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
385326 1kzs 5283 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ACE A  33      18.808  -1.660   5.112  1.00  0.00      A       
ATOM      2  CH3 ACE A  33      19.713  -0.432   5.233  1.00  0.00      A       
ATOM      3  H1  ACE A  33      20.709  -0.745   5.515  1.00  0.00      A       
ATOM      4  H2  ACE A  33      19.319   0.233   5.987  1.00  0.00      A       
ATOM      5  H3  ACE A  33      19.753   0.081   4.285  1.00  0.00      A       
ATOM      6  O   ACE A  33      17.644  -1.621   5.456  1.00  0.00      A       
ATOM      7  C   PHE A  34      17.247  -3.676   3.663  1.00  0.00      A       
ATOM      8  CA  PHE A  34      18.502  -3.980   4.482  1.00  0.00      A       
ATOM      9  CB  PHE A  34      18.131  -4.372   5.912  1.00  0.00      A       
ATOM     10  CD1 PHE A  34      19.800  -6.197   6.401  1.00  0.00      A       
ATOM     11  CD2 PHE A  34      20.052  -4.055   7.512  1.00  0.00      A       
ATOM     12  CE1 PHE A  34      20.938  -6.673   7.064  1.00  0.00      A       
ATOM     13  CE2 PHE A  34      21.191  -4.532   8.174  1.00  0.00      A       
ATOM     14  CG  PHE A  34      19.357  -4.887   6.626  1.00  0.00      A       
ATOM     15  CZ  PHE A  34      21.632  -5.841   7.950  1.00  0.00      A       
ATOM     16  HN  PHE A  34      20.276  -2.761   4.353  1.00  0.00      A       
ATOM     17  HA  PHE A  34      19.069  -4.769   4.021  1.00  0.00      A       
ATOM     18  HB2 PHE A  34      17.746  -3.508   6.434  1.00  0.00      A       
ATOM     19  HB1 PHE A  34      17.376  -5.144   5.889  1.00  0.00      A       
ATOM     20  HD1 PHE A  34      19.264  -6.838   5.718  1.00  0.00      A       
ATOM     21  HD2 PHE A  34      19.710  -3.045   7.685  1.00  0.00      A       
ATOM     22  HE1 PHE A  34      21.279  -7.683   6.891  1.00  0.00      A       
ATOM     23  HE2 PHE A  34      21.726  -3.890   8.857  1.00  0.00      A       
ATOM     24  HZ  PHE A  34      22.510  -6.210   8.460  1.00  0.00      A       
ATOM     25  N   PHE A  34      19.334  -2.751   4.625  1.00  0.00      A       
ATOM     26  O   PHE A  34      16.145  -3.790   4.155  1.00  0.00      A       
ATOM     27  C   PRO A  35      15.428  -4.222   1.356  1.00  0.00      A       
ATOM     28  CA  PRO A  35      16.298  -2.979   1.565  1.00  0.00      A       
ATOM     29  CB  PRO A  35      16.929  -2.538   0.250  1.00  0.00      A       
ATOM     30  CD  PRO A  35      18.713  -3.319   1.663  1.00  0.00      A       
ATOM     31  CG  PRO A  35      18.269  -3.194   0.230  1.00  0.00      A       
ATOM     32  HA  PRO A  35      15.718  -2.174   1.985  1.00  0.00      A       
ATOM     33  HB2 PRO A  35      16.332  -2.874  -0.585  1.00  0.00      A       
ATOM     34  HB1 PRO A  35      17.036  -1.463   0.227  1.00  0.00      A       
ATOM     35  HD2 PRO A  35      19.235  -4.253   1.816  1.00  0.00      A       
ATOM     36  HD1 PRO A  35      19.342  -2.485   1.938  1.00  0.00      A       
ATOM     37  HG2 PRO A  35      18.192  -4.174  -0.219  1.00  0.00      A       
ATOM     38  HG1 PRO A  35      18.970  -2.588  -0.323  1.00  0.00      A       
ATOM     39  N   PRO A  35      17.461  -3.297   2.434  1.00  0.00      A       
