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
444482 2kht 16254 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ALA A   1      -1.316  -2.487   0.085  1.00  0.00      A       
ATOM      2  CA  ALA A   1      -2.017  -1.983   1.346  1.00  0.00      A       
ATOM      3  CB  ALA A   1      -3.528  -1.908   1.103  1.00  0.00      A       
ATOM      4  HT1 ALA A   1      -1.436  -0.051   0.828  1.00  0.00      A       
ATOM      5  HT2 ALA A   1      -0.568  -0.712   2.131  1.00  0.00      A       
ATOM      6  HT3 ALA A   1      -2.162  -0.169   2.358  1.00  0.00      A       
ATOM      7  HA  ALA A   1      -1.819  -2.661   2.164  1.00  0.00      A       
ATOM      8  HB1 ALA A   1      -3.880  -2.860   0.733  1.00  0.00      A       
ATOM      9  HB2 ALA A   1      -3.737  -1.140   0.374  1.00  0.00      A       
ATOM     10  HB3 ALA A   1      -4.032  -1.674   2.029  1.00  0.00      A       
ATOM     11  N   ALA A   1      -1.507  -0.627   1.692  1.00  0.00      A       
ATOM     12  O   ALA A   1      -1.031  -1.711  -0.827  1.00  0.00      A       
ATOM     13  C   CYS A   2      -1.386  -5.109  -1.999  1.00  0.00      A       
ATOM     14  CA  CYS A   2      -0.375  -4.409  -1.114  1.00  0.00      A       
ATOM     15  CB  CYS A   2       0.680  -5.415  -0.633  1.00  0.00      A       
ATOM     16  HN  CYS A   2      -1.296  -4.362   0.798  1.00  0.00      A       
ATOM     17  HA  CYS A   2       0.119  -3.641  -1.691  1.00  0.00      A       
ATOM     18  HB2 CYS A   2       0.332  -5.895   0.268  1.00  0.00      A       
ATOM     19  HB1 CYS A   2       0.863  -6.158  -1.395  1.00  0.00      A       
ATOM     20  HG  CYS A   2       2.146  -4.135   0.595  1.00  0.00      A       
ATOM     21  N   CYS A   2      -1.042  -3.796   0.042  1.00  0.00      A       
ATOM     22  O   CYS A   2      -2.320  -5.748  -1.517  1.00  0.00      A       
ATOM     23  SG  CYS A   2       2.221  -4.530  -0.279  1.00  0.00      A       
ATOM     24  C   TYR A   3      -1.497  -6.972  -4.635  1.00  0.00      A       
ATOM     25  CA  TYR A   3      -2.048  -5.612  -4.272  1.00  0.00      A       
ATOM     26  CB  TYR A   3      -2.161  -4.748  -5.529  1.00  0.00      A       
ATOM     27  CD1 TYR A   3      -1.938  -2.366  -4.741  1.00  0.00      A       
ATOM     28  CD2 TYR A   3      -4.149  -3.218  -5.256  1.00  0.00      A       
ATOM     29  CE1 TYR A   3      -2.493  -1.128  -4.405  1.00  0.00      A       
ATOM     30  CE2 TYR A   3      -4.705  -1.978  -4.920  1.00  0.00      A       
ATOM     31  CG  TYR A   3      -2.764  -3.412  -5.166  1.00  0.00      A       
ATOM     32  CZ  TYR A   3      -3.875  -0.932  -4.494  1.00  0.00      A       
ATOM     33  HN  TYR A   3      -0.407  -4.466  -3.612  1.00  0.00      A       
ATOM     34  HA  TYR A   3      -3.034  -5.738  -3.844  1.00  0.00      A       
ATOM     35  HB2 TYR A   3      -1.181  -4.598  -5.955  1.00  0.00      A       
ATOM     36  HB1 TYR A   3      -2.796  -5.243  -6.249  1.00  0.00      A       
ATOM     37  HD1 TYR A   3      -0.870  -2.518  -4.673  1.00  0.00      A       
ATOM     38  HD2 TYR A   3      -4.787  -4.025  -5.583  1.00  0.00      A       
ATOM     39  HE1 TYR A   3      -1.853  -0.321  -4.077  1.00  0.00      A       
ATOM     40  HE2 TYR A   3      -5.771  -1.827  -4.988  1.00  0.00      A       
ATOM     41  HH  TYR A   3      -4.185   0.917  -4.852  1.00  0.00      A       
ATOM     42  N   TYR A   3      -1.176  -4.986  -3.299  1.00  0.00      A       
ATOM     43  O   TYR A   3      -0.601  -7.489  -3.975  1.00  0.00      A       
ATOM     44  OH  TYR A   3      -4.422   0.291  -4.164  1.00  0.00      A       
ATOM     45  C   CYS A   4      -0.416  -8.735  -7.073  1.00  0.00      A       
ATOM     46  CA  CYS A   4      -1.627  -8.864  -6.138  1.00  0.00      A       
ATOM     47  CB  CYS A   4      -2.773  -9.569  -6.845  1.00  0.00      A       
ATOM     48  HN  CYS A   4      -2.769  -7.083  -6.163  1.00  0.00      A       
ATOM     49  HA  CYS A   4      -1.352  -9.441  -5.275  1.00  0.00      A       
ATOM     50  HB2 CYS A   4      -3.713  -9.178  -6.486  1.00  0.00      A       
ATOM     51  HB1 CYS A   4      -2.704  -9.409  -7.916  1.00  0.00      A       
ATOM     52  HG  CYS A   4      -1.864 -11.691  -6.844  1.00  0.00      A       
ATOM     53  N   CYS A   4      -2.050  -7.549  -5.682  1.00  0.00      A       
ATOM     54  O   CYS A   4       0.127  -7.643  -7.234  1.00  0.00      A       
ATOM     55  SG  CYS A   4      -2.698 -11.359  -6.504  1.00  0.00      A       
ATOM     56  C   ARG A   5       0.738  -9.674  -9.979  1.00  0.00      A       
ATOM     57  CA  ARG A   5       1.190  -9.826  -8.558  1.00  0.00      A       
ATOM     58  CB  ARG A   5       1.942 -11.149  -8.483  1.00  0.00      A       
