  20      -3.741  -0.210  -2.985  1.00  0.00      A       
ATOM    299  O   ALA A  20      -2.047  -2.271  -3.419  1.00  0.00      A       
ATOM    300  C   ILE A  21       1.685  -2.161  -3.739  1.00  0.00      A       
ATOM    301  CA  ILE A  21       0.444  -2.131  -4.625  1.00  0.00      A       
ATOM    302  CB  ILE A  21       0.882  -2.094  -6.102  1.00  0.00      A       
ATOM    303  CD1 ILE A  21       1.658  -3.641  -7.968  1.00  0.00      A       
ATOM    304  CG1 ILE A  21       0.838  -3.499  -6.704  1.00  0.00      A       
ATOM    305  CG2 ILE A  21       2.278  -1.502  -6.224  1.00  0.00      A       
ATOM    306  HN  ILE A  21      -0.104  -0.091  -4.505  1.00  0.00      A       
ATOM    307  HA  ILE A  21      -0.124  -3.035  -4.461  1.00  0.00      A       
ATOM    308  HB  ILE A  21       0.199  -1.457  -6.641  1.00  0.00      A       
ATOM    309 HD11 ILE A  21       1.542  -2.754  -8.574  1.00  0.00      A       
ATOM    310 HD12 ILE A  21       2.699  -3.768  -7.710  1.00  0.00      A       
ATOM    311 HD13 ILE A  21       1.317  -4.503  -8.524  1.00  0.00      A       
ATOM    312 HG12 ILE A  21       1.218  -4.206  -5.983  1.00  0.00      A       
ATOM    313 HG11 ILE A  21      -0.186  -3.748  -6.942  1.00  0.00      A       
ATOM    314 HG21 ILE A  21       2.986  -2.141  -5.717  1.00  0.00      A       
ATOM    315 HG22 ILE A  21       2.546  -1.427  -7.268  1.00  0.00      A       
ATOM    316 HG23 ILE A  21       2.295  -0.519  -5.777  1.00  0.00      A       
ATOM    317  N   ILE A  21      -0.411  -0.998  -4.295  1.00  0.00      A       
ATOM    318  O   ILE A  21       2.320  -3.203  -3.576  1.00  0.00      A       
ATOM    319  C   LYS A  22       2.933   0.093  -1.168  1.00  0.00      A       
ATOM    320  CA  LYS A  22       3.187  -0.904  -2.294  1.00  0.00      A       
ATOM    321  CB  LYS A  22       4.417  -0.479  -3.099  1.00  0.00      A       
ATOM    322  CD  LYS A  22       5.509   1.257  -4.549  1.00  0.00      A       
ATOM    323  CE  LYS A  22       5.825   0.361  -5.737  1.00  0.00      A       
ATOM    324  CG  LYS A  22       4.230   0.827  -3.852  1.00  0.00      A       
ATOM    325  HN  LYS A  22       1.478  -0.214  -3.335  1.00  0.00      A       
ATOM    326  HA  LYS A  22       3.368  -1.877  -1.862  1.00  0.00      A       
ATOM    327  HB2 LYS A  22       5.252  -0.363  -2.423  1.00  0.00      A       
ATOM    328  HB1 LYS A  22       4.650  -1.254  -3.815  1.00  0.00      A       
ATOM    329  HD2 LYS A  22       5.395   2.271  -4.899  1.00  0.00      A       
ATOM    330  HD1 LYS A  22       6.327   1.207  -3.845  1.00  0.00      A       
ATOM    331  HE2 LYS A  22       5.764  -0.669  -5.422  1.00  0.00      A       
ATOM    332  HE1 LYS A  22       5.095   0.543  -6.513  1.00  0.00      A       
ATOM    333  HG2 LYS A  22       3.455   0.695  -4.594  1.00  0.00      A       
ATOM    334  HG1 LYS A  22       3.935   1.596  -3.153  1.00  0.00      A       
ATOM    335  HZ1 LYS A  22       7.294   0.163  -7.210  1.00  0.00      A       
ATOM    336  HZ2 LYS A  22       7.908   0.243  -5.636  1.00  0.00      A       
ATOM    337  HZ3 LYS A  22       7.338   1.645  -6.393  1.00  0.00      A       
ATOM    338  N   LYS A  22       2.024  -1.011  -3.167  1.00  0.00      A       
ATOM    339  NZ  LYS A  22       7.187   0.621  -6.282  1.00  0.00      A       
ATOM    340  O   LYS A  22       1.846   0.664  -1.064  1.00  0.00      A       