ATOM     40  O   PRO A  35      14.314  -4.136   0.878  1.00  0.00      A       
ATOM     41  C   ARG A  36      13.830  -6.546   2.336  1.00  0.00      A       
ATOM     42  CA  ARG A  36      15.123  -6.620   1.522  1.00  0.00      A       
ATOM     43  CB  ARG A  36      16.016  -7.752   2.032  1.00  0.00      A       
ATOM     44  CD  ARG A  36      16.200 -10.228   2.320  1.00  0.00      A       
ATOM     45  CG  ARG A  36      15.321  -9.094   1.792  1.00  0.00      A       
ATOM     46  CZ  ARG A  36      18.571  -9.842   2.020  1.00  0.00      A       
ATOM     47  HN  ARG A  36      16.828  -5.426   2.088  1.00  0.00      A       
ATOM     48  HA  ARG A  36      14.901  -6.770   0.479  1.00  0.00      A       
ATOM     49  HB2 ARG A  36      16.958  -7.734   1.504  1.00  0.00      A       
ATOM     50  HB1 ARG A  36      16.193  -7.622   3.090  1.00  0.00      A       
ATOM     51  HD2 ARG A  36      16.445 -10.061   3.358  1.00  0.00      A       
ATOM     52  HD1 ARG A  36      15.703 -11.179   2.198  1.00  0.00      A       
ATOM     53  HE  ARG A  36      17.385 -10.399   0.529  1.00  0.00      A       
ATOM     54  HG2 ARG A  36      14.371  -9.104   2.308  1.00  0.00      A       
ATOM     55  HG1 ARG A  36      15.156  -9.229   0.733  1.00  0.00      A       
ATOM     56 HH11 ARG A  36      18.363 -11.062   3.591  1.00  0.00      A       
ATOM     57 HH12 ARG A  36      19.821 -10.130   3.556  1.00  0.00      A       
ATOM     58 HH21 ARG A  36      19.046  -8.540   0.573  1.00  0.00      A       
ATOM     59 HH22 ARG A  36      20.208  -8.701   1.847  1.00  0.00      A       
ATOM     60  N   ARG A  36      15.926  -5.376   1.707  1.00  0.00      A       
ATOM     61  NE  ARG A  36      17.432 -10.178   1.483  1.00  0.00      A       
ATOM     62  NH1 ARG A  36      18.948 -10.387   3.143  1.00  0.00      A       
ATOM     63  NH2 ARG A  36      19.334  -8.959   1.434  1.00  0.00      A       
ATOM     64  O   ARG A  36      12.788  -6.997   1.905  1.00  0.00      A       
ATOM     65  C   ILE A  37      11.653  -4.930   3.690  1.00  0.00      A       
ATOM     66  CA  ILE A  37      12.658  -5.881   4.348  1.00  0.00      A       
ATOM     67  CB  ILE A  37      13.131  -5.323   5.695  1.00  0.00      A       
ATOM     68  CD1 ILE A  37      13.774  -3.250   6.935  1.00  0.00      A       
ATOM     69  CG1 ILE A  37      13.405  -3.823   5.565  1.00  0.00      A       
ATOM     70  CG2 ILE A  37      14.415  -6.039   6.122  1.00  0.00      A       
ATOM     71  HN  ILE A  37      14.739  -5.624   3.838  1.00  0.00      A       
ATOM     72  HA  ILE A  37      12.218  -6.856   4.487  1.00  0.00      A       
ATOM     73  HB  ILE A  37      12.365  -5.486   6.438  1.00  0.00      A       
ATOM     74 HD11 ILE A  37      14.291  -2.311   6.805  1.00  0.00      A       
ATOM     75 HD12 ILE A  37      14.417  -3.944   7.456  1.00  0.00      A       
ATOM     76 HD13 ILE A  37      12.875  -3.089   7.513  1.00  0.00      A       
ATOM     77 HG12 ILE A  37      14.221  -3.665   4.878  1.00  0.00      A       
ATOM     78 HG11 ILE A  37      12.521  -3.327   5.194  1.00  0.00      A       
