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
458055 2khb 16235 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLY A   1       5.643  10.641  -5.844  1.00  0.00      A       
ATOM      2  CA  GLY A   1       6.427  11.865  -5.417  1.00  0.00      A       
ATOM      3  HT1 GLY A   1       4.637  12.980  -5.398  1.00  0.00      A       
ATOM      4  HA2 GLY A   1       7.265  11.998  -6.086  1.00  0.00      A       
ATOM      5  HA1 GLY A   1       6.797  11.712  -4.414  1.00  0.00      A       
ATOM      6  N   GLY A   1       5.614  13.064  -5.438  1.00  0.00      A       
ATOM      7  O   GLY A   1       4.496  10.461  -5.436  1.00  0.00      A       
ATOM      8  C   LEU A   2       5.593   7.529  -6.058  1.00  0.00      A       
ATOM      9  CA  LEU A   2       5.615   8.593  -7.153  1.00  0.00      A       
ATOM     10  CB  LEU A   2       6.353   8.062  -8.386  1.00  0.00      A       
ATOM     11  CD1 LEU A   2       4.379   7.167  -9.657  1.00  0.00      A       
ATOM     12  CD2 LEU A   2       6.666   6.260 -10.100  1.00  0.00      A       
ATOM     13  CG  LEU A   2       5.730   6.828  -9.046  1.00  0.00      A       
ATOM     14  HN  LEU A   2       7.172  10.007  -6.957  1.00  0.00      A       
ATOM     15  HA  LEU A   2       4.599   8.840  -7.425  1.00  0.00      A       
ATOM     16  HB2 LEU A   2       6.393   8.854  -9.121  1.00  0.00      A       
ATOM     17  HB1 LEU A   2       7.363   7.815  -8.094  1.00  0.00      A       
ATOM     18 HD11 LEU A   2       4.499   7.963 -10.378  1.00  0.00      A       
ATOM     19 HD12 LEU A   2       3.700   7.486  -8.879  1.00  0.00      A       
ATOM     20 HD13 LEU A   2       3.976   6.294 -10.149  1.00  0.00      A       
ATOM     21 HD21 LEU A   2       6.980   7.051 -10.765  1.00  0.00      A       
ATOM     22 HD22 LEU A   2       6.153   5.497 -10.664  1.00  0.00      A       
ATOM     23 HD23 LEU A   2       7.533   5.831  -9.618  1.00  0.00      A       
ATOM     24  HG  LEU A   2       5.573   6.068  -8.293  1.00  0.00      A       
ATOM     25  N   LEU A   2       6.260   9.805  -6.668  1.00  0.00      A       
ATOM     26  O   LEU A   2       6.642   7.155  -5.529  1.00  0.00      A       
ATOM     27  C   PRO A   3       4.820   4.665  -5.111  1.00  0.00      A       
ATOM     28  CA  PRO A   3       4.251   6.008  -4.667  1.00  0.00      A       
ATOM     29  CB  PRO A   3       2.731   5.902  -4.461  1.00  0.00      A       
ATOM     30  CD  PRO A   3       3.105   7.423  -6.268  1.00  0.00      A       
ATOM     31  CG  PRO A   3       2.149   7.083  -5.164  1.00  0.00      A       
ATOM     32  HA  PRO A   3       4.723   6.308  -3.743  1.00  0.00      A       
ATOM     33  HB2 PRO A   3       2.375   4.977  -4.886  1.00  0.00      A       
ATOM     34  HB1 PRO A   3       2.509   5.925  -3.404  1.00  0.00      A       
ATOM     35  HD2 PRO A   3       2.880   6.850  -7.156  1.00  0.00      A       
ATOM     36  HD1 PRO A   3       3.080   8.481  -6.481  1.00  0.00      A       
ATOM     37  HG2 PRO A   3       1.182   6.828  -5.572  1.00  0.00      A       
ATOM     38  HG1 PRO A   3       2.059   7.911  -4.478  1.00  0.00      A       
ATOM     39  N   PRO A   3       4.401   7.032  -5.701  1.00  0.00      A       
ATOM     40  O   PRO A   3       4.537   4.195  -6.214  1.00  0.00      A       
ATOM     41  C   VAL A   4       5.182   1.670  -4.548  1.00  0.00      A       
ATOM     42  CA  VAL A   4       6.237   2.768  -4.551  1.00  0.00      A       
ATOM     43  CB  VAL A   4       7.348   2.419  -3.536  1.00  0.00      A       
ATOM     44  CG1 VAL A   4       8.033   1.112  -3.908  1.00  0.00      A       
ATOM     45  CG2 VAL A   4       8.361   3.550  -3.441  1.00  0.00      A       
ATOM     46  HN  VAL A   4       5.815   4.487  -3.392  1.00  0.00      A       
