CNRS Nantes University UFIP UFIP
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***  inhibitor1  ***

elNémo ID: 200915033340135109

Job options:

ID        	=	 200915033340135109
JOBID     	=	 inhibitor1
USERID    	=	 joakosamu
PRIVAT    	=	 0

NMODES    	=	 5
DQMIN     	=	 -100
DQMAX     	=	 100
DQSTEP    	=	 20
DOGRAPHS  	=	 on

DOPROJMODS	=	 0
DORMSD    	=	 0

NRBL      	=	 0
CUTOFF    	=	 0
CAONLY    	=	 0


Input data for this run:

HEADER inhibitor1

REMARK   4      COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006
REMARK 888
REMARK 888 WRITTEN BY MAESTRO (A PRODUCT OF SCHRODINGER, LLC)
TITLE     Displayed atoms
MODEL        1
ATOM      1  N   ILE A   1     -16.040  13.269  17.015  1.00  3.02           N1+
ATOM      2  CA  ILE A   1     -15.406  12.081  16.417  1.00  3.02           C  
ATOM      3  C   ILE A   1     -14.565  12.432  15.179  1.00  3.02           C  
ATOM      4  O   ILE A   1     -13.478  11.866  15.045  1.00  3.02           O  
ATOM      5  CB  ILE A   1     -16.416  10.928  16.132  1.00  3.02           C  
ATOM      6  CG2 ILE A   1     -16.898  10.264  17.425  1.00  3.02           C  
ATOM      7  CG1 ILE A   1     -17.565  11.184  15.108  1.00  3.02           C  
ATOM      8  CD1 ILE A   1     -18.578  12.262  15.507  1.00  3.02           C  
ATOM      9  HA  ILE A   1     -14.662  11.713  17.124  1.00  3.02           H  
ATOM     10  HB  ILE A   1     -15.811  10.167  15.640  1.00  3.02           H  
ATOM     11 1HG2 ILE A   1     -17.537   9.412  17.193  1.00  3.02           H  
ATOM     12 2HG2 ILE A   1     -16.048   9.891  17.996  1.00  3.02           H  
ATOM     13 3HG2 ILE A   1     -17.456  10.967  18.044  1.00  3.02           H  
ATOM     14 1HG1 ILE A   1     -18.102  10.246  14.965  1.00  3.02           H  
ATOM     15 2HG1 ILE A   1     -17.164  11.413  14.121  1.00  3.02           H  
ATOM     16  HD1 ILE A   1     -19.394  12.284  14.785  1.00  3.02           H  
ATOM     17  HD2 ILE A   1     -19.040  12.043  16.469  1.00  3.02           H  
ATOM     18  HD3 ILE A   1     -18.149  13.264  15.513  1.00  3.02           H  
ATOM     19  H1  ILE A   1     -16.625  13.796  16.382  1.00  0.00           H  
ATOM     20  H2  ILE A   1     -16.608  13.043  17.819  1.00  0.00           H  
ATOM     21  H3  ILE A   1     -15.314  13.914  17.294  1.00  0.00           H  
ATOM     22  N   GLU A   2     -15.038  13.312  14.281  1.00  1.85           N  
ATOM     23  CA  GLU A   2     -14.555  13.596  12.916  1.00  1.85           C  
ATOM     24  C   GLU A   2     -13.089  13.265  12.537  1.00  1.85           C  
ATOM     25  O   GLU A   2     -12.844  12.522  11.580  1.00  1.85           O  
ATOM     26  CB  GLU A   2     -15.091  14.981  12.472  1.00  1.85           C  
ATOM     27  CG  GLU A   2     -14.598  15.540  11.122  1.00  1.85           C  
ATOM     28  CD  GLU A   2     -14.977  14.712   9.899  1.00  1.85           C  
ATOM     29  OE1 GLU A   2     -16.035  14.038   9.917  1.00  1.85           O  
ATOM     30  OE2 GLU A   2     -14.187  14.759   8.933  1.00  1.85           O1-
ATOM     31  H   GLU A   2     -15.976  13.663  14.408  1.00  1.85           H  
ATOM     32  HA  GLU A   2     -15.073  12.844  12.322  1.00  1.85           H  
ATOM     33  HB1 GLU A   2     -14.804  15.705  13.234  1.00  1.85           H  
ATOM     34  HB2 GLU A   2     -16.181  14.976  12.452  1.00  1.85           H  
ATOM     35  HG1 GLU A   2     -13.515  15.662  11.127  1.00  1.85           H  
ATOM     36  HG2 GLU A   2     -15.019  16.536  10.986  1.00  1.85           H  
ATOM     37  N   GLU A   3     -12.111  13.746  13.317  1.00  1.52           N  
ATOM     38  CA  GLU A   3     -10.689  13.552  13.058  1.00  1.52           C  
ATOM     39  C   GLU A   3     -10.198  12.098  13.214  1.00  1.52           C  
ATOM     40  O   GLU A   3      -9.103  11.764  12.754  1.00  1.52           O  
ATOM     41  CB  GLU A   3      -9.875  14.541  13.905  1.00  1.52           C  
ATOM     42  CG  GLU A   3     -10.248  16.030  13.619  1.00  1.52           C  
ATOM     43  CD  GLU A   3     -10.029  16.418  12.162  1.00  1.52           C  
ATOM     44  OE1 GLU A   3     -11.046  16.589  11.442  1.00  1.52           O  
ATOM     45  OE2 GLU A   3      -8.861  16.507  11.741  1.00  1.52           O1-
ATOM     46  H   GLU A   3     -12.370  14.325  14.103  1.00  1.52           H  
ATOM     47  HA  GLU A   3     -10.502  13.789  12.010  1.00  1.52           H  
ATOM     48  HB1 GLU A   3      -8.812  14.431  13.690  1.00  1.52           H  
ATOM     49  HB2 GLU A   3     -10.005  14.343  14.969  1.00  1.52           H  
ATOM     50  HG1 GLU A   3      -9.645  16.708  14.224  1.00  1.52           H  
