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
434055 2jvy 15500 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   SER A   1      10.961  -0.448   5.903  1.00  0.00      A       
ATOM      2  CA  SER A   1      10.941  -1.874   6.441  1.00  0.00      A       
ATOM      3  CB  SER A   1       9.579  -2.514   6.162  1.00  0.00      A       
ATOM      4  HT1 SER A   1      12.122  -1.424   8.089  1.00  0.00      A       
ATOM      5  HT2 SER A   1      11.266  -2.877   8.231  1.00  0.00      A       
ATOM      6  HT3 SER A   1      10.456  -1.393   8.403  1.00  0.00      A       
ATOM      7  HA  SER A   1      11.707  -2.448   5.940  1.00  0.00      A       
ATOM      8  HB2 SER A   1       8.813  -1.966   6.691  1.00  0.00      A       
ATOM      9  HB1 SER A   1       9.380  -2.479   5.101  1.00  0.00      A       
ATOM     10  HG  SER A   1       9.628  -4.443   5.819  1.00  0.00      A       
ATOM     11  N   SER A   1      11.216  -1.892   7.890  1.00  0.00      A       
ATOM     12  O   SER A   1      10.357   0.454   6.481  1.00  0.00      A       
ATOM     13  OG  SER A   1       9.549  -3.866   6.589  1.00  0.00      A       
ATOM     14  C   SER A   2      10.580   1.184   3.133  1.00  0.00      A       
ATOM     15  CA  SER A   2      11.723   1.050   4.140  1.00  0.00      A       
ATOM     16  CB  SER A   2      13.078   1.215   3.440  1.00  0.00      A       
ATOM     17  HN  SER A   2      12.159  -1.004   4.401  1.00  0.00      A       
ATOM     18  HA  SER A   2      11.616   1.812   4.899  1.00  0.00      A       
ATOM     19  HB2 SER A   2      13.871   1.065   4.158  1.00  0.00      A       
ATOM     20  HB1 SER A   2      13.164   0.482   2.651  1.00  0.00      A       
ATOM     21  HG  SER A   2      12.377   2.782   2.487  1.00  0.00      A       
ATOM     22  N   SER A   2      11.660  -0.251   4.793  1.00  0.00      A       
ATOM     23  O   SER A   2      10.617   2.026   2.234  1.00  0.00      A       
ATOM     24  OG  SER A   2      13.221   2.509   2.877  1.00  0.00      A       
ATOM     25  C   ASP A   3       7.144   0.139   3.189  1.00  0.00      A       
ATOM     26  CA  ASP A   3       8.426   0.328   2.399  1.00  0.00      A       
ATOM     27  CB  ASP A   3       8.571  -0.812   1.386  1.00  0.00      A       
ATOM     28  CG  ASP A   3       8.478  -2.183   2.036  1.00  0.00      A       
ATOM     29  HN  ASP A   3       9.576  -0.266   4.058  1.00  0.00      A       
ATOM     30  HA  ASP A   3       8.385   1.270   1.876  1.00  0.00      A       
ATOM     31  HB2 ASP A   3       7.791  -0.731   0.645  1.00  0.00      A       
ATOM     32  HB1 ASP A   3       9.533  -0.731   0.900  1.00  0.00      A       
ATOM     33  N   ASP A   3       9.565   0.352   3.301  1.00  0.00      A       
ATOM     34  O   ASP A   3       7.170   0.010   4.415  1.00  0.00      A       
ATOM     35  OD1 ASP A   3       9.490  -2.649   2.602  1.00  0.00      A       
ATOM     36  OD2 ASP A   3       7.398  -2.806   1.976  1.00  0.00      A       
ATOM     37  C   PHE A   4       4.010  -1.179   2.230  1.00  0.00      A       
ATOM     38  CA  PHE A   4       4.734  -0.131   3.067  1.00  0.00      A       
ATOM     39  CB  PHE A   4       3.889   1.145   3.162  1.00  0.00      A       
ATOM     40  CD1 PHE A   4       4.055   2.136   5.462  1.00  0.00      A       
ATOM     41  CD2 PHE A   4       5.309   3.142   3.704  1.00  0.00      A       
ATOM     42  CE1 PHE A   4       4.552   3.068   6.351  1.00  0.00      A       
ATOM     43  CE2 PHE A   4       5.808   4.076   4.590  1.00  0.00      A       
ATOM     44  CG  PHE A   4       4.426   2.162   4.128  1.00  0.00      A       
ATOM     45  CZ  PHE A   4       5.410   4.049   5.916  1.00  0.00      A       
ATOM     46  HN  PHE A   4       6.084   0.349   1.518  1.00  0.00      A       
ATOM     47  HA  PHE A   4       4.895  -0.525   4.059  1.00  0.00      A       
ATOM     48  HB2 PHE A   4       3.842   1.606   2.188  1.00  0.00      A       
ATOM     49  HB1 PHE A   4       2.891   0.880   3.478  1.00  0.00      A       
ATOM     50  HD1 PHE A   4       3.368   1.375   5.806  1.00  0.00      A       
ATOM     51  HD2 PHE A   4       5.607   3.174   2.667  1.00  0.00      A       
ATOM     52  HE1 PHE A   4       4.253   3.036   7.389  1.00  0.00      A       
ATOM     53  HE2 PHE A   4       6.497   4.834   4.247  1.00  0.00      A       