ATOM     47  HA  VAL A   4       6.674   2.828  -5.532  1.00  0.00      A       
ATOM     48  HB  VAL A   4       6.890   2.293  -2.565  1.00  0.00      A       
ATOM     49 HG11 VAL A   4       9.101   1.267  -3.958  1.00  0.00      A       
ATOM     50 HG12 VAL A   4       7.673   0.776  -4.869  1.00  0.00      A       
ATOM     51 HG13 VAL A   4       7.813   0.364  -3.160  1.00  0.00      A       
ATOM     52 HG21 VAL A   4       9.314   3.211  -3.822  1.00  0.00      A       
ATOM     53 HG22 VAL A   4       8.472   3.847  -2.409  1.00  0.00      A       
ATOM     54 HG23 VAL A   4       8.019   4.391  -4.023  1.00  0.00      A       
ATOM     55  N   VAL A   4       5.626   4.057  -4.250  1.00  0.00      A       
ATOM     56  O   VAL A   4       5.138   0.821  -5.435  1.00  0.00      A       
ATOM     57  C   CYS A   5       1.978   1.308  -3.987  1.00  0.00      A       
ATOM     58  CA  CYS A   5       3.262   0.745  -3.392  1.00  0.00      A       
ATOM     59  CB  CYS A   5       3.046   0.418  -1.915  1.00  0.00      A       
ATOM     60  HN  CYS A   5       4.427   2.423  -2.881  1.00  0.00      A       
ATOM     61  HA  CYS A   5       3.538  -0.151  -3.923  1.00  0.00      A       
ATOM     62  HB2 CYS A   5       2.307   1.090  -1.510  1.00  0.00      A       
ATOM     63  HB1 CYS A   5       2.688  -0.598  -1.829  1.00  0.00      A       
ATOM     64  N   CYS A   5       4.334   1.713  -3.540  1.00  0.00      A       
ATOM     65  O   CYS A   5       1.820   2.529  -4.084  1.00  0.00      A       
ATOM     66  SG  CYS A   5       4.554   0.564  -0.896  1.00  0.00      A       
ATOM     67  C   GLY A   6      -1.253  -0.190  -4.935  1.00  0.00      A       
ATOM     68  CA  GLY A   6      -0.186   0.884  -4.946  1.00  0.00      A       
ATOM     69  HN  GLY A   6       1.244  -0.531  -4.266  1.00  0.00      A       
ATOM     70  HA2 GLY A   6      -0.541   1.733  -4.383  1.00  0.00      A       
ATOM     71  HA1 GLY A   6      -0.012   1.191  -5.969  1.00  0.00      A       
ATOM     72  N   GLY A   6       1.067   0.432  -4.375  1.00  0.00      A       
ATOM     73  O   GLY A   6      -2.250  -0.094  -5.652  1.00  0.00      A       
ATOM     74  C   GLU A   7      -3.170  -1.872  -3.126  1.00  0.00      A       
ATOM     75  CA  GLU A   7      -2.013  -2.298  -4.012  1.00  0.00      A       
ATOM     76  CB  GLU A   7      -1.367  -3.560  -3.425  1.00  0.00      A       
ATOM     77  CD  GLU A   7       1.139  -3.305  -3.235  1.00  0.00      A       
ATOM     78  CG  GLU A   7      -0.011  -3.909  -4.018  1.00  0.00      A       
ATOM     79  HN  GLU A   7      -0.239  -1.235  -3.563  1.00  0.00      A       
ATOM     80  HA  GLU A   7      -2.385  -2.516  -5.001  1.00  0.00      A       
ATOM     81  HB2 GLU A   7      -1.241  -3.419  -2.362  1.00  0.00      A       
ATOM     82  HB1 GLU A   7      -2.031  -4.395  -3.589  1.00  0.00      A       
ATOM     83  HG2 GLU A   7       0.100  -4.983  -4.021  1.00  0.00      A       
ATOM     84  HG1 GLU A   7       0.029  -3.539  -5.032  1.00  0.00      A       
ATOM     85  N   GLU A   7      -1.054  -1.212  -4.118  1.00  0.00      A       
ATOM     86  O   GLU A   7      -2.962  -1.259  -2.078  1.00  0.00      A       
ATOM     87  OE1 GLU A   7       1.259  -2.063  -3.204  1.00  0.00      A       
ATOM     88  OE2 GLU A   7       1.913  -4.077  -2.638  1.00  0.00      A       
ATOM     89  C   THR A   8      -5.619  -2.695  -1.496  1.00  0.00      A       
ATOM     90  CA  THR A   8      -5.543  -1.840  -2.754  1.00  0.00      A       
ATOM     91  CB  THR A   8      -6.827  -2.014  -3.566  1.00  0.00      A       
ATOM     92  CG2 THR A   8      -6.977  -0.905  -4.599  1.00  0.00      A       
ATOM     93  HN  THR A   8      -4.502  -2.683  -4.372  1.00  0.00      A       
