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
371373 1ckx 4596 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   MET A   1      18.644   4.486  -1.754  1.00  0.00      A       
ATOM      2  CA  MET A   1      19.139   5.802  -2.366  1.00  0.00      A       
ATOM      3  CB  MET A   1      17.971   6.762  -2.591  1.00  0.00      A       
ATOM      4  CE  MET A   1      17.770   8.939   0.676  1.00  0.00      A       
ATOM      5  CG  MET A   1      18.241   8.076  -1.855  1.00  0.00      A       
ATOM      6  HT1 MET A   1      20.374   4.764  -3.684  1.00  0.00      A       
ATOM      7  HT2 MET A   1      18.933   5.331  -4.384  1.00  0.00      A       
ATOM      8  HT3 MET A   1      20.202   6.411  -4.051  1.00  0.00      A       
ATOM      9  HA  MET A   1      19.876   6.263  -1.729  1.00  0.00      A       
ATOM     10  HB2 MET A   1      17.865   6.956  -3.649  1.00  0.00      A       
ATOM     11  HB1 MET A   1      17.062   6.319  -2.213  1.00  0.00      A       
ATOM     12  HE1 MET A   1      18.517   8.183   0.875  1.00  0.00      A       
ATOM     13  HE2 MET A   1      18.256   9.887   0.512  1.00  0.00      A       
ATOM     14  HE3 MET A   1      17.099   9.022   1.520  1.00  0.00      A       
ATOM     15  HG2 MET A   1      19.127   7.971  -1.245  1.00  0.00      A       
ATOM     16  HG1 MET A   1      18.390   8.867  -2.574  1.00  0.00      A       
ATOM     17  N   MET A   1      19.705   5.558  -3.724  1.00  0.00      A       
ATOM     18  O   MET A   1      17.759   3.848  -2.288  1.00  0.00      A       
ATOM     19  SD  MET A   1      16.827   8.478  -0.799  1.00  0.00      A       
ATOM     20  C   PRO A   2      17.497   3.037   0.740  1.00  0.00      A       
ATOM     21  CA  PRO A   2      18.853   2.871   0.048  1.00  0.00      A       
ATOM     22  CB  PRO A   2      19.967   2.676   1.075  1.00  0.00      A       
ATOM     23  CD  PRO A   2      20.308   4.840   0.054  1.00  0.00      A       
ATOM     24  CG  PRO A   2      20.513   4.047   1.319  1.00  0.00      A       
ATOM     25  HA  PRO A   2      18.834   2.041  -0.640  1.00  0.00      A       
ATOM     26  HB2 PRO A   2      19.565   2.260   1.989  1.00  0.00      A       
ATOM     27  HB1 PRO A   2      20.739   2.037   0.676  1.00  0.00      A       
ATOM     28  HD2 PRO A   2      20.002   5.851   0.289  1.00  0.00      A       
ATOM     29  HD1 PRO A   2      21.206   4.843  -0.543  1.00  0.00      A       
ATOM     30  HG2 PRO A   2      19.984   4.512   2.140  1.00  0.00      A       
ATOM     31  HG1 PRO A   2      21.567   3.990   1.545  1.00  0.00      A       
ATOM     32  N   PRO A   2      19.237   4.124  -0.647  1.00  0.00      A       
ATOM     33  O   PRO A   2      17.412   3.124   1.949  1.00  0.00      A       
ATOM     34  C   GLY A   3      14.158   2.145   0.078  1.00  0.00      A       
ATOM     35  CA  GLY A   3      15.087   3.242   0.599  1.00  0.00      A       
ATOM     36  HN  GLY A   3      16.524   3.009  -0.990  1.00  0.00      A       
ATOM     37  HA2 GLY A   3      15.172   3.167   1.674  1.00  0.00      A       
ATOM     38  HA1 GLY A   3      14.683   4.207   0.334  1.00  0.00      A       
ATOM     39  N   GLY A   3      16.435   3.082  -0.017  1.00  0.00      A       
ATOM     40  O   GLY A   3      12.954   2.303   0.041  1.00  0.00      A       
ATOM     41  C   THR A   4      12.833  -0.462   0.225  1.00  0.00      A       
ATOM     42  CA  THR A   4      13.861  -0.074  -0.842  1.00  0.00      A       
ATOM     43  CB  THR A   4      14.766  -1.270  -1.201  1.00  0.00      A       
ATOM     44  CG2 THR A   4      14.806  -2.301  -0.064  1.00  0.00      A       
ATOM     45  HN  THR A   4      15.682   0.927  -0.283  1.00  0.00      A       
ATOM     46  HA  THR A   4      13.343   0.260  -1.729  1.00  0.00      A       
ATOM     47  HB  THR A   4      15.767  -0.908  -1.376  1.00  0.00      A       
ATOM     48  HG1 THR A   4      14.531  -1.343  -3.130  1.00  0.00      A       
ATOM     49 HG21 THR A   4      13.798  -2.585   0.203  1.00  0.00      A       
ATOM     50 HG22 THR A   4      15.350  -3.175  -0.390  1.00  0.00      A       
ATOM     51 HG23 THR A   4      15.299  -1.872   0.795  1.00  0.00      A       
ATOM     52  N   THR A   4      14.709   1.034  -0.324  1.00  0.00      A       
ATOM     53  O   THR A   4      11.653  -0.571  -0.040  1.00  0.00      A       
