NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
481133 1azh cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   THR A   1      -5.781  -4.886  -8.203  1.00  0.00      A       
ATOM      2  CA  THR A   1      -4.254  -4.697  -8.404  1.00  0.00      A       
ATOM      3  CB  THR A   1      -3.957  -3.595  -9.443  1.00  0.00      A       
ATOM      4  CG2 THR A   1      -4.418  -2.210  -8.982  1.00  0.00      A       
ATOM      5  HT1 THR A   1      -3.638  -6.639  -7.966  1.00  0.00      A       
ATOM      6  HT2 THR A   1      -3.622  -6.346  -9.600  1.00  0.00      A       
ATOM      7  HT3 THR A   1      -2.485  -5.741  -8.587  1.00  0.00      A       
ATOM      8  HA  THR A   1      -3.869  -4.334  -7.447  1.00  0.00      A       
ATOM      9  HB  THR A   1      -4.436  -3.831 -10.396  1.00  0.00      A       
ATOM     10  HG1 THR A   1      -2.343  -2.703 -10.088  1.00  0.00      A       
ATOM     11 HG21 THR A   1      -5.493  -2.193  -8.799  1.00  0.00      A       
ATOM     12 HG22 THR A   1      -3.900  -1.925  -8.065  1.00  0.00      A       
ATOM     13 HG23 THR A   1      -4.193  -1.467  -9.748  1.00  0.00      A       
ATOM     14  N   THR A   1      -3.479  -5.943  -8.689  1.00  0.00      A       
ATOM     15  O   THR A   1      -6.285  -4.638  -7.113  1.00  0.00      A       
ATOM     16  OG1 THR A   1      -2.562  -3.534  -9.649  1.00  0.00      A       
ATOM     17  C   GLN A   2      -8.437  -6.856  -8.590  1.00  0.00      A       
ATOM     18  CA  GLN A   2      -7.991  -5.500  -9.185  1.00  0.00      A       
ATOM     19  CB  GLN A   2      -8.569  -5.305 -10.601  1.00  0.00      A       
ATOM     20  CD  GLN A   2     -10.850  -4.459  -9.764  1.00  0.00      A       
ATOM     21  CG  GLN A   2     -10.106  -5.436 -10.672  1.00  0.00      A       
ATOM     22  HN  GLN A   2      -6.085  -5.484 -10.129  1.00  0.00      A       
ATOM     23  HA  GLN A   2      -8.406  -4.716  -8.550  1.00  0.00      A       
ATOM     24  HB2 GLN A   2      -8.289  -4.316 -10.969  1.00  0.00      A       
ATOM     25  HB1 GLN A   2      -8.139  -6.046 -11.277  1.00  0.00      A       
ATOM     26 HE21 GLN A   2     -10.743  -5.694  -8.138  1.00  0.00      A       
ATOM     27 HE22 GLN A   2     -11.559  -4.140  -7.951  1.00  0.00      A       
ATOM     28  HG2 GLN A   2     -10.429  -5.238 -11.696  1.00  0.00      A       
ATOM     29  HG1 GLN A   2     -10.423  -6.451 -10.430  1.00  0.00      A       
ATOM     30  N   GLN A   2      -6.525  -5.316  -9.239  1.00  0.00      A       
ATOM     31  NE2 GLN A   2     -11.072  -4.814  -8.515  1.00  0.00      A       
ATOM     32  O   GLN A   2      -9.296  -6.909  -7.718  1.00  0.00      A       
ATOM     33  OE1 GLN A   2     -11.212  -3.365 -10.160  1.00  0.00      A       
ATOM     34  C   SER A   3      -7.218  -9.526  -7.284  1.00  0.00      A       
ATOM     35  CA  SER A   3      -8.044  -9.318  -8.572  1.00  0.00      A       
ATOM     36  CB  SER A   3      -7.647 -10.321  -9.673  1.00  0.00      A       
ATOM     37  HN  SER A   3      -7.212  -7.855  -9.851  1.00  0.00      A       
ATOM     38  HA  SER A   3      -9.094  -9.487  -8.324  1.00  0.00      A       
ATOM     39  HB2 SER A   3      -7.609 -11.330  -9.252  1.00  0.00      A       
ATOM     40  HB1 SER A   3      -8.417 -10.310 -10.454  1.00  0.00      A       
ATOM     41  HG  SER A   3      -6.112 -10.671 -10.858  1.00  0.00      A       
ATOM     42  N   SER A   3      -7.874  -7.956  -9.100  1.00  0.00      A       
ATOM     43  O   SER A   3      -7.737  -9.471  -6.174  1.00  0.00      A       
ATOM     44  OG  SER A   3      -6.370  -9.991 -10.220  1.00  0.00      A       
ATOM     45  C   HIS A   4      -4.919  -8.128  -5.788  1.00  0.00      A       
ATOM     46  CA  HIS A   4      -4.946  -9.582  -6.324  1.00  0.00      A       
ATOM     47  CB  HIS A   4      -3.556 -10.052  -6.788  1.00  0.00      A       
ATOM     48  CD2 HIS A   4      -2.023 -10.884  -4.862  1.00  0.00      A       
ATOM     49  CE1 HIS A   4      -1.137  -8.957  -4.343  1.00  0.00      A       
ATOM     50  CG  HIS A   4      -2.509  -9.930  -5.710  1.00  0.00      A       
ATOM     51  HN  HIS A   4      -5.576  -9.754  -8.386  1.00  0.00      A       
ATOM     52  HA  HIS A   4      -5.261 -10.260  -5.524  1.00  0.00      A       
ATOM     53  HB2 HIS A   4      -3.609 -11.101  -7.080  1.00  0.00      A       
ATOM     54  HB1 HIS A   4      -3.235  -9.470  -7.653  1.00  0.00      A       
ATOM     55  HD2 HIS A   4      -2.309 -11.924  -4.848  1.00  0.00      A       
ATOM     56  HE1 HIS A   4      -0.549  -8.203  -3.834  1.00  0.00      A       
ATOM     57  HE2 HIS A   4      -0.602 -10.692  -3.267  1.00  0.00      A       
ATOM     58  N   HIS A   4      -5.902  -9.697  -7.430  1.00  0.00      A       
ATOM     59  ND1 HIS A   4      -1.936  -8.701  -5.385  1.00  0.00      A       