ATOM     54  HZ  PHE A   4       5.793   4.783   6.608  1.00  0.00      A       
ATOM     55  N   PHE A   4       6.031   0.148   2.481  1.00  0.00      A       
ATOM     56  O   PHE A   4       3.612  -0.915   1.093  1.00  0.00      A       
ATOM     57  C   CYS A   5       1.717  -3.401   2.167  1.00  0.00      A       
ATOM     58  CA  CYS A   5       3.240  -3.475   2.071  1.00  0.00      A       
ATOM     59  CB  CYS A   5       3.734  -4.801   2.643  1.00  0.00      A       
ATOM     60  HN  CYS A   5       4.187  -2.517   3.696  1.00  0.00      A       
ATOM     61  HA  CYS A   5       3.531  -3.411   1.032  1.00  0.00      A       
ATOM     62  HB2 CYS A   5       3.331  -4.926   3.636  1.00  0.00      A       
ATOM     63  HB1 CYS A   5       3.386  -5.608   2.014  1.00  0.00      A       
ATOM     64  HG  CYS A   5       6.065  -3.798   2.293  1.00  0.00      A       
ATOM     65  N   CYS A   5       3.864  -2.372   2.784  1.00  0.00      A       
ATOM     66  O   CYS A   5       1.168  -3.039   3.208  1.00  0.00      A       
ATOM     67  SG  CYS A   5       5.535  -4.929   2.760  1.00  0.00      A       
ATOM     68  C   CYS A   6      -0.940  -4.987   1.773  1.00  0.00      A       
ATOM     69  CA  CYS A   6      -0.417  -3.751   1.050  1.00  0.00      A       
ATOM     70  CB  CYS A   6      -0.940  -3.741  -0.393  1.00  0.00      A       
ATOM     71  HN  CYS A   6       1.537  -4.002   0.266  1.00  0.00      A       
ATOM     72  HA  CYS A   6      -0.768  -2.869   1.561  1.00  0.00      A       
ATOM     73  HB2 CYS A   6      -0.586  -2.852  -0.896  1.00  0.00      A       
ATOM     74  HB1 CYS A   6      -0.570  -4.613  -0.911  1.00  0.00      A       
ATOM     75  N   CYS A   6       1.041  -3.739   1.074  1.00  0.00      A       
ATOM     76  O   CYS A   6      -0.572  -6.105   1.428  1.00  0.00      A       
ATOM     77  SG  CYS A   6      -2.746  -3.758  -0.507  1.00  0.00      A       
ATOM     78  C   PRO A   7      -3.349  -6.785   2.750  1.00  0.00      A       
ATOM     79  CA  PRO A   7      -2.379  -5.919   3.555  1.00  0.00      A       
ATOM     80  CB  PRO A   7      -3.113  -5.217   4.700  1.00  0.00      A       
ATOM     81  CD  PRO A   7      -2.340  -3.500   3.227  1.00  0.00      A       
ATOM     82  CG  PRO A   7      -3.455  -3.869   4.168  1.00  0.00      A       
ATOM     83  HA  PRO A   7      -1.597  -6.543   3.957  1.00  0.00      A       
ATOM     84  HB2 PRO A   7      -4.001  -5.776   4.959  1.00  0.00      A       
ATOM     85  HB1 PRO A   7      -2.462  -5.147   5.559  1.00  0.00      A       
ATOM     86  HD2 PRO A   7      -2.722  -2.924   2.396  1.00  0.00      A       
ATOM     87  HD1 PRO A   7      -1.573  -2.947   3.749  1.00  0.00      A       
ATOM     88  HG2 PRO A   7      -4.396  -3.908   3.640  1.00  0.00      A       
ATOM     89  HG1 PRO A   7      -3.509  -3.159   4.981  1.00  0.00      A       
ATOM     90  N   PRO A   7      -1.824  -4.806   2.771  1.00  0.00      A       
ATOM     91  O   PRO A   7      -3.948  -7.725   3.270  1.00  0.00      A       
ATOM     92  C   LYS A   8      -3.594  -7.928  -0.479  1.00  0.00      A       
ATOM     93  CA  LYS A   8      -4.391  -7.183   0.587  1.00  0.00      A       
ATOM     94  CB  LYS A   8      -5.363  -6.217  -0.100  1.00  0.00      A       
ATOM     95  CD  LYS A   8      -7.164  -6.178   1.656  1.00  0.00      A       
ATOM     96  CE  LYS A   8      -8.004  -5.294   2.564  1.00  0.00      A       
ATOM     97  CG  LYS A   8      -6.171  -5.354   0.855  1.00  0.00      A       
ATOM     98  HN  LYS A   8      -2.995  -5.691   1.127  1.00  0.00      A       
ATOM     99  HA  LYS A   8      -4.950  -7.895   1.174  1.00  0.00      A       
ATOM    100  HB2 LYS A   8      -4.800  -5.562  -0.750  1.00  0.00      A       
ATOM    101  HB1 LYS A   8      -6.052  -6.792  -0.699  1.00  0.00      A       
ATOM    102  HD2 LYS A   8      -7.817  -6.700   0.972  1.00  0.00      A       
ATOM    103  HD1 LYS A   8      -6.621  -6.892   2.258  1.00  0.00      A       
ATOM    104  HE2 LYS A   8      -7.348  -4.793   3.259  1.00  0.00      A       
ATOM    105  HE1 LYS A   8      -8.511  -4.559   1.958  1.00  0.00      A       
ATOM    106  HG2 LYS A   8      -5.494  -4.863   1.541  1.00  0.00      A       
ATOM    107  HG1 LYS A   8      -6.708  -4.611   0.285  1.00  0.00      A       