ATOM     54  OG1 THR A   4      14.279  -1.890  -2.382  1.00  0.00      A       
ATOM     55  C   ILE A   5      11.410   0.112   2.840  1.00  0.00      A       
ATOM     56  CA  ILE A   5      12.346  -1.057   2.522  1.00  0.00      A       
ATOM     57  CB  ILE A   5      13.149  -1.426   3.770  1.00  0.00      A       
ATOM     58  CD1 ILE A   5      13.042  -3.788   2.961  1.00  0.00      A       
ATOM     59  CG1 ILE A   5      13.966  -2.688   3.488  1.00  0.00      A       
ATOM     60  CG2 ILE A   5      12.194  -1.686   4.937  1.00  0.00      A       
ATOM     61  HN  ILE A   5      14.242  -0.580   1.612  1.00  0.00      A       
ATOM     62  HA  ILE A   5      11.761  -1.909   2.209  1.00  0.00      A       
ATOM     63  HB  ILE A   5      13.813  -0.613   4.023  1.00  0.00      A       
ATOM     64 HD11 ILE A   5      12.014  -3.513   3.145  1.00  0.00      A       
ATOM     65 HD12 ILE A   5      13.198  -3.911   1.899  1.00  0.00      A       
ATOM     66 HD13 ILE A   5      13.262  -4.717   3.467  1.00  0.00      A       
ATOM     67 HG12 ILE A   5      14.724  -2.468   2.750  1.00  0.00      A       
ATOM     68 HG11 ILE A   5      14.437  -3.023   4.400  1.00  0.00      A       
ATOM     69 HG21 ILE A   5      11.174  -1.602   4.592  1.00  0.00      A       
ATOM     70 HG22 ILE A   5      12.363  -2.679   5.326  1.00  0.00      A       
ATOM     71 HG23 ILE A   5      12.372  -0.959   5.715  1.00  0.00      A       
ATOM     72  N   ILE A   5      13.283  -0.673   1.428  1.00  0.00      A       
ATOM     73  O   ILE A   5      10.212  -0.056   2.948  1.00  0.00      A       
ATOM     74  C   LYS A   6       9.852   2.437   2.392  1.00  0.00      A       
ATOM     75  CA  LYS A   6      11.078   2.468   3.298  1.00  0.00      A       
ATOM     76  CB  LYS A   6      11.859   3.761   3.056  1.00  0.00      A       
ATOM     77  CD  LYS A   6      10.551   5.171   4.651  1.00  0.00      A       
ATOM     78  CE  LYS A   6       9.235   5.947   4.745  1.00  0.00      A       
ATOM     79  CG  LYS A   6      10.916   4.959   3.180  1.00  0.00      A       
ATOM     80  HN  LYS A   6      12.909   1.410   2.892  1.00  0.00      A       
ATOM     81  HA  LYS A   6      10.762   2.422   4.329  1.00  0.00      A       
ATOM     82  HB2 LYS A   6      12.649   3.845   3.788  1.00  0.00      A       
ATOM     83  HB1 LYS A   6      12.287   3.743   2.065  1.00  0.00      A       
ATOM     84  HD2 LYS A   6      10.440   4.211   5.135  1.00  0.00      A       
ATOM     85  HD1 LYS A   6      11.334   5.732   5.138  1.00  0.00      A       
ATOM     86  HE2 LYS A   6       9.379   6.968   4.420  1.00  0.00      A       
ATOM     87  HE1 LYS A   6       8.470   5.466   4.155  1.00  0.00      A       
ATOM     88  HG2 LYS A   6      11.406   5.843   2.799  1.00  0.00      A       
ATOM     89  HG1 LYS A   6      10.018   4.771   2.611  1.00  0.00      A       
ATOM     90  HZ1 LYS A   6       9.733   5.910   6.767  1.00  0.00      A       
ATOM     91  HZ2 LYS A   6       8.291   6.739   6.423  1.00  0.00      A       
ATOM     92  HZ3 LYS A   6       8.323   5.043   6.385  1.00  0.00      A       
ATOM     93  N   LYS A   6      11.943   1.294   2.987  1.00  0.00      A       
ATOM     94  NZ  LYS A   6       8.868   5.907   6.189  1.00  0.00      A       
ATOM     95  O   LYS A   6       8.765   2.809   2.786  1.00  0.00      A       
ATOM     96  C   GLU A   7       7.871   0.881   0.773  1.00  0.00      A       
ATOM     97  CA  GLU A   7       8.857   1.924   0.256  1.00  0.00      A       
ATOM     98  CB  GLU A   7       9.336   1.527  -1.140  1.00  0.00      A       
ATOM     99  CD  GLU A   7      10.308   2.965  -2.938  1.00  0.00      A       
ATOM    100  CG  GLU A   7      10.532   2.395  -1.536  1.00  0.00      A       
ATOM    101  HN  GLU A   7      10.903   1.686   0.887  1.00  0.00      A       
ATOM    102  HA  GLU A   7       8.373   2.890   0.214  1.00  0.00      A       
ATOM    103  HB2 GLU A   7       9.629   0.487  -1.137  1.00  0.00      A       
ATOM    104  HB1 GLU A   7       8.536   1.674  -1.847  1.00  0.00      A       
ATOM    105  HG2 GLU A   7      10.636   3.204  -0.829  1.00  0.00      A       
ATOM    106  HG1 GLU A   7      11.430   1.796  -1.532  1.00  0.00      A       
ATOM    107  N   GLU A   7      10.017   1.988   1.183  1.00  0.00      A       