ATOM     60  NE2 HIS A   4      -1.137 -10.257  -4.011  1.00  0.00      A       
ATOM     61  O   HIS A   4      -4.429  -7.227  -6.478  1.00  0.00      A       
ATOM     62  C   ALA A   5      -4.128  -5.943  -3.671  1.00  0.00      A       
ATOM     63  CA  ALA A   5      -5.520  -6.552  -3.978  1.00  0.00      A       
ATOM     64  CB  ALA A   5      -6.380  -6.631  -2.710  1.00  0.00      A       
ATOM     65  HN  ALA A   5      -5.921  -8.649  -4.123  1.00  0.00      A       
ATOM     66  HA  ALA A   5      -6.036  -5.890  -4.678  1.00  0.00      A       
ATOM     67  HB1 ALA A   5      -7.394  -6.958  -2.958  1.00  0.00      A       
ATOM     68  HB2 ALA A   5      -5.942  -7.337  -2.001  1.00  0.00      A       
ATOM     69  HB3 ALA A   5      -6.439  -5.648  -2.235  1.00  0.00      A       
ATOM     70  N   ALA A   5      -5.472  -7.880  -4.599  1.00  0.00      A       
ATOM     71  O   ALA A   5      -3.205  -6.636  -3.247  1.00  0.00      A       
ATOM     72  C   GLY A   6      -2.537  -3.467  -2.162  1.00  0.00      A       
ATOM     73  CA  GLY A   6      -2.735  -3.888  -3.635  1.00  0.00      A       
ATOM     74  HN  GLY A   6      -4.782  -4.133  -4.246  1.00  0.00      A       
ATOM     75  HA2 GLY A   6      -1.874  -4.489  -3.924  1.00  0.00      A       
ATOM     76  HA1 GLY A   6      -2.719  -2.998  -4.266  1.00  0.00      A       
ATOM     77  N   GLY A   6      -3.978  -4.631  -3.898  1.00  0.00      A       
ATOM     78  O   GLY A   6      -1.702  -4.030  -1.460  1.00  0.00      A       
ATOM     79  C   GLN A   7      -3.325  -2.588   0.864  1.00  0.00      A       
ATOM     80  CA  GLN A   7      -3.105  -1.749  -0.429  1.00  0.00      A       
ATOM     81  CB  GLN A   7      -4.035  -0.518  -0.446  1.00  0.00      A       
ATOM     82  CD  GLN A   7      -4.763   1.590   0.818  1.00  0.00      A       
ATOM     83  CG  GLN A   7      -4.006   0.268   0.882  1.00  0.00      A       
ATOM     84  HN  GLN A   7      -3.991  -2.099  -2.335  1.00  0.00      A       
ATOM     85  HA  GLN A   7      -2.091  -1.344  -0.410  1.00  0.00      A       
ATOM     86  HB2 GLN A   7      -3.737   0.133  -1.271  1.00  0.00      A       
ATOM     87  HB1 GLN A   7      -5.063  -0.842  -0.625  1.00  0.00      A       
ATOM     88 HE21 GLN A   7      -5.547   1.379   2.678  1.00  0.00      A       
ATOM     89 HE22 GLN A   7      -6.031   2.791   1.720  1.00  0.00      A       
ATOM     90  HG2 GLN A   7      -4.460  -0.337   1.665  1.00  0.00      A       
ATOM     91  HG1 GLN A   7      -2.981   0.487   1.169  1.00  0.00      A       
ATOM     92  N   GLN A   7      -3.288  -2.456  -1.709  1.00  0.00      A       
ATOM     93  NE2 GLN A   7      -5.440   1.982   1.878  1.00  0.00      A       
ATOM     94  O   GLN A   7      -4.461  -2.935   1.175  1.00  0.00      A       
ATOM     95  OE1 GLN A   7      -4.755   2.285  -0.188  1.00  0.00      A       
ATOM     96  C   CYS A   8      -2.451  -1.545   3.881  1.00  0.00      A       
ATOM     97  CA  CYS A   8      -2.358  -2.919   3.145  1.00  0.00      A       
ATOM     98  CB  CYS A   8      -1.192  -3.809   3.631  1.00  0.00      A       
ATOM     99  HN  CYS A   8      -1.364  -2.602   1.269  1.00  0.00      A       
ATOM    100  HA  CYS A   8      -3.274  -3.464   3.392  1.00  0.00      A       
ATOM    101  HB2 CYS A   8      -1.268  -3.945   4.709  1.00  0.00      A       
ATOM    102  HB1 CYS A   8      -1.276  -4.791   3.165  1.00  0.00      A       
ATOM    103  N   CYS A   8      -2.276  -2.752   1.680  1.00  0.00      A       
ATOM    104  O   CYS A   8      -3.406  -1.275   4.604  1.00  0.00      A       
ATOM    105  SG  CYS A   8       0.484  -3.212   3.276  1.00  0.00      A       
ATOM    106  C   GLY A   9      -0.923   0.778   5.713  1.00  0.00      A       
ATOM    107  CA  GLY A   9      -1.407   0.711   4.242  1.00  0.00      A       
ATOM    108  HN  GLY A   9      -0.753  -0.928   3.021  1.00  0.00      A       
ATOM    109  HA2 GLY A   9      -0.691   1.276   3.646  1.00  0.00      A       
ATOM    110  HA1 GLY A   9      -2.374   1.212   4.173  1.00  0.00      A       
ATOM    111  N   GLY A   9      -1.494  -0.634   3.637  1.00  0.00      A       
ATOM    112  O   GLY A   9      -0.809  -0.241   6.387  1.00  0.00      A       
ATOM    113  C   GLY A  10      -0.691   3.433   8.319  1.00  0.00      A       
ATOM    114  CA  GLY A  10      -0.084   2.222   7.569  1.00  0.00      A       
ATOM    115  HN  GLY A  10      -0.666   2.789   5.596  1.00  0.00      A       
ATOM    116  HA2 GLY A  10      -0.283   1.357   8.202  1.00  0.00      A       
ATOM    117  HA1 GLY A  10       0.998   2.331   7.517  1.00  0.00      A       
ATOM    118  N   GLY A  10      -0.588   1.987   6.202  1.00  0.00      A       
ATOM    119  O   GLY A  10      -1.891   3.462   8.597  1.00  0.00      A       
ATOM    120  C   ILE A  11      -1.397   6.370   9.205  1.00  0.00      A       