ATOM     59  CD  ARG A   5       3.964 -12.401  -9.127  1.00  0.00      A       
ATOM     60  CG  ARG A   5       3.210 -11.092  -9.319  1.00  0.00      A       
ATOM     61  CZ  ARG A   5       6.023 -13.390  -9.985  1.00  0.00      A       
ATOM     62  HN  ARG A   5      -0.430 -10.703  -7.495  1.00  0.00      A       
ATOM     63  HA  ARG A   5       1.856  -9.022  -8.290  1.00  0.00      A       
ATOM     64  HB2 ARG A   5       2.198 -11.365  -7.456  1.00  0.00      A       
ATOM     65  HB1 ARG A   5       1.313 -11.936  -8.867  1.00  0.00      A       
ATOM     66  HD2 ARG A   5       4.092 -12.594  -8.072  1.00  0.00      A       
ATOM     67  HD1 ARG A   5       3.401 -13.208  -9.572  1.00  0.00      A       
ATOM     68  HE  ARG A   5       5.608 -11.434 -10.040  1.00  0.00      A       
ATOM     69  HG2 ARG A   5       2.953 -10.973 -10.360  1.00  0.00      A       
ATOM     70  HG1 ARG A   5       3.828 -10.270  -9.001  1.00  0.00      A       
ATOM     71 HH11 ARG A   5       4.713 -14.674  -9.182  1.00  0.00      A       
ATOM     72 HH12 ARG A   5       6.172 -15.377  -9.796  1.00  0.00      A       
ATOM     73 HH21 ARG A   5       7.513 -12.358 -10.838  1.00  0.00      A       
ATOM     74 HH22 ARG A   5       7.755 -14.070 -10.731  1.00  0.00      A       
ATOM     75  N   ARG A   5       0.024  -9.851  -7.664  1.00  0.00      A       
ATOM     76  NE  ARG A   5       5.272 -12.310  -9.765  1.00  0.00      A       
ATOM     77  NH1 ARG A   5       5.602 -14.573  -9.625  1.00  0.00      A       
ATOM     78  NH2 ARG A   5       7.187 -13.263 -10.563  1.00  0.00      A       
ATOM     79  O   ARG A   5       0.130 -10.572 -10.553  1.00  0.00      A       
ATOM     80  C   ILE A   6       1.904  -7.591 -12.580  1.00  0.00      A       
ATOM     81  CA  ILE A   6       0.706  -8.245 -11.907  1.00  0.00      A       
ATOM     82  CB  ILE A   6      -0.510  -7.300 -11.959  1.00  0.00      A       
ATOM     83  CD1 ILE A   6      -1.004  -6.605  -9.563  1.00  0.00      A       
ATOM     84  CG1 ILE A   6      -0.373  -6.183 -10.887  1.00  0.00      A       
ATOM     85  CG2 ILE A   6      -1.797  -8.117 -11.740  1.00  0.00      A       
ATOM     86  HN  ILE A   6       1.544  -7.862 -10.021  1.00  0.00      A       
ATOM     87  HA  ILE A   6       0.449  -9.165 -12.400  1.00  0.00      A       
ATOM     88  HB  ILE A   6      -0.556  -6.847 -12.938  1.00  0.00      A       
ATOM     89 HD11 ILE A   6      -2.077  -6.478  -9.619  1.00  0.00      A       
ATOM     90 HD12 ILE A   6      -0.609  -5.993  -8.761  1.00  0.00      A       
ATOM     91 HD13 ILE A   6      -0.779  -7.633  -9.373  1.00  0.00      A       
ATOM     92 HG12 ILE A   6       0.670  -5.958 -10.727  1.00  0.00      A       
ATOM     93 HG11 ILE A   6      -0.874  -5.288 -11.242  1.00  0.00      A       
ATOM     94 HG21 ILE A   6      -1.649  -8.813 -10.925  1.00  0.00      A       
ATOM     95 HG22 ILE A   6      -2.029  -8.665 -12.638  1.00  0.00      A       
ATOM     96 HG23 ILE A   6      -2.618  -7.451 -11.506  1.00  0.00      A       
ATOM     97  N   ILE A   6       1.055  -8.529 -10.540  1.00  0.00      A       
ATOM     98  O   ILE A   6       2.558  -6.753 -11.965  1.00  0.00      A       
ATOM     99  C   PRO A   7       3.404  -5.826 -14.458  1.00  0.00      A       
ATOM    100  CA  PRO A   7       3.338  -7.360 -14.573  1.00  0.00      A       
ATOM    101  CB  PRO A   7       3.023  -7.777 -16.009  1.00  0.00      A       
ATOM    102  CD  PRO A   7       1.478  -8.972 -14.590  1.00  0.00      A       
ATOM    103  CG  PRO A   7       2.191  -9.011 -15.935  1.00  0.00      A       
ATOM    104  HA  PRO A   7       4.267  -7.803 -14.262  1.00  0.00      A       
ATOM    105  HB2 PRO A   7       2.463  -6.995 -16.511  1.00  0.00      A       
ATOM    106  HB1 PRO A   7       3.934  -7.978 -16.552  1.00  0.00      A       
ATOM    107  HD2 PRO A   7       0.435  -8.701 -14.710  1.00  0.00      A       
ATOM    108  HD1 PRO A   7       1.561  -9.939 -14.102  1.00  0.00      A       
ATOM    109  HG2 PRO A   7       1.464  -9.021 -16.741  1.00  0.00      A       
ATOM    110  HG1 PRO A   7       2.816  -9.893 -15.996  1.00  0.00      A       
ATOM    111  N   PRO A   7       2.193  -7.947 -13.810  1.00  0.00      A       
ATOM    112  O   PRO A   7       3.102  -5.093 -15.404  1.00  0.00      A       
ATOM    113  C   ALA A   8       5.105  -3.656 -12.112  1.00  0.00      A       
ATOM    114  CA  ALA A   8       3.907  -3.936 -12.999  1.00  0.00      A       
ATOM    115  CB  ALA A   8       2.630  -3.445 -12.326  1.00  0.00      A       
ATOM    116  HN  ALA A   8       4.029  -6.000 -12.578  1.00  0.00      A       