ATOM     51  HG2 GLU A   3     -11.288  16.242  13.868  1.00  1.52           H  
ATOM     52  N   GLN A   4     -11.037  11.202  13.753  1.00  1.25           N  
ATOM     53  CA  GLN A   4     -10.870   9.745  13.659  1.00  1.25           C  
ATOM     54  C   GLN A   4     -10.970   9.252  12.212  1.00  1.25           C  
ATOM     55  O   GLN A   4     -10.255   8.320  11.837  1.00  1.25           O  
ATOM     56  CB  GLN A   4     -11.965   9.053  14.498  1.00  1.25           C  
ATOM     57  CG  GLN A   4     -11.742   9.143  16.020  1.00  1.25           C  
ATOM     58  CD  GLN A   4     -12.775   8.324  16.797  1.00  1.25           C  
ATOM     59  OE1 GLN A   4     -13.924   8.196  16.404  1.00  1.25           O  
ATOM     60  NE2 GLN A   4     -12.374   7.727  17.909  1.00  1.25           N  
ATOM     61  H   GLN A   4     -11.920  11.552  14.097  1.00  1.25           H  
ATOM     62  HA  GLN A   4      -9.889   9.470  14.046  1.00  1.25           H  
ATOM     63  HB1 GLN A   4     -11.976   7.994  14.242  1.00  1.25           H  
ATOM     64  HB2 GLN A   4     -12.942   9.451  14.222  1.00  1.25           H  
ATOM     65  HG1 GLN A   4     -11.799  10.182  16.342  1.00  1.25           H  
ATOM     66  HG2 GLN A   4     -10.749   8.778  16.278  1.00  1.25           H  
ATOM     67 1HE2 GLN A   4     -11.413   7.814  18.206  1.00  1.25           H  
ATOM     68 2HE2 GLN A   4     -13.001   7.096  18.388  1.00  1.25           H  
ATOM     69  N   ALA A   5     -11.819   9.879  11.391  1.00  0.99           N  
ATOM     70  CA  ALA A   5     -11.966   9.550   9.984  1.00  0.99           C  
ATOM     71  C   ALA A   5     -10.758  10.051   9.167  1.00  0.99           C  
ATOM     72  O   ALA A   5     -10.235   9.328   8.321  1.00  0.99           O  
ATOM     73  CB  ALA A   5     -13.233  10.216   9.438  1.00  0.99           C  
ATOM     74  H   ALA A   5     -12.308  10.686  11.752  1.00  0.99           H  
ATOM     75  HA  ALA A   5     -12.042   8.470   9.863  1.00  0.99           H  
ATOM     76  HB1 ALA A   5     -13.422   9.881   8.418  1.00  0.99           H  
ATOM     77  HB2 ALA A   5     -14.107   9.977  10.043  1.00  0.99           H  
ATOM     78  HB3 ALA A   5     -13.164  11.304   9.398  1.00  0.99           H  
ATOM     79  N   LYS A   6     -10.252  11.257   9.486  1.00  0.89           N  
ATOM     80  CA  LYS A   6      -9.056  11.824   8.863  1.00  0.89           C  
ATOM     81  C   LYS A   6      -7.817  10.966   9.169  1.00  0.89           C  
ATOM     82  O   LYS A   6      -7.045  10.657   8.261  1.00  0.89           O  
ATOM     83  CB  LYS A   6      -8.796  13.240   9.393  1.00  0.89           C  
ATOM     84  CG  LYS A   6      -9.961  14.244   9.287  1.00  0.89           C  
ATOM     85  CD  LYS A   6     -10.486  14.588   7.907  1.00  0.89           C  
ATOM     86  CE  LYS A   6     -11.086  16.013   7.866  1.00  0.89           C  
ATOM     87  NZ  LYS A   6     -12.044  16.282   8.950  1.00  0.89           N1+
ATOM     88  H   LYS A   6     -10.739  11.798  10.187  1.00  0.89           H  
ATOM     89  HA  LYS A   6      -9.212  11.849   7.785  1.00  0.89           H  
ATOM     90  HB1 LYS A   6      -7.931  13.662   8.879  1.00  0.89           H  
ATOM     91  HB2 LYS A   6      -8.495  13.202  10.440  1.00  0.89           H  
ATOM     92  HG1 LYS A   6      -9.604  15.157   9.763  1.00  0.89           H  
ATOM     93  HG2 LYS A   6     -10.797  13.905   9.899  1.00  0.89           H  
ATOM     94  HD1 LYS A   6     -11.213  13.843   7.587  1.00  0.89           H  
ATOM     95  HD2 LYS A   6      -9.682  14.527   7.173  1.00  0.89           H  
ATOM     96  HE1 LYS A   6     -11.591  16.180   6.914  1.00  0.89           H  
ATOM     97  HE2 LYS A   6     -10.298  16.764   7.917  1.00  0.89           H  
ATOM     98  HZ1 LYS A   6     -11.588  16.228   9.849  1.00  0.89           H  
ATOM     99  HZ2 LYS A   6     -12.381  17.228   8.844  1.00  0.89           H  
ATOM    100  HZ3 LYS A   6     -12.839  15.661   8.934  1.00  0.89           H  
ATOM    101  N   THR A   7      -7.618  10.554  10.429  1.00  0.87           N  
ATOM    102  CA  THR A   7      -6.482   9.724  10.837  1.00  0.87           C  
ATOM    103  C   THR A   7      -6.614   8.259  10.379  1.00  0.87           C  
ATOM    104  O   THR A   7      -5.592   7.601  10.168  1.00  0.87           O  
ATOM    105  CB  THR A   7      -6.224   9.852  12.351  1.00  0.87           C  
ATOM    106  CG2 THR A   7      -5.695  11.237  12.757  1.00  0.87           C  
ATOM    107  OG1 THR A   7      -7.383   9.576  13.119  1.00  0.87           O  