ATOM    121  CA  ILE A  11      -0.184   5.506   9.653  1.00  0.00      A       
ATOM    122  CB  ILE A  11       1.079   6.357   9.976  1.00  0.00      A       
ATOM    123  CD1 ILE A  11       3.559   6.265  10.689  1.00  0.00      A       
ATOM    124  CG1 ILE A  11       2.250   5.482  10.489  1.00  0.00      A       
ATOM    125  CG2 ILE A  11       0.779   7.456  11.018  1.00  0.00      A       
ATOM    126  HN  ILE A  11       1.074   4.363   8.326  1.00  0.00      A       
ATOM    127  HA  ILE A  11      -0.463   5.037  10.598  1.00  0.00      A       
ATOM    128  HB  ILE A  11       1.393   6.856   9.063  1.00  0.00      A       
ATOM    129 HD11 ILE A  11       3.809   6.820   9.783  1.00  0.00      A       
ATOM    130 HD12 ILE A  11       3.480   6.957  11.527  1.00  0.00      A       
ATOM    131 HD13 ILE A  11       4.373   5.572  10.908  1.00  0.00      A       
ATOM    132 HG12 ILE A  11       1.969   5.019  11.434  1.00  0.00      A       
ATOM    133 HG11 ILE A  11       2.464   4.686   9.774  1.00  0.00      A       
ATOM    134 HG21 ILE A  11      -0.035   8.103  10.694  1.00  0.00      A       
ATOM    135 HG22 ILE A  11       0.514   7.004  11.973  1.00  0.00      A       
ATOM    136 HG23 ILE A  11       1.648   8.100  11.161  1.00  0.00      A       
ATOM    137  N   ILE A  11       0.138   4.418   8.701  1.00  0.00      A       
ATOM    138  O   ILE A  11      -1.248   7.407   8.564  1.00  0.00      A       
ATOM    139  C   GLY A  12      -4.463   6.175   7.793  1.00  0.00      A       
ATOM    140  CA  GLY A  12      -3.898   6.536   9.185  1.00  0.00      A       
ATOM    141  HN  GLY A  12      -2.621   4.978   9.927  1.00  0.00      A       
ATOM    142  HA2 GLY A  12      -4.633   6.208   9.921  1.00  0.00      A       
ATOM    143  HA1 GLY A  12      -3.819   7.622   9.262  1.00  0.00      A       
ATOM    144  N   GLY A  12      -2.610   5.912   9.536  1.00  0.00      A       
ATOM    145  O   GLY A  12      -5.221   6.951   7.214  1.00  0.00      A       
ATOM    146  C   TYR A  13      -5.772   3.554   5.962  1.00  0.00      A       
ATOM    147  CA  TYR A  13      -4.566   4.527   5.926  1.00  0.00      A       
ATOM    148  CB  TYR A  13      -3.369   3.917   5.169  1.00  0.00      A       
ATOM    149  CD1 TYR A  13      -1.867   5.975   5.273  1.00  0.00      A       
ATOM    150  CD2 TYR A  13      -2.376   4.995   3.097  1.00  0.00      A       
ATOM    151  CE1 TYR A  13      -1.258   7.071   4.628  1.00  0.00      A       
ATOM    152  CE2 TYR A  13      -1.694   6.055   2.462  1.00  0.00      A       
ATOM    153  CG  TYR A  13      -2.460   4.944   4.507  1.00  0.00      A       
ATOM    154  CZ  TYR A  13      -1.139   7.091   3.230  1.00  0.00      A       
ATOM    155  HN  TYR A  13      -3.501   4.405   7.790  1.00  0.00      A       
ATOM    156  HA  TYR A  13      -4.892   5.392   5.339  1.00  0.00      A       
ATOM    157  HB2 TYR A  13      -2.790   3.295   5.851  1.00  0.00      A       
ATOM    158  HB1 TYR A  13      -3.752   3.256   4.388  1.00  0.00      A       
ATOM    159  HD1 TYR A  13      -1.910   5.956   6.351  1.00  0.00      A       
ATOM    160  HD2 TYR A  13      -2.851   4.232   2.497  1.00  0.00      A       
ATOM    161  HE1 TYR A  13      -0.906   7.914   5.200  1.00  0.00      A       
ATOM    162  HE2 TYR A  13      -1.619   6.082   1.385  1.00  0.00      A       
ATOM    163  HH  TYR A  13      -0.414   7.943   1.677  1.00  0.00      A       
ATOM    164  N   TYR A  13      -4.125   4.996   7.253  1.00  0.00      A       
ATOM    165  O   TYR A  13      -5.955   2.780   6.897  1.00  0.00      A       
ATOM    166  OH  TYR A  13      -0.478   8.105   2.619  1.00  0.00      A       
ATOM    167  C   SER A  14      -8.407   2.992   3.291  1.00  0.00      A       
ATOM    168  CA  SER A  14      -7.782   2.746   4.684  1.00  0.00      A       
ATOM    169  CB  SER A  14      -8.809   2.933   5.815  1.00  0.00      A       
ATOM    170  HN  SER A  14      -6.339   4.255   4.184  1.00  0.00      A       
ATOM    171  HA  SER A  14      -7.460   1.702   4.707  1.00  0.00      A       
ATOM    172  HB2 SER A  14      -8.432   2.481   6.738  1.00  0.00      A       
ATOM    173  HB1 SER A  14      -8.975   3.995   6.007  1.00  0.00      A       
ATOM    174  HG  SER A  14      -9.946   1.379   5.389  1.00  0.00      A       
ATOM    175  N   SER A  14      -6.596   3.598   4.906  1.00  0.00      A       
ATOM    176  O   SER A  14      -8.509   2.076   2.476  1.00  0.00      A       
ATOM    177  OG  SER A  14     -10.049   2.334   5.469  1.00  0.00      A       
ATOM    178  C   GLY A  15      -8.203   4.248   0.500  1.00  0.00      A       
ATOM    179  CA  GLY A  15      -9.172   4.679   1.630  1.00  0.00      A       
ATOM    180  HN  GLY A  15      -8.692   4.941   3.707  1.00  0.00      A       
ATOM    181  HA2 GLY A  15     -10.168   4.276   1.448  1.00  0.00      A       