ATOM    117  HA  ALA A   8       4.036  -3.396 -13.930  1.00  0.00      A       
ATOM    118  HB1 ALA A   8       2.620  -3.763 -11.296  1.00  0.00      A       
ATOM    119  HB2 ALA A   8       1.776  -3.860 -12.841  1.00  0.00      A       
ATOM    120  HB3 ALA A   8       2.591  -2.367 -12.375  1.00  0.00      A       
ATOM    121  N   ALA A   8       3.805  -5.361 -13.281  1.00  0.00      A       
ATOM    122  O   ALA A   8       6.007  -4.483 -12.002  1.00  0.00      A       
ATOM    123  C   CYS A   9       6.373  -3.066  -9.483  1.00  0.00      A       
ATOM    124  CA  CYS A   9       6.217  -2.078 -10.634  1.00  0.00      A       
ATOM    125  CB  CYS A   9       5.944  -0.688 -10.067  1.00  0.00      A       
ATOM    126  HN  CYS A   9       4.375  -1.854 -11.654  1.00  0.00      A       
ATOM    127  HA  CYS A   9       7.131  -2.051 -11.209  1.00  0.00      A       
ATOM    128  HB2 CYS A   9       6.781  -0.375  -9.463  1.00  0.00      A       
ATOM    129  HB1 CYS A   9       5.805   0.012 -10.880  1.00  0.00      A       
ATOM    130  HG  CYS A   9       3.737  -0.318  -9.541  1.00  0.00      A       
ATOM    131  N   CYS A   9       5.118  -2.476 -11.507  1.00  0.00      A       
ATOM    132  O   CYS A   9       6.089  -2.742  -8.330  1.00  0.00      A       
ATOM    133  SG  CYS A   9       4.444  -0.742  -9.051  1.00  0.00      A       
ATOM    134  C   ILE A  10       8.304  -5.042  -8.014  1.00  0.00      A       
ATOM    135  CA  ILE A  10       7.020  -5.300  -8.793  1.00  0.00      A       
ATOM    136  CB  ILE A  10       7.076  -6.679  -9.459  1.00  0.00      A       
ATOM    137  CD1 ILE A  10       5.840  -8.185 -11.023  1.00  0.00      A       
ATOM    138  CG1 ILE A  10       5.704  -7.011 -10.055  1.00  0.00      A       
ATOM    139  CG2 ILE A  10       7.441  -7.739  -8.416  1.00  0.00      A       
ATOM    140  HN  ILE A  10       7.038  -4.470 -10.738  1.00  0.00      A       
ATOM    141  HA  ILE A  10       6.187  -5.278  -8.107  1.00  0.00      A       
ATOM    142  HB  ILE A  10       7.820  -6.671 -10.242  1.00  0.00      A       
ATOM    143 HD11 ILE A  10       6.378  -7.866 -11.904  1.00  0.00      A       
ATOM    144 HD12 ILE A  10       4.859  -8.535 -11.307  1.00  0.00      A       
ATOM    145 HD13 ILE A  10       6.383  -8.986 -10.542  1.00  0.00      A       
ATOM    146 HG12 ILE A  10       5.022  -7.277  -9.261  1.00  0.00      A       
ATOM    147 HG11 ILE A  10       5.321  -6.156 -10.583  1.00  0.00      A       
ATOM    148 HG21 ILE A  10       7.269  -8.723  -8.828  1.00  0.00      A       
ATOM    149 HG22 ILE A  10       6.829  -7.603  -7.538  1.00  0.00      A       
ATOM    150 HG23 ILE A  10       8.482  -7.638  -8.148  1.00  0.00      A       
ATOM    151  N   ILE A  10       6.826  -4.269  -9.803  1.00  0.00      A       
ATOM    152  O   ILE A  10       8.476  -5.538  -6.900  1.00  0.00      A       
ATOM    153  C   ALA A  11      10.240  -3.364  -6.585  1.00  0.00      A       
ATOM    154  CA  ALA A  11      10.473  -3.953  -7.971  1.00  0.00      A       
ATOM    155  CB  ALA A  11      11.259  -2.957  -8.825  1.00  0.00      A       
ATOM    156  HN  ALA A  11       9.012  -3.908  -9.504  1.00  0.00      A       
ATOM    157  HA  ALA A  11      11.049  -4.860  -7.875  1.00  0.00      A       
ATOM    158  HB1 ALA A  11      12.269  -2.878  -8.446  1.00  0.00      A       
ATOM    159  HB2 ALA A  11      10.783  -1.988  -8.779  1.00  0.00      A       
ATOM    160  HB3 ALA A  11      11.285  -3.299  -9.848  1.00  0.00      A       
ATOM    161  N   ALA A  11       9.204  -4.269  -8.614  1.00  0.00      A       
ATOM    162  O   ALA A  11       9.143  -3.461  -6.032  1.00  0.00      A       
ATOM    163  C   GLY A  12      11.166  -3.232  -3.622  1.00  0.00      A       
ATOM    164  CA  GLY A  12      11.170  -2.156  -4.705  1.00  0.00      A       
ATOM    165  HN  GLY A  12      12.125  -2.705  -6.512  1.00  0.00      A       
ATOM    166  HA2 GLY A  12      12.010  -1.496  -4.546  1.00  0.00      A       
ATOM    167  HA1 GLY A  12      10.254  -1.591  -4.640  1.00  0.00      A       
ATOM    168  N   GLY A  12      11.276  -2.755  -6.028  1.00  0.00      A       
ATOM    169  O   GLY A  12      12.032  -3.249  -2.746  1.00  0.00      A       
ATOM    170  C   GLU A  13       9.568  -6.482  -3.385  1.00  0.00      A       
ATOM    171  CA  GLU A  13      10.065  -5.210  -2.715  1.00  0.00      A       
ATOM    172  CB  GLU A  13       9.084  -4.810  -1.608  1.00  0.00      A       
ATOM    173  CD  GLU A  13       9.450  -2.325  -1.470  1.00  0.00      A       
ATOM    174  CG  GLU A  13       9.676  -3.667  -0.776  1.00  0.00      A       
ATOM    175  HN  GLU A  13       9.523  -4.064  -4.412  1.00  0.00      A       