ATOM    108  O   GLU A   7       6.687   1.125   0.864  1.00  0.00      A       
ATOM    109  OE1 GLU A   7       9.374   3.732  -3.102  1.00  0.00      A       
ATOM    110  OE2 GLU A   7      11.076   2.625  -3.823  1.00  0.00      A       
ATOM    111  C   ASN A   8       6.660  -0.778   2.844  1.00  0.00      A       
ATOM    112  CA  ASN A   8       7.441  -1.333   1.650  1.00  0.00      A       
ATOM    113  CB  ASN A   8       8.265  -2.544   2.079  1.00  0.00      A       
ATOM    114  CG  ASN A   8       7.434  -3.450   2.992  1.00  0.00      A       
ATOM    115  HN  ASN A   8       9.314  -0.451   1.055  1.00  0.00      A       
ATOM    116  HA  ASN A   8       6.757  -1.628   0.878  1.00  0.00      A       
ATOM    117  HB2 ASN A   8       8.571  -3.098   1.203  1.00  0.00      A       
ATOM    118  HB1 ASN A   8       9.133  -2.204   2.607  1.00  0.00      A       
ATOM    119 HD21 ASN A   8       5.903  -3.557   1.732  1.00  0.00      A       
ATOM    120 HD22 ASN A   8       5.713  -4.423   3.181  1.00  0.00      A       
ATOM    121  N   ASN A   8       8.352  -0.278   1.127  1.00  0.00      A       
ATOM    122  ND2 ASN A   8       6.252  -3.842   2.603  1.00  0.00      A       
ATOM    123  O   ASN A   8       5.643  -1.316   3.238  1.00  0.00      A       
ATOM    124  OD1 ASN A   8       7.868  -3.807   4.070  1.00  0.00      A       
ATOM    125  C   ILE A   9       5.374   1.901   4.075  1.00  0.00      A       
ATOM    126  CA  ILE A   9       6.407   0.895   4.581  1.00  0.00      A       
ATOM    127  CB  ILE A   9       7.405   1.609   5.487  1.00  0.00      A       
ATOM    128  CD1 ILE A   9       8.433  -0.548   6.219  1.00  0.00      A       
ATOM    129  CG1 ILE A   9       8.701   0.801   5.549  1.00  0.00      A       
ATOM    130  CG2 ILE A   9       6.817   1.737   6.893  1.00  0.00      A       
ATOM    131  HN  ILE A   9       7.943   0.720   3.079  1.00  0.00      A       
ATOM    132  HA  ILE A   9       5.911   0.115   5.137  1.00  0.00      A       
ATOM    133  HB  ILE A   9       7.611   2.594   5.091  1.00  0.00      A       
ATOM    134 HD11 ILE A   9       7.392  -0.611   6.497  1.00  0.00      A       
ATOM    135 HD12 ILE A   9       8.671  -1.345   5.531  1.00  0.00      A       
ATOM    136 HD13 ILE A   9       9.048  -0.639   7.103  1.00  0.00      A       
ATOM    137 HG12 ILE A   9       9.073   0.640   4.550  1.00  0.00      A       
ATOM    138 HG11 ILE A   9       9.431   1.345   6.119  1.00  0.00      A       
ATOM    139 HG21 ILE A   9       5.758   1.939   6.823  1.00  0.00      A       
ATOM    140 HG22 ILE A   9       6.973   0.816   7.434  1.00  0.00      A       
ATOM    141 HG23 ILE A   9       7.304   2.548   7.415  1.00  0.00      A       
ATOM    142  N   ILE A   9       7.124   0.300   3.417  1.00  0.00      A       
ATOM    143  O   ILE A   9       4.490   2.318   4.797  1.00  0.00      A       
ATOM    144  C   ILE A  10       3.707   2.533   1.190  1.00  0.00      A       
ATOM    145  CA  ILE A  10       4.496   3.256   2.268  1.00  0.00      A       
ATOM    146  CB  ILE A  10       5.264   4.449   1.670  1.00  0.00      A       
ATOM    147  CD1 ILE A  10       3.043   5.534   1.323  1.00  0.00      A       
ATOM    148  CG1 ILE A  10       4.453   5.728   1.883  1.00  0.00      A       
ATOM    149  CG2 ILE A  10       5.513   4.251   0.169  1.00  0.00      A       
ATOM    150  HN  ILE A  10       6.191   1.924   2.263  1.00  0.00      A       
ATOM    151  HA  ILE A  10       3.826   3.600   3.045  1.00  0.00      A       
ATOM    152  HB  ILE A  10       6.214   4.537   2.170  1.00  0.00      A       
ATOM    153 HD11 ILE A  10       3.046   4.716   0.616  1.00  0.00      A       
ATOM    154 HD12 ILE A  10       2.363   5.308   2.131  1.00  0.00      A       
ATOM    155 HD13 ILE A  10       2.724   6.438   0.826  1.00  0.00      A       
ATOM    156 HG12 ILE A  10       4.396   5.948   2.939  1.00  0.00      A       
ATOM    157 HG11 ILE A  10       4.932   6.548   1.369  1.00  0.00      A       
ATOM    158 HG21 ILE A  10       5.955   3.279   0.003  1.00  0.00      A       
ATOM    159 HG22 ILE A  10       4.576   4.315  -0.363  1.00  0.00      A       
ATOM    160 HG23 ILE A  10       6.185   5.017  -0.190  1.00  0.00      A       
ATOM    161  N   ILE A  10       5.474   2.286   2.834  1.00  0.00      A       
ATOM    162  O   ILE A  10       2.513   2.698   1.034  1.00  0.00      A       