ATOM    108  H   THR A   7      -8.278  10.840  11.137  1.00  0.87           H  
ATOM    109  HA  THR A   7      -5.592  10.091  10.328  1.00  0.87           H  
ATOM    110  HB  THR A   7      -5.463   9.123  12.630  1.00  0.87           H  
ATOM    111 1HG2 THR A   7      -5.526  11.323  13.830  1.00  0.87           H  
ATOM    112 2HG2 THR A   7      -4.752  11.472  12.263  1.00  0.87           H  
ATOM    113 3HG2 THR A   7      -6.403  12.019  12.484  1.00  0.87           H  
ATOM    114  HG1 THR A   7      -7.983  10.301  13.024  1.00  0.87           H  
ATOM    115  N   PHE A   8      -7.837   7.767  10.131  1.00  0.75           N  
ATOM    116  CA  PHE A   8      -8.105   6.501   9.456  1.00  0.75           C  
ATOM    117  C   PHE A   8      -7.684   6.609   7.980  1.00  0.75           C  
ATOM    118  O   PHE A   8      -6.960   5.740   7.494  1.00  0.75           O  
ATOM    119  CB  PHE A   8      -9.610   6.136   9.602  1.00  0.75           C  
ATOM    120  CG  PHE A   8     -10.050   4.861   8.890  1.00  0.75           C  
ATOM    121  CD1 PHE A   8      -9.526   3.615   9.298  1.00  0.75           C  
ATOM    122  CE1 PHE A   8      -9.891   2.446   8.622  1.00  0.75           C  
ATOM    123  CZ  PHE A   8     -10.799   2.511   7.549  1.00  0.75           C  
ATOM    124  CE2 PHE A   8     -11.343   3.751   7.146  1.00  0.75           C  
ATOM    125  CD2 PHE A   8     -10.968   4.922   7.833  1.00  0.75           C  
ATOM    126  H   PHE A   8      -8.640   8.320  10.396  1.00  0.75           H  
ATOM    127  HA  PHE A   8      -7.506   5.714   9.915  1.00  0.75           H  
ATOM    128  HB1 PHE A   8     -10.247   6.954   9.265  1.00  0.75           H  
ATOM    129  HB2 PHE A   8      -9.836   6.033  10.663  1.00  0.75           H  
ATOM    130  HD1 PHE A   8      -8.823   3.550  10.115  1.00  0.75           H  
ATOM    131  HE1 PHE A   8      -9.484   1.493   8.926  1.00  0.75           H  
ATOM    132  HZ  PHE A   8     -11.091   1.609   7.033  1.00  0.75           H  
ATOM    133  HE2 PHE A   8     -12.054   3.780   6.333  1.00  0.75           H  
ATOM    134  HD2 PHE A   8     -11.401   5.858   7.513  1.00  0.75           H  
ATOM    135  N   LEU A   9      -8.054   7.693   7.283  1.00  0.73           N  
ATOM    136  CA  LEU A   9      -7.625   7.969   5.904  1.00  0.73           C  
ATOM    137  C   LEU A   9      -6.088   8.134   5.795  1.00  0.73           C  
ATOM    138  O   LEU A   9      -5.485   7.597   4.879  1.00  0.73           O  
ATOM    139  CB  LEU A   9      -8.334   9.215   5.349  1.00  0.73           C  
ATOM    140  CG  LEU A   9      -9.827   9.013   5.024  1.00  0.73           C  
ATOM    141  CD1 LEU A   9     -10.574  10.344   4.930  1.00  0.73           C  
ATOM    142  CD2 LEU A   9     -10.027   8.187   3.738  1.00  0.73           C  
ATOM    143  H   LEU A   9      -8.677   8.365   7.707  1.00  0.73           H  
ATOM    144  HA  LEU A   9      -7.884   7.101   5.299  1.00  0.73           H  
ATOM    145  HB1 LEU A   9      -7.825   9.526   4.436  1.00  0.73           H  
ATOM    146  HB2 LEU A   9      -8.221  10.045   6.046  1.00  0.73           H  
ATOM    147  HG  LEU A   9     -10.271   8.446   5.843  1.00  0.73           H  
ATOM    148 1HD1 LEU A   9     -11.624  10.205   4.672  1.00  0.73           H  
ATOM    149 2HD1 LEU A   9     -10.560  10.863   5.888  1.00  0.73           H  
ATOM    150 3HD1 LEU A   9     -10.118  11.005   4.193  1.00  0.73           H  
ATOM    151 1HD2 LEU A   9     -11.081   7.998   3.535  1.00  0.73           H  
ATOM    152 2HD2 LEU A   9      -9.617   8.685   2.860  1.00  0.73           H  
ATOM    153 3HD2 LEU A   9      -9.564   7.202   3.800  1.00  0.73           H  
ATOM    154  N   ASP A  10      -5.468   8.838   6.756  1.00  0.80           N  
ATOM    155  CA  ASP A  10      -4.018   9.004   6.915  1.00  0.80           C  
ATOM    156  C   ASP A  10      -3.290   7.642   6.959  1.00  0.80           C  
ATOM    157  O   ASP A  10      -2.477   7.315   6.094  1.00  0.80           O  
ATOM    158  CB  ASP A  10      -3.766   9.891   8.172  1.00  0.80           C  
ATOM    159  CG  ASP A  10      -2.401  10.551   8.263  1.00  0.80           C  
ATOM    160  OD1 ASP A  10      -2.365  11.800   8.212  1.00  0.80           O  
ATOM    161  OD2 ASP A  10      -1.372   9.869   8.462  1.00  0.80           O1-
ATOM    162  H   ASP A  10      -6.065   9.301   7.426  1.00  0.80           H  
ATOM    163  HA  ASP A  10      -3.668   9.530   6.026  1.00  0.80           H  
ATOM    164  HB1 ASP A  10      -3.894   9.299   9.078  1.00  0.80           H  
ATOM    165  HB2 ASP A  10      -4.489  10.705   8.215  1.00  0.80           H  