ATOM    176  HA  GLU A  13      11.032  -5.409  -2.273  1.00  0.00      A       
ATOM    177  HB2 GLU A  13       8.158  -4.491  -2.057  1.00  0.00      A       
ATOM    178  HB1 GLU A  13       8.902  -5.660  -0.969  1.00  0.00      A       
ATOM    179  HG2 GLU A  13       9.184  -3.645   0.190  1.00  0.00      A       
ATOM    180  HG1 GLU A  13      10.730  -3.825  -0.628  1.00  0.00      A       
ATOM    181  N   GLU A  13      10.185  -4.129  -3.691  1.00  0.00      A       
ATOM    182  O   GLU A  13       8.825  -6.434  -4.367  1.00  0.00      A       
ATOM    183  OE1 GLU A  13       8.953  -2.332  -2.585  1.00  0.00      A       
ATOM    184  OE2 GLU A  13       9.787  -1.311  -0.882  1.00  0.00      A       
ATOM    185  C   ARG A  14       9.002  -9.792  -2.304  1.00  0.00      A       
ATOM    186  CA  ARG A  14       9.589  -8.917  -3.398  1.00  0.00      A       
ATOM    187  CB  ARG A  14      10.809  -9.609  -4.008  1.00  0.00      A       
ATOM    188  CD  ARG A  14      10.630  -8.763  -6.374  1.00  0.00      A       
ATOM    189  CG  ARG A  14      11.447  -8.711  -5.078  1.00  0.00      A       
ATOM    190  CZ  ARG A  14      11.042  -8.302  -8.718  1.00  0.00      A       
ATOM    191  HN  ARG A  14      10.574  -7.599  -2.067  1.00  0.00      A       
ATOM    192  HA  ARG A  14       8.841  -8.777  -4.163  1.00  0.00      A       
ATOM    193  HB2 ARG A  14      11.531  -9.805  -3.228  1.00  0.00      A       
ATOM    194  HB1 ARG A  14      10.506 -10.544  -4.456  1.00  0.00      A       
ATOM    195  HD2 ARG A  14      10.474  -9.792  -6.659  1.00  0.00      A       
ATOM    196  HD1 ARG A  14       9.674  -8.288  -6.219  1.00  0.00      A       
ATOM    197  HE  ARG A  14      12.046  -7.428  -7.222  1.00  0.00      A       
ATOM    198  HG2 ARG A  14      11.480  -7.694  -4.720  1.00  0.00      A       
ATOM    199  HG1 ARG A  14      12.451  -9.051  -5.278  1.00  0.00      A       
ATOM    200 HH11 ARG A  14       9.621  -9.647  -8.296  1.00  0.00      A       
ATOM    201 HH12 ARG A  14       9.882  -9.338  -9.981  1.00  0.00      A       
ATOM    202 HH21 ARG A  14      12.400  -7.017  -9.427  1.00  0.00      A       
ATOM    203 HH22 ARG A  14      11.459  -7.847 -10.620  1.00  0.00      A       
ATOM    204  N   ARG A  14       9.984  -7.625  -2.848  1.00  0.00      A       
ATOM    205  NE  ARG A  14      11.340  -8.073  -7.444  1.00  0.00      A       
ATOM    206  NH1 ARG A  14      10.110  -9.163  -9.023  1.00  0.00      A       
ATOM    207  NH2 ARG A  14      11.683  -7.673  -9.662  1.00  0.00      A       
ATOM    208  O   ARG A  14       9.684 -10.156  -1.343  1.00  0.00      A       
ATOM    209  C   ARG A  15       7.425 -12.426  -1.682  1.00  0.00      A       
ATOM    210  CA  ARG A  15       7.048 -10.961  -1.480  1.00  0.00      A       
ATOM    211  CB  ARG A  15       5.527 -10.819  -1.618  1.00  0.00      A       
ATOM    212  CD  ARG A  15       4.731 -10.292   0.717  1.00  0.00      A       
ATOM    213  CG  ARG A  15       4.832 -11.376  -0.364  1.00  0.00      A       
ATOM    214  CZ  ARG A  15       4.332 -10.205   3.102  1.00  0.00      A       
ATOM    215  HN  ARG A  15       7.239  -9.808  -3.243  1.00  0.00      A       
ATOM    216  HA  ARG A  15       7.345 -10.655  -0.490  1.00  0.00      A       
ATOM    217  HB2 ARG A  15       5.269  -9.782  -1.744  1.00  0.00      A       
ATOM    218  HB1 ARG A  15       5.195 -11.372  -2.483  1.00  0.00      A       
ATOM    219  HD2 ARG A  15       5.705  -9.871   0.902  1.00  0.00      A       
ATOM    220  HD1 ARG A  15       4.067  -9.511   0.377  1.00  0.00      A       
ATOM    221  HE  ARG A  15       3.778 -11.736   1.938  1.00  0.00      A       
ATOM    222  HG2 ARG A  15       3.839 -11.706  -0.626  1.00  0.00      A       
ATOM    223  HG1 ARG A  15       5.395 -12.213   0.023  1.00  0.00      A       
ATOM    224 HH11 ARG A  15       5.275  -8.637   2.288  1.00  0.00      A       
ATOM    225 HH12 ARG A  15       5.004  -8.545   3.996  1.00  0.00      A       
ATOM    226 HH21 ARG A  15       3.422 -11.626   4.173  1.00  0.00      A       
ATOM    227 HH22 ARG A  15       3.953 -10.240   5.065  1.00  0.00      A       
ATOM    228  N   ARG A  15       7.729 -10.126  -2.458  1.00  0.00      A       
ATOM    229  NE  ARG A  15       4.215 -10.859   1.954  1.00  0.00      A       
ATOM    230  NH1 ARG A  15       4.916  -9.038   3.131  1.00  0.00      A       
ATOM    231  NH2 ARG A  15       3.866 -10.732   4.199  1.00  0.00      A       
ATOM    232  O   ARG A  15       7.494 -12.909  -2.812  1.00  0.00      A       
ATOM    233  C   TYR A  16       6.779 -15.418  -0.729  1.00  0.00      A       
ATOM    234  CA  TYR A  16       8.027 -14.545  -0.647  1.00  0.00      A       