ATOM    163  C   PHE A  11       2.560   0.186  -0.054  1.00  0.00      A       
ATOM    164  CA  PHE A  11       3.766   0.938  -0.617  1.00  0.00      A       
ATOM    165  CB  PHE A  11       4.812  -0.041  -1.125  1.00  0.00      A       
ATOM    166  CD1 PHE A  11       5.012   1.028  -3.380  1.00  0.00      A       
ATOM    167  CD2 PHE A  11       4.424  -1.318  -3.242  1.00  0.00      A       
ATOM    168  CE1 PHE A  11       4.952   0.964  -4.776  1.00  0.00      A       
ATOM    169  CE2 PHE A  11       4.364  -1.387  -4.638  1.00  0.00      A       
ATOM    170  CG  PHE A  11       4.747  -0.114  -2.620  1.00  0.00      A       
ATOM    171  CZ  PHE A  11       4.628  -0.245  -5.407  1.00  0.00      A       
ATOM    172  HN  PHE A  11       5.353   1.609   0.626  1.00  0.00      A       
ATOM    173  HA  PHE A  11       3.455   1.591  -1.418  1.00  0.00      A       
ATOM    174  HB2 PHE A  11       5.792   0.300  -0.828  1.00  0.00      A       
ATOM    175  HB1 PHE A  11       4.629  -1.008  -0.701  1.00  0.00      A       
ATOM    176  HD1 PHE A  11       5.263   1.960  -2.886  1.00  0.00      A       
ATOM    177  HD2 PHE A  11       4.224  -2.195  -2.642  1.00  0.00      A       
ATOM    178  HE1 PHE A  11       5.156   1.845  -5.367  1.00  0.00      A       
ATOM    179  HE2 PHE A  11       4.114  -2.319  -5.123  1.00  0.00      A       
ATOM    180  HZ  PHE A  11       4.581  -0.296  -6.485  1.00  0.00      A       
ATOM    181  N   PHE A  11       4.395   1.718   0.458  1.00  0.00      A       
ATOM    182  O   PHE A  11       1.564  -0.005  -0.724  1.00  0.00      A       
ATOM    183  C   GLY A  12       0.388   0.060   2.098  1.00  0.00      A       
ATOM    184  CA  GLY A  12       1.491  -0.952   1.797  1.00  0.00      A       
ATOM    185  HN  GLY A  12       3.446  -0.052   1.707  1.00  0.00      A       
ATOM    186  HA2 GLY A  12       1.123  -1.702   1.112  1.00  0.00      A       
ATOM    187  HA1 GLY A  12       1.806  -1.421   2.716  1.00  0.00      A       
ATOM    188  N   GLY A  12       2.638  -0.229   1.181  1.00  0.00      A       
ATOM    189  O   GLY A  12      -0.781  -0.191   1.880  1.00  0.00      A       
ATOM    190  C   VAL A  13      -1.011   2.593   1.599  1.00  0.00      A       
ATOM    191  CA  VAL A  13      -0.255   2.257   2.886  1.00  0.00      A       
ATOM    192  CB  VAL A  13       0.454   3.509   3.408  1.00  0.00      A       
ATOM    193  CG1 VAL A  13      -0.549   4.654   3.540  1.00  0.00      A       
ATOM    194  CG2 VAL A  13       1.070   3.211   4.777  1.00  0.00      A       
ATOM    195  HN  VAL A  13       1.709   1.394   2.739  1.00  0.00      A       
ATOM    196  HA  VAL A  13      -0.946   1.891   3.631  1.00  0.00      A       
ATOM    197  HB  VAL A  13       1.234   3.793   2.716  1.00  0.00      A       
ATOM    198 HG11 VAL A  13      -1.543   4.249   3.663  1.00  0.00      A       
ATOM    199 HG12 VAL A  13      -0.296   5.256   4.399  1.00  0.00      A       
ATOM    200 HG13 VAL A  13      -0.517   5.265   2.650  1.00  0.00      A       
ATOM    201 HG21 VAL A  13       1.177   2.144   4.900  1.00  0.00      A       
ATOM    202 HG22 VAL A  13       2.042   3.680   4.843  1.00  0.00      A       
ATOM    203 HG23 VAL A  13       0.429   3.602   5.553  1.00  0.00      A       
ATOM    204  N   VAL A  13       0.759   1.212   2.584  1.00  0.00      A       
ATOM    205  O   VAL A  13      -2.090   3.150   1.625  1.00  0.00      A       
ATOM    206  C   SER A  14      -1.844   1.278  -1.306  1.00  0.00      A       
ATOM    207  CA  SER A  14      -1.121   2.538  -0.824  1.00  0.00      A       
ATOM    208  CB  SER A  14      -0.073   2.955  -1.858  1.00  0.00      A       
ATOM    209  HN  SER A  14       0.423   1.799   0.480  1.00  0.00      A       
ATOM    210  HA  SER A  14      -1.836   3.337  -0.691  1.00  0.00      A       
ATOM    211  HB2 SER A  14       0.737   3.466  -1.365  1.00  0.00      A       
ATOM    212  HB1 SER A  14       0.311   2.074  -2.356  1.00  0.00      A       
ATOM    213  HG  SER A  14      -0.692   4.710  -2.424  1.00  0.00      A       
ATOM    214  N   SER A  14      -0.447   2.251   0.472  1.00  0.00      A       
ATOM    215  O   SER A  14      -3.020   1.303  -1.612  1.00  0.00      A       
ATOM    216  OG  SER A  14      -0.670   3.830  -2.806  1.00  0.00      A       