ATOM    108  HZ1 LYS A   8      -9.557  -5.426   3.956  1.00  0.00      A       
ATOM    109  HZ2 LYS A   8      -8.547  -6.791   3.917  1.00  0.00      A       
ATOM    110  HZ3 LYS A   8      -9.677  -6.540   2.678  1.00  0.00      A       
ATOM    111  N   LYS A   8      -3.500  -6.452   1.477  1.00  0.00      A       
ATOM    112  NZ  LYS A   8      -9.013  -6.069   3.330  1.00  0.00      A       
ATOM    113  O   LYS A   8      -4.143  -8.745  -1.217  1.00  0.00      A       
ATOM    114  C   CYS A   9      -0.087  -8.490  -1.142  1.00  0.00      A       
ATOM    115  CA  CYS A   9      -1.477  -8.138  -1.648  1.00  0.00      A       
ATOM    116  CB  CYS A   9      -1.342  -7.055  -2.717  1.00  0.00      A       
ATOM    117  HN  CYS A   9      -1.881  -7.097   0.141  1.00  0.00      A       
ATOM    118  HA  CYS A   9      -1.944  -9.012  -2.070  1.00  0.00      A       
ATOM    119  HB2 CYS A   9      -0.663  -6.299  -2.356  1.00  0.00      A       
ATOM    120  HB1 CYS A   9      -0.936  -7.495  -3.617  1.00  0.00      A       
ATOM    121  N   CYS A   9      -2.301  -7.639  -0.560  1.00  0.00      A       
ATOM    122  O   CYS A   9       0.204  -8.348   0.041  1.00  0.00      A       
ATOM    123  SG  CYS A   9      -2.897  -6.218  -3.159  1.00  0.00      A       
ATOM    124  C   GLN A  10       2.936  -7.854  -2.258  1.00  0.00      A       
ATOM    125  CA  GLN A  10       2.187  -9.075  -1.731  1.00  0.00      A       
ATOM    126  CB  GLN A  10       2.769 -10.362  -2.331  1.00  0.00      A       
ATOM    127  CD  GLN A  10       3.356 -11.659  -4.410  1.00  0.00      A       
ATOM    128  CG  GLN A  10       2.625 -10.460  -3.838  1.00  0.00      A       
ATOM    129  HN  GLN A  10       0.446  -9.197  -2.933  1.00  0.00      A       
ATOM    130  HA  GLN A  10       2.287  -9.109  -0.655  1.00  0.00      A       
ATOM    131  HB2 GLN A  10       3.820 -10.414  -2.090  1.00  0.00      A       
ATOM    132  HB1 GLN A  10       2.267 -11.210  -1.888  1.00  0.00      A       
ATOM    133 HE21 GLN A  10       4.754 -11.524  -3.000  1.00  0.00      A       
ATOM    134 HE22 GLN A  10       4.958 -12.807  -4.144  1.00  0.00      A       
ATOM    135  HG2 GLN A  10       1.576 -10.545  -4.083  1.00  0.00      A       
ATOM    136  HG1 GLN A  10       3.027  -9.563  -4.285  1.00  0.00      A       
ATOM    137  N   GLN A  10       0.772  -8.938  -2.044  1.00  0.00      A       
ATOM    138  NE2 GLN A  10       4.466 -12.034  -3.788  1.00  0.00      A       
ATOM    139  O   GLN A  10       4.163  -7.795  -2.233  1.00  0.00      A       
ATOM    140  OE1 GLN A  10       2.936 -12.234  -5.413  1.00  0.00      A       
ATOM    141  C   TYR A  11       3.184  -4.743  -2.123  1.00  0.00      A       
ATOM    142  CA  TYR A  11       2.719  -5.639  -3.260  1.00  0.00      A       
ATOM    143  CB  TYR A  11       1.664  -4.901  -4.095  1.00  0.00      A       
ATOM    144  CD1 TYR A  11       2.788  -3.656  -5.980  1.00  0.00      A       
ATOM    145  CD2 TYR A  11       2.026  -2.396  -4.107  1.00  0.00      A       
ATOM    146  CE1 TYR A  11       3.254  -2.499  -6.573  1.00  0.00      A       
ATOM    147  CE2 TYR A  11       2.489  -1.234  -4.694  1.00  0.00      A       
ATOM    148  CG  TYR A  11       2.169  -3.627  -4.740  1.00  0.00      A       
ATOM    149  CZ  TYR A  11       3.103  -1.292  -5.927  1.00  0.00      A       
ATOM    150  HN  TYR A  11       1.200  -7.005  -2.744  1.00  0.00      A       
ATOM    151  HA  TYR A  11       3.563  -5.881  -3.887  1.00  0.00      A       
ATOM    152  HB2 TYR A  11       1.316  -5.552  -4.881  1.00  0.00      A       
ATOM    153  HB1 TYR A  11       0.831  -4.640  -3.455  1.00  0.00      A       
ATOM    154  HD1 TYR A  11       2.907  -4.604  -6.485  1.00  0.00      A       
ATOM    155  HD2 TYR A  11       1.545  -2.354  -3.142  1.00  0.00      A       
ATOM    156  HE1 TYR A  11       3.732  -2.544  -7.541  1.00  0.00      A       
ATOM    157  HE2 TYR A  11       2.370  -0.287  -4.187  1.00  0.00      A       
ATOM    158  HH  TYR A  11       3.273  -0.114  -7.442  1.00  0.00      A       
ATOM    159  N   TYR A  11       2.168  -6.880  -2.740  1.00  0.00      A       
ATOM    160  O   TYR A  11       2.477  -4.566  -1.129  1.00  0.00      A       
ATOM    161  OH  TYR A  11       3.567  -0.139  -6.518  1.00  0.00      A       
ATOM    162  C   GLN A  12       5.254  -1.934  -1.991  1.00  0.00      A       