ATOM    166  N   LYS A  11      -3.719   6.765   7.882  1.00  0.88           N  
ATOM    167  CA  LYS A  11      -3.215   5.400   8.039  1.00  0.88           C  
ATOM    168  C   LYS A  11      -3.587   4.458   6.884  1.00  0.88           C  
ATOM    169  O   LYS A  11      -2.817   3.537   6.618  1.00  0.88           O  
ATOM    170  CB  LYS A  11      -3.752   4.805   9.356  1.00  0.88           C  
ATOM    171  CG  LYS A  11      -2.842   5.096  10.565  1.00  0.88           C  
ATOM    172  CD  LYS A  11      -1.770   4.006  10.810  1.00  0.88           C  
ATOM    173  CE  LYS A  11      -0.561   4.040   9.860  1.00  0.88           C  
ATOM    174  NZ  LYS A  11       0.376   2.948  10.135  1.00  0.88           N1+
ATOM    175  H   LYS A  11      -4.420   7.088   8.533  1.00  0.88           H  
ATOM    176  HA  LYS A  11      -2.130   5.498   8.077  1.00  0.88           H  
ATOM    177  HB1 LYS A  11      -3.913   3.729   9.290  1.00  0.88           H  
ATOM    178  HB2 LYS A  11      -4.747   5.192   9.576  1.00  0.88           H  
ATOM    179  HG1 LYS A  11      -3.469   5.136  11.456  1.00  0.88           H  
ATOM    180  HG2 LYS A  11      -2.410   6.094  10.501  1.00  0.88           H  
ATOM    181  HD1 LYS A  11      -2.236   3.022  10.785  1.00  0.88           H  
ATOM    182  HD2 LYS A  11      -1.413   4.122  11.833  1.00  0.88           H  
ATOM    183  HE1 LYS A  11      -0.031   4.990   9.924  1.00  0.88           H  
ATOM    184  HE2 LYS A  11      -0.885   3.895   8.829  1.00  0.88           H  
ATOM    185  HZ1 LYS A  11       0.680   2.925  11.098  1.00  0.88           H  
ATOM    186  HZ2 LYS A  11      -0.074   2.093   9.840  1.00  0.88           H  
ATOM    187  HZ3 LYS A  11       1.191   3.022   9.543  1.00  0.88           H  
ATOM    188  N   PHE A  12      -4.710   4.679   6.190  1.00  1.06           N  
ATOM    189  CA  PHE A  12      -5.122   3.946   4.991  1.00  1.06           C  
ATOM    190  C   PHE A  12      -4.115   4.175   3.860  1.00  1.06           C  
ATOM    191  O   PHE A  12      -3.623   3.197   3.292  1.00  1.06           O  
ATOM    192  CB  PHE A  12      -6.546   4.381   4.559  1.00  1.06           C  
ATOM    193  CG  PHE A  12      -7.183   3.640   3.380  1.00  1.06           C  
ATOM    194  CD1 PHE A  12      -8.173   2.653   3.633  1.00  1.06           C  
ATOM    195  CE1 PHE A  12      -8.813   2.000   2.567  1.00  1.06           C  
ATOM    196  CZ  PHE A  12      -8.452   2.301   1.246  1.00  1.06           C  
ATOM    197  CE2 PHE A  12      -7.479   3.287   0.984  1.00  1.06           C  
ATOM    198  CD2 PHE A  12      -6.859   3.965   2.047  1.00  1.06           C  
ATOM    199  H   PHE A  12      -5.317   5.422   6.507  1.00  1.06           H  
ATOM    200  HA  PHE A  12      -5.128   2.884   5.234  1.00  1.06           H  
ATOM    201  HB1 PHE A  12      -6.566   5.438   4.294  1.00  1.06           H  
ATOM    202  HB2 PHE A  12      -7.218   4.278   5.410  1.00  1.06           H  
ATOM    203  HD1 PHE A  12      -8.472   2.408   4.642  1.00  1.06           H  
ATOM    204  HE1 PHE A  12      -9.573   1.261   2.773  1.00  1.06           H  
ATOM    205  HZ  PHE A  12      -8.943   1.781   0.437  1.00  1.06           H  
ATOM    206  HE2 PHE A  12      -7.210   3.513  -0.037  1.00  1.06           H  
ATOM    207  HD2 PHE A  12      -6.129   4.735   1.841  1.00  1.06           H  
ATOM    208  N   ASN A  13      -3.775   5.435   3.575  1.00  1.05           N  
ATOM    209  CA  ASN A  13      -2.829   5.818   2.527  1.00  1.05           C  
ATOM    210  C   ASN A  13      -1.411   5.280   2.802  1.00  1.05           C  
ATOM    211  O   ASN A  13      -0.796   4.719   1.897  1.00  1.05           O  
ATOM    212  CB  ASN A  13      -2.772   7.347   2.339  1.00  1.05           C  
ATOM    213  CG  ASN A  13      -3.968   7.954   1.601  1.00  1.05           C  
ATOM    214  OD1 ASN A  13      -3.944   8.130   0.385  1.00  1.05           O  
ATOM    215  ND2 ASN A  13      -5.028   8.335   2.302  1.00  1.05           N  
ATOM    216  H   ASN A  13      -4.226   6.164   4.110  1.00  1.05           H  
ATOM    217  HA  ASN A  13      -3.166   5.386   1.585  1.00  1.05           H  
ATOM    218  HB1 ASN A  13      -1.878   7.610   1.775  1.00  1.05           H  
ATOM    219  HB2 ASN A  13      -2.629   7.831   3.305  1.00  1.05           H  
ATOM    220 1HD2 ASN A  13      -5.074   8.190   3.301  1.00  1.05           H  
ATOM    221 2HD2 ASN A  13      -5.818   8.741   1.821  1.00  1.05           H  
ATOM    222  N   HIS A  14      -0.922   5.383   4.053  1.00  1.00           N  
ATOM    223  CA  HIS A  14       0.435   4.970   4.425  1.00  1.00           C  