ATOM    182  HA1 GLY A  15      -9.234   5.766   1.612  1.00  0.00      A       
ATOM    183  N   GLY A  15      -8.760   4.249   2.978  1.00  0.00      A       
ATOM    184  O   GLY A  15      -7.006   4.081   0.758  1.00  0.00      A       
ATOM    185  C   PRO A  16      -6.807   4.288  -2.410  1.00  0.00      A       
ATOM    186  CA  PRO A  16      -7.923   3.396  -1.812  1.00  0.00      A       
ATOM    187  CB  PRO A  16      -9.000   2.983  -2.834  1.00  0.00      A       
ATOM    188  CD  PRO A  16     -10.043   4.346  -1.195  1.00  0.00      A       
ATOM    189  CG  PRO A  16     -10.023   4.113  -2.707  1.00  0.00      A       
ATOM    190  HA  PRO A  16      -7.451   2.485  -1.431  1.00  0.00      A       
ATOM    191  HB2 PRO A  16      -8.625   2.873  -3.854  1.00  0.00      A       
ATOM    192  HB1 PRO A  16      -9.475   2.046  -2.522  1.00  0.00      A       
ATOM    193  HD2 PRO A  16     -10.352   5.371  -0.967  1.00  0.00      A       
ATOM    194  HD1 PRO A  16     -10.739   3.636  -0.740  1.00  0.00      A       
ATOM    195  HG2 PRO A  16      -9.646   5.002  -3.223  1.00  0.00      A       
ATOM    196  HG1 PRO A  16     -11.001   3.838  -3.109  1.00  0.00      A       
ATOM    197  N   PRO A  16      -8.684   4.057  -0.746  1.00  0.00      A       
ATOM    198  O   PRO A  16      -6.868   4.700  -3.565  1.00  0.00      A       
ATOM    199  C   THR A  17      -3.604   4.338  -3.011  1.00  0.00      A       
ATOM    200  CA  THR A  17      -4.499   5.232  -2.119  1.00  0.00      A       
ATOM    201  CB  THR A  17      -3.708   5.755  -0.901  1.00  0.00      A       
ATOM    202  CG2 THR A  17      -4.532   6.757  -0.084  1.00  0.00      A       
ATOM    203  HN  THR A  17      -5.730   4.140  -0.726  1.00  0.00      A       
ATOM    204  HA  THR A  17      -4.773   6.101  -2.723  1.00  0.00      A       
ATOM    205  HB  THR A  17      -2.803   6.273  -1.240  1.00  0.00      A       
ATOM    206  HG1 THR A  17      -4.008   4.021  -0.034  1.00  0.00      A       
ATOM    207 HG21 THR A  17      -4.847   7.581  -0.725  1.00  0.00      A       
ATOM    208 HG22 THR A  17      -5.416   6.279   0.337  1.00  0.00      A       
ATOM    209 HG23 THR A  17      -3.926   7.151   0.732  1.00  0.00      A       
ATOM    210  N   THR A  17      -5.729   4.537  -1.660  1.00  0.00      A       
ATOM    211  O   THR A  17      -2.392   4.261  -2.846  1.00  0.00      A       
ATOM    212  OG1 THR A  17      -3.321   4.698  -0.045  1.00  0.00      A       
ATOM    213  C   VAL A  18      -2.614   2.286  -5.478  1.00  0.00      A       
ATOM    214  CA  VAL A  18      -3.733   2.285  -4.402  1.00  0.00      A       
ATOM    215  CB  VAL A  18      -4.950   1.387  -4.745  1.00  0.00      A       
ATOM    216  CG1 VAL A  18      -5.829   1.903  -5.899  1.00  0.00      A       
ATOM    217  CG2 VAL A  18      -4.529  -0.062  -5.038  1.00  0.00      A       
ATOM    218  HN  VAL A  18      -5.195   3.817  -4.076  1.00  0.00      A       
ATOM    219  HA  VAL A  18      -3.302   1.791  -3.530  1.00  0.00      A       
ATOM    220  HB  VAL A  18      -5.587   1.359  -3.853  1.00  0.00      A       
ATOM    221 HG11 VAL A  18      -6.111   2.941  -5.736  1.00  0.00      A       
ATOM    222 HG12 VAL A  18      -5.313   1.826  -6.855  1.00  0.00      A       
ATOM    223 HG13 VAL A  18      -6.739   1.306  -5.953  1.00  0.00      A       
ATOM    224 HG21 VAL A  18      -3.943  -0.455  -4.207  1.00  0.00      A       
ATOM    225 HG22 VAL A  18      -5.415  -0.683  -5.169  1.00  0.00      A       
ATOM    226 HG23 VAL A  18      -3.932  -0.113  -5.949  1.00  0.00      A       
ATOM    227  N   VAL A  18      -4.215   3.597  -3.939  1.00  0.00      A       
ATOM    228  O   VAL A  18      -2.880   2.214  -6.677  1.00  0.00      A       
ATOM    229  C   CYS A  19      -0.583   0.016  -6.018  1.00  0.00      A       
ATOM    230  CA  CYS A  19      -0.292   1.541  -5.837  1.00  0.00      A       
ATOM    231  CB  CYS A  19       1.099   1.813  -5.220  1.00  0.00      A       
ATOM    232  HN  CYS A  19      -1.186   2.344  -4.057  1.00  0.00      A       
ATOM    233  HA  CYS A  19      -0.287   1.994  -6.831  1.00  0.00      A       
ATOM    234  HB2 CYS A  19       1.273   2.888  -5.155  1.00  0.00      A       
ATOM    235  HB1 CYS A  19       1.116   1.402  -4.213  1.00  0.00      A       
ATOM    236  N   CYS A  19      -1.345   2.209  -5.048  1.00  0.00      A       
ATOM    237  O   CYS A  19      -1.360  -0.590  -5.278  1.00  0.00      A       
ATOM    238  SG  CYS A  19       2.480   1.080  -6.166  1.00  0.00      A       
ATOM    239  C   ALA A  20       0.146  -3.115  -6.371  1.00  0.00      A       
ATOM    240  CA  ALA A  20      -0.138  -2.006  -7.439  1.00  0.00      A       
ATOM    241  CB  ALA A  20       0.694  -2.185  -8.725  1.00  0.00      A       
ATOM    242  HN  ALA A  20       0.595  -0.025  -7.631  1.00  0.00      A       