ATOM     94  HA  THR A   8      -5.454  -0.801  -2.471  1.00  0.00      A       
ATOM     95  HB  THR A   8      -7.659  -1.968  -2.885  1.00  0.00      A       
ATOM     96  HG1 THR A   8      -6.430  -3.948  -3.628  1.00  0.00      A       
ATOM     97 HG21 THR A   8      -6.688   0.038  -4.160  1.00  0.00      A       
ATOM     98 HG22 THR A   8      -8.006  -0.852  -4.922  1.00  0.00      A       
ATOM     99 HG23 THR A   8      -6.343  -1.117  -5.447  1.00  0.00      A       
ATOM    100  N   THR A   8      -4.382  -2.193  -3.534  1.00  0.00      A       
ATOM    101  O   THR A   8      -5.668  -3.923  -1.568  1.00  0.00      A       
ATOM    102  OG1 THR A   8      -6.821  -3.290  -4.217  1.00  0.00      A       
ATOM    103  C   CYS A   9      -7.168  -2.857   1.361  1.00  0.00      A       
ATOM    104  CA  CYS A   9      -5.720  -2.730   0.928  1.00  0.00      A       
ATOM    105  CB  CYS A   9      -4.927  -1.975   1.991  1.00  0.00      A       
ATOM    106  HN  CYS A   9      -5.616  -1.060  -0.371  1.00  0.00      A       
ATOM    107  HA  CYS A   9      -5.297  -3.714   0.806  1.00  0.00      A       
ATOM    108  HB2 CYS A   9      -3.964  -1.708   1.588  1.00  0.00      A       
ATOM    109  HB1 CYS A   9      -5.470  -1.078   2.245  1.00  0.00      A       
ATOM    110  N   CYS A   9      -5.642  -2.039  -0.352  1.00  0.00      A       
ATOM    111  O   CYS A   9      -7.491  -2.739   2.539  1.00  0.00      A       
ATOM    112  SG  CYS A   9      -4.650  -2.915   3.529  1.00  0.00      A       
ATOM    113  C   VAL A  10      -9.728  -4.373   1.622  1.00  0.00      A       
ATOM    114  CA  VAL A  10      -9.463  -3.209   0.674  1.00  0.00      A       
ATOM    115  CB  VAL A  10     -10.282  -3.396  -0.621  1.00  0.00      A       
ATOM    116  CG1 VAL A  10     -11.774  -3.440  -0.321  1.00  0.00      A       
ATOM    117  CG2 VAL A  10      -9.968  -2.289  -1.618  1.00  0.00      A       
ATOM    118  HN  VAL A  10      -7.722  -3.157  -0.525  1.00  0.00      A       
ATOM    119  HA  VAL A  10      -9.780  -2.299   1.150  1.00  0.00      A       
ATOM    120  HB  VAL A  10     -10.000  -4.339  -1.067  1.00  0.00      A       
ATOM    121 HG11 VAL A  10     -12.273  -2.649  -0.864  1.00  0.00      A       
ATOM    122 HG12 VAL A  10     -11.932  -3.305   0.738  1.00  0.00      A       
ATOM    123 HG13 VAL A  10     -12.175  -4.395  -0.628  1.00  0.00      A       
ATOM    124 HG21 VAL A  10      -9.179  -2.614  -2.280  1.00  0.00      A       
ATOM    125 HG22 VAL A  10      -9.648  -1.406  -1.084  1.00  0.00      A       
ATOM    126 HG23 VAL A  10     -10.853  -2.061  -2.193  1.00  0.00      A       
ATOM    127  N   VAL A  10      -8.042  -3.083   0.397  1.00  0.00      A       
ATOM    128  O   VAL A  10     -10.538  -4.268   2.542  1.00  0.00      A       
ATOM    129  C   GLY A  11      -8.176  -6.699   3.368  1.00  0.00      A       
ATOM    130  CA  GLY A  11      -9.182  -6.644   2.233  1.00  0.00      A       
ATOM    131  HN  GLY A  11      -8.388  -5.480   0.654  1.00  0.00      A       
ATOM    132  HA2 GLY A  11     -10.177  -6.641   2.652  1.00  0.00      A       
ATOM    133  HA1 GLY A  11      -9.065  -7.525   1.621  1.00  0.00      A       
ATOM    134  N   GLY A  11      -9.025  -5.470   1.394  1.00  0.00      A       
ATOM    135  O   GLY A  11      -7.873  -7.777   3.874  1.00  0.00      A       
ATOM    136  C   GLY A  12      -5.446  -6.273   4.601  1.00  0.00      A       
ATOM    137  CA  GLY A  12      -6.707  -5.466   4.861  1.00  0.00      A       
ATOM    138  HN  GLY A  12      -7.962  -4.710   3.332  1.00  0.00      A       
ATOM    139  HA2 GLY A  12      -6.431  -4.434   5.014  1.00  0.00      A       
ATOM    140  HA1 GLY A  12      -7.177  -5.837   5.761  1.00  0.00      A       