ATOM     79 HG21 ILE A  37      14.640  -6.826   5.417  1.00  0.00      A       
ATOM     80 HG22 ILE A  37      14.280  -6.466   7.105  1.00  0.00      A       
ATOM     81 HG23 ILE A  37      15.231  -5.333   6.145  1.00  0.00      A       
ATOM     82  N   ILE A  37      13.888  -5.981   3.510  1.00  0.00      A       
ATOM     83  O   ILE A  37      10.524  -4.808   4.120  1.00  0.00      A       
ATOM     84  C   TRP A  38       9.878  -4.047   1.487  1.00  0.00      A       
ATOM     85  CA  TRP A  38      11.134  -3.311   1.962  1.00  0.00      A       
ATOM     86  CB  TRP A  38      11.930  -2.781   0.768  1.00  0.00      A       
ATOM     87  CD1 TRP A  38      11.182  -0.423   0.254  1.00  0.00      A       
ATOM     88  CD2 TRP A  38      10.129  -1.958  -1.008  1.00  0.00      A       
ATOM     89  CE2 TRP A  38       9.620  -0.696  -1.395  1.00  0.00      A       
ATOM     90  CE3 TRP A  38       9.628  -3.102  -1.655  1.00  0.00      A       
ATOM     91  CG  TRP A  38      11.119  -1.756   0.041  1.00  0.00      A       
ATOM     92  CH2 TRP A  38       8.161  -1.719  -3.022  1.00  0.00      A       
ATOM     93  CZ2 TRP A  38       8.647  -0.572  -2.388  1.00  0.00      A       
ATOM     94  CZ3 TRP A  38       8.649  -2.981  -2.656  1.00  0.00      A       
ATOM     95  HN  TRP A  38      12.976  -4.368   2.321  1.00  0.00      A       
ATOM     96  HA  TRP A  38      10.870  -2.497   2.618  1.00  0.00      A       
ATOM     97  HB2 TRP A  38      12.847  -2.331   1.119  1.00  0.00      A       
ATOM     98  HB1 TRP A  38      12.163  -3.596   0.099  1.00  0.00      A       
ATOM     99  HD1 TRP A  38      11.821   0.070   0.972  1.00  0.00      A       
ATOM    100  HE1 TRP A  38      10.144   1.176  -0.643  1.00  0.00      A       
ATOM    101  HE3 TRP A  38       9.997  -4.079  -1.381  1.00  0.00      A       
ATOM    102  HH2 TRP A  38       7.409  -1.633  -3.792  1.00  0.00      A       
ATOM    103  HZ2 TRP A  38       8.275   0.403  -2.667  1.00  0.00      A       
ATOM    104  HZ3 TRP A  38       8.271  -3.865  -3.147  1.00  0.00      A       
ATOM    105  N   TRP A  38      12.060  -4.255   2.650  1.00  0.00      A       
ATOM    106  NE1 TRP A  38      10.293   0.208  -0.597  1.00  0.00      A       
ATOM    107  O   TRP A  38       8.811  -3.473   1.390  1.00  0.00      A       
ATOM    108  C   LEU A  39       7.705  -6.061   1.790  1.00  0.00      A       
ATOM    109  CA  LEU A  39       8.802  -6.079   0.723  1.00  0.00      A       
ATOM    110  CB  LEU A  39       9.308  -7.505   0.497  1.00  0.00      A       
ATOM    111  CD1 LEU A  39       7.934  -8.003  -1.528  1.00  0.00      A       
ATOM    112  CD2 LEU A  39       8.547  -9.842   0.047  1.00  0.00      A       
ATOM    113  CG  LEU A  39       8.171  -8.363  -0.061  1.00  0.00      A       
ATOM    114  HN  LEU A  39      10.863  -5.759   1.274  1.00  0.00      A       
ATOM    115  HA  LEU A  39       8.433  -5.670  -0.202  1.00  0.00      A       
ATOM    116  HB2 LEU A  39      10.126  -7.488  -0.209  1.00  0.00      A       
ATOM    117  HB1 LEU A  39       9.648  -7.919   1.434  1.00  0.00      A       
ATOM    118 HD11 LEU A  39       8.884  -7.888  -2.029  1.00  0.00      A       