ATOM    224  C   HIS A  14       0.648   3.445   4.311  1.00  1.00           C  
ATOM    225  O   HIS A  14       1.685   3.027   3.796  1.00  1.00           O  
ATOM    226  CB  HIS A  14       0.774   5.416   5.862  1.00  1.00           C  
ATOM    227  CG  HIS A  14       1.105   6.869   6.026  1.00  1.00           C  
ATOM    228  ND1 HIS A  14       2.165   7.486   5.333  1.00  1.00           N  
ATOM    229  CE1 HIS A  14       2.162   8.748   5.765  1.00  1.00           C  
ATOM    230  NE2 HIS A  14       1.222   8.964   6.688  1.00  1.00           N  
ATOM    231  CD2 HIS A  14       0.526   7.794   6.867  1.00  1.00           C  
ATOM    232  H   HIS A  14      -1.485   5.871   4.734  1.00  1.00           H  
ATOM    233  HA  HIS A  14       1.133   5.450   3.739  1.00  1.00           H  
ATOM    234  HB1 HIS A  14       1.640   4.851   6.209  1.00  1.00           H  
ATOM    235  HB2 HIS A  14      -0.041   5.154   6.536  1.00  1.00           H  
ATOM    236  HE1 HIS A  14       2.841   9.519   5.430  1.00  1.00           H  
ATOM    237  HE2 HIS A  14       1.024   9.843   7.145  1.00  1.00           H  
ATOM    238  HD2 HIS A  14      -0.305   7.731   7.554  1.00  1.00           H  
ATOM    239  N   GLU A  15      -0.314   2.630   4.764  1.00  1.27           N  
ATOM    240  CA  GLU A  15      -0.235   1.170   4.680  1.00  1.27           C  
ATOM    241  C   GLU A  15      -0.527   0.710   3.230  1.00  1.27           C  
ATOM    242  O   GLU A  15      -0.007  -0.320   2.797  1.00  1.27           O  
ATOM    243  CB  GLU A  15      -1.238   0.518   5.676  1.00  1.27           C  
ATOM    244  CG  GLU A  15      -0.597  -0.355   6.771  1.00  1.27           C  
ATOM    245  CD  GLU A  15      -0.036   0.473   7.926  1.00  1.27           C  
ATOM    246  OE1 GLU A  15      -0.816   1.060   8.710  1.00  1.27           O  
ATOM    247  OE2 GLU A  15       1.196   0.462   8.135  1.00  1.27           O1-
ATOM    248  H   GLU A  15      -1.151   3.048   5.146  1.00  1.27           H  
ATOM    249  HA  GLU A  15       0.784   0.869   4.923  1.00  1.27           H  
ATOM    250  HB1 GLU A  15      -1.953  -0.105   5.138  1.00  1.27           H  
ATOM    251  HB2 GLU A  15      -1.890   1.269   6.124  1.00  1.27           H  
ATOM    252  HG1 GLU A  15       0.178  -0.995   6.350  1.00  1.27           H  
ATOM    253  HG2 GLU A  15      -1.333  -1.035   7.198  1.00  1.27           H  
ATOM    254  N   ALA A  16      -1.327   1.467   2.456  1.00  1.38           N  
ATOM    255  CA  ALA A  16      -1.650   1.170   1.057  1.00  1.38           C  
ATOM    256  C   ALA A  16      -0.431   1.372   0.142  1.00  1.38           C  
ATOM    257  O   ALA A  16      -0.275   0.643  -0.842  1.00  1.38           O  
ATOM    258  CB  ALA A  16      -2.794   2.071   0.558  1.00  1.38           C  
ATOM    259  H   ALA A  16      -1.716   2.306   2.862  1.00  1.38           H  
ATOM    260  HA  ALA A  16      -1.951   0.124   0.985  1.00  1.38           H  
ATOM    261  HB1 ALA A  16      -3.041   1.852  -0.480  1.00  1.38           H  
ATOM    262  HB2 ALA A  16      -3.696   1.917   1.151  1.00  1.38           H  
ATOM    263  HB3 ALA A  16      -2.535   3.129   0.617  1.00  1.38           H  
ATOM    264  N   GLU A  17       0.470   2.304   0.470  1.00  1.17           N  
ATOM    265  CA  GLU A  17       1.742   2.532  -0.221  1.00  1.17           C  
ATOM    266  C   GLU A  17       2.685   1.321  -0.095  1.00  1.17           C  
ATOM    267  O   GLU A  17       3.381   1.028  -1.072  1.00  1.17           O  
ATOM    268  CB  GLU A  17       2.423   3.796   0.344  1.00  1.17           C  
ATOM    269  CG  GLU A  17       1.856   5.099  -0.240  1.00  1.17           C  
ATOM    270  CD  GLU A  17       2.351   5.428  -1.639  1.00  1.17           C  
ATOM    271  OE1 GLU A  17       3.584   5.433  -1.841  1.00  1.17           O  
ATOM    272  OE2 GLU A  17       1.521   5.758  -2.506  1.00  1.17           O1-
ATOM    273  H   GLU A  17       0.252   2.915   1.244  1.00  1.17           H  
ATOM    274  HA  GLU A  17       1.541   2.664  -1.284  1.00  1.17           H  
ATOM    275  HB1 GLU A  17       3.496   3.789   0.153  1.00  1.17           H  
ATOM    276  HB2 GLU A  17       2.320   3.798   1.429  1.00  1.17           H  
ATOM    277  HG1 GLU A  17       2.132   5.930   0.408  1.00  1.17           H  
ATOM    278  HG2 GLU A  17       0.766   5.074  -0.242  1.00  1.17           H  
ATOM    279  N   ASP A  18       2.663   0.611   1.046  1.00  1.06           N  
ATOM    280  CA  ASP A  18       3.400  -0.644   1.238  1.00  1.06           C  