ATOM    243  HA  ALA A  20      -1.184  -2.133  -7.721  1.00  0.00      A       
ATOM    244  HB1 ALA A  20       0.392  -1.448  -9.473  1.00  0.00      A       
ATOM    245  HB2 ALA A  20       1.753  -2.041  -8.505  1.00  0.00      A       
ATOM    246  HB3 ALA A  20       0.555  -3.174  -9.162  1.00  0.00      A       
ATOM    247  N   ALA A  20       0.016  -0.602  -7.041  1.00  0.00      A       
ATOM    248  O   ALA A  20       0.456  -2.875  -5.203  1.00  0.00      A       
ATOM    249  C   SER A  21       1.457  -5.848  -5.281  1.00  0.00      A       
ATOM    250  CA  SER A  21       0.140  -5.641  -6.075  1.00  0.00      A       
ATOM    251  CB  SER A  21      -0.024  -6.774  -7.107  1.00  0.00      A       
ATOM    252  HN  SER A  21      -0.257  -4.449  -7.779  1.00  0.00      A       
ATOM    253  HA  SER A  21      -0.677  -5.739  -5.359  1.00  0.00      A       
ATOM    254  HB2 SER A  21       0.616  -6.569  -7.972  1.00  0.00      A       
ATOM    255  HB1 SER A  21       0.319  -7.731  -6.698  1.00  0.00      A       
ATOM    256  HG  SER A  21      -1.818  -7.362  -6.713  1.00  0.00      A       
ATOM    257  N   SER A  21      -0.009  -4.370  -6.809  1.00  0.00      A       
ATOM    258  O   SER A  21       2.357  -6.520  -5.773  1.00  0.00      A       
ATOM    259  OG  SER A  21      -1.399  -6.885  -7.451  1.00  0.00      A       
ATOM    260  C   GLY A  22       2.753  -7.025  -2.534  1.00  0.00      A       
ATOM    261  CA  GLY A  22       2.676  -5.602  -3.131  1.00  0.00      A       
ATOM    262  HN  GLY A  22       0.741  -4.839  -3.689  1.00  0.00      A       
ATOM    263  HA2 GLY A  22       3.603  -5.397  -3.671  1.00  0.00      A       
ATOM    264  HA1 GLY A  22       2.619  -4.899  -2.301  1.00  0.00      A       
ATOM    265  N   GLY A  22       1.524  -5.380  -4.028  1.00  0.00      A       
ATOM    266  O   GLY A  22       3.828  -7.602  -2.394  1.00  0.00      A       
ATOM    267  C   THR A  23       1.969  -8.998  -0.065  1.00  0.00      A       
ATOM    268  CA  THR A  23       1.393  -8.906  -1.492  1.00  0.00      A       
ATOM    269  CB  THR A  23       1.755 -10.132  -2.373  1.00  0.00      A       
ATOM    270  CG2 THR A  23       3.097 -10.814  -2.085  1.00  0.00      A       
ATOM    271  HN  THR A  23       0.786  -7.011  -2.271  1.00  0.00      A       
ATOM    272  HA  THR A  23       0.310  -8.943  -1.358  1.00  0.00      A       
ATOM    273  HB  THR A  23       1.740  -9.833  -3.427  1.00  0.00      A       
ATOM    274  HG1 THR A  23       0.899 -11.541  -1.323  1.00  0.00      A       
ATOM    275 HG21 THR A  23       3.133 -11.184  -1.061  1.00  0.00      A       
ATOM    276 HG22 THR A  23       3.217 -11.665  -2.756  1.00  0.00      A       
ATOM    277 HG23 THR A  23       3.919 -10.121  -2.255  1.00  0.00      A       
ATOM    278  N   THR A  23       1.597  -7.599  -2.164  1.00  0.00      A       
ATOM    279  O   THR A  23       1.267  -9.386   0.864  1.00  0.00      A       
ATOM    280  OG1 THR A  23       0.787 -11.152  -2.198  1.00  0.00      A       
ATOM    281  C   THR A  24       3.719  -6.645   1.600  1.00  0.00      A       
ATOM    282  CA  THR A  24       3.816  -8.178   1.399  1.00  0.00      A       
ATOM    283  CB  THR A  24       5.267  -8.680   1.545  1.00  0.00      A       
ATOM    284  CG2 THR A  24       5.414 -10.169   1.213  1.00  0.00      A       
ATOM    285  HN  THR A  24       3.731  -8.324  -0.720  1.00  0.00      A       
ATOM    286  HA  THR A  24       3.243  -8.630   2.213  1.00  0.00      A       
ATOM    287  HB  THR A  24       5.577  -8.537   2.584  1.00  0.00      A       
ATOM    288  HG1 THR A  24       5.979  -8.146  -0.198  1.00  0.00      A       
ATOM    289 HG21 THR A  24       4.687 -10.749   1.782  1.00  0.00      A       
ATOM    290 HG22 THR A  24       5.255 -10.343   0.151  1.00  0.00      A       
ATOM    291 HG23 THR A  24       6.418 -10.499   1.475  1.00  0.00      A       
ATOM    292  N   THR A  24       3.232  -8.602   0.114  1.00  0.00      A       
ATOM    293  O   THR A  24       3.244  -5.916   0.725  1.00  0.00      A       
ATOM    294  OG1 THR A  24       6.150  -7.946   0.728  1.00  0.00      A       
ATOM    295  C   CYS A  25       4.926  -4.037   3.833  1.00  0.00      A       
ATOM    296  CA  CYS A  25       3.705  -4.858   3.334  1.00  0.00      A       
ATOM    297  CB  CYS A  25       2.664  -5.140   4.440  1.00  0.00      A       
ATOM    298  HN  CYS A  25       4.538  -6.814   3.427  1.00  0.00      A       
ATOM    299  HA  CYS A  25       3.211  -4.258   2.567  1.00  0.00      A       
ATOM    300  HB2 CYS A  25       1.947  -5.883   4.099  1.00  0.00      A       
ATOM    301  HB1 CYS A  25       3.163  -5.537   5.322  1.00  0.00      A       
ATOM    302  N   CYS A  25       4.097  -6.168   2.791  1.00  0.00      A       