ATOM    141  N   GLY A  12      -7.670  -5.534   3.771  1.00  0.00      A       
ATOM    142  O   GLY A  12      -5.004  -7.035   5.458  1.00  0.00      A       
ATOM    143  C   THR A  13      -2.813  -6.033   2.079  1.00  0.00      A       
ATOM    144  CA  THR A  13      -3.659  -6.830   3.066  1.00  0.00      A       
ATOM    145  CB  THR A  13      -3.990  -8.216   2.477  1.00  0.00      A       
ATOM    146  CG2 THR A  13      -4.755  -8.096   1.165  1.00  0.00      A       
ATOM    147  HN  THR A  13      -5.258  -5.491   2.775  1.00  0.00      A       
ATOM    148  HA  THR A  13      -3.086  -6.977   3.971  1.00  0.00      A       
ATOM    149  HB  THR A  13      -4.608  -8.737   3.185  1.00  0.00      A       
ATOM    150  HG1 THR A  13      -2.866  -9.820   2.715  1.00  0.00      A       
ATOM    151 HG21 THR A  13      -4.565  -7.127   0.725  1.00  0.00      A       
ATOM    152 HG22 THR A  13      -5.813  -8.202   1.354  1.00  0.00      A       
ATOM    153 HG23 THR A  13      -4.430  -8.869   0.486  1.00  0.00      A       
ATOM    154  N   THR A  13      -4.867  -6.108   3.420  1.00  0.00      A       
ATOM    155  O   THR A  13      -3.331  -5.203   1.327  1.00  0.00      A       
ATOM    156  OG1 THR A  13      -2.790  -8.973   2.269  1.00  0.00      A       
ATOM    157  C   CYS A  14       0.378  -6.659   0.600  1.00  0.00      A       
ATOM    158  CA  CYS A  14      -0.567  -5.633   1.212  1.00  0.00      A       
ATOM    159  CB  CYS A  14       0.230  -4.574   1.980  1.00  0.00      A       
ATOM    160  HN  CYS A  14      -1.187  -6.982   2.717  1.00  0.00      A       
ATOM    161  HA  CYS A  14      -1.125  -5.154   0.421  1.00  0.00      A       
ATOM    162  HB2 CYS A  14       0.726  -5.043   2.817  1.00  0.00      A       
ATOM    163  HB1 CYS A  14       0.975  -4.149   1.321  1.00  0.00      A       
ATOM    164  N   CYS A  14      -1.517  -6.299   2.095  1.00  0.00      A       
ATOM    165  O   CYS A  14       0.825  -7.582   1.283  1.00  0.00      A       
ATOM    166  SG  CYS A  14      -0.780  -3.204   2.633  1.00  0.00      A       
ATOM    167  C   ASN A  15       3.006  -7.146  -1.134  1.00  0.00      A       
ATOM    168  CA  ASN A  15       1.531  -7.436  -1.398  1.00  0.00      A       
ATOM    169  CB  ASN A  15       1.258  -7.361  -2.904  1.00  0.00      A       
ATOM    170  CG  ASN A  15       2.177  -8.262  -3.712  1.00  0.00      A       
ATOM    171  HN  ASN A  15       0.259  -5.760  -1.177  1.00  0.00      A       
ATOM    172  HA  ASN A  15       1.305  -8.432  -1.052  1.00  0.00      A       
ATOM    173  HB2 ASN A  15       0.239  -7.659  -3.093  1.00  0.00      A       
ATOM    174  HB1 ASN A  15       1.399  -6.343  -3.237  1.00  0.00      A       
ATOM    175 HD21 ASN A  15       3.065  -6.678  -4.518  1.00  0.00      A       
ATOM    176 HD22 ASN A  15       3.658  -8.218  -5.029  1.00  0.00      A       
ATOM    177  N   ASN A  15       0.658  -6.507  -0.687  1.00  0.00      A       
ATOM    178  ND2 ASN A  15       3.054  -7.659  -4.500  1.00  0.00      A       
ATOM    179  O   ASN A  15       3.764  -8.040  -0.754  1.00  0.00      A       
ATOM    180  OD1 ASN A  15       2.101  -9.484  -3.626  1.00  0.00      A       
ATOM    181  C   THR A  16       5.194  -5.409   0.284  1.00  0.00      A       
ATOM    182  CA  THR A  16       4.805  -5.515  -1.193  1.00  0.00      A       
ATOM    183  CB  THR A  16       5.080  -4.174  -1.898  1.00  0.00      A       
ATOM    184  CG2 THR A  16       6.575  -3.919  -2.025  1.00  0.00      A       
ATOM    185  HN  THR A  16       2.767  -5.241  -1.700  1.00  0.00      A       
ATOM    186  HA  THR A  16       5.422  -6.269  -1.659  1.00  0.00      A       
ATOM    187  HB  THR A  16       4.639  -3.378  -1.314  1.00  0.00      A       
ATOM    188  HG1 THR A  16       3.532  -4.005  -3.118  1.00  0.00      A       