ATOM    281  C   ASP A  18       2.731  -1.811   0.494  1.00  1.06           C  
ATOM    282  O   ASP A  18       3.415  -2.601  -0.150  1.00  1.06           O  
ATOM    283  CB  ASP A  18       3.566  -1.020   2.729  1.00  1.06           C  
ATOM    284  CG  ASP A  18       4.715  -2.003   2.917  1.00  1.06           C  
ATOM    285  OD1 ASP A  18       5.879  -1.531   2.906  1.00  1.06           O  
ATOM    286  OD2 ASP A  18       4.486  -3.238   2.966  1.00  1.06           O1-
ATOM    287  H   ASP A  18       2.091   0.966   1.799  1.00  1.06           H  
ATOM    288  HA  ASP A  18       4.402  -0.477   0.843  1.00  1.06           H  
ATOM    289  HB1 ASP A  18       2.651  -1.429   3.157  1.00  1.06           H  
ATOM    290  HB2 ASP A  18       3.801  -0.134   3.320  1.00  1.06           H  
ATOM    291  N   LEU A  19       1.391  -1.890   0.529  1.00  1.43           N  
ATOM    292  CA  LEU A  19       0.610  -2.882  -0.233  1.00  1.43           C  
ATOM    293  C   LEU A  19       0.885  -2.782  -1.743  1.00  1.43           C  
ATOM    294  O   LEU A  19       1.089  -3.784  -2.440  1.00  1.43           O  
ATOM    295  CB  LEU A  19      -0.891  -2.745   0.126  1.00  1.43           C  
ATOM    296  CG  LEU A  19      -1.890  -3.815  -0.399  1.00  1.43           C  
ATOM    297  CD1 LEU A  19      -2.341  -3.578  -1.846  1.00  1.43           C  
ATOM    298  CD2 LEU A  19      -1.398  -5.256  -0.194  1.00  1.43           C  
ATOM    299  H   LEU A  19       0.891  -1.242   1.121  1.00  1.43           H  
ATOM    300  HA  LEU A  19       0.949  -3.865   0.094  1.00  1.43           H  
ATOM    301  HB1 LEU A  19      -1.258  -1.759  -0.159  1.00  1.43           H  
ATOM    302  HB2 LEU A  19      -0.974  -2.780   1.213  1.00  1.43           H  
ATOM    303  HG  LEU A  19      -2.793  -3.701   0.201  1.00  1.43           H  
ATOM    304 1HD1 LEU A  19      -3.257  -4.136  -2.043  1.00  1.43           H  
ATOM    305 2HD1 LEU A  19      -2.581  -2.532  -2.035  1.00  1.43           H  
ATOM    306 3HD1 LEU A  19      -1.598  -3.876  -2.585  1.00  1.43           H  
ATOM    307 1HD2 LEU A  19      -2.184  -5.972  -0.436  1.00  1.43           H  
ATOM    308 2HD2 LEU A  19      -0.533  -5.486  -0.817  1.00  1.43           H  
ATOM    309 3HD2 LEU A  19      -1.124  -5.431   0.846  1.00  1.43           H  
ATOM    310  N   PHE A  20       0.951  -1.554  -2.250  1.00  1.37           N  
ATOM    311  CA  PHE A  20       1.336  -1.228  -3.625  1.00  1.37           C  
ATOM    312  C   PHE A  20       2.799  -1.628  -3.891  1.00  1.37           C  
ATOM    313  O   PHE A  20       3.080  -2.299  -4.885  1.00  1.37           O  
ATOM    314  CB  PHE A  20       1.120   0.292  -3.838  1.00  1.37           C  
ATOM    315  CG  PHE A  20       1.440   0.857  -5.209  1.00  1.37           C  
ATOM    316  CD1 PHE A  20       1.153   0.144  -6.391  1.00  1.37           C  
ATOM    317  CE1 PHE A  20       1.487   0.686  -7.640  1.00  1.37           C  
ATOM    318  CZ  PHE A  20       2.058   1.955  -7.744  1.00  1.37           C  
ATOM    319  CE2 PHE A  20       2.291   2.699  -6.568  1.00  1.37           C  
ATOM    320  CD2 PHE A  20       2.019   2.142  -5.304  1.00  1.37           C  
ATOM    321  H   PHE A  20       0.689  -0.785  -1.650  1.00  1.37           H  
ATOM    322  HA  PHE A  20       0.673  -1.787  -4.286  1.00  1.37           H  
ATOM    323  HB1 PHE A  20       1.689   0.835  -3.084  1.00  1.37           H  
ATOM    324  HB2 PHE A  20       0.077   0.549  -3.655  1.00  1.37           H  
ATOM    325  HD1 PHE A  20       0.679  -0.825  -6.338  1.00  1.37           H  
ATOM    326  HE1 PHE A  20       1.275   0.139  -8.547  1.00  1.37           H  
ATOM    327  HZ  PHE A  20       2.288   2.397  -8.702  1.00  1.37           H  
ATOM    328  HE2 PHE A  20       2.698   3.697  -6.628  1.00  1.37           H  
ATOM    329  HD2 PHE A  20       2.213   2.728  -4.418  1.00  1.37           H  
ATOM    330  N   TYR A  21       3.730  -1.290  -2.990  1.00  0.97           N  
ATOM    331  CA  TYR A  21       5.158  -1.618  -3.051  1.00  0.97           C  
ATOM    332  C   TYR A  21       5.405  -3.153  -3.021  1.00  0.97           C  
ATOM    333  O   TYR A  21       6.078  -3.679  -3.912  1.00  0.97           O  
ATOM    334  CB  TYR A  21       5.878  -0.913  -1.886  1.00  0.97           C  
ATOM    335  CG  TYR A  21       7.380  -1.082  -1.766  1.00  0.97           C  
ATOM    336  CD1 TYR A  21       8.246  -0.494  -2.715  1.00  0.97           C  
ATOM    337  CE1 TYR A  21       9.638  -0.578  -2.545  1.00  0.97           C  
ATOM    338  CZ  TYR A  21      10.180  -1.217  -1.414  1.00  0.97           C  