ATOM    341  C   CYS A  23       3.837   2.675   0.298  1.00  0.00      A       
ATOM    342  CA  CYS A  23       3.828   1.231   0.789  1.00  0.00      A       
ATOM    343  CB  CYS A  23       4.972   1.011   1.781  1.00  0.00      A       
ATOM    344  HN  CYS A  23       4.783  -0.183  -0.463  1.00  0.00      A       
ATOM    345  HA  CYS A  23       2.889   1.039   1.286  1.00  0.00      A       
ATOM    346  HB2 CYS A  23       5.243  -0.035   1.779  1.00  0.00      A       
ATOM    347  HB1 CYS A  23       5.824   1.598   1.473  1.00  0.00      A       
ATOM    348  N   CYS A  23       3.942   0.301  -0.328  1.00  0.00      A       
ATOM    349  O   CYS A  23       4.326   2.968  -0.794  1.00  0.00      A       
ATOM    350  SG  CYS A  23       4.568   1.474   3.495  1.00  0.00      A       
ATOM    351  C   VAL A  24       4.241   5.797   1.580  1.00  0.00      A       
ATOM    352  CA  VAL A  24       3.240   4.990   0.761  1.00  0.00      A       
ATOM    353  CB  VAL A  24       1.830   5.568   0.978  1.00  0.00      A       
ATOM    354  CG1 VAL A  24       1.612   5.907   2.445  1.00  0.00      A       
ATOM    355  CG2 VAL A  24       1.616   6.794   0.101  1.00  0.00      A       
ATOM    356  HN  VAL A  24       2.921   3.281   1.968  1.00  0.00      A       
ATOM    357  HA  VAL A  24       3.488   5.084  -0.286  1.00  0.00      A       
ATOM    358  HB  VAL A  24       1.106   4.818   0.694  1.00  0.00      A       
ATOM    359 HG11 VAL A  24       1.839   6.951   2.611  1.00  0.00      A       
ATOM    360 HG12 VAL A  24       0.582   5.716   2.710  1.00  0.00      A       
ATOM    361 HG13 VAL A  24       2.261   5.298   3.056  1.00  0.00      A       
ATOM    362 HG21 VAL A  24       2.410   7.504   0.279  1.00  0.00      A       
ATOM    363 HG22 VAL A  24       1.622   6.499  -0.938  1.00  0.00      A       
ATOM    364 HG23 VAL A  24       0.666   7.247   0.341  1.00  0.00      A       
ATOM    365  N   VAL A  24       3.294   3.575   1.111  1.00  0.00      A       
ATOM    366  O   VAL A  24       4.128   7.018   1.689  1.00  0.00      A       
ATOM    367  C   ALA A  25       7.632   5.225   2.627  1.00  0.00      A       
ATOM    368  CA  ALA A  25       6.244   5.760   2.962  1.00  0.00      A       
ATOM    369  CB  ALA A  25       5.946   5.574   4.442  1.00  0.00      A       
ATOM    370  HN  ALA A  25       5.257   4.135   2.031  1.00  0.00      A       
ATOM    371  HA  ALA A  25       6.214   6.818   2.745  1.00  0.00      A       
ATOM    372  HB1 ALA A  25       6.874   5.456   4.983  1.00  0.00      A       
ATOM    373  HB2 ALA A  25       5.419   6.439   4.815  1.00  0.00      A       
ATOM    374  HB3 ALA A  25       5.336   4.693   4.578  1.00  0.00      A       
ATOM    375  N   ALA A  25       5.221   5.107   2.154  1.00  0.00      A       
ATOM    376  O   ALA A  25       8.588   5.988   2.497  1.00  0.00      A       
ATOM    377  C   CYS A  26       8.970   2.646   0.781  1.00  0.00      A       
ATOM    378  CA  CYS A  26       9.007   3.268   2.174  1.00  0.00      A       
ATOM    379  CB  CYS A  26       9.337   2.197   3.214  1.00  0.00      A       
ATOM    380  HN  CYS A  26       6.936   3.349   2.608  1.00  0.00      A       
ATOM    381  HA  CYS A  26       9.774   4.027   2.195  1.00  0.00      A       
ATOM    382  HB2 CYS A  26      10.383   1.940   3.136  1.00  0.00      A       