ATOM    189 HG21 THR A  16       6.902  -3.280  -1.217  1.00  0.00      A       
ATOM    190 HG22 THR A  16       6.779  -3.436  -2.969  1.00  0.00      A       
ATOM    191 HG23 THR A  16       7.107  -4.857  -1.979  1.00  0.00      A       
ATOM    192  N   THR A  16       3.416  -5.908  -1.371  1.00  0.00      A       
ATOM    193  O   THR A  16       4.695  -4.544   1.024  1.00  0.00      A       
ATOM    194  OG1 THR A  16       4.483  -4.188  -3.202  1.00  0.00      A       
ATOM    195  C   PRO A  17       7.308  -4.979   2.425  1.00  0.00      A       
ATOM    196  CA  PRO A  17       6.591  -6.277   2.109  1.00  0.00      A       
ATOM    197  CB  PRO A  17       7.558  -7.465   2.178  1.00  0.00      A       
ATOM    198  CD  PRO A  17       6.775  -7.315  -0.075  1.00  0.00      A       
ATOM    199  CG  PRO A  17       7.269  -8.281   0.963  1.00  0.00      A       
ATOM    200  HA  PRO A  17       5.780  -6.415   2.808  1.00  0.00      A       
ATOM    201  HB2 PRO A  17       8.577  -7.105   2.175  1.00  0.00      A       
ATOM    202  HB1 PRO A  17       7.375  -8.029   3.080  1.00  0.00      A       
ATOM    203  HD2 PRO A  17       7.604  -6.903  -0.633  1.00  0.00      A       
ATOM    204  HD1 PRO A  17       6.072  -7.796  -0.738  1.00  0.00      A       
ATOM    205  HG2 PRO A  17       8.171  -8.768   0.622  1.00  0.00      A       
ATOM    206  HG1 PRO A  17       6.506  -9.013   1.185  1.00  0.00      A       
ATOM    207  N   PRO A  17       6.116  -6.279   0.732  1.00  0.00      A       
ATOM    208  O   PRO A  17       8.270  -4.602   1.756  1.00  0.00      A       
ATOM    209  C   GLY A  18       6.398  -1.901   3.608  1.00  0.00      A       
ATOM    210  CA  GLY A  18       7.394  -3.017   3.791  1.00  0.00      A       
ATOM    211  HN  GLY A  18       6.031  -4.618   3.908  1.00  0.00      A       
ATOM    212  HA2 GLY A  18       7.705  -3.053   4.826  1.00  0.00      A       
ATOM    213  HA1 GLY A  18       8.255  -2.828   3.167  1.00  0.00      A       
ATOM    214  N   GLY A  18       6.814  -4.283   3.427  1.00  0.00      A       
ATOM    215  O   GLY A  18       6.583  -0.800   4.130  1.00  0.00      A       
ATOM    216  C   CYS A  19       3.238  -1.272   3.718  1.00  0.00      A       
ATOM    217  CA  CYS A  19       4.298  -1.192   2.624  1.00  0.00      A       
ATOM    218  CB  CYS A  19       3.657  -1.398   1.251  1.00  0.00      A       
ATOM    219  HN  CYS A  19       5.240  -3.090   2.466  1.00  0.00      A       
ATOM    220  HA  CYS A  19       4.759  -0.213   2.659  1.00  0.00      A       
ATOM    221  HB2 CYS A  19       3.194  -2.373   1.220  1.00  0.00      A       
ATOM    222  HB1 CYS A  19       2.901  -0.641   1.097  1.00  0.00      A       
ATOM    223  N   CYS A  19       5.335  -2.185   2.862  1.00  0.00      A       
ATOM    224  O   CYS A  19       2.766  -2.356   4.060  1.00  0.00      A       
ATOM    225  SG  CYS A  19       4.832  -1.299  -0.140  1.00  0.00      A       
ATOM    226  C   THR A  20       0.488   0.093   4.714  1.00  0.00      A       
ATOM    227  CA  THR A  20       1.883  -0.048   5.315  1.00  0.00      A       
ATOM    228  CB  THR A  20       2.155   1.154   6.238  1.00  0.00      A       
ATOM    229  CG2 THR A  20       1.507   0.954   7.601  1.00  0.00      A       
ATOM    230  HN  THR A  20       3.291   0.709   3.947  1.00  0.00      A       
ATOM    231  HA  THR A  20       1.932  -0.954   5.900  1.00  0.00      A       
ATOM    232  HB  THR A  20       1.736   2.039   5.783  1.00  0.00      A       
ATOM    233  HG1 THR A  20       3.766   2.277   6.444  1.00  0.00      A       
ATOM    234 HG21 THR A  20       1.223   1.912   8.009  1.00  0.00      A       
ATOM    235 HG22 THR A  20       2.209   0.472   8.266  1.00  0.00      A       