ATOM    235  CB  TYR A  16       8.835 -14.933   0.594  1.00  0.00      A       
ATOM    236  CD1 TYR A  16      10.173 -12.891   1.217  1.00  0.00      A       
ATOM    237  CD2 TYR A  16      11.283 -14.698   0.040  1.00  0.00      A       
ATOM    238  CE1 TYR A  16      11.373 -12.169   1.240  1.00  0.00      A       
ATOM    239  CE2 TYR A  16      12.482 -13.975   0.061  1.00  0.00      A       
ATOM    240  CG  TYR A  16      10.128 -14.156   0.618  1.00  0.00      A       
ATOM    241  CZ  TYR A  16      12.527 -12.710   0.662  1.00  0.00      A       
ATOM    242  HN  TYR A  16       7.592 -12.694   0.294  1.00  0.00      A       
ATOM    243  HA  TYR A  16       8.633 -14.716  -1.524  1.00  0.00      A       
ATOM    244  HB2 TYR A  16       8.262 -14.708   1.482  1.00  0.00      A       
ATOM    245  HB1 TYR A  16       9.053 -15.991   0.566  1.00  0.00      A       
ATOM    246  HD1 TYR A  16       9.284 -12.473   1.664  1.00  0.00      A       
ATOM    247  HD2 TYR A  16      11.249 -15.673  -0.422  1.00  0.00      A       
ATOM    248  HE1 TYR A  16      11.408 -11.193   1.702  1.00  0.00      A       
ATOM    249  HE2 TYR A  16      13.373 -14.392  -0.384  1.00  0.00      A       
ATOM    250  HH  TYR A  16      14.308 -12.397   0.048  1.00  0.00      A       
ATOM    251  N   TYR A  16       7.664 -13.130  -0.580  1.00  0.00      A       
ATOM    252  O   TYR A  16       6.741 -16.395  -1.476  1.00  0.00      A       
ATOM    253  OH  TYR A  16      13.709 -11.997   0.682  1.00  0.00      A       
ATOM    254  C   GLY A  17       3.764 -15.603  -1.271  1.00  0.00      A       
ATOM    255  CA  GLY A  17       4.513 -15.813   0.039  1.00  0.00      A       
ATOM    256  HN  GLY A  17       5.843 -14.268   0.615  1.00  0.00      A       
ATOM    257  HA2 GLY A  17       4.735 -16.864   0.162  1.00  0.00      A       
ATOM    258  HA1 GLY A  17       3.892 -15.480   0.857  1.00  0.00      A       
ATOM    259  N   GLY A  17       5.758 -15.057   0.040  1.00  0.00      A       
ATOM    260  O   GLY A  17       3.943 -14.586  -1.940  1.00  0.00      A       
ATOM    261  C   THR A  18       0.651 -16.692  -2.576  1.00  0.00      A       
ATOM    262  CA  THR A  18       2.137 -16.484  -2.871  1.00  0.00      A       
ATOM    263  CB  THR A  18       2.619 -17.536  -3.865  1.00  0.00      A       
ATOM    264  CG2 THR A  18       4.103 -17.323  -4.152  1.00  0.00      A       
ATOM    265  HN  THR A  18       2.819 -17.357  -1.059  1.00  0.00      A       
ATOM    266  HA  THR A  18       2.275 -15.510  -3.314  1.00  0.00      A       
ATOM    267  HB  THR A  18       2.062 -17.451  -4.780  1.00  0.00      A       
ATOM    268  HG1 THR A  18       1.826 -19.315  -3.885  1.00  0.00      A       
ATOM    269 HG21 THR A  18       4.677 -17.525  -3.259  1.00  0.00      A       
ATOM    270 HG22 THR A  18       4.263 -16.300  -4.459  1.00  0.00      A       
ATOM    271 HG23 THR A  18       4.415 -17.990  -4.941  1.00  0.00      A       
ATOM    272  N   THR A  18       2.920 -16.570  -1.634  1.00  0.00      A       
ATOM    273  O   THR A  18       0.287 -17.508  -1.727  1.00  0.00      A       
ATOM    274  OG1 THR A  18       2.422 -18.828  -3.309  1.00  0.00      A       
ATOM    275  C   CYS A  19      -2.285 -16.851  -4.216  1.00  0.00      A       
ATOM    276  CA  CYS A  19      -1.656 -16.040  -3.092  1.00  0.00      A       
ATOM    277  CB  CYS A  19      -2.280 -14.636  -3.032  1.00  0.00      A       
ATOM    278  HN  CYS A  19       0.149 -15.313  -3.941  1.00  0.00      A       
ATOM    279  HA  CYS A  19      -1.856 -16.545  -2.156  1.00  0.00      A       
ATOM    280  HB2 CYS A  19      -3.266 -14.702  -2.590  1.00  0.00      A       
ATOM    281  HB1 CYS A  19      -1.659 -13.998  -2.419  1.00  0.00      A       
ATOM    282  HG  CYS A  19      -3.334 -13.980  -4.968  1.00  0.00      A       
ATOM    283  N   CYS A  19      -0.204 -15.943  -3.282  1.00  0.00      A       
ATOM    284  O   CYS A  19      -2.191 -16.495  -5.387  1.00  0.00      A       
ATOM    285  SG  CYS A  19      -2.414 -13.923  -4.697  1.00  0.00      A       
ATOM    286  C   ILE A  20      -4.979 -18.372  -5.123  1.00  0.00      A       
ATOM    287  CA  ILE A  20      -3.536 -18.804  -4.881  1.00  0.00      A       
ATOM    288  CB  ILE A  20      -3.502 -20.264  -4.430  1.00  0.00      A       
ATOM    289  CD1 ILE A  20      -0.996 -20.158  -4.609  1.00  0.00      A       
ATOM    290  CG1 ILE A  20      -2.177 -20.552  -3.717  1.00  0.00      A       
ATOM    291  CG2 ILE A  20      -3.630 -21.179  -5.647  1.00  0.00      A       
ATOM    292  HN  ILE A  20      -2.977 -18.222  -2.920  1.00  0.00      A       
ATOM    293  HA  ILE A  20      -2.979 -18.712  -5.806  1.00  0.00      A       