ATOM    163  CA  GLN A  12       4.898  -3.250  -1.307  1.00  0.00      A       
ATOM    164  CB  GLN A  12       6.114  -3.864  -0.612  1.00  0.00      A       
ATOM    165  CD  GLN A  12       8.297  -5.118  -0.875  1.00  0.00      A       
ATOM    166  CG  GLN A  12       7.216  -4.309  -1.563  1.00  0.00      A       
ATOM    167  HN  GLN A  12       4.889  -4.382  -3.080  1.00  0.00      A       
ATOM    168  HA  GLN A  12       4.126  -3.064  -0.573  1.00  0.00      A       
ATOM    169  HB2 GLN A  12       6.528  -3.133   0.067  1.00  0.00      A       
ATOM    170  HB1 GLN A  12       5.791  -4.724  -0.042  1.00  0.00      A       
ATOM    171 HE21 GLN A  12       7.975  -4.159   0.836  1.00  0.00      A       
ATOM    172 HE22 GLN A  12       9.207  -5.376   0.867  1.00  0.00      A       
ATOM    173  HG2 GLN A  12       6.780  -4.913  -2.342  1.00  0.00      A       
ATOM    174  HG1 GLN A  12       7.669  -3.430  -2.002  1.00  0.00      A       
ATOM    175  N   GLN A  12       4.362  -4.178  -2.280  1.00  0.00      A       
ATOM    176  NE2 GLN A  12       8.517  -4.861   0.401  1.00  0.00      A       
ATOM    177  O   GLN A  12       5.891  -1.924  -3.045  1.00  0.00      A       
ATOM    178  OE1 GLN A  12       8.930  -5.978  -1.492  1.00  0.00      A       
ATOM    179  C   ALA A  13       6.164   1.195  -1.235  1.00  0.00      A       
ATOM    180  CA  ALA A  13       5.044   0.483  -1.980  1.00  0.00      A       
ATOM    181  CB  ALA A  13       3.768   1.311  -1.951  1.00  0.00      A       
ATOM    182  HN  ALA A  13       4.312  -0.904  -0.561  1.00  0.00      A       
ATOM    183  HA  ALA A  13       5.338   0.352  -3.010  1.00  0.00      A       
ATOM    184  HB1 ALA A  13       3.482   1.496  -0.927  1.00  0.00      A       
ATOM    185  HB2 ALA A  13       2.979   0.770  -2.452  1.00  0.00      A       
ATOM    186  HB3 ALA A  13       3.937   2.251  -2.455  1.00  0.00      A       
ATOM    187  N   ALA A  13       4.807  -0.833  -1.409  1.00  0.00      A       
ATOM    188  O   ALA A  13       6.252   1.109  -0.012  1.00  0.00      A       
ATOM    189  C   PRO A  14       7.773   3.744  -0.441  1.00  0.00      A       
ATOM    190  CA  PRO A  14       8.184   2.608  -1.375  1.00  0.00      A       
ATOM    191  CB  PRO A  14       8.932   3.164  -2.591  1.00  0.00      A       
ATOM    192  CD  PRO A  14       6.974   2.086  -3.429  1.00  0.00      A       
ATOM    193  CG  PRO A  14       7.910   3.233  -3.674  1.00  0.00      A       
ATOM    194  HA  PRO A  14       8.824   1.924  -0.840  1.00  0.00      A       
ATOM    195  HB2 PRO A  14       9.325   4.141  -2.355  1.00  0.00      A       
ATOM    196  HB1 PRO A  14       9.740   2.499  -2.856  1.00  0.00      A       
ATOM    197  HD2 PRO A  14       5.974   2.338  -3.747  1.00  0.00      A       
ATOM    198  HD1 PRO A  14       7.323   1.200  -3.938  1.00  0.00      A       
ATOM    199  HG2 PRO A  14       7.377   4.172  -3.619  1.00  0.00      A       
ATOM    200  HG1 PRO A  14       8.387   3.128  -4.635  1.00  0.00      A       
ATOM    201  N   PRO A  14       7.034   1.910  -1.965  1.00  0.00      A       
ATOM    202  O   PRO A  14       8.565   4.197   0.390  1.00  0.00      A       
ATOM    203  C   ASP A  15       4.584   5.046   0.628  1.00  0.00      A       
ATOM    204  CA  ASP A  15       6.036   5.292   0.243  1.00  0.00      A       
ATOM    205  CB  ASP A  15       6.161   6.614  -0.508  1.00  0.00      A       
ATOM    206  CG  ASP A  15       5.816   7.807   0.358  1.00  0.00      A       
ATOM    207  HN  ASP A  15       5.944   3.785  -1.235  1.00  0.00      A       
ATOM    208  HA  ASP A  15       6.632   5.338   1.141  1.00  0.00      A       
ATOM    209  HB2 ASP A  15       7.175   6.728  -0.855  1.00  0.00      A       
ATOM    210  HB1 ASP A  15       5.492   6.602  -1.358  1.00  0.00      A       
ATOM    211  N   ASP A  15       6.537   4.199  -0.575  1.00  0.00      A       
ATOM    212  O   ASP A  15       3.841   4.391  -0.106  1.00  0.00      A       
ATOM    213  OD1 ASP A  15       6.718   8.334   1.039  1.00  0.00      A       
ATOM    214  OD2 ASP A  15       4.641   8.216   0.362  1.00  0.00      A       
ATOM    215  C   MET A  16       1.783   6.052   1.432  1.00  0.00      A       
ATOM    216  CA  MET A  16       2.835   5.360   2.292  1.00  0.00      A       