ATOM    339  OH  TYR A  21      11.531  -1.217  -1.248  1.00  0.97           O  
ATOM    340  CE2 TYR A  21       9.323  -1.820  -0.479  1.00  0.97           C  
ATOM    341  CD2 TYR A  21       7.930  -1.748  -0.647  1.00  0.97           C  
ATOM    342  H   TYR A  21       3.432  -0.739  -2.199  1.00  0.97           H  
ATOM    343  HA  TYR A  21       5.552  -1.243  -3.995  1.00  0.97           H  
ATOM    344  HB1 TYR A  21       5.440  -1.253  -0.947  1.00  0.97           H  
ATOM    345  HB2 TYR A  21       5.704   0.160  -1.965  1.00  0.97           H  
ATOM    346  HD1 TYR A  21       7.844   0.066  -3.547  1.00  0.97           H  
ATOM    347  HE1 TYR A  21      10.279  -0.105  -3.273  1.00  0.97           H  
ATOM    348  HH  TYR A  21      11.794  -1.530  -0.396  1.00  0.97           H  
ATOM    349  HE2 TYR A  21       9.718  -2.316   0.395  1.00  0.97           H  
ATOM    350  HD2 TYR A  21       7.298  -2.199   0.103  1.00  0.97           H  
ATOM    351  N   GLN A  22       4.849  -3.865  -2.025  1.00  1.00           N  
ATOM    352  CA  GLN A  22       5.070  -5.291  -1.807  1.00  1.00           C  
ATOM    353  C   GLN A  22       4.488  -6.132  -2.961  1.00  1.00           C  
ATOM    354  O   GLN A  22       5.091  -7.131  -3.342  1.00  1.00           O  
ATOM    355  CB  GLN A  22       4.532  -5.679  -0.406  1.00  1.00           C  
ATOM    356  CG  GLN A  22       3.035  -6.080  -0.338  1.00  1.00           C  
ATOM    357  CD  GLN A  22       2.391  -6.130   1.052  1.00  1.00           C  
ATOM    358  OE1 GLN A  22       1.391  -6.829   1.252  1.00  1.00           O  
ATOM    359  NE2 GLN A  22       2.912  -5.415   2.039  1.00  1.00           N  
ATOM    360  H   GLN A  22       4.330  -3.357  -1.324  1.00  1.00           H  
ATOM    361  HA  GLN A  22       6.148  -5.449  -1.799  1.00  1.00           H  
ATOM    362  HB1 GLN A  22       4.756  -4.867   0.285  1.00  1.00           H  
ATOM    363  HB2 GLN A  22       5.116  -6.526  -0.046  1.00  1.00           H  
ATOM    364  HG1 GLN A  22       2.852  -7.038  -0.826  1.00  1.00           H  
ATOM    365  HG2 GLN A  22       2.449  -5.360  -0.909  1.00  1.00           H  
ATOM    366 1HE2 GLN A  22       3.638  -4.723   1.918  1.00  1.00           H  
ATOM    367 2HE2 GLN A  22       2.474  -5.450   2.948  1.00  1.00           H  
ATOM    368  N   SER A  23       3.350  -5.724  -3.560  1.00  1.26           N  
ATOM    369  CA  SER A  23       2.758  -6.408  -4.716  1.00  1.26           C  
ATOM    370  C   SER A  23       3.481  -6.035  -6.027  1.00  1.26           C  
ATOM    371  O   SER A  23       3.644  -6.886  -6.896  1.00  1.26           O  
ATOM    372  CB  SER A  23       1.233  -6.129  -4.775  1.00  1.26           C  
ATOM    373  OG  SER A  23       0.894  -4.772  -5.022  1.00  1.26           O  
ATOM    374  H   SER A  23       2.894  -4.890  -3.221  1.00  1.26           H  
ATOM    375  HA  SER A  23       2.887  -7.481  -4.578  1.00  1.26           H  
ATOM    376  HB1 SER A  23       0.754  -6.443  -3.847  1.00  1.26           H  
ATOM    377  HB2 SER A  23       0.790  -6.721  -5.575  1.00  1.26           H  
ATOM    378  HG  SER A  23       0.954  -4.318  -4.196  1.00  1.26           H  
ATOM    379  N   SER A  24       4.048  -4.821  -6.144  1.00  1.10           N  
ATOM    380  CA  SER A  24       4.934  -4.430  -7.246  1.00  1.10           C  
ATOM    381  C   SER A  24       6.285  -5.188  -7.206  1.00  1.10           C  
ATOM    382  O   SER A  24       6.963  -5.252  -8.227  1.00  1.10           O  
ATOM    383  CB  SER A  24       5.171  -2.896  -7.217  1.00  1.10           C  
ATOM    384  OG  SER A  24       3.974  -2.190  -7.530  1.00  1.10           O  
ATOM    385  H   SER A  24       3.879  -4.134  -5.424  1.00  1.10           H  
ATOM    386  HA  SER A  24       4.451  -4.677  -8.192  1.00  1.10           H  
ATOM    387  HB1 SER A  24       5.935  -2.605  -7.938  1.00  1.10           H  
ATOM    388  HB2 SER A  24       5.540  -2.583  -6.240  1.00  1.10           H  
ATOM    389  HG  SER A  24       3.419  -2.205  -6.765  1.00  1.10           H  
ATOM    390  N   LEU A  25       6.642  -5.787  -6.058  1.00  0.81           N  
ATOM    391  CA  LEU A  25       7.790  -6.682  -5.853  1.00  0.81           C  
ATOM    392  C   LEU A  25       7.397  -8.171  -5.939  1.00  0.81           C  
ATOM    393  O   LEU A  25       8.295  -9.014  -5.921  1.00  0.81           O  
ATOM    394  CB  LEU A  25       8.386  -6.439  -4.448  1.00  0.81           C  
ATOM    395  CG  LEU A  25       9.094  -5.080  -4.293  1.00  0.81           C  
ATOM    396  CD1 LEU A  25       9.346  -4.760  -2.809  1.00  0.81           C  