ATOM    236 HG23 THR A  20       0.628   0.334   7.494  1.00  0.00      A       
ATOM    237  N   THR A  20       2.878  -0.123   4.263  1.00  0.00      A       
ATOM    238  O   THR A  20       0.312   0.734   3.677  1.00  0.00      A       
ATOM    239  OG1 THR A  20       3.568   1.331   6.404  1.00  0.00      A       
ATOM    240  C   CYS A  21      -2.490   0.913   5.219  1.00  0.00      A       
ATOM    241  CA  CYS A  21      -1.860  -0.429   4.864  1.00  0.00      A       
ATOM    242  CB  CYS A  21      -2.706  -1.568   5.436  1.00  0.00      A       
ATOM    243  HN  CYS A  21      -0.304  -1.002   6.175  1.00  0.00      A       
ATOM    244  HA  CYS A  21      -1.828  -0.522   3.789  1.00  0.00      A       
ATOM    245  HB2 CYS A  21      -2.311  -2.509   5.084  1.00  0.00      A       
ATOM    246  HB1 CYS A  21      -2.651  -1.541   6.514  1.00  0.00      A       
ATOM    247  N   CYS A  21      -0.496  -0.504   5.354  1.00  0.00      A       
ATOM    248  O   CYS A  21      -2.515   1.315   6.381  1.00  0.00      A       
ATOM    249  SG  CYS A  21      -4.467  -1.494   4.966  1.00  0.00      A       
ATOM    250  C   SER A  22      -4.975   2.816   3.620  1.00  0.00      A       
ATOM    251  CA  SER A  22      -3.664   2.869   4.385  1.00  0.00      A       
ATOM    252  CB  SER A  22      -2.770   4.005   3.889  1.00  0.00      A       
ATOM    253  HN  SER A  22      -2.964   1.209   3.305  1.00  0.00      A       
ATOM    254  HA  SER A  22      -3.872   3.000   5.437  1.00  0.00      A       
ATOM    255  HB2 SER A  22      -2.592   3.887   2.830  1.00  0.00      A       
ATOM    256  HB1 SER A  22      -3.257   4.952   4.072  1.00  0.00      A       
ATOM    257  HG  SER A  22      -1.520   3.274   5.207  1.00  0.00      A       
ATOM    258  N   SER A  22      -3.008   1.588   4.210  1.00  0.00      A       
ATOM    259  O   SER A  22      -5.130   3.458   2.582  1.00  0.00      A       
ATOM    260  OG  SER A  22      -1.524   3.992   4.568  1.00  0.00      A       
ATOM    261  C   TRP A  23      -7.743   2.896   2.766  1.00  0.00      A       
ATOM    262  CA  TRP A  23      -7.188   1.706   3.551  1.00  0.00      A       
ATOM    263  CB  TRP A  23      -8.176   1.320   4.651  1.00  0.00      A       
ATOM    264  CD1 TRP A  23      -9.307  -0.875   3.978  1.00  0.00      A       
ATOM    265  CD2 TRP A  23     -10.625   0.922   3.791  1.00  0.00      A       
ATOM    266  CE2 TRP A  23     -11.356  -0.215   3.395  1.00  0.00      A       
ATOM    267  CE3 TRP A  23     -11.252   2.171   3.756  1.00  0.00      A       
ATOM    268  CG  TRP A  23      -9.318   0.475   4.166  1.00  0.00      A       
ATOM    269  CH2 TRP A  23     -13.266   1.098   2.943  1.00  0.00      A       
ATOM    270  CZ2 TRP A  23     -12.680  -0.137   2.968  1.00  0.00      A       
ATOM    271  CZ3 TRP A  23     -12.565   2.247   3.332  1.00  0.00      A       
ATOM    272  HN  TRP A  23      -5.620   1.476   4.940  1.00  0.00      A       
ATOM    273  HA  TRP A  23      -7.078   0.871   2.880  1.00  0.00      A       
ATOM    274  HB2 TRP A  23      -7.652   0.765   5.414  1.00  0.00      A       
ATOM    275  HB1 TRP A  23      -8.587   2.220   5.086  1.00  0.00      A       
ATOM    276  HD1 TRP A  23      -8.455  -1.509   4.172  1.00  0.00      A       
ATOM    277  HE1 TRP A  23     -10.771  -2.232   3.314  1.00  0.00      A       
ATOM    278  HE3 TRP A  23     -10.725   3.069   4.051  1.00  0.00      A       
ATOM    279  HH2 TRP A  23     -14.291   1.205   2.619  1.00  0.00      A       
ATOM    280  HZ2 TRP A  23     -13.236  -1.013   2.667  1.00  0.00      A       
ATOM    281  HZ3 TRP A  23     -13.064   3.204   3.297  1.00  0.00      A       
ATOM    282  N   TRP A  23      -5.873   1.975   4.137  1.00  0.00      A       