ATOM    119 HD12 LEU A  39       7.383  -7.075  -1.586  1.00  0.00      A       
ATOM    120 HD13 LEU A  39       7.369  -8.788  -2.005  1.00  0.00      A       
ATOM    121 HD21 LEU A  39       9.543  -9.989  -0.345  1.00  0.00      A       
ATOM    122 HD22 LEU A  39       7.846 -10.435  -0.521  1.00  0.00      A       
ATOM    123 HD23 LEU A  39       8.520 -10.147   1.084  1.00  0.00      A       
ATOM    124  HG  LEU A  39       7.270  -8.179   0.506  1.00  0.00      A       
ATOM    125  N   LEU A  39       9.993  -5.313   1.190  1.00  0.00      A       
ATOM    126  O   LEU A  39       6.529  -6.050   1.484  1.00  0.00      A       
ATOM    127  C   HIS A  40       6.193  -4.781   4.012  1.00  0.00      A       
ATOM    128  CA  HIS A  40       7.057  -6.039   4.125  1.00  0.00      A       
ATOM    129  CB  HIS A  40       7.860  -6.024   5.426  1.00  0.00      A       
ATOM    130  CD2 HIS A  40       8.382  -8.487   6.181  1.00  0.00      A       
ATOM    131  CE1 HIS A  40      10.316  -8.704   5.229  1.00  0.00      A       
ATOM    132  CG  HIS A  40       8.645  -7.301   5.541  1.00  0.00      A       
ATOM    133  HN  HIS A  40       9.033  -6.065   3.261  1.00  0.00      A       
ATOM    134  HA  HIS A  40       6.444  -6.924   4.080  1.00  0.00      A       
ATOM    135  HB2 HIS A  40       8.538  -5.183   5.422  1.00  0.00      A       
ATOM    136  HB1 HIS A  40       7.186  -5.939   6.265  1.00  0.00      A       
ATOM    137  HD1 HIS A  40      10.357  -6.794   4.403  1.00  0.00      A       
ATOM    138  HD2 HIS A  40       7.490  -8.700   6.751  1.00  0.00      A       
ATOM    139  HE1 HIS A  40      11.258  -9.111   4.892  1.00  0.00      A       
ATOM    140  N   HIS A  40       8.081  -6.057   3.039  1.00  0.00      A       
ATOM    141  ND1 HIS A  40       9.883  -7.463   4.940  1.00  0.00      A       
ATOM    142  NE2 HIS A  40       9.437  -9.372   5.983  1.00  0.00      A       
ATOM    143  O   HIS A  40       5.014  -4.798   4.308  1.00  0.00      A       
ATOM    144  C   ASN A  41       4.762  -2.675   2.553  1.00  0.00      A       
ATOM    145  CA  ASN A  41       5.980  -2.435   3.449  1.00  0.00      A       
ATOM    146  CB  ASN A  41       6.936  -1.441   2.793  1.00  0.00      A       
ATOM    147  CG  ASN A  41       8.094  -1.145   3.749  1.00  0.00      A       
ATOM    148  HN  ASN A  41       7.720  -3.701   3.348  1.00  0.00      A       
ATOM    149  HA  ASN A  41       5.674  -2.073   4.416  1.00  0.00      A       
ATOM    150  HB2 ASN A  41       7.325  -1.864   1.878  1.00  0.00      A       
ATOM    151  HB1 ASN A  41       6.409  -0.526   2.572  1.00  0.00      A       
ATOM    152 HD21 ASN A  41       6.932  -1.054   5.356  1.00  0.00      A       
ATOM    153 HD22 ASN A  41       8.586  -0.797   5.641  1.00  0.00      A       
ATOM    154  N   ASN A  41       6.769  -3.693   3.583  1.00  0.00      A       
ATOM    155  ND2 ASN A  41       7.851  -0.985   5.021  1.00  0.00      A       
ATOM    156  O   ASN A  41       3.670  -2.220   2.834  1.00  0.00      A       
ATOM    157  OD1 ASN A  41       9.233  -1.060   3.334  1.00  0.00      A       
ATOM    158  C   LEU A  42       2.610  -4.218   1.337  1.00  0.00      A       