ATOM    383  HB1 CYS A  26       9.142   2.591   4.201  1.00  0.00      A       
ATOM    384  N   CYS A  26       7.735   3.907   2.492  1.00  0.00      A       
ATOM    385  O   CYS A  26      10.000   2.245   0.243  1.00  0.00      A       
ATOM    386  SG  CYS A  26       8.376   0.660   3.030  1.00  0.00      A       
ATOM    387  C   GLU A  27       7.906   0.500  -1.116  1.00  0.00      A       
ATOM    388  CA  GLU A  27       7.603   1.995  -1.126  1.00  0.00      A       
ATOM    389  CB  GLU A  27       8.513   2.704  -2.131  1.00  0.00      A       
ATOM    390  CD  GLU A  27       9.907   4.796  -2.381  1.00  0.00      A       
ATOM    391  CG  GLU A  27       8.582   4.209  -1.935  1.00  0.00      A       
ATOM    392  HN  GLU A  27       6.990   2.907   0.684  1.00  0.00      A       
ATOM    393  HA  GLU A  27       6.576   2.140  -1.419  1.00  0.00      A       
ATOM    394  HB2 GLU A  27       9.512   2.304  -2.040  1.00  0.00      A       
ATOM    395  HB1 GLU A  27       8.147   2.509  -3.129  1.00  0.00      A       
ATOM    396  HG2 GLU A  27       7.792   4.671  -2.508  1.00  0.00      A       
ATOM    397  HG1 GLU A  27       8.442   4.430  -0.887  1.00  0.00      A       
ATOM    398  N   GLU A  27       7.774   2.569   0.204  1.00  0.00      A       
ATOM    399  O   GLU A  27       8.634  -0.005  -1.972  1.00  0.00      A       
ATOM    400  OE1 GLU A  27      10.331   4.509  -3.519  1.00  0.00      A       
ATOM    401  OE2 GLU A  27      10.521   5.542  -1.589  1.00  0.00      A       
ATOM    402  C   THR A  28       6.528  -2.420  -0.835  1.00  0.00      A       
ATOM    403  CA  THR A  28       7.551  -1.642  -0.016  1.00  0.00      A       
ATOM    404  CB  THR A  28       7.468  -2.097   1.454  1.00  0.00      A       
ATOM    405  CG2 THR A  28       6.623  -3.355   1.583  1.00  0.00      A       
ATOM    406  HN  THR A  28       6.772   0.254   0.513  1.00  0.00      A       
ATOM    407  HA  THR A  28       8.541  -1.868  -0.385  1.00  0.00      A       
ATOM    408  HB  THR A  28       7.006  -1.311   2.033  1.00  0.00      A       
ATOM    409  HG1 THR A  28       9.161  -3.106   1.521  1.00  0.00      A       
ATOM    410 HG21 THR A  28       6.611  -3.677   2.614  1.00  0.00      A       
ATOM    411 HG22 THR A  28       7.044  -4.137   0.968  1.00  0.00      A       
ATOM    412 HG23 THR A  28       5.614  -3.147   1.260  1.00  0.00      A       
ATOM    413  N   THR A  28       7.342  -0.206  -0.140  1.00  0.00      A       
ATOM    414  O   THR A  28       5.372  -2.020  -0.970  1.00  0.00      A       
ATOM    415  OG1 THR A  28       8.783  -2.344   1.966  1.00  0.00      A       
ATOM    416  C   PRO A  29       5.027  -5.118  -1.383  1.00  0.00      A       
ATOM    417  CA  PRO A  29       6.097  -4.416  -2.213  1.00  0.00      A       
ATOM    418  CB  PRO A  29       7.071  -5.440  -2.805  1.00  0.00      A       
ATOM    419  CD  PRO A  29       8.327  -4.096  -1.279  1.00  0.00      A       
ATOM    420  CG  PRO A  29       8.205  -5.485  -1.840  1.00  0.00      A       
ATOM    421  HA  PRO A  29       5.627  -3.862  -3.011  1.00  0.00      A       
ATOM    422  HB2 PRO A  29       6.582  -6.400  -2.886  1.00  0.00      A       
ATOM    423  HB1 PRO A  29       7.395  -5.110  -3.780  1.00  0.00      A       
ATOM    424  HD2 PRO A  29       8.639  -4.132  -0.245  1.00  0.00      A       