ATOM    283  NE1 TRP A  23     -10.530  -1.300   3.520  1.00  0.00      A       
ATOM    284  O   TRP A  23      -7.798   4.018   3.270  1.00  0.00      A       
ATOM    285  C   PRO A  24      -6.868   1.115   0.003  1.00  0.00      A       
ATOM    286  CA  PRO A  24      -8.104   1.344   0.884  1.00  0.00      A       
ATOM    287  CB  PRO A  24      -9.362   1.382   0.022  1.00  0.00      A       
ATOM    288  CD  PRO A  24      -8.716   3.655   0.594  1.00  0.00      A       
ATOM    289  CG  PRO A  24      -9.505   2.818  -0.393  1.00  0.00      A       
ATOM    290  HA  PRO A  24      -8.191   0.547   1.607  1.00  0.00      A       
ATOM    291  HB2 PRO A  24      -9.234   0.734  -0.832  1.00  0.00      A       
ATOM    292  HB1 PRO A  24     -10.211   1.057   0.606  1.00  0.00      A       
ATOM    293  HD2 PRO A  24      -7.934   4.197   0.088  1.00  0.00      A       
ATOM    294  HD1 PRO A  24      -9.371   4.334   1.120  1.00  0.00      A       
ATOM    295  HG2 PRO A  24      -9.108   2.948  -1.388  1.00  0.00      A       
ATOM    296  HG1 PRO A  24     -10.547   3.099  -0.370  1.00  0.00      A       
ATOM    297  N   PRO A  24      -8.151   2.658   1.511  1.00  0.00      A       
ATOM    298  O   PRO A  24      -6.953   0.407  -1.001  1.00  0.00      A       
ATOM    299  C   VAL A  25      -3.241   1.375   0.389  1.00  0.00      A       
ATOM    300  CA  VAL A  25      -4.509   1.530  -0.455  1.00  0.00      A       
ATOM    301  CB  VAL A  25      -4.303   2.708  -1.441  1.00  0.00      A       
ATOM    302  CG1 VAL A  25      -5.311   2.650  -2.580  1.00  0.00      A       
ATOM    303  CG2 VAL A  25      -4.395   4.047  -0.718  1.00  0.00      A       
ATOM    304  HN  VAL A  25      -5.692   2.266   1.167  1.00  0.00      A       
ATOM    305  HA  VAL A  25      -4.639   0.632  -1.041  1.00  0.00      A       
ATOM    306  HB  VAL A  25      -3.313   2.622  -1.865  1.00  0.00      A       
ATOM    307 HG11 VAL A  25      -5.611   3.652  -2.847  1.00  0.00      A       
ATOM    308 HG12 VAL A  25      -6.176   2.085  -2.266  1.00  0.00      A       
ATOM    309 HG13 VAL A  25      -4.858   2.170  -3.436  1.00  0.00      A       
ATOM    310 HG21 VAL A  25      -3.466   4.585  -0.839  1.00  0.00      A       
ATOM    311 HG22 VAL A  25      -4.579   3.876   0.332  1.00  0.00      A       
ATOM    312 HG23 VAL A  25      -5.205   4.627  -1.137  1.00  0.00      A       
ATOM    313  N   VAL A  25      -5.723   1.702   0.356  1.00  0.00      A       
ATOM    314  O   VAL A  25      -3.049   2.056   1.391  1.00  0.00      A       
ATOM    315  C   CYS A  26      -0.054   1.240   0.202  1.00  0.00      A       
ATOM    316  CA  CYS A  26      -1.109   0.230   0.647  1.00  0.00      A       
ATOM    317  CB  CYS A  26      -0.616  -1.189   0.370  1.00  0.00      A       
ATOM    318  HN  CYS A  26      -2.577  -0.040  -0.851  1.00  0.00      A       
ATOM    319  HA  CYS A  26      -1.278   0.345   1.707  1.00  0.00      A       
ATOM    320  HB2 CYS A  26      -0.512  -1.327  -0.696  1.00  0.00      A       
ATOM    321  HB1 CYS A  26       0.345  -1.328   0.842  1.00  0.00      A       
ATOM    322  N   CYS A  26      -2.373   0.472  -0.037  1.00  0.00      A       
ATOM    323  O   CYS A  26       0.066   1.537  -0.986  1.00  0.00      A       
ATOM    324  SG  CYS A  26      -1.731  -2.486   0.989  1.00  0.00      A       
ATOM    325  C   THR A  27       2.899   2.580   1.848  1.00  0.00      A       
ATOM    326  CA  THR A  27       1.773   2.700   0.838  1.00  0.00      A       
ATOM    327  CB  THR A  27       1.259   4.152   0.785  1.00  0.00      A       
ATOM    328  CG2 THR A  27       0.594   4.559   2.093  1.00  0.00      A       
ATOM    329  HN  THR A  27       0.590   1.467   2.081  1.00  0.00      A       