ATOM    217  C   TYR A  15      -2.943  -1.430  -0.874  1.00  0.00      A       
ATOM    218  CA  TYR A  15      -1.797  -1.090  -1.821  1.00  0.00      A       
ATOM    219  CB  TYR A  15      -0.771  -2.218  -1.802  1.00  0.00      A       
ATOM    220  CD1 TYR A  15      -1.259  -2.599  -4.247  1.00  0.00      A       
ATOM    221  CD2 TYR A  15      -0.938  -4.523  -2.806  1.00  0.00      A       
ATOM    222  CE1 TYR A  15      -1.466  -3.451  -5.338  1.00  0.00      A       
ATOM    223  CE2 TYR A  15      -1.144  -5.375  -3.898  1.00  0.00      A       
ATOM    224  CG  TYR A  15      -0.995  -3.135  -2.980  1.00  0.00      A       
ATOM    225  CZ  TYR A  15      -1.408  -4.840  -5.164  1.00  0.00      A       
ATOM    226  HN  TYR A  15      -0.205   0.175  -1.111  1.00  0.00      A       
ATOM    227  HA  TYR A  15      -2.179  -0.964  -2.823  1.00  0.00      A       
ATOM    228  HB2 TYR A  15       0.216  -1.794  -1.858  1.00  0.00      A       
ATOM    229  HB1 TYR A  15      -0.870  -2.779  -0.885  1.00  0.00      A       
ATOM    230  HD1 TYR A  15      -1.304  -1.529  -4.381  1.00  0.00      A       
ATOM    231  HD2 TYR A  15      -0.734  -4.937  -1.830  1.00  0.00      A       
ATOM    232  HE1 TYR A  15      -1.670  -3.038  -6.315  1.00  0.00      A       
ATOM    233  HE2 TYR A  15      -1.100  -6.446  -3.763  1.00  0.00      A       
ATOM    234  HH  TYR A  15      -2.094  -5.191  -6.911  1.00  0.00      A       
ATOM    235  N   TYR A  15      -1.151   0.174  -1.368  1.00  0.00      A       
ATOM    236  O   TYR A  15      -4.063  -1.647  -1.293  1.00  0.00      A       
ATOM    237  OH  TYR A  15      -1.612  -5.679  -6.240  1.00  0.00      A       
ATOM    238  C   ASP A  16      -4.962  -0.886   1.037  1.00  0.00      A       
ATOM    239  CA  ASP A  16      -3.768  -1.779   1.365  1.00  0.00      A       
ATOM    240  CB  ASP A  16      -3.292  -1.497   2.792  1.00  0.00      A       
ATOM    241  CG  ASP A  16      -1.958  -2.205   3.035  1.00  0.00      A       
ATOM    242  HN  ASP A  16      -1.773  -1.280   0.725  1.00  0.00      A       
ATOM    243  HA  ASP A  16      -4.052  -2.817   1.270  1.00  0.00      A       
ATOM    244  HB2 ASP A  16      -3.166  -0.433   2.925  1.00  0.00      A       
ATOM    245  HB1 ASP A  16      -4.025  -1.863   3.495  1.00  0.00      A       
ATOM    246  N   ASP A  16      -2.680  -1.467   0.403  1.00  0.00      A       
ATOM    247  O   ASP A  16      -6.097  -1.211   1.321  1.00  0.00      A       
ATOM    248  OD1 ASP A  16      -1.426  -2.765   2.091  1.00  0.00      A       
ATOM    249  OD2 ASP A  16      -1.491  -2.174   4.162  1.00  0.00      A       
ATOM    250  C   GLU A  17      -6.341   0.774  -1.322  1.00  0.00      A       
ATOM    251  CA  GLU A  17      -5.806   1.165   0.056  1.00  0.00      A       
ATOM    252  CB  GLU A  17      -5.272   2.599   0.010  1.00  0.00      A       
ATOM    253  CD  GLU A  17      -6.834   3.993   1.374  1.00  0.00      A       
ATOM    254  CG  GLU A  17      -6.443   3.582  -0.046  1.00  0.00      A       
ATOM    255  HN  GLU A  17      -3.778   0.471   0.202  1.00  0.00      A       
ATOM    256  HA  GLU A  17      -6.599   1.096   0.786  1.00  0.00      A       
ATOM    257  HB2 GLU A  17      -4.682   2.791   0.895  1.00  0.00      A       
ATOM    258  HB1 GLU A  17      -4.656   2.725  -0.867  1.00  0.00      A       
ATOM    259  HG2 GLU A  17      -6.150   4.458  -0.607  1.00  0.00      A       
ATOM    260  HG1 GLU A  17      -7.286   3.111  -0.528  1.00  0.00      A       
ATOM    261  N   GLU A  17      -4.704   0.239   0.426  1.00  0.00      A       
ATOM    262  O   GLU A  17      -7.464   1.079  -1.673  1.00  0.00      A       
ATOM    263  OE1 GLU A  17      -5.994   3.889   2.253  1.00  0.00      A       
ATOM    264  OE2 GLU A  17      -7.968   4.404   1.560  1.00  0.00      A       
ATOM    265  C   TYR A  18      -6.697  -1.676  -3.374  1.00  0.00      A       
ATOM    266  CA  TYR A  18      -6.011  -0.312  -3.462  1.00  0.00      A       
ATOM    267  CB  TYR A  18      -4.812  -0.405  -4.408  1.00  0.00      A       
ATOM    268  CD1 TYR A  18      -5.543   1.740  -5.509  1.00  0.00      A       
ATOM    269  CD2 TYR A  18      -3.200   1.457  -4.949  1.00  0.00      A       
ATOM    270  CE1 TYR A  18      -5.265   3.010  -6.027  1.00  0.00      A       
ATOM    271  CE2 TYR A  18      -2.923   2.727  -5.468  1.00  0.00      A       