ATOM    303  O   CYS A  25       5.267  -4.100   5.011  1.00  0.00      A       
ATOM    304  SG  CYS A  25       1.698  -3.713   4.970  1.00  0.00      A       
ATOM    305  C   GLN A  26       6.580  -1.004   3.266  1.00  0.00      A       
ATOM    306  CA  GLN A  26       6.829  -2.538   3.231  1.00  0.00      A       
ATOM    307  CB  GLN A  26       8.009  -3.016   2.360  1.00  0.00      A       
ATOM    308  CD  GLN A  26      10.593  -2.913   2.200  1.00  0.00      A       
ATOM    309  CG  GLN A  26       9.348  -2.652   3.040  1.00  0.00      A       
ATOM    310  HN  GLN A  26       5.282  -3.355   1.980  1.00  0.00      A       
ATOM    311  HA  GLN A  26       7.134  -2.769   4.255  1.00  0.00      A       
ATOM    312  HB2 GLN A  26       7.967  -4.104   2.276  1.00  0.00      A       
ATOM    313  HB1 GLN A  26       7.944  -2.594   1.356  1.00  0.00      A       
ATOM    314 HE21 GLN A  26      10.016  -4.780   1.631  1.00  0.00      A       
ATOM    315 HE22 GLN A  26      11.560  -4.157   1.036  1.00  0.00      A       
ATOM    316  HG2 GLN A  26       9.345  -1.593   3.296  1.00  0.00      A       
ATOM    317  HG1 GLN A  26       9.463  -3.226   3.961  1.00  0.00      A       
ATOM    318  N   GLN A  26       5.619  -3.327   2.927  1.00  0.00      A       
ATOM    319  NE2 GLN A  26      10.726  -4.073   1.592  1.00  0.00      A       
ATOM    320  O   GLN A  26       5.975  -0.539   4.224  1.00  0.00      A       
ATOM    321  OE1 GLN A  26      11.478  -2.081   2.102  1.00  0.00      A       
ATOM    322  C   VAL A  27       7.128   1.945   0.870  1.00  0.00      A       
ATOM    323  CA  VAL A  27       6.787   1.272   2.232  1.00  0.00      A       
ATOM    324  CB  VAL A  27       7.550   1.988   3.383  1.00  0.00      A       
ATOM    325  CG1 VAL A  27       9.062   2.066   3.111  1.00  0.00      A       
ATOM    326  CG2 VAL A  27       7.002   3.400   3.648  1.00  0.00      A       
ATOM    327  HN  VAL A  27       7.496  -0.609   1.499  1.00  0.00      A       
ATOM    328  HA  VAL A  27       5.730   1.428   2.408  1.00  0.00      A       
ATOM    329  HB  VAL A  27       7.423   1.433   4.314  1.00  0.00      A       
ATOM    330 HG11 VAL A  27       9.450   1.071   2.900  1.00  0.00      A       
ATOM    331 HG12 VAL A  27       9.273   2.719   2.262  1.00  0.00      A       
ATOM    332 HG13 VAL A  27       9.584   2.466   3.979  1.00  0.00      A       
ATOM    333 HG21 VAL A  27       5.926   3.366   3.833  1.00  0.00      A       
ATOM    334 HG22 VAL A  27       7.483   3.824   4.528  1.00  0.00      A       
ATOM    335 HG23 VAL A  27       7.202   4.045   2.800  1.00  0.00      A       
ATOM    336  N   VAL A  27       7.009  -0.198   2.279  1.00  0.00      A       
ATOM    337  O   VAL A  27       8.125   1.591   0.250  1.00  0.00      A       
ATOM    338  C   LEU A  28       7.371   5.292   0.322  1.00  0.00      A       
ATOM    339  CA  LEU A  28       6.873   4.052  -0.454  1.00  0.00      A       
ATOM    340  CB  LEU A  28       5.787   4.529  -1.451  1.00  0.00      A       
ATOM    341  CD1 LEU A  28       3.833   2.978  -1.061  1.00  0.00      A       
ATOM    342  CD2 LEU A  28       4.084   4.198  -3.227  1.00  0.00      A       
ATOM    343  CG  LEU A  28       4.850   3.494  -2.090  1.00  0.00      A       
ATOM    344  HN  LEU A  28       5.542   3.163   1.003  1.00  0.00      A       
ATOM    345  HA  LEU A  28       7.701   3.661  -1.048  1.00  0.00      A       
ATOM    346  HB2 LEU A  28       5.136   5.273  -0.989  1.00  0.00      A       
ATOM    347  HB1 LEU A  28       6.321   5.043  -2.251  1.00  0.00      A       
ATOM    348 HD11 LEU A  28       3.540   3.784  -0.395  1.00  0.00      A       
ATOM    349 HD12 LEU A  28       2.954   2.580  -1.562  1.00  0.00      A       
ATOM    350 HD13 LEU A  28       4.257   2.187  -0.455  1.00  0.00      A       
ATOM    351 HD21 LEU A  28       3.533   5.055  -2.839  1.00  0.00      A       
ATOM    352 HD22 LEU A  28       4.782   4.544  -3.991  1.00  0.00      A       
ATOM    353 HD23 LEU A  28       3.379   3.511  -3.692  1.00  0.00      A       
ATOM    354  HG  LEU A  28       5.426   2.660  -2.505  1.00  0.00      A       
ATOM    355  N   LEU A  28       6.395   3.007   0.486  1.00  0.00      A       
ATOM    356  O   LEU A  28       8.519   5.723   0.248  1.00  0.00      A       
ATOM    357  C   ASN A  29       6.032   6.663   3.369  1.00  0.00      A       
ATOM    358  CA  ASN A  29       6.596   7.037   1.971  1.00  0.00      A       
ATOM    359  CB  ASN A  29       5.863   8.246   1.358  1.00  0.00      A       
ATOM    360  CG  ASN A  29       6.213   8.529  -0.104  1.00  0.00      A       
ATOM    361  HN  ASN A  29       5.540   5.429   1.082  1.00  0.00      A       
ATOM    362  HA  ASN A  29       7.658   7.279   2.050  1.00  0.00      A       
ATOM    363  HB2 ASN A  29       4.786   8.071   1.411  1.00  0.00      A       