ATOM    217  CB  MET A  16       2.725   5.826   3.746  1.00  0.00      A       
ATOM    218  CE  MET A  16       3.628   9.432   5.634  1.00  0.00      A       
ATOM    219  CG  MET A  16       3.112   7.278   3.968  1.00  0.00      A       
ATOM    220  HN  MET A  16       4.810   6.139   2.285  1.00  0.00      A       
ATOM    221  HA  MET A  16       2.650   4.296   2.258  1.00  0.00      A       
ATOM    222  HB2 MET A  16       1.704   5.698   4.075  1.00  0.00      A       
ATOM    223  HB1 MET A  16       3.368   5.211   4.355  1.00  0.00      A       
ATOM    224  HE1 MET A  16       3.045  10.034   4.954  1.00  0.00      A       
ATOM    225  HE2 MET A  16       4.652   9.392   5.290  1.00  0.00      A       
ATOM    226  HE3 MET A  16       3.595   9.868   6.620  1.00  0.00      A       
ATOM    227  HG2 MET A  16       4.140   7.416   3.665  1.00  0.00      A       
ATOM    228  HG1 MET A  16       2.472   7.905   3.365  1.00  0.00      A       
ATOM    229  N   MET A  16       4.182   5.580   1.774  1.00  0.00      A       
ATOM    230  O   MET A  16       0.661   5.564   1.311  1.00  0.00      A       
ATOM    231  SD  MET A  16       2.949   7.776   5.695  1.00  0.00      A       
ATOM    232  C   ASP A  17       1.009   7.067  -1.327  1.00  0.00      A       
ATOM    233  CA  ASP A  17       1.222   7.882  -0.064  1.00  0.00      A       
ATOM    234  CB  ASP A  17       1.752   9.277  -0.416  1.00  0.00      A       
ATOM    235  CG  ASP A  17       0.842  10.028  -1.373  1.00  0.00      A       
ATOM    236  HN  ASP A  17       3.056   7.534   0.954  1.00  0.00      A       
ATOM    237  HA  ASP A  17       0.277   7.980   0.451  1.00  0.00      A       
ATOM    238  HB2 ASP A  17       1.844   9.858   0.488  1.00  0.00      A       
ATOM    239  HB1 ASP A  17       2.723   9.179  -0.876  1.00  0.00      A       
ATOM    240  N   ASP A  17       2.145   7.176   0.820  1.00  0.00      A       
ATOM    241  O   ASP A  17      -0.099   6.988  -1.853  1.00  0.00      A       
ATOM    242  OD1 ASP A  17      -0.293  10.369  -0.981  1.00  0.00      A       
ATOM    243  OD2 ASP A  17       1.267  10.303  -2.516  1.00  0.00      A       
ATOM    244  C   THR A  18       1.103   4.356  -2.634  1.00  0.00      A       
ATOM    245  CA  THR A  18       2.005   5.551  -2.938  1.00  0.00      A       
ATOM    246  CB  THR A  18       3.407   5.059  -3.339  1.00  0.00      A       
ATOM    247  CG2 THR A  18       3.363   4.294  -4.655  1.00  0.00      A       
ATOM    248  HN  THR A  18       2.940   6.559  -1.339  1.00  0.00      A       
ATOM    249  HA  THR A  18       1.586   6.109  -3.764  1.00  0.00      A       
ATOM    250  HB  THR A  18       3.776   4.397  -2.567  1.00  0.00      A       
ATOM    251  HG1 THR A  18       4.017   6.731  -4.205  1.00  0.00      A       
ATOM    252 HG21 THR A  18       4.359   3.975  -4.920  1.00  0.00      A       
ATOM    253 HG22 THR A  18       2.969   4.935  -5.430  1.00  0.00      A       
ATOM    254 HG23 THR A  18       2.726   3.429  -4.546  1.00  0.00      A       
ATOM    255  N   THR A  18       2.077   6.430  -1.787  1.00  0.00      A       
ATOM    256  O   THR A  18       0.292   3.947  -3.465  1.00  0.00      A       
ATOM    257  OG1 THR A  18       4.297   6.179  -3.459  1.00  0.00      A       
ATOM    258  C   LEU A  19      -1.064   3.134  -0.914  1.00  0.00      A       
ATOM    259  CA  LEU A  19       0.399   2.704  -0.991  1.00  0.00      A       
ATOM    260  CB  LEU A  19       0.861   2.175   0.371  1.00  0.00      A       
ATOM    261  CD1 LEU A  19       0.352  -0.246  -0.053  1.00  0.00      A       
ATOM    262  CD2 LEU A  19       0.509   0.597   2.295  1.00  0.00      A       
ATOM    263  CG  LEU A  19       0.108   0.937   0.869  1.00  0.00      A       
ATOM    264  HN  LEU A  19       1.904   4.181  -0.806  1.00  0.00      A       
ATOM    265  HA  LEU A  19       0.492   1.916  -1.726  1.00  0.00      A       
ATOM    266  HB2 LEU A  19       1.912   1.933   0.301  1.00  0.00      A       
ATOM    267  HB1 LEU A  19       0.737   2.961   1.101  1.00  0.00      A       
ATOM    268 HD11 LEU A  19       1.402  -0.496  -0.049  1.00  0.00      A       
ATOM    269 HD12 LEU A  19       0.047   0.012  -1.055  1.00  0.00      A       
ATOM    270 HD13 LEU A  19      -0.223  -1.094   0.291  1.00  0.00      A       
ATOM    271 HD21 LEU A  19      -0.055  -0.260   2.631  1.00  0.00      A       