ATOM    294  HB  ILE A  20      -4.322 -20.453  -3.754  1.00  0.00      A       
ATOM    295 HD11 ILE A  20      -0.938 -19.082  -4.675  1.00  0.00      A       
ATOM    296 HD12 ILE A  20      -1.127 -20.573  -5.597  1.00  0.00      A       
ATOM    297 HD13 ILE A  20      -0.081 -20.541  -4.180  1.00  0.00      A       
ATOM    298 HG12 ILE A  20      -2.138 -19.983  -2.800  1.00  0.00      A       
ATOM    299 HG11 ILE A  20      -2.117 -21.604  -3.488  1.00  0.00      A       
ATOM    300 HG21 ILE A  20      -4.548 -20.956  -6.171  1.00  0.00      A       
ATOM    301 HG22 ILE A  20      -3.645 -22.209  -5.321  1.00  0.00      A       
ATOM    302 HG23 ILE A  20      -2.791 -21.022  -6.308  1.00  0.00      A       
ATOM    303  N   ILE A  20      -2.924 -17.961  -3.866  1.00  0.00      A       
ATOM    304  O   ILE A  20      -5.886 -18.768  -4.391  1.00  0.00      A       
ATOM    305  C   TYR A  21      -6.636 -16.903  -8.007  1.00  0.00      A       
ATOM    306  CA  TYR A  21      -6.512 -17.074  -6.498  1.00  0.00      A       
ATOM    307  CB  TYR A  21      -6.778 -15.736  -5.800  1.00  0.00      A       
ATOM    308  CD1 TYR A  21      -9.299 -15.744  -5.689  1.00  0.00      A       
ATOM    309  CD2 TYR A  21      -8.203 -14.173  -7.176  1.00  0.00      A       
ATOM    310  CE1 TYR A  21     -10.546 -15.253  -6.091  1.00  0.00      A       
ATOM    311  CE2 TYR A  21      -9.449 -13.683  -7.578  1.00  0.00      A       
ATOM    312  CG  TYR A  21      -8.126 -15.203  -6.231  1.00  0.00      A       
ATOM    313  CZ  TYR A  21     -10.622 -14.223  -7.036  1.00  0.00      A       
ATOM    314  HN  TYR A  21      -4.415 -17.279  -6.701  1.00  0.00      A       
ATOM    315  HA  TYR A  21      -7.248 -17.792  -6.167  1.00  0.00      A       
ATOM    316  HB2 TYR A  21      -6.776 -15.881  -4.730  1.00  0.00      A       
ATOM    317  HB1 TYR A  21      -6.009 -15.027  -6.069  1.00  0.00      A       
ATOM    318  HD1 TYR A  21      -9.239 -16.538  -4.958  1.00  0.00      A       
ATOM    319  HD2 TYR A  21      -7.297 -13.756  -7.594  1.00  0.00      A       
ATOM    320  HE1 TYR A  21     -11.451 -15.670  -5.673  1.00  0.00      A       
ATOM    321  HE2 TYR A  21      -9.507 -12.889  -8.307  1.00  0.00      A       
ATOM    322  HH  TYR A  21     -12.103 -14.200  -8.238  1.00  0.00      A       
ATOM    323  N   TYR A  21      -5.179 -17.559  -6.156  1.00  0.00      A       
ATOM    324  O   TYR A  21      -6.084 -15.968  -8.585  1.00  0.00      A       
ATOM    325  OH  TYR A  21     -11.851 -13.741  -7.435  1.00  0.00      A       
ATOM    326  C   GLN A  22      -6.225 -17.954 -10.792  1.00  0.00      A       
ATOM    327  CA  GLN A  22      -7.562 -17.773 -10.075  1.00  0.00      A       
ATOM    328  CB  GLN A  22      -8.197 -16.431 -10.481  1.00  0.00      A       
ATOM    329  CD  GLN A  22     -10.176 -17.427 -11.638  1.00  0.00      A       
ATOM    330  CG  GLN A  22      -8.925 -16.574 -11.823  1.00  0.00      A       
ATOM    331  HN  GLN A  22      -7.777 -18.539  -8.112  1.00  0.00      A       
ATOM    332  HA  GLN A  22      -8.220 -18.579 -10.361  1.00  0.00      A       
ATOM    333  HB2 GLN A  22      -8.904 -16.130  -9.722  1.00  0.00      A       
ATOM    334  HB1 GLN A  22      -7.428 -15.677 -10.571  1.00  0.00      A       
ATOM    335 HE21 GLN A  22      -9.901 -18.458 -13.312  1.00  0.00      A       
ATOM    336 HE22 GLN A  22     -11.279 -18.882 -12.417  1.00  0.00      A       
ATOM    337  HG2 GLN A  22      -9.209 -15.596 -12.185  1.00  0.00      A       
ATOM    338  HG1 GLN A  22      -8.274 -17.047 -12.540  1.00  0.00      A       
ATOM    339  N   GLN A  22      -7.365 -17.817  -8.632  1.00  0.00      A       
ATOM    340  NE2 GLN A  22     -10.477 -18.331 -12.530  1.00  0.00      A       
ATOM    341  O   GLN A  22      -6.107 -17.698 -11.989  1.00  0.00      A       
ATOM    342  OE1 GLN A  22     -10.898 -17.265 -10.654  1.00  0.00      A       
ATOM    343  C   GLY A  23      -3.094 -17.312 -10.652  1.00  0.00      A       
ATOM    344  CA  GLY A  23      -3.893 -18.612 -10.632  1.00  0.00      A       
ATOM    345  HN  GLY A  23      -5.358 -18.594  -9.100  1.00  0.00      A       
ATOM    346  HA2 GLY A  23      -3.361 -19.348 -10.047  1.00  0.00      A       
ATOM    347  HA1 GLY A  23      -4.001 -18.975 -11.644  1.00  0.00      A       
ATOM    348  N   GLY A  23      -5.214 -18.403 -10.050  1.00  0.00      A       
ATOM    349  O   GLY A  23      -2.300 -17.075 -11.564  1.00  0.00      A       
ATOM    350  C   ARG A  24      -2.006 -15.006  -8.149  1.00  0.00      A       
ATOM    351  CA  ARG A  24      -2.598 -15.189  -9.543  1.00  0.00      A       
ATOM    352  CB  ARG A  24      -3.558 -14.041  -9.840  1.00  0.00      A       