ATOM    272  CG  TYR A  18      -4.510   0.963  -4.970  1.00  0.00      A       
ATOM    273  CZ  TYR A  18      -3.956   3.503  -6.007  1.00  0.00      A       
ATOM    274  HN  TYR A  18      -4.639  -0.140  -1.808  1.00  0.00      A       
ATOM    275  HA  TYR A  18      -6.711   0.419  -3.839  1.00  0.00      A       
ATOM    276  HB2 TYR A  18      -3.952  -0.770  -3.865  1.00  0.00      A       
ATOM    277  HB1 TYR A  18      -5.043  -1.082  -5.216  1.00  0.00      A       
ATOM    278  HD1 TYR A  18      -6.553   1.359  -5.525  1.00  0.00      A       
ATOM    279  HD2 TYR A  18      -2.404   0.857  -4.533  1.00  0.00      A       
ATOM    280  HE1 TYR A  18      -6.062   3.610  -6.443  1.00  0.00      A       
ATOM    281  HE2 TYR A  18      -1.913   3.108  -5.452  1.00  0.00      A       
ATOM    282  HH  TYR A  18      -4.462   5.303  -6.391  1.00  0.00      A       
ATOM    283  N   TYR A  18      -5.545   0.098  -2.109  1.00  0.00      A       
ATOM    284  O   TYR A  18      -7.566  -1.997  -4.161  1.00  0.00      A       
ATOM    285  OH  TYR A  18      -3.684   4.756  -6.517  1.00  0.00      A       
ATOM    286  C   ARG A  19      -8.077  -3.754  -1.252  1.00  0.00      A       
ATOM    287  CA  ARG A  19      -6.948  -3.823  -2.283  1.00  0.00      A       
ATOM    288  CB  ARG A  19      -5.901  -4.838  -1.821  1.00  0.00      A       
ATOM    289  CD  ARG A  19      -4.103  -6.355  -2.667  1.00  0.00      A       
ATOM    290  CG  ARG A  19      -4.883  -5.068  -2.940  1.00  0.00      A       
ATOM    291  CZ  ARG A  19      -4.336  -8.685  -3.287  1.00  0.00      A       
ATOM    292  HN  ARG A  19      -5.615  -2.204  -1.796  1.00  0.00      A       
ATOM    293  HA  ARG A  19      -7.350  -4.130  -3.237  1.00  0.00      A       
ATOM    294  HB2 ARG A  19      -5.394  -4.459  -0.944  1.00  0.00      A       
ATOM    295  HB1 ARG A  19      -6.386  -5.773  -1.581  1.00  0.00      A       
ATOM    296  HD2 ARG A  19      -3.173  -6.334  -3.215  1.00  0.00      A       
ATOM    297  HD1 ARG A  19      -3.897  -6.433  -1.610  1.00  0.00      A       
ATOM    298  HE  ARG A  19      -5.875  -7.431  -3.252  1.00  0.00      A       
ATOM    299  HG2 ARG A  19      -5.401  -5.153  -3.884  1.00  0.00      A       
ATOM    300  HG1 ARG A  19      -4.197  -4.234  -2.979  1.00  0.00      A       
ATOM    301 HH11 ARG A  19      -3.880  -8.326  -5.203  1.00  0.00      A       
ATOM    302 HH12 ARG A  19      -3.385  -9.869  -4.592  1.00  0.00      A       
ATOM    303 HH21 ARG A  19      -4.663  -9.316  -1.415  1.00  0.00      A       
ATOM    304 HH22 ARG A  19      -3.832 -10.432  -2.448  1.00  0.00      A       
ATOM    305  N   ARG A  19      -6.316  -2.481  -2.421  1.00  0.00      A       
ATOM    306  NE  ARG A  19      -4.911  -7.528  -3.104  1.00  0.00      A       
ATOM    307  NH1 ARG A  19      -3.828  -8.984  -4.451  1.00  0.00      A       
ATOM    308  NH2 ARG A  19      -4.272  -9.544  -2.307  1.00  0.00      A       
ATOM    309  O   ARG A  19      -8.786  -4.714  -1.031  1.00  0.00      A       
ATOM    310  C   TYR A  20     -10.617  -2.024  -0.282  1.00  0.00      A       
ATOM    311  CA  TYR A  20      -9.332  -2.502   0.396  1.00  0.00      A       
ATOM    312  CB  TYR A  20      -8.917  -1.491   1.467  1.00  0.00      A       
ATOM    313  CD1 TYR A  20     -11.065  -0.371   2.163  1.00  0.00      A       
ATOM    314  CD2 TYR A  20     -10.096  -2.044   3.627  1.00  0.00      A       
ATOM    315  CE1 TYR A  20     -12.119  -0.191   3.067  1.00  0.00      A       
ATOM    316  CE2 TYR A  20     -11.151  -1.864   4.531  1.00  0.00      A       
ATOM    317  CG  TYR A  20     -10.053  -1.298   2.443  1.00  0.00      A       
ATOM    318  CZ  TYR A  20     -12.162  -0.937   4.250  1.00  0.00      A       
ATOM    319  HN  TYR A  20      -7.667  -1.861  -0.810  1.00  0.00      A       
ATOM    320  HA  TYR A  20      -9.505  -3.463   0.857  1.00  0.00      A       
ATOM    321  HB2 TYR A  20      -8.048  -1.859   1.993  1.00  0.00      A       
ATOM    322  HB1 TYR A  20      -8.682  -0.547   0.999  1.00  0.00      A       
ATOM    323  HD1 TYR A  20     -11.033   0.204   1.250  1.00  0.00      A       
ATOM    324  HD2 TYR A  20      -9.316  -2.760   3.843  1.00  0.00      A       
ATOM    325  HE1 TYR A  20     -12.899   0.523   2.850  1.00  0.00      A       