ATOM    272 HD22 LEU A  19       0.301   1.440   2.938  1.00  0.00      A       
ATOM    273 HD23 LEU A  19       1.565   0.369   2.328  1.00  0.00      A       
ATOM    274  HG  LEU A  19      -0.952   1.146   0.860  1.00  0.00      A       
ATOM    275  N   LEU A  19       1.231   3.818  -1.423  1.00  0.00      A       
ATOM    276  O   LEU A  19      -1.961   2.371  -1.266  1.00  0.00      A       
ATOM    277  C   GLN A  20      -3.271   5.013  -1.759  1.00  0.00      A       
ATOM    278  CA  GLN A  20      -2.638   4.911  -0.369  1.00  0.00      A       
ATOM    279  CB  GLN A  20      -2.605   6.280   0.319  1.00  0.00      A       
ATOM    280  CD  GLN A  20      -4.906   6.003   1.352  1.00  0.00      A       
ATOM    281  CG  GLN A  20      -3.979   6.895   0.542  1.00  0.00      A       
ATOM    282  HN  GLN A  20      -0.531   4.920  -0.179  1.00  0.00      A       
ATOM    283  HA  GLN A  20      -3.228   4.231   0.230  1.00  0.00      A       
ATOM    284  HB2 GLN A  20      -2.123   6.173   1.281  1.00  0.00      A       
ATOM    285  HB1 GLN A  20      -2.027   6.958  -0.289  1.00  0.00      A       
ATOM    286 HE21 GLN A  20      -5.609   5.184  -0.317  1.00  0.00      A       
ATOM    287 HE22 GLN A  20      -6.294   4.601   1.163  1.00  0.00      A       
ATOM    288  HG2 GLN A  20      -3.859   7.831   1.069  1.00  0.00      A       
ATOM    289  HG1 GLN A  20      -4.433   7.085  -0.420  1.00  0.00      A       
ATOM    290  N   GLN A  20      -1.292   4.364  -0.464  1.00  0.00      A       
ATOM    291  NE2 GLN A  20      -5.680   5.176   0.666  1.00  0.00      A       
ATOM    292  O   GLN A  20      -4.477   4.817  -1.918  1.00  0.00      A       
ATOM    293  OE1 GLN A  20      -4.936   6.064   2.582  1.00  0.00      A       
ATOM    294  C   ILE A  21      -3.155   3.935  -4.671  1.00  0.00      A       
ATOM    295  CA  ILE A  21      -2.911   5.351  -4.143  1.00  0.00      A       
ATOM    296  CB  ILE A  21      -1.888   6.079  -5.045  1.00  0.00      A       
ATOM    297  CD1 ILE A  21      -0.610   8.271  -5.316  1.00  0.00      A       
ATOM    298  CG1 ILE A  21      -1.674   7.511  -4.552  1.00  0.00      A       
ATOM    299  CG2 ILE A  21      -2.351   6.082  -6.495  1.00  0.00      A       
ATOM    300  HN  ILE A  21      -1.508   5.499  -2.563  1.00  0.00      A       
ATOM    301  HA  ILE A  21      -3.842   5.902  -4.167  1.00  0.00      A       
ATOM    302  HB  ILE A  21      -0.951   5.547  -4.994  1.00  0.00      A       
ATOM    303 HD11 ILE A  21      -0.533   9.275  -4.924  1.00  0.00      A       
ATOM    304 HD12 ILE A  21      -0.876   8.313  -6.362  1.00  0.00      A       
ATOM    305 HD13 ILE A  21       0.340   7.768  -5.207  1.00  0.00      A       
ATOM    306 HG12 ILE A  21      -2.601   8.058  -4.642  1.00  0.00      A       
ATOM    307 HG11 ILE A  21      -1.379   7.483  -3.513  1.00  0.00      A       
ATOM    308 HG21 ILE A  21      -1.605   6.565  -7.110  1.00  0.00      A       
ATOM    309 HG22 ILE A  21      -3.284   6.621  -6.572  1.00  0.00      A       
ATOM    310 HG23 ILE A  21      -2.494   5.066  -6.831  1.00  0.00      A       
ATOM    311  N   ILE A  21      -2.450   5.304  -2.759  1.00  0.00      A       
ATOM    312  O   ILE A  21      -4.083   3.697  -5.449  1.00  0.00      A       
ATOM    313  C   HIS A  22      -3.777   1.029  -4.086  1.00  0.00      A       
ATOM    314  CA  HIS A  22      -2.451   1.596  -4.597  1.00  0.00      A       
ATOM    315  CB  HIS A  22      -1.263   0.793  -4.039  1.00  0.00      A       
ATOM    316  CD2 HIS A  22      -1.763  -1.586  -3.157  1.00  0.00      A       
ATOM    317  CE1 HIS A  22      -1.440  -2.725  -4.969  1.00  0.00      A       
ATOM    318  CG  HIS A  22      -1.420  -0.698  -4.121  1.00  0.00      A       
ATOM    319  HN  HIS A  22      -1.575   3.270  -3.647  1.00  0.00      A       
ATOM    320  HA  HIS A  22      -2.442   1.532  -5.676  1.00  0.00      A       
ATOM    321  HB2 HIS A  22      -0.371   1.060  -4.589  1.00  0.00      A       
ATOM    322  HB1 HIS A  22      -1.124   1.054  -3.000  1.00  0.00      A       
ATOM    323  HD1 HIS A  22      -0.963  -1.086  -6.153  1.00  0.00      A       
ATOM    324  HD2 HIS A  22      -1.997  -1.347  -2.131  1.00  0.00      A       
ATOM    325  HE1 HIS A  22      -1.353  -3.540  -5.673  1.00  0.00      A       