ATOM    330  HA  THR A  27       2.162   2.446  -0.139  1.00  0.00      A       
ATOM    331  HB  THR A  27       0.536   4.220  -0.006  1.00  0.00      A       
ATOM    332  HG1 THR A  27       2.091   5.942   0.755  1.00  0.00      A       
ATOM    333 HG21 THR A  27       1.206   4.237   2.923  1.00  0.00      A       
ATOM    334 HG22 THR A  27      -0.378   4.093   2.161  1.00  0.00      A       
ATOM    335 HG23 THR A  27       0.481   5.633   2.122  1.00  0.00      A       
ATOM    336  N   THR A  27       0.719   1.750   1.146  1.00  0.00      A       
ATOM    337  O   THR A  27       2.678   2.236   3.007  1.00  0.00      A       
ATOM    338  OG1 THR A  27       2.339   5.050   0.492  1.00  0.00      A       
ATOM    339  C   ARG A  28       5.651   4.157   2.754  1.00  0.00      A       
ATOM    340  CA  ARG A  28       5.263   2.775   2.272  1.00  0.00      A       
ATOM    341  CB  ARG A  28       6.439   2.110   1.554  1.00  0.00      A       
ATOM    342  CD  ARG A  28       8.766   1.176   1.743  1.00  0.00      A       
ATOM    343  CG  ARG A  28       7.699   2.039   2.398  1.00  0.00      A       
ATOM    344  CZ  ARG A  28      10.214   0.748   3.718  1.00  0.00      A       
ATOM    345  HN  ARG A  28       4.213   3.137   0.477  1.00  0.00      A       
ATOM    346  HA  ARG A  28       4.990   2.175   3.128  1.00  0.00      A       
ATOM    347  HB2 ARG A  28       6.156   1.103   1.280  1.00  0.00      A       
ATOM    348  HB1 ARG A  28       6.661   2.668   0.657  1.00  0.00      A       
ATOM    349  HD2 ARG A  28       8.413   0.156   1.709  1.00  0.00      A       
ATOM    350  HD1 ARG A  28       8.931   1.533   0.737  1.00  0.00      A       
ATOM    351  HE  ARG A  28      10.801   1.623   2.013  1.00  0.00      A       
ATOM    352  HG2 ARG A  28       8.090   3.038   2.527  1.00  0.00      A       
ATOM    353  HG1 ARG A  28       7.451   1.621   3.362  1.00  0.00      A       
ATOM    354 HH11 ARG A  28       8.307   0.075   3.946  1.00  0.00      A       
ATOM    355 HH12 ARG A  28       9.350  -0.174   5.308  1.00  0.00      A       
ATOM    356 HH21 ARG A  28      12.168   1.282   3.811  1.00  0.00      A       
ATOM    357 HH22 ARG A  28      11.545   0.509   5.231  1.00  0.00      A       
ATOM    358  N   ARG A  28       4.104   2.857   1.405  1.00  0.00      A       
ATOM    359  NE  ARG A  28      10.037   1.215   2.476  1.00  0.00      A       
ATOM    360  NH1 ARG A  28       9.213   0.170   4.377  1.00  0.00      A       
ATOM    361  NH2 ARG A  28      11.405   0.855   4.300  1.00  0.00      A       
ATOM    362  O   ARG A  28       5.862   5.067   1.954  1.00  0.00      A       
ATOM    363  C   ASN A  29       7.548   5.915   4.377  1.00  0.00      A       
ATOM    364  CA  ASN A  29       6.087   5.584   4.656  1.00  0.00      A       
ATOM    365  CB  ASN A  29       5.838   5.574   6.170  1.00  0.00      A       
ATOM    366  CG  ASN A  29       4.417   5.179   6.536  1.00  0.00      A       
ATOM    367  HN  ASN A  29       5.542   3.540   4.644  1.00  0.00      A       
ATOM    368  HA  ASN A  29       5.464   6.338   4.197  1.00  0.00      A       
ATOM    369  HB2 ASN A  29       6.514   4.871   6.633  1.00  0.00      A       
ATOM    370  HB1 ASN A  29       6.030   6.560   6.564  1.00  0.00      A       
ATOM    371 HD21 ASN A  29       4.071   6.987   7.282  1.00  0.00      A       
ATOM    372 HD22 ASN A  29       2.752   5.874   7.361  1.00  0.00      A       
ATOM    373  N   ASN A  29       5.733   4.306   4.062  1.00  0.00      A       
ATOM    374  ND2 ASN A  29       3.673   6.107   7.120  1.00  0.00      A       
ATOM    375  OT1 ASN A  29       8.403   5.025   4.367  1.00  0.00      A       
ATOM    376  OD1 ASN A  29       3.994   4.048   6.301  1.00  0.00      A       
END


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