ATOM    353  CD  ARG A  24      -4.923 -12.932 -11.610  1.00  0.00      A       
ATOM    354  CG  ARG A  24      -3.966 -14.086 -11.312  1.00  0.00      A       
ATOM    355  CZ  ARG A  24      -4.615 -12.461 -13.975  1.00  0.00      A       
ATOM    356  HN  ARG A  24      -3.947 -16.711  -8.942  1.00  0.00      A       
ATOM    357  HA  ARG A  24      -1.794 -15.165 -10.268  1.00  0.00      A       
ATOM    358  HB2 ARG A  24      -4.435 -14.143  -9.217  1.00  0.00      A       
ATOM    359  HB1 ARG A  24      -3.073 -13.100  -9.628  1.00  0.00      A       
ATOM    360  HD2 ARG A  24      -5.787 -13.009 -10.966  1.00  0.00      A       
ATOM    361  HD1 ARG A  24      -4.420 -11.993 -11.422  1.00  0.00      A       
ATOM    362  HE  ARG A  24      -6.209 -13.412 -13.226  1.00  0.00      A       
ATOM    363  HG2 ARG A  24      -3.086 -13.996 -11.933  1.00  0.00      A       
ATOM    364  HG1 ARG A  24      -4.459 -15.023 -11.521  1.00  0.00      A       
ATOM    365 HH11 ARG A  24      -3.160 -11.848 -12.744  1.00  0.00      A       
ATOM    366 HH12 ARG A  24      -2.918 -11.499 -14.423  1.00  0.00      A       
ATOM    367 HH21 ARG A  24      -5.900 -12.956 -15.429  1.00  0.00      A       
ATOM    368 HH22 ARG A  24      -4.469 -12.126 -15.943  1.00  0.00      A       
ATOM    369  N   ARG A  24      -3.306 -16.469  -9.638  1.00  0.00      A       
ATOM    370  NE  ARG A  24      -5.356 -12.984 -13.002  1.00  0.00      A       
ATOM    371  NH1 ARG A  24      -3.476 -11.891 -13.692  1.00  0.00      A       
ATOM    372  NH2 ARG A  24      -5.027 -12.518 -15.212  1.00  0.00      A       
ATOM    373  O   ARG A  24      -2.722 -15.008  -7.147  1.00  0.00      A       
ATOM    374  C   LEU A  25       0.069 -13.177  -6.476  1.00  0.00      A       
ATOM    375  CA  LEU A  25       0.032 -14.654  -6.848  1.00  0.00      A       
ATOM    376  CB  LEU A  25       1.461 -15.196  -6.950  1.00  0.00      A       
ATOM    377  CD1 LEU A  25       2.886 -17.068  -7.781  1.00  0.00      A       
ATOM    378  CD2 LEU A  25       0.426 -17.460  -7.344  1.00  0.00      A       
ATOM    379  CG  LEU A  25       1.484 -16.447  -7.826  1.00  0.00      A       
ATOM    380  HN  LEU A  25      -0.181 -14.854  -8.942  1.00  0.00      A       
ATOM    381  HA  LEU A  25      -0.481 -15.186  -6.065  1.00  0.00      A       
ATOM    382  HB2 LEU A  25       2.104 -14.444  -7.388  1.00  0.00      A       
ATOM    383  HB1 LEU A  25       1.826 -15.442  -5.961  1.00  0.00      A       
ATOM    384 HD11 LEU A  25       3.559 -16.473  -8.383  1.00  0.00      A       
ATOM    385 HD12 LEU A  25       2.849 -18.073  -8.173  1.00  0.00      A       
ATOM    386 HD13 LEU A  25       3.244 -17.093  -6.764  1.00  0.00      A       
ATOM    387 HD21 LEU A  25      -0.522 -17.232  -7.810  1.00  0.00      A       
ATOM    388 HD22 LEU A  25       0.318 -17.402  -6.273  1.00  0.00      A       
ATOM    389 HD23 LEU A  25       0.727 -18.461  -7.620  1.00  0.00      A       
ATOM    390  HG  LEU A  25       1.265 -16.161  -8.844  1.00  0.00      A       
ATOM    391  N   LEU A  25      -0.688 -14.845  -8.105  1.00  0.00      A       
ATOM    392  O   LEU A  25      -0.252 -12.320  -7.296  1.00  0.00      A       
ATOM    393  C   TRP A  26       1.987 -11.102  -4.465  1.00  0.00      A       
ATOM    394  CA  TRP A  26       0.547 -11.495  -4.755  1.00  0.00      A       
ATOM    395  CB  TRP A  26      -0.294 -11.264  -3.490  1.00  0.00      A       
ATOM    396  CD1 TRP A  26       0.845 -13.141  -2.262  1.00  0.00      A       
ATOM    397  CD2 TRP A  26       0.646 -11.295  -1.025  1.00  0.00      A       
ATOM    398  CE2 TRP A  26       1.328 -12.241  -0.230  1.00  0.00      A       
ATOM    399  CE3 TRP A  26       0.380 -10.033  -0.482  1.00  0.00      A       
ATOM    400  CG  TRP A  26       0.370 -11.886  -2.311  1.00  0.00      A       
ATOM    401  CH2 TRP A  26       1.467 -10.682   1.594  1.00  0.00      A       
ATOM    402  CZ2 TRP A  26       1.739 -11.944   1.064  1.00  0.00      A       
ATOM    403  CZ3 TRP A  26       0.785  -9.727   0.822  1.00  0.00      A       
ATOM    404  HN  TRP A  26       0.701 -13.621  -4.630  1.00  0.00      A       
ATOM    405  HA  TRP A  26       0.183 -10.849  -5.525  1.00  0.00      A       
ATOM    406  HB2 TRP A  26      -0.415 -10.205  -3.317  1.00  0.00      A       
ATOM    407  HB1 TRP A  26      -1.269 -11.719  -3.624  1.00  0.00      A       
ATOM    408  HD1 TRP A  26       0.794 -13.851  -3.055  1.00  0.00      A       
ATOM    409  HE1 TRP A  26       1.865 -14.181  -0.745  1.00  0.00      A       
ATOM    410  HE3 TRP A  26      -0.151  -9.298  -1.067  1.00  0.00      A       
ATOM    411  HH2 TRP A  26       1.778 -10.441   2.598  1.00  0.00      A       