ATOM    159  CA  LEU A  42       3.803  -3.662   0.556  1.00  0.00      A       
ATOM    160  CB  LEU A  42       4.331  -4.712  -0.424  1.00  0.00      A       
ATOM    161  CD1 LEU A  42       5.942  -5.123  -2.287  1.00  0.00      A       
ATOM    162  CD2 LEU A  42       5.193  -2.796  -1.778  1.00  0.00      A       
ATOM    163  CG  LEU A  42       5.545  -4.155  -1.171  1.00  0.00      A       
ATOM    164  HN  LEU A  42       5.834  -3.742   1.272  1.00  0.00      A       
ATOM    165  HA  LEU A  42       3.524  -2.768   0.022  1.00  0.00      A       
ATOM    166  HB2 LEU A  42       4.621  -5.597   0.122  1.00  0.00      A       
ATOM    167  HB1 LEU A  42       3.556  -4.964  -1.133  1.00  0.00      A       
ATOM    168 HD11 LEU A  42       7.014  -5.256  -2.284  1.00  0.00      A       
ATOM    169 HD12 LEU A  42       5.633  -4.721  -3.241  1.00  0.00      A       
ATOM    170 HD13 LEU A  42       5.462  -6.077  -2.125  1.00  0.00      A       
ATOM    171 HD21 LEU A  42       5.825  -2.609  -2.633  1.00  0.00      A       
ATOM    172 HD22 LEU A  42       5.346  -2.021  -1.041  1.00  0.00      A       
ATOM    173 HD23 LEU A  42       4.158  -2.797  -2.089  1.00  0.00      A       
ATOM    174  HG  LEU A  42       6.370  -4.040  -0.486  1.00  0.00      A       
ATOM    175  N   LEU A  42       4.943  -3.387   1.476  1.00  0.00      A       
ATOM    176  O   LEU A  42       1.469  -3.929   1.037  1.00  0.00      A       
ATOM    177  C   GLY A  43       0.885  -4.487   3.716  1.00  0.00      A       
ATOM    178  CA  GLY A  43       1.748  -5.605   3.129  1.00  0.00      A       
ATOM    179  HN  GLY A  43       3.794  -5.246   2.555  1.00  0.00      A       
ATOM    180  HA2 GLY A  43       1.141  -6.229   2.490  1.00  0.00      A       
ATOM    181  HA1 GLY A  43       2.154  -6.204   3.932  1.00  0.00      A       
ATOM    182  N   GLY A  43       2.866  -5.022   2.334  1.00  0.00      A       
ATOM    183  O   GLY A  43      -0.276  -4.682   4.016  1.00  0.00      A       
ATOM    184  C   GLN A  44      -0.399  -1.705   3.450  1.00  0.00      A       
ATOM    185  CA  GLN A  44       0.640  -2.196   4.463  1.00  0.00      A       
ATOM    186  CB  GLN A  44       1.656  -1.095   4.765  1.00  0.00      A       
ATOM    187  CD  GLN A  44       1.898   1.273   5.530  1.00  0.00      A       
ATOM    188  CG  GLN A  44       0.946   0.079   5.445  1.00  0.00      A       
ATOM    189  HN  GLN A  44       2.379  -3.178   3.647  1.00  0.00      A       
ATOM    190  HA  GLN A  44       0.156  -2.509   5.374  1.00  0.00      A       
ATOM    191  HB2 GLN A  44       2.422  -1.481   5.423  1.00  0.00      A       
ATOM    192  HB1 GLN A  44       2.108  -0.757   3.845  1.00  0.00      A       
ATOM    193 HE21 GLN A  44       1.915   1.302   7.516  1.00  0.00      A       
ATOM    194 HE22 GLN A  44       2.864   2.492   6.765  1.00  0.00      A       
ATOM    195  HG2 GLN A  44       0.075   0.353   4.870  1.00  0.00      A       
ATOM    196  HG1 GLN A  44       0.643  -0.212   6.440  1.00  0.00      A       
ATOM    197  N   GLN A  44       1.439  -3.318   3.890  1.00  0.00      A       
ATOM    198  NE2 GLN A  44       2.256   1.727   6.701  1.00  0.00      A       