ATOM    326  HE2 TYR A  20     -11.184  -2.440   5.443  1.00  0.00      A       
ATOM    327  HH  TYR A  20     -13.823  -1.480   5.019  1.00  0.00      A       
ATOM    328  N   TYR A  20      -8.249  -2.625  -0.619  1.00  0.00      A       
ATOM    329  O   TYR A  20     -11.699  -2.484   0.022  1.00  0.00      A       
ATOM    330  OH  TYR A  20     -13.201  -0.759   5.141  1.00  0.00      A       
ATOM    331  C   ARG A  21     -12.261  -1.670  -2.840  1.00  0.00      A       
ATOM    332  CA  ARG A  21     -11.728  -0.597  -1.892  1.00  0.00      A       
ATOM    333  CB  ARG A  21     -11.378   0.657  -2.692  1.00  0.00      A       
ATOM    334  CD  ARG A  21     -11.877   3.092  -2.955  1.00  0.00      A       
ATOM    335  CG  ARG A  21     -12.098   1.856  -2.081  1.00  0.00      A       
ATOM    336  CZ  ARG A  21     -13.391   4.975  -2.777  1.00  0.00      A       
ATOM    337  HN  ARG A  21      -9.626  -0.740  -1.431  1.00  0.00      A       
ATOM    338  HA  ARG A  21     -12.485  -0.356  -1.160  1.00  0.00      A       
ATOM    339  HB2 ARG A  21     -10.310   0.819  -2.658  1.00  0.00      A       
ATOM    340  HB1 ARG A  21     -11.693   0.532  -3.717  1.00  0.00      A       
ATOM    341  HD2 ARG A  21     -11.215   3.778  -2.447  1.00  0.00      A       
ATOM    342  HD1 ARG A  21     -11.437   2.796  -3.895  1.00  0.00      A       
ATOM    343  HE  ARG A  21     -13.892   3.286  -3.693  1.00  0.00      A       
ATOM    344  HG2 ARG A  21     -13.155   1.643  -2.018  1.00  0.00      A       
ATOM    345  HG1 ARG A  21     -11.708   2.039  -1.093  1.00  0.00      A       
ATOM    346 HH11 ARG A  21     -11.488   5.547  -3.021  1.00  0.00      A       
ATOM    347 HH12 ARG A  21     -12.560   6.756  -2.397  1.00  0.00      A       
ATOM    348 HH21 ARG A  21     -15.342   4.687  -2.433  1.00  0.00      A       
ATOM    349 HH22 ARG A  21     -14.743   6.270  -2.068  1.00  0.00      A       
ATOM    350  N   ARG A  21     -10.509  -1.102  -1.199  1.00  0.00      A       
ATOM    351  NE  ARG A  21     -13.186   3.760  -3.206  1.00  0.00      A       
ATOM    352  NH1 ARG A  21     -12.403   5.826  -2.728  1.00  0.00      A       
ATOM    353  NH2 ARG A  21     -14.585   5.339  -2.396  1.00  0.00      A       
ATOM    354  O   ARG A  21     -13.434  -1.714  -3.150  1.00  0.00      A       
ATOM    355  C   SER A  22     -12.713  -4.623  -3.492  1.00  0.00      A       
ATOM    356  CA  SER A  22     -11.855  -3.600  -4.243  1.00  0.00      A       
ATOM    357  CB  SER A  22     -10.634  -4.303  -4.839  1.00  0.00      A       
ATOM    358  HN  SER A  22     -10.462  -2.469  -3.045  1.00  0.00      A       
ATOM    359  HA  SER A  22     -12.437  -3.159  -5.037  1.00  0.00      A       
ATOM    360  HB2 SER A  22     -10.324  -3.792  -5.735  1.00  0.00      A       
ATOM    361  HB1 SER A  22      -9.825  -4.289  -4.121  1.00  0.00      A       
ATOM    362  HG  SER A  22     -10.509  -6.224  -4.553  1.00  0.00      A       
ATOM    363  N   SER A  22     -11.404  -2.530  -3.307  1.00  0.00      A       
ATOM    364  O   SER A  22     -13.857  -4.856  -3.832  1.00  0.00      A       
ATOM    365  OG  SER A  22     -10.975  -5.645  -5.161  1.00  0.00      A       
ATOM    366  C   VAL A  23     -14.218  -5.623  -1.141  1.00  0.00      A       
ATOM    367  CA  VAL A  23     -12.949  -6.257  -1.715  1.00  0.00      A       
ATOM    368  CB  VAL A  23     -12.091  -6.798  -0.571  1.00  0.00      A       
ATOM    369  CG1 VAL A  23     -12.911  -7.787   0.261  1.00  0.00      A       
ATOM    370  CG2 VAL A  23     -10.867  -7.511  -1.148  1.00  0.00      A       
ATOM    371  HN  VAL A  23     -11.243  -5.043  -2.228  1.00  0.00      A       
ATOM    372  HA  VAL A  23     -13.221  -7.070  -2.372  1.00  0.00      A       
ATOM    373  HB  VAL A  23     -11.771  -5.979   0.057  1.00  0.00      A       
ATOM    374 HG11 VAL A  23     -13.957  -7.524   0.205  1.00  0.00      A       
ATOM    375 HG12 VAL A  23     -12.770  -8.786  -0.125  1.00  0.00      A       
ATOM    376 HG13 VAL A  23     -12.585  -7.748   1.289  1.00  0.00      A       
ATOM    377 HG21 VAL A  23     -11.163  -8.097  -2.005  1.00  0.00      A       
ATOM    378 HG22 VAL A  23     -10.133  -6.777  -1.450  1.00  0.00      A       
ATOM    379 HG23 VAL A  23     -10.440  -8.159  -0.398  1.00  0.00      A       