ATOM    364  HB1 ASN A  29       6.085   9.143   1.937  1.00  0.00      A       
ATOM    365 HD21 ASN A  29       8.198   8.110   0.114  1.00  0.00      A       
ATOM    366 HD22 ASN A  29       7.624   8.625  -1.470  1.00  0.00      A       
ATOM    367  N   ASN A  29       6.440   5.888   1.078  1.00  0.00      A       
ATOM    368  ND2 ASN A  29       7.472   8.468  -0.488  1.00  0.00      A       
ATOM    369  O   ASN A  29       4.985   6.015   3.420  1.00  0.00      A       
ATOM    370  OD1 ASN A  29       5.348   8.803  -0.918  1.00  0.00      A       
ATOM    371  C   PRO A  30       5.044   6.019   6.202  1.00  0.00      A       
ATOM    372  CA  PRO A  30       6.452   6.547   5.848  1.00  0.00      A       
ATOM    373  CB  PRO A  30       6.912   7.694   6.752  1.00  0.00      A       
ATOM    374  CD  PRO A  30       7.761   8.038   4.521  1.00  0.00      A       
ATOM    375  CG  PRO A  30       8.138   8.211   5.997  1.00  0.00      A       
ATOM    376  HA  PRO A  30       7.144   5.715   6.003  1.00  0.00      A       
ATOM    377  HB2 PRO A  30       6.156   8.482   6.798  1.00  0.00      A       
ATOM    378  HB1 PRO A  30       7.154   7.352   7.761  1.00  0.00      A       
ATOM    379  HD2 PRO A  30       7.391   8.987   4.129  1.00  0.00      A       
ATOM    380  HD1 PRO A  30       8.644   7.727   3.959  1.00  0.00      A       
ATOM    381  HG2 PRO A  30       8.365   9.249   6.247  1.00  0.00      A       
ATOM    382  HG1 PRO A  30       8.998   7.581   6.236  1.00  0.00      A       
ATOM    383  N   PRO A  30       6.694   7.041   4.484  1.00  0.00      A       
ATOM    384  O   PRO A  30       4.899   4.879   6.633  1.00  0.00      A       
ATOM    385  C   TYR A  31       2.071   5.249   5.535  1.00  0.00      A       
ATOM    386  CA  TYR A  31       2.625   6.423   6.392  1.00  0.00      A       
ATOM    387  CB  TYR A  31       1.656   7.622   6.301  1.00  0.00      A       
ATOM    388  CD1 TYR A  31       2.969   9.067   7.995  1.00  0.00      A       
ATOM    389  CD2 TYR A  31       0.721   9.735   7.316  1.00  0.00      A       
ATOM    390  CE1 TYR A  31       3.019  10.163   8.881  1.00  0.00      A       
ATOM    391  CE2 TYR A  31       0.768  10.820   8.216  1.00  0.00      A       
ATOM    392  CG  TYR A  31       1.810   8.837   7.214  1.00  0.00      A       
ATOM    393  CZ  TYR A  31       1.917  11.029   8.998  1.00  0.00      A       
ATOM    394  HN  TYR A  31       4.150   7.761   5.688  1.00  0.00      A       
ATOM    395  HA  TYR A  31       2.633   6.069   7.424  1.00  0.00      A       
ATOM    396  HB2 TYR A  31       1.616   7.974   5.268  1.00  0.00      A       
ATOM    397  HB1 TYR A  31       0.681   7.208   6.562  1.00  0.00      A       
ATOM    398  HD1 TYR A  31       3.820   8.409   7.950  1.00  0.00      A       
ATOM    399  HD2 TYR A  31      -0.168   9.584   6.720  1.00  0.00      A       
ATOM    400  HE1 TYR A  31       3.893  10.333   9.491  1.00  0.00      A       
ATOM    401  HE2 TYR A  31      -0.085  11.477   8.315  1.00  0.00      A       
ATOM    402  HH  TYR A  31       1.127  12.536   9.882  1.00  0.00      A       
ATOM    403  N   TYR A  31       3.994   6.831   6.043  1.00  0.00      A       
ATOM    404  O   TYR A  31       1.293   4.423   6.018  1.00  0.00      A       
ATOM    405  OH  TYR A  31       1.963  12.069   9.869  1.00  0.00      A       
ATOM    406  C   TYR A  32       2.719   2.959   3.141  1.00  0.00      A       
ATOM    407  CA  TYR A  32       1.869   4.253   3.264  1.00  0.00      A       
ATOM    408  CB  TYR A  32       1.684   5.004   1.926  1.00  0.00      A       
ATOM    409  CD1 TYR A  32      -0.073   3.306   1.134  1.00  0.00      A       
ATOM    410  CD2 TYR A  32       1.135   4.620  -0.528  1.00  0.00      A       
ATOM    411  CE1 TYR A  32      -0.671   2.557   0.103  1.00  0.00      A       
ATOM    412  CE2 TYR A  32       0.540   3.863  -1.560  1.00  0.00      A       
ATOM    413  CG  TYR A  32       0.904   4.286   0.828  1.00  0.00      A       
ATOM    414  CZ  TYR A  32      -0.343   2.818  -1.240  1.00  0.00      A       
ATOM    415  HN  TYR A  32       3.162   5.814   3.942  1.00  0.00      A       
ATOM    416  HA  TYR A  32       0.875   3.977   3.614  1.00  0.00      A       
ATOM    417  HB2 TYR A  32       1.169   5.945   2.112  1.00  0.00      A       
ATOM    418  HB1 TYR A  32       2.677   5.262   1.543  1.00  0.00      A       
ATOM    419  HD1 TYR A  32      -0.385   3.123   2.148  1.00  0.00      A       
ATOM    420  HD2 TYR A  32       1.834   5.409  -0.779  1.00  0.00      A       
ATOM    421  HE1 TYR A  32      -1.368   1.777   0.344  1.00  0.00      A       
ATOM    422  HE2 TYR A  32       0.770   4.072  -2.594  1.00  0.00      A       
ATOM    423  HH  TYR A  32      -1.780   1.843  -1.952  1.00  0.00      A       
ATOM    424  N   TYR A  32       2.422   5.192   4.246  1.00  0.00      A       