ATOM    199  O   GLN A  44      -1.418  -1.152   3.812  1.00  0.00      A       
ATOM    200  OE1 GLN A  44       2.321   1.800   4.520  1.00  0.00      A       
ATOM    201  C   HIS A  45      -2.337  -2.382   1.119  1.00  0.00      A       
ATOM    202  CA  HIS A  45      -1.129  -1.443   1.155  1.00  0.00      A       
ATOM    203  CB  HIS A  45      -0.369  -1.493  -0.171  1.00  0.00      A       
ATOM    204  CD2 HIS A  45       0.630   0.899  -0.606  1.00  0.00      A       
ATOM    205  CE1 HIS A  45       2.645   0.531   0.101  1.00  0.00      A       
ATOM    206  CG  HIS A  45       0.675  -0.410  -0.193  1.00  0.00      A       
ATOM    207  HN  HIS A  45       0.676  -2.349   1.909  1.00  0.00      A       
ATOM    208  HA  HIS A  45      -1.445  -0.433   1.361  1.00  0.00      A       
ATOM    209  HB2 HIS A  45       0.109  -2.456  -0.277  1.00  0.00      A       
ATOM    210  HB1 HIS A  45      -1.061  -1.343  -0.988  1.00  0.00      A       
ATOM    211  HD1 HIS A  45       2.328  -1.460   0.612  1.00  0.00      A       
ATOM    212  HD2 HIS A  45      -0.239   1.393  -1.014  1.00  0.00      A       
ATOM    213  HE1 HIS A  45       3.683   0.665   0.366  1.00  0.00      A       
ATOM    214  N   HIS A  45      -0.150  -1.902   2.183  1.00  0.00      A       
ATOM    215  ND1 HIS A  45       1.970  -0.622   0.253  1.00  0.00      A       
ATOM    216  NE2 HIS A  45       1.875   1.492  -0.419  1.00  0.00      A       
ATOM    217  O   HIS A  45      -3.472  -1.947   1.107  1.00  0.00      A       
ATOM    218  C   ILE A  46      -4.003  -4.581   2.402  1.00  0.00      A       
ATOM    219  CA  ILE A  46      -3.243  -4.628   1.075  1.00  0.00      A       
ATOM    220  CB  ILE A  46      -2.598  -6.001   0.867  1.00  0.00      A       
ATOM    221  CD1 ILE A  46      -1.489  -7.909   2.037  1.00  0.00      A       
ATOM    222  CG1 ILE A  46      -1.894  -6.438   2.153  1.00  0.00      A       
ATOM    223  CG2 ILE A  46      -1.578  -5.915  -0.270  1.00  0.00      A       
ATOM    224  HN  ILE A  46      -1.182  -3.997   1.118  1.00  0.00      A       
ATOM    225  HA  ILE A  46      -3.904  -4.403   0.253  1.00  0.00      A       
ATOM    226  HB  ILE A  46      -3.362  -6.721   0.611  1.00  0.00      A       
ATOM    227 HD11 ILE A  46      -1.917  -8.331   1.139  1.00  0.00      A       
ATOM    228 HD12 ILE A  46      -1.855  -8.451   2.897  1.00  0.00      A       
ATOM    229 HD13 ILE A  46      -0.413  -7.985   1.995  1.00  0.00      A       
ATOM    230 HG12 ILE A  46      -1.011  -5.834   2.304  1.00  0.00      A       
ATOM    231 HG11 ILE A  46      -2.563  -6.315   2.991  1.00  0.00      A       
ATOM    232 HG21 ILE A  46      -0.580  -5.884   0.142  1.00  0.00      A       
ATOM    233 HG22 ILE A  46      -1.756  -5.019  -0.847  1.00  0.00      A       
ATOM    234 HG23 ILE A  46      -1.677  -6.780  -0.909  1.00  0.00      A       
ATOM    235  N   ILE A  46      -2.104  -3.666   1.106  1.00  0.00      A       
ATOM    236  O   ILE A  46      -5.179  -4.878   2.467  1.00  0.00      A       
ATOM    237  C   TYR A  47      -5.095  -3.044   4.767  1.00  0.00      A       
ATOM    238  CA  TYR A  47      -4.026  -4.137   4.784  1.00  0.00      A       