ATOM    326  N   HIS A  22      -2.316   3.002  -4.233  1.00  0.00      A       
ATOM    327  ND1 HIS A  22      -1.221  -1.439  -5.265  1.00  0.00      A       
ATOM    328  NE2 HIS A  22      -1.774  -2.870  -3.699  1.00  0.00      A       
ATOM    329  O   HIS A  22      -4.576   0.506  -4.863  1.00  0.00      A       
ATOM    330  C   VAL A  23      -6.440   1.459  -2.595  1.00  0.00      A       
ATOM    331  CA  VAL A  23      -5.229   0.638  -2.165  1.00  0.00      A       
ATOM    332  CB  VAL A  23      -5.132   0.612  -0.619  1.00  0.00      A       
ATOM    333  CG1 VAL A  23      -4.081  -0.389  -0.168  1.00  0.00      A       
ATOM    334  CG2 VAL A  23      -4.814   1.987  -0.063  1.00  0.00      A       
ATOM    335  HN  VAL A  23      -3.328   1.583  -2.214  1.00  0.00      A       
ATOM    336  HA  VAL A  23      -5.372  -0.378  -2.501  1.00  0.00      A       
ATOM    337  HB  VAL A  23      -6.088   0.300  -0.222  1.00  0.00      A       
ATOM    338 HG11 VAL A  23      -3.117  -0.104  -0.567  1.00  0.00      A       
ATOM    339 HG12 VAL A  23      -4.342  -1.373  -0.526  1.00  0.00      A       
ATOM    340 HG13 VAL A  23      -4.035  -0.400   0.912  1.00  0.00      A       
ATOM    341 HG21 VAL A  23      -5.587   2.680  -0.353  1.00  0.00      A       
ATOM    342 HG22 VAL A  23      -3.863   2.319  -0.453  1.00  0.00      A       
ATOM    343 HG23 VAL A  23      -4.763   1.935   1.015  1.00  0.00      A       
ATOM    344  N   VAL A  23      -4.004   1.144  -2.780  1.00  0.00      A       
ATOM    345  O   VAL A  23      -7.510   0.906  -2.849  1.00  0.00      A       
ATOM    346  C   MET A  24      -8.474   3.543  -2.030  1.00  0.00      A       
ATOM    347  CA  MET A  24      -7.325   3.708  -3.026  1.00  0.00      A       
ATOM    348  CB  MET A  24      -7.814   3.511  -4.466  1.00  0.00      A       
ATOM    349  CE  MET A  24      -8.982   7.346  -5.634  1.00  0.00      A       
ATOM    350  CG  MET A  24      -8.648   4.671  -4.988  1.00  0.00      A       
ATOM    351  HN  MET A  24      -5.343   3.133  -2.567  1.00  0.00      A       
ATOM    352  HA  MET A  24      -6.928   4.708  -2.926  1.00  0.00      A       
ATOM    353  HB2 MET A  24      -6.958   3.387  -5.112  1.00  0.00      A       
ATOM    354  HB1 MET A  24      -8.417   2.617  -4.510  1.00  0.00      A       
ATOM    355  HE1 MET A  24      -8.571   8.341  -5.709  1.00  0.00      A       
ATOM    356  HE2 MET A  24      -9.814   7.353  -4.947  1.00  0.00      A       
ATOM    357  HE3 MET A  24      -9.321   7.022  -6.608  1.00  0.00      A       
ATOM    358  HG2 MET A  24      -8.979   4.435  -5.988  1.00  0.00      A       
ATOM    359  HG1 MET A  24      -9.507   4.795  -4.345  1.00  0.00      A       
ATOM    360  N   MET A  24      -6.247   2.775  -2.706  1.00  0.00      A       
ATOM    361  O   MET A  24      -9.593   3.177  -2.397  1.00  0.00      A       
ATOM    362  SD  MET A  24      -7.724   6.220  -5.036  1.00  0.00      A       
ATOM    363  C   GLU A  25      -9.520   2.161   0.476  1.00  0.00      A       
ATOM    364  CA  GLU A  25      -9.102   3.624   0.348  1.00  0.00      A       
ATOM    365  CB  GLU A  25     -10.324   4.524   0.188  1.00  0.00      A       
ATOM    366  CD  GLU A  25     -11.194   6.897   0.215  1.00  0.00      A       
ATOM    367  CG  GLU A  25      -9.977   6.004   0.123  1.00  0.00      A       
ATOM    368  HN  GLU A  25      -7.260   4.121  -0.560  1.00  0.00      A       
ATOM    369  HA  GLU A  25      -8.583   3.905   1.255  1.00  0.00      A       
ATOM    370  HB2 GLU A  25     -10.835   4.250  -0.719  1.00  0.00      A       
ATOM    371  HB1 GLU A  25     -10.984   4.365   1.027  1.00  0.00      A       
ATOM    372  HG2 GLU A  25      -9.317   6.240   0.943  1.00  0.00      A       
ATOM    373  HG1 GLU A  25      -9.474   6.201  -0.812  1.00  0.00      A       
ATOM    374  N   GLU A  25      -8.161   3.801  -0.760  1.00  0.00      A       
ATOM    375  O   GLU A  25      -8.966   1.290  -0.193  1.00  0.00      A       
ATOM    376  OE1 GLU A  25     -11.749   7.049   1.323  1.00  0.00      A       
ATOM    377  OE2 GLU A  25     -11.612   7.443  -0.827  1.00  0.00      A       
ATOM    378  C   PHE A  26     -12.375   0.397   1.805  1.00  0.00      A       
ATOM    379  CA  PHE A  26     -10.867   0.501   1.619  1.00  0.00      A       