ATOM    425  O   TYR A  32       3.589   2.862   2.274  1.00  0.00      A       
ATOM    426  OH  TYR A  32      -0.881   2.041  -2.214  1.00  0.00      A       
ATOM    427  C   SER A  33       3.303  -0.283   3.000  1.00  0.00      A       
ATOM    428  CA  SER A  33       3.299   0.744   4.176  1.00  0.00      A       
ATOM    429  CB  SER A  33       2.890   0.032   5.489  1.00  0.00      A       
ATOM    430  HN  SER A  33       1.821   2.186   4.752  1.00  0.00      A       
ATOM    431  HA  SER A  33       4.314   1.117   4.295  1.00  0.00      A       
ATOM    432  HB2 SER A  33       2.850   0.741   6.315  1.00  0.00      A       
ATOM    433  HB1 SER A  33       1.895  -0.418   5.388  1.00  0.00      A       
ATOM    434  HG  SER A  33       4.506  -1.095   5.207  1.00  0.00      A       
ATOM    435  N   SER A  33       2.467   1.962   4.007  1.00  0.00      A       
ATOM    436  O   SER A  33       3.073  -1.473   3.195  1.00  0.00      A       
ATOM    437  OG  SER A  33       3.813  -0.974   5.875  1.00  0.00      A       
ATOM    438  C   GLN A  34       4.139  -0.711  -0.558  1.00  0.00      A       
ATOM    439  CA  GLN A  34       3.085  -0.637   0.575  1.00  0.00      A       
ATOM    440  CB  GLN A  34       1.742   0.019   0.184  1.00  0.00      A       
ATOM    441  CD  GLN A  34       0.623  -2.056  -0.800  1.00  0.00      A       
ATOM    442  CG  GLN A  34       0.985  -0.596  -0.995  1.00  0.00      A       
ATOM    443  HN  GLN A  34       3.753   1.111   1.620  1.00  0.00      A       
ATOM    444  HA  GLN A  34       2.898  -1.680   0.842  1.00  0.00      A       
ATOM    445  HB2 GLN A  34       1.081  -0.032   1.054  1.00  0.00      A       
ATOM    446  HB1 GLN A  34       1.905   1.077  -0.028  1.00  0.00      A       
ATOM    447 HE21 GLN A  34       1.003  -2.553  -2.742  1.00  0.00      A       
ATOM    448 HE22 GLN A  34       0.287  -3.757  -1.642  1.00  0.00      A       
ATOM    449  HG2 GLN A  34       0.043  -0.068  -1.116  1.00  0.00      A       
ATOM    450  HG1 GLN A  34       1.550  -0.463  -1.904  1.00  0.00      A       
ATOM    451  N   GLN A  34       3.512   0.135   1.751  1.00  0.00      A       
ATOM    452  NE2 GLN A  34       0.751  -2.874  -1.821  1.00  0.00      A       
ATOM    453  O   GLN A  34       5.162  -0.042  -0.490  1.00  0.00      A       
ATOM    454  OE1 GLN A  34       0.173  -2.456   0.260  1.00  0.00      A       
ATOM    455  C   CYS A  35       5.908  -1.232  -3.120  1.00  0.00      A       
ATOM    456  CA  CYS A  35       4.363  -1.237  -2.979  1.00  0.00      A       
ATOM    457  CB  CYS A  35       3.640   0.028  -3.476  1.00  0.00      A       
ATOM    458  HN  CYS A  35       3.078  -2.119  -1.519  1.00  0.00      A       
ATOM    459  HA  CYS A  35       4.003  -2.051  -3.615  1.00  0.00      A       
ATOM    460  HB2 CYS A  35       2.621  -0.260  -3.709  1.00  0.00      A       
ATOM    461  HB1 CYS A  35       3.622   0.767  -2.683  1.00  0.00      A       
ATOM    462  N   CYS A  35       3.860  -1.494  -1.615  1.00  0.00      A       
ATOM    463  O   CYS A  35       6.562  -0.204  -2.967  1.00  0.00      A       
ATOM    464  SG  CYS A  35       4.215   0.963  -4.905  1.00  0.00      A       
ATOM    465  C   LEU A  36       8.272  -2.982  -5.013  1.00  0.00      A       
ATOM    466  CA  LEU A  36       7.862  -2.774  -3.530  1.00  0.00      A       
ATOM    467  CB  LEU A  36       8.147  -4.061  -2.713  1.00  0.00      A       
ATOM    468  CD1 LEU A  36       5.928  -4.929  -1.713  1.00  0.00      A       
ATOM    469  CD2 LEU A  36       8.060  -5.297  -0.517  1.00  0.00      A       
ATOM    470  CG  LEU A  36       7.313  -4.308  -1.426  1.00  0.00      A       
ATOM    471  HN  LEU A  36       5.828  -3.143  -3.731  1.00  0.00      A       
ATOM    472  HA  LEU A  36       8.476  -1.966  -3.123  1.00  0.00      A       
ATOM    473  HB2 LEU A  36       8.019  -4.933  -3.358  1.00  0.00      A       
ATOM    474  HB1 LEU A  36       9.204  -4.019  -2.445  1.00  0.00      A       
ATOM    475 HD11 LEU A  36       6.036  -5.782  -2.384  1.00  0.00      A       
ATOM    476 HD12 LEU A  36       5.469  -5.279  -0.787  1.00  0.00      A       
ATOM    477 HD13 LEU A  36       5.246  -4.214  -2.162  1.00  0.00      A       
ATOM    478 HD21 LEU A  36       9.057  -4.919  -0.296  1.00  0.00      A       
ATOM    479 HD22 LEU A  36       7.517  -5.431   0.419  1.00  0.00      A       
ATOM    480 HD23 LEU A  36       8.151  -6.268  -1.007  1.00  0.00      A       
ATOM    481  HG  LEU A  36       7.195  -3.367  -0.883  1.00  0.00      A       
ATOM    482  N   LEU A  36       6.446  -2.420  -3.408  1.00  0.00      A       
ATOM    483  OT1 LEU A  36       9.473  -2.799  -5.314  1.00  0.00      A       
ATOM    484  OT2 LEU A  36       7.384  -3.368  -5.814  1.00  0.00      A       
END


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