ATOM    239  CB  TYR A  47      -2.923  -3.797   5.785  1.00  0.00      A       
ATOM    240  CD1 TYR A  47      -3.561  -4.927   7.945  1.00  0.00      A       
ATOM    241  CD2 TYR A  47      -3.993  -2.553   7.699  1.00  0.00      A       
ATOM    242  CE1 TYR A  47      -4.103  -4.892   9.236  1.00  0.00      A       
ATOM    243  CE2 TYR A  47      -4.536  -2.519   8.990  1.00  0.00      A       
ATOM    244  CG  TYR A  47      -3.505  -3.758   7.177  1.00  0.00      A       
ATOM    245  CZ  TYR A  47      -4.591  -3.689   9.757  1.00  0.00      A       
ATOM    246  HN  TYR A  47      -2.391  -3.969   3.388  1.00  0.00      A       
ATOM    247  HA  TYR A  47      -4.464  -5.089   5.029  1.00  0.00      A       
ATOM    248  HB2 TYR A  47      -2.149  -4.548   5.740  1.00  0.00      A       
ATOM    249  HB1 TYR A  47      -2.501  -2.831   5.543  1.00  0.00      A       
ATOM    250  HD1 TYR A  47      -3.185  -5.856   7.542  1.00  0.00      A       
ATOM    251  HD2 TYR A  47      -3.950  -1.651   7.107  1.00  0.00      A       
ATOM    252  HE1 TYR A  47      -4.146  -5.794   9.828  1.00  0.00      A       
ATOM    253  HE2 TYR A  47      -4.912  -1.590   9.392  1.00  0.00      A       
ATOM    254  HH  TYR A  47      -5.978  -4.097  11.004  1.00  0.00      A       
ATOM    255  N   TYR A  47      -3.339  -4.205   3.462  1.00  0.00      A       
ATOM    256  O   TYR A  47      -6.135  -3.168   5.383  1.00  0.00      A       
ATOM    257  OH  TYR A  47      -5.126  -3.655  11.029  1.00  0.00      A       
ATOM    258  C   GLU A  48      -7.076  -1.349   3.202  1.00  0.00      A       
ATOM    259  CA  GLU A  48      -5.855  -0.879   3.995  1.00  0.00      A       
ATOM    260  CB  GLU A  48      -5.151   0.268   3.271  1.00  0.00      A       
ATOM    261  CD  GLU A  48      -3.257   1.895   3.380  1.00  0.00      A       
ATOM    262  CG  GLU A  48      -3.968   0.754   4.111  1.00  0.00      A       
ATOM    263  HN  GLU A  48      -4.009  -1.900   3.567  1.00  0.00      A       
ATOM    264  HA  GLU A  48      -6.144  -0.570   4.988  1.00  0.00      A       
ATOM    265  HB2 GLU A  48      -4.794  -0.077   2.312  1.00  0.00      A       
ATOM    266  HB1 GLU A  48      -5.845   1.083   3.123  1.00  0.00      A       
ATOM    267  HG2 GLU A  48      -4.325   1.105   5.067  1.00  0.00      A       
ATOM    268  HG1 GLU A  48      -3.276  -0.062   4.263  1.00  0.00      A       
ATOM    269  N   GLU A  48      -4.850  -1.977   4.060  1.00  0.00      A       
ATOM    270  O   GLU A  48      -8.192  -0.948   3.463  1.00  0.00      A       
ATOM    271  OE1 GLU A  48      -3.571   2.116   2.223  1.00  0.00      A       
ATOM    272  OE2 GLU A  48      -2.413   2.529   3.992  1.00  0.00      A       
ATOM    273  C   THR A  49      -9.032  -3.387   2.356  1.00  0.00      A       
ATOM    274  CA  THR A  49      -8.013  -2.713   1.435  1.00  0.00      A       
ATOM    275  CB  THR A  49      -7.401  -3.732   0.471  1.00  0.00      A       
ATOM    276  CG2 THR A  49      -8.475  -4.243  -0.488  1.00  0.00      A       
ATOM    277  HN  THR A  49      -5.959  -2.520   2.052  1.00  0.00      A       
ATOM    278  HA  THR A  49      -8.474  -1.910   0.881  1.00  0.00      A       