ATOM    380  N   VAL A  23     -12.169  -5.241  -2.481  1.00  0.00      A       
ATOM    381  O   VAL A  23     -15.252  -6.256  -1.050  1.00  0.00      A       
ATOM    382  C   ILE A  24     -16.037  -2.877  -1.255  1.00  0.00      A       
ATOM    383  CA  ILE A  24     -15.354  -3.719  -0.171  1.00  0.00      A       
ATOM    384  CB  ILE A  24     -14.927  -2.829   1.002  1.00  0.00      A       
ATOM    385  CD1 ILE A  24     -13.270  -4.544   1.763  1.00  0.00      A       
ATOM    386  CG1 ILE A  24     -14.487  -3.712   2.174  1.00  0.00      A       
ATOM    387  CG2 ILE A  24     -16.099  -1.954   1.447  1.00  0.00      A       
ATOM    388  HN  ILE A  24     -13.307  -3.890  -0.822  1.00  0.00      A       
ATOM    389  HA  ILE A  24     -16.043  -4.473   0.183  1.00  0.00      A       
ATOM    390  HB  ILE A  24     -14.103  -2.200   0.696  1.00  0.00      A       
ATOM    391 HD11 ILE A  24     -12.751  -4.049   0.956  1.00  0.00      A       
ATOM    392 HD12 ILE A  24     -12.604  -4.650   2.607  1.00  0.00      A       
ATOM    393 HD13 ILE A  24     -13.595  -5.521   1.436  1.00  0.00      A       
ATOM    394 HG12 ILE A  24     -14.229  -3.088   3.017  1.00  0.00      A       
ATOM    395 HG11 ILE A  24     -15.295  -4.373   2.450  1.00  0.00      A       
ATOM    396 HG21 ILE A  24     -17.023  -2.499   1.324  1.00  0.00      A       
ATOM    397 HG22 ILE A  24     -15.975  -1.686   2.486  1.00  0.00      A       
ATOM    398 HG23 ILE A  24     -16.128  -1.057   0.846  1.00  0.00      A       
ATOM    399  N   ILE A  24     -14.150  -4.383  -0.746  1.00  0.00      A       
ATOM    400  O   ILE A  24     -16.852  -2.020  -0.975  1.00  0.00      A       
ATOM    401  C   LYS A  25     -17.846  -2.635  -3.644  1.00  0.00      A       
ATOM    402  CA  LYS A  25     -16.346  -2.337  -3.597  1.00  0.00      A       
ATOM    403  CB  LYS A  25     -15.708  -2.730  -4.932  1.00  0.00      A       
ATOM    404  CD  LYS A  25     -17.161  -2.993  -6.949  1.00  0.00      A       
ATOM    405  CE  LYS A  25     -16.187  -3.637  -7.939  1.00  0.00      A       
ATOM    406  CG  LYS A  25     -16.411  -1.989  -6.071  1.00  0.00      A       
ATOM    407  HN  LYS A  25     -15.059  -3.817  -2.705  1.00  0.00      A       
ATOM    408  HA  LYS A  25     -16.194  -1.282  -3.423  1.00  0.00      A       
ATOM    409  HB2 LYS A  25     -14.661  -2.466  -4.921  1.00  0.00      A       
ATOM    410  HB1 LYS A  25     -15.811  -3.794  -5.080  1.00  0.00      A       
ATOM    411  HD2 LYS A  25     -17.600  -3.758  -6.325  1.00  0.00      A       
ATOM    412  HD1 LYS A  25     -17.940  -2.482  -7.495  1.00  0.00      A       
ATOM    413  HE2 LYS A  25     -15.176  -3.314  -7.733  1.00  0.00      A       
ATOM    414  HE1 LYS A  25     -16.258  -4.712  -7.891  1.00  0.00      A       
ATOM    415  HG2 LYS A  25     -17.111  -1.276  -5.658  1.00  0.00      A       
ATOM    416  HG1 LYS A  25     -15.677  -1.469  -6.669  1.00  0.00      A       
ATOM    417  HZ1 LYS A  25     -17.659  -3.028  -9.280  1.00  0.00      A       
ATOM    418  HZ2 LYS A  25     -16.163  -2.250  -9.491  1.00  0.00      A       
ATOM    419  HZ3 LYS A  25     -16.361  -3.854 -10.003  1.00  0.00      A       
ATOM    420  N   LYS A  25     -15.714  -3.119  -2.496  1.00  0.00      A       
ATOM    421  NZ  LYS A  25     -16.626  -3.156  -9.279  1.00  0.00      A       
ATOM    422  O   LYS A  25     -18.264  -3.700  -4.054  1.00  0.00      A       
ATOM    423  C   ALA A  26     -20.492  -3.067  -2.296  1.00  0.00      A       
ATOM    424  CA  ALA A  26     -20.133  -1.932  -3.258  1.00  0.00      A       
ATOM    425  CB  ALA A  26     -20.564  -2.311  -4.677  1.00  0.00      A       
ATOM    426  HN  ALA A  26     -18.304  -0.848  -2.909  1.00  0.00      A       
ATOM    427  HA  ALA A  26     -20.644  -1.029  -2.957  1.00  0.00      A       
ATOM    428  HB1 ALA A  26     -20.220  -1.558  -5.371  1.00  0.00      A       
ATOM    429  HB2 ALA A  26     -20.133  -3.266  -4.941  1.00  0.00      A       
ATOM    430  HB3 ALA A  26     -21.641  -2.377  -4.722  1.00  0.00      A       
ATOM    431  N   ALA A  26     -18.661  -1.702  -3.232  1.00  0.00      A       
ATOM    432  OT1 ALA A  26     -21.659  -3.188  -1.963  1.00  0.00      A       
ATOM    433  OT2 ALA A  26     -19.593  -3.794  -1.907  1.00  0.00      A       
END


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