ATOM    412  HZ2 TRP A  26       2.264 -12.684   1.651  1.00  0.00      A       
ATOM    413  HZ3 TRP A  26       0.574  -8.754   1.233  1.00  0.00      A       
ATOM    414  N   TRP A  26       0.458 -12.889  -5.230  1.00  0.00      A       
ATOM    415  NE1 TRP A  26       1.431 -13.352  -1.032  1.00  0.00      A       
ATOM    416  O   TRP A  26       2.596 -11.555  -3.496  1.00  0.00      A       
ATOM    417  C   ALA A  27       3.823  -8.447  -4.351  1.00  0.00      A       
ATOM    418  CA  ALA A  27       3.878  -9.756  -5.100  1.00  0.00      A       
ATOM    419  CB  ALA A  27       4.593  -9.576  -6.436  1.00  0.00      A       
ATOM    420  HN  ALA A  27       1.995  -9.895  -6.052  1.00  0.00      A       
ATOM    421  HA  ALA A  27       4.426 -10.474  -4.501  1.00  0.00      A       
ATOM    422  HB1 ALA A  27       4.747 -10.544  -6.887  1.00  0.00      A       
ATOM    423  HB2 ALA A  27       5.551  -9.104  -6.270  1.00  0.00      A       
ATOM    424  HB3 ALA A  27       3.995  -8.962  -7.089  1.00  0.00      A       
ATOM    425  N   ALA A  27       2.522 -10.233  -5.299  1.00  0.00      A       
ATOM    426  O   ALA A  27       2.787  -7.786  -4.323  1.00  0.00      A       
ATOM    427  C   PHE A  28       4.996  -5.663  -3.938  1.00  0.00      A       
ATOM    428  CA  PHE A  28       4.931  -6.838  -2.971  1.00  0.00      A       
ATOM    429  CB  PHE A  28       6.157  -6.830  -2.064  1.00  0.00      A       
ATOM    430  CD1 PHE A  28       5.779  -4.563  -1.003  1.00  0.00      A       
ATOM    431  CD2 PHE A  28       5.895  -6.517   0.431  1.00  0.00      A       
ATOM    432  CE1 PHE A  28       5.572  -3.753   0.123  1.00  0.00      A       
ATOM    433  CE2 PHE A  28       5.684  -5.708   1.552  1.00  0.00      A       
ATOM    434  CG  PHE A  28       5.940  -5.946  -0.849  1.00  0.00      A       
ATOM    435  CZ  PHE A  28       5.520  -4.327   1.399  1.00  0.00      A       
ATOM    436  HN  PHE A  28       5.723  -8.630  -3.756  1.00  0.00      A       
ATOM    437  HA  PHE A  28       4.034  -6.769  -2.369  1.00  0.00      A       
ATOM    438  HB2 PHE A  28       6.372  -7.830  -1.740  1.00  0.00      A       
ATOM    439  HB1 PHE A  28       7.009  -6.458  -2.618  1.00  0.00      A       
ATOM    440  HD1 PHE A  28       5.823  -4.119  -1.988  1.00  0.00      A       
ATOM    441  HD2 PHE A  28       6.025  -7.581   0.551  1.00  0.00      A       
ATOM    442  HE1 PHE A  28       5.447  -2.687   0.007  1.00  0.00      A       
ATOM    443  HE2 PHE A  28       5.650  -6.150   2.536  1.00  0.00      A       
ATOM    444  HZ  PHE A  28       5.354  -3.705   2.265  1.00  0.00      A       
ATOM    445  N   PHE A  28       4.922  -8.071  -3.725  1.00  0.00      A       
ATOM    446  O   PHE A  28       6.053  -5.343  -4.482  1.00  0.00      A       
ATOM    447  C   CYS A  29       3.197  -2.671  -4.295  1.00  0.00      A       
ATOM    448  CA  CYS A  29       3.739  -3.889  -5.049  1.00  0.00      A       
ATOM    449  CB  CYS A  29       2.800  -4.247  -6.207  1.00  0.00      A       
ATOM    450  HN  CYS A  29       3.042  -5.337  -3.682  1.00  0.00      A       
ATOM    451  HA  CYS A  29       4.715  -3.649  -5.451  1.00  0.00      A       
ATOM    452  HB2 CYS A  29       3.006  -5.251  -6.539  1.00  0.00      A       
ATOM    453  HB1 CYS A  29       1.776  -4.171  -5.880  1.00  0.00      A       
ATOM    454  HG  CYS A  29       3.833  -3.409  -8.083  1.00  0.00      A       
ATOM    455  N   CYS A  29       3.844  -5.029  -4.145  1.00  0.00      A       
ATOM    456  O   CYS A  29       2.111  -2.724  -3.714  1.00  0.00      A       
ATOM    457  SG  CYS A  29       3.090  -3.084  -7.570  1.00  0.00      A       
ATOM    458  C   CYS A  30       4.209   0.865  -4.274  1.00  0.00      A       
ATOM    459  CA  CYS A  30       3.548  -0.350  -3.627  1.00  0.00      A       
ATOM    460  CB  CYS A  30       3.935  -0.412  -2.148  1.00  0.00      A       
ATOM    461  HN  CYS A  30       4.809  -1.594  -4.793  1.00  0.00      A       
ATOM    462  HA  CYS A  30       2.477  -0.246  -3.703  1.00  0.00      A       
ATOM    463  HB2 CYS A  30       5.012  -0.395  -2.055  1.00  0.00      A       
ATOM    464  HB1 CYS A  30       3.516   0.439  -1.631  1.00  0.00      A       
ATOM    465  HG  CYS A  30       3.752  -2.086  -0.588  1.00  0.00      A       
ATOM    466  N   CYS A  30       3.958  -1.579  -4.312  1.00  0.00      A       
ATOM    467  OT1 CYS A  30       4.899   1.586  -3.572  1.00  0.00      A       
ATOM    468  OT2 CYS A  30       4.015   1.054  -5.464  1.00  0.00      A       
ATOM    469  SG  CYS A  30       3.291  -1.938  -1.416  1.00  0.00      A       
END


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