ATOM    279  HB  THR A  49      -7.000  -4.562   1.033  1.00  0.00      A       
ATOM    280  HG1 THR A  49      -6.717  -2.830  -1.112  1.00  0.00      A       
ATOM    281 HG21 THR A  49      -9.436  -4.228   0.006  1.00  0.00      A       
ATOM    282 HG22 THR A  49      -8.241  -5.254  -0.787  1.00  0.00      A       
ATOM    283 HG23 THR A  49      -8.510  -3.609  -1.362  1.00  0.00      A       
ATOM    284  N   THR A  49      -6.868  -2.206   2.239  1.00  0.00      A       
ATOM    285  O   THR A  49     -10.227  -3.295   2.152  1.00  0.00      A       
ATOM    286  OG1 THR A  49      -6.357  -3.112  -0.268  1.00  0.00      A       
ATOM    287  C   TYR A  50     -10.275  -3.688   5.123  1.00  0.00      A       
ATOM    288  CA  TYR A  50      -9.501  -4.734   4.317  1.00  0.00      A       
ATOM    289  CB  TYR A  50      -8.607  -5.561   5.242  1.00  0.00      A       
ATOM    290  CD1 TYR A  50      -8.670  -7.845   4.178  1.00  0.00      A       
ATOM    291  CD2 TYR A  50      -6.630  -6.544   4.027  1.00  0.00      A       
ATOM    292  CE1 TYR A  50      -8.063  -8.882   3.460  1.00  0.00      A       
ATOM    293  CE2 TYR A  50      -6.022  -7.580   3.309  1.00  0.00      A       
ATOM    294  CG  TYR A  50      -7.955  -6.676   4.462  1.00  0.00      A       
ATOM    295  CZ  TYR A  50      -6.738  -8.748   3.025  1.00  0.00      A       
ATOM    296  HN  TYR A  50      -7.598  -4.113   3.520  1.00  0.00      A       
ATOM    297  HA  TYR A  50     -10.179  -5.380   3.783  1.00  0.00      A       
ATOM    298  HB2 TYR A  50      -7.843  -4.924   5.665  1.00  0.00      A       
ATOM    299  HB1 TYR A  50      -9.204  -5.981   6.038  1.00  0.00      A       
ATOM    300  HD1 TYR A  50      -9.692  -7.946   4.514  1.00  0.00      A       
ATOM    301  HD2 TYR A  50      -6.078  -5.642   4.245  1.00  0.00      A       
ATOM    302  HE1 TYR A  50      -8.615  -9.784   3.242  1.00  0.00      A       
ATOM    303  HE2 TYR A  50      -5.001  -7.477   2.974  1.00  0.00      A       
ATOM    304  HH  TYR A  50      -6.814 -10.216   1.806  1.00  0.00      A       
ATOM    305  N   TYR A  50      -8.565  -4.058   3.374  1.00  0.00      A       
ATOM    306  O   TYR A  50     -11.464  -3.811   5.343  1.00  0.00      A       
ATOM    307  OH  TYR A  50      -6.136  -9.770   2.318  1.00  0.00      A       
ATOM    308  C   GLY A  51     -10.932  -0.586   5.409  1.00  0.00      A       
ATOM    309  CA  GLY A  51     -10.299  -1.603   6.359  1.00  0.00      A       
ATOM    310  HN  GLY A  51      -8.646  -2.580   5.378  1.00  0.00      A       
ATOM    311  HA2 GLY A  51     -11.068  -2.057   6.966  1.00  0.00      A       
ATOM    312  HA1 GLY A  51      -9.584  -1.104   6.997  1.00  0.00      A       
ATOM    313  N   GLY A  51      -9.605  -2.659   5.566  1.00  0.00      A       
ATOM    314  O   GLY A  51     -10.376   0.465   5.159  1.00  0.00      A       
ATOM    315  HN1 NH2 A  52     -12.536  -1.703   5.061  1.00  0.00      A       
ATOM    316  HN2 NH2 A  52     -12.501  -0.213   4.250  1.00  0.00      A       
ATOM    317  N   NH2 A  52     -12.085  -0.857   4.861  1.00  0.00      A       
END


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