ATOM    425  HD1 PRO A  29       9.022  -3.512  -1.864  1.00  0.00      A       
ATOM    426  HG2 PRO A  29       7.989  -6.190  -1.052  1.00  0.00      A       
ATOM    427  HG1 PRO A  29       9.113  -5.762  -2.355  1.00  0.00      A       
ATOM    428  N   PRO A  29       6.961  -3.559  -1.397  1.00  0.00      A       
ATOM    429  O   PRO A  29       5.331  -5.976  -0.555  1.00  0.00      A       
ATOM    430  C   LYS A  30       2.693  -6.863  -0.978  1.00  0.00      A       
ATOM    431  CA  LYS A  30       2.655  -5.341  -0.886  1.00  0.00      A       
ATOM    432  CB  LYS A  30       1.325  -4.821  -1.440  1.00  0.00      A       
ATOM    433  CD  LYS A  30      -1.050  -5.509  -1.875  1.00  0.00      A       
ATOM    434  CE  LYS A  30      -2.050  -4.425  -1.504  1.00  0.00      A       
ATOM    435  CG  LYS A  30       0.112  -5.553  -0.897  1.00  0.00      A       
ATOM    436  HN  LYS A  30       3.592  -4.057  -2.284  1.00  0.00      A       
ATOM    437  HA  LYS A  30       2.740  -5.053   0.151  1.00  0.00      A       
ATOM    438  HB2 LYS A  30       1.231  -3.774  -1.190  1.00  0.00      A       
ATOM    439  HB1 LYS A  30       1.332  -4.925  -2.515  1.00  0.00      A       
ATOM    440  HD2 LYS A  30      -0.669  -5.307  -2.864  1.00  0.00      A       
ATOM    441  HD1 LYS A  30      -1.552  -6.467  -1.869  1.00  0.00      A       
ATOM    442  HE2 LYS A  30      -2.384  -4.592  -0.491  1.00  0.00      A       
ATOM    443  HE1 LYS A  30      -1.560  -3.465  -1.567  1.00  0.00      A       
ATOM    444  HG2 LYS A  30       0.376  -6.584  -0.715  1.00  0.00      A       
ATOM    445  HG1 LYS A  30      -0.192  -5.089   0.031  1.00  0.00      A       
ATOM    446  HZ1 LYS A  30      -3.545  -3.451  -2.590  1.00  0.00      A       
ATOM    447  HZ2 LYS A  30      -4.015  -4.953  -1.975  1.00  0.00      A       
ATOM    448  HZ3 LYS A  30      -2.987  -4.874  -3.316  1.00  0.00      A       
ATOM    449  N   LYS A  30       3.771  -4.747  -1.611  1.00  0.00      A       
ATOM    450  NZ  LYS A  30      -3.232  -4.426  -2.410  1.00  0.00      A       
ATOM    451  O   LYS A  30       3.054  -7.438  -2.006  1.00  0.00      A       
ATOM    452  C   PRO A  31       1.198  -9.604  -0.684  1.00  0.00      A       
ATOM    453  CA  PRO A  31       2.294  -8.998   0.186  1.00  0.00      A       
ATOM    454  CB  PRO A  31       2.021  -9.282   1.665  1.00  0.00      A       
ATOM    455  CD  PRO A  31       1.870  -6.913   1.379  1.00  0.00      A       
ATOM    456  CG  PRO A  31       1.308  -8.071   2.158  1.00  0.00      A       
ATOM    457  HA  PRO A  31       3.248  -9.420  -0.093  1.00  0.00      A       
ATOM    458  HB2 PRO A  31       1.407 -10.167   1.757  1.00  0.00      A       
ATOM    459  HB1 PRO A  31       2.955  -9.429   2.185  1.00  0.00      A       
ATOM    460  HD2 PRO A  31       1.105  -6.174   1.197  1.00  0.00      A       
ATOM    461  HD1 PRO A  31       2.705  -6.474   1.906  1.00  0.00      A       
ATOM    462  HG2 PRO A  31       0.249  -8.167   1.974  1.00  0.00      A       
ATOM    463  HG1 PRO A  31       1.496  -7.938   3.213  1.00  0.00      A       
ATOM    464  N   PRO A  31       2.312  -7.534   0.120  1.00  0.00      A       
ATOM    465  OT1 PRO A  31       0.127  -9.011  -0.802  1.00  0.00      A       
TER
ATOM    466  ZN   ZN B  32       6.574   0.769   4.613  1.00  0.00      B       
END


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