ATOM    380  CB  PHE A  26     -10.160  -0.017   2.882  1.00  0.00      A       
ATOM    381  CD1 PHE A  26      -7.679   0.050   2.457  1.00  0.00      A       
ATOM    382  CD2 PHE A  26      -8.630   1.666   3.930  1.00  0.00      A       
ATOM    383  CE1 PHE A  26      -6.431   0.611   2.651  1.00  0.00      A       
ATOM    384  CE2 PHE A  26      -7.387   2.230   4.125  1.00  0.00      A       
ATOM    385  CG  PHE A  26      -8.792   0.571   3.097  1.00  0.00      A       
ATOM    386  CZ  PHE A  26      -6.284   1.701   3.485  1.00  0.00      A       
ATOM    387  HN  PHE A  26     -10.931   2.613   1.828  1.00  0.00      A       
ATOM    388  HA  PHE A  26     -10.573  -0.103   0.775  1.00  0.00      A       
ATOM    389  HB2 PHE A  26     -10.763   0.225   3.745  1.00  0.00      A       
ATOM    390  HB1 PHE A  26     -10.055  -1.090   2.812  1.00  0.00      A       
ATOM    391  HD1 PHE A  26      -7.788  -0.801   1.797  1.00  0.00      A       
ATOM    392  HD2 PHE A  26      -9.490   2.081   4.433  1.00  0.00      A       
ATOM    393  HE1 PHE A  26      -5.570   0.198   2.146  1.00  0.00      A       
ATOM    394  HE2 PHE A  26      -7.278   3.085   4.773  1.00  0.00      A       
ATOM    395  HZ  PHE A  26      -5.310   2.140   3.636  1.00  0.00      A       
ATOM    396  N   PHE A  26     -10.476   1.879   1.352  1.00  0.00      A       
ATOM    397  O   PHE A  26     -13.092   1.396   1.748  1.00  0.00      A       
ATOM    398  C   ILE A  27     -14.423  -1.288   3.824  1.00  0.00      A       
ATOM    399  CA  ILE A  27     -14.260  -1.049   2.324  1.00  0.00      A       
ATOM    400  CB  ILE A  27     -14.801  -2.268   1.537  1.00  0.00      A       
ATOM    401  CD1 ILE A  27     -14.646  -3.478  -0.703  1.00  0.00      A       
ATOM    402  CG1 ILE A  27     -14.255  -2.259   0.108  1.00  0.00      A       
ATOM    403  CG2 ILE A  27     -16.325  -2.249   1.507  1.00  0.00      A       
ATOM    404  HN  ILE A  27     -12.238  -1.581   2.020  1.00  0.00      A       
ATOM    405  HA  ILE A  27     -14.819  -0.171   2.036  1.00  0.00      A       
ATOM    406  HB  ILE A  27     -14.482  -3.171   2.035  1.00  0.00      A       
ATOM    407 HD11 ILE A  27     -14.253  -3.386  -1.705  1.00  0.00      A       
ATOM    408 HD12 ILE A  27     -15.724  -3.552  -0.746  1.00  0.00      A       
ATOM    409 HD13 ILE A  27     -14.244  -4.365  -0.238  1.00  0.00      A       
ATOM    410 HG12 ILE A  27     -14.628  -1.386  -0.407  1.00  0.00      A       
ATOM    411 HG11 ILE A  27     -13.176  -2.217   0.143  1.00  0.00      A       
ATOM    412 HG21 ILE A  27     -16.664  -1.356   1.003  1.00  0.00      A       
ATOM    413 HG22 ILE A  27     -16.705  -2.256   2.519  1.00  0.00      A       
ATOM    414 HG23 ILE A  27     -16.687  -3.119   0.981  1.00  0.00      A       
ATOM    415  N   ILE A  27     -12.851  -0.818   2.038  1.00  0.00      A       
ATOM    416  O   ILE A  27     -15.425  -1.833   4.290  1.00  0.00      A       
ATOM    417  C   GLU A  28     -13.282   0.252   6.737  1.00  0.00      A       
ATOM    418  CA  GLU A  28     -13.386  -1.084   6.008  1.00  0.00      A       
ATOM    419  CB  GLU A  28     -12.197  -1.984   6.354  1.00  0.00      A       
ATOM    420  CD  GLU A  28     -10.943  -4.057   5.625  1.00  0.00      A       
ATOM    421  CG  GLU A  28     -12.284  -3.363   5.720  1.00  0.00      A       
ATOM    422  HN  GLU A  28     -12.679  -0.390   4.150  1.00  0.00      A       
ATOM    423  HA  GLU A  28     -14.304  -1.577   6.299  1.00  0.00      A       
ATOM    424  HB2 GLU A  28     -11.289  -1.509   6.014  1.00  0.00      A       
ATOM    425  HB1 GLU A  28     -12.150  -2.105   7.427  1.00  0.00      A       
ATOM    426  HG2 GLU A  28     -12.945  -3.975   6.315  1.00  0.00      A       
ATOM    427  HG1 GLU A  28     -12.691  -3.260   4.725  1.00  0.00      A       
ATOM    428  N   GLU A  28     -13.419  -0.869   4.573  1.00  0.00      A       
ATOM    429  OT1 GLU A  28     -14.249   1.040   6.677  1.00  0.00      A       
ATOM    430  OT2 GLU A  28     -12.240   0.510   7.371  1.00  0.00      A       
ATOM    431  OE1 GLU A  28     -10.388  -4.454   6.671  1.00  0.00      A       
ATOM    432  OE2 GLU A  28     -10.436  -4.217   4.498  1.00  0.00      A       
TER
ATOM    433  ZN   ZN B  29      -3.412  -3.852  -2.717  1.00  0.00      B       
END


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