ATOM    397  CD2 LEU A  25      10.399  -5.003  -5.098  1.00  0.81           C  
ATOM    398  H   LEU A  25       6.071  -5.600  -5.245  1.00  0.81           H  
ATOM    399  HA  LEU A  25       8.533  -6.527  -6.636  1.00  0.81           H  
ATOM    400  HB1 LEU A  25       9.104  -7.220  -4.199  1.00  0.81           H  
ATOM    401  HB2 LEU A  25       7.594  -6.526  -3.703  1.00  0.81           H  
ATOM    402  HG  LEU A  25       8.454  -4.285  -4.676  1.00  0.81           H  
ATOM    403 1HD1 LEU A  25       9.842  -3.797  -2.686  1.00  0.81           H  
ATOM    404 2HD1 LEU A  25       8.401  -4.693  -2.271  1.00  0.81           H  
ATOM    405 3HD1 LEU A  25       9.944  -5.526  -2.315  1.00  0.81           H  
ATOM    406 1HD2 LEU A  25      10.886  -4.042  -4.937  1.00  0.81           H  
ATOM    407 2HD2 LEU A  25      11.104  -5.778  -4.795  1.00  0.81           H  
ATOM    408 3HD2 LEU A  25      10.196  -5.089  -6.165  1.00  0.81           H  
ATOM    409  N   ALA A  26       6.100  -8.515  -6.041  1.00  1.00           N  
ATOM    410  CA  ALA A  26       5.640  -9.842  -6.494  1.00  1.00           C  
ATOM    411  C   ALA A  26       5.676  -9.853  -8.027  1.00  1.00           C  
ATOM    412  O   ALA A  26       6.213 -10.773  -8.655  1.00  1.00           O  
ATOM    413  CB  ALA A  26       4.208 -10.113  -5.997  1.00  1.00           C  
ATOM    414  H   ALA A  26       5.429  -7.761  -6.009  1.00  1.00           H  
ATOM    415  HA  ALA A  26       6.303 -10.633  -6.143  1.00  1.00           H  
ATOM    416  HB1 ALA A  26       3.916 -11.134  -6.242  1.00  1.00           H  
ATOM    417  HB2 ALA A  26       4.146  -9.996  -4.915  1.00  1.00           H  
ATOM    418  HB3 ALA A  26       3.474  -9.444  -6.447  1.00  1.00           H  
ATOM    419  N   SER A  27       5.264  -8.731  -8.633  1.00  1.12           N  
ATOM    420  CA  SER A  27       5.643  -8.332  -9.985  1.00  1.12           C  
ATOM    421  C   SER A  27       7.145  -7.950 -10.012  1.00  1.12           C  
ATOM    422  O   SER A  27       7.822  -8.028  -8.985  1.00  1.12           O  
ATOM    423  CB  SER A  27       4.751  -7.146 -10.405  1.00  1.12           C  
ATOM    424  OG  SER A  27       4.900  -6.840 -11.784  1.00  1.12           O  
ATOM    425  H   SER A  27       4.874  -8.019  -8.032  1.00  1.12           H  
ATOM    426  HA  SER A  27       5.479  -9.164 -10.669  1.00  1.12           H  
ATOM    427  HB1 SER A  27       4.993  -6.240  -9.848  1.00  1.12           H  
ATOM    428  HB2 SER A  27       3.699  -7.374 -10.233  1.00  1.12           H  
ATOM    429  HG  SER A  27       4.351  -6.091 -11.960  1.00  1.12           H  
ATOM    430  N   TRP A  28       7.695  -7.576 -11.177  1.00  1.03           N  
ATOM    431  CA  TRP A  28       9.106  -7.283 -11.446  1.00  1.03           C  
ATOM    432  C   TRP A  28       9.946  -8.575 -11.391  1.00  1.03           C  
ATOM    433  O   TRP A  28      10.487  -9.022 -12.394  1.00  1.03           O  
ATOM    434  CB  TRP A  28       9.657  -6.124 -10.552  1.00  1.03           C  
ATOM    435  CG  TRP A  28      11.096  -5.740 -10.746  1.00  1.03           C  
ATOM    436  CD1 TRP A  28      12.128  -6.237 -10.029  1.00  1.03           C  
ATOM    437  NE1 TRP A  28      13.303  -5.645 -10.440  1.00  1.03           N  
ATOM    438  CE2 TRP A  28      13.078  -4.711 -11.426  1.00  1.03           C  
ATOM    439  CZ2 TRP A  28      13.929  -3.830 -12.117  1.00  1.03           C  
ATOM    440  CH2 TRP A  28      13.394  -2.959 -13.079  1.00  1.03           C  
ATOM    441  CZ3 TRP A  28      12.004  -2.941 -13.314  1.00  1.03           C  
ATOM    442  CE3 TRP A  28      11.151  -3.818 -12.600  1.00  1.03           C  
ATOM    443  CD2 TRP A  28      11.678  -4.727 -11.635  1.00  1.03           C  
ATOM    444  H   TRP A  28       7.025  -7.427 -11.918  1.00  1.03           H  
ATOM    445  HA  TRP A  28       9.164  -6.920 -12.472  1.00  1.03           H  
ATOM    446  HB1 TRP A  28       9.567  -6.373  -9.495  1.00  1.03           H  
ATOM    447  HB2 TRP A  28       9.053  -5.230 -10.705  1.00  1.03           H  
ATOM    448  HD1 TRP A  28      12.035  -6.988  -9.259  1.00  1.03           H  
ATOM    449  HE1 TRP A  28      14.206  -5.861 -10.043  1.00  1.03           H  
ATOM    450  HZ2 TRP A  28      14.992  -3.879 -11.934  1.00  1.03           H  
ATOM    451  HH2 TRP A  28      14.037  -2.307 -13.652  1.00  1.03           H  
ATOM    452  HZ3 TRP A  28      11.594  -2.279 -14.063  1.00  1.03           H  
ATOM    453  HE3 TRP A  28      10.091  -3.837 -12.802  1.00  1.03           H  
ATOM    454  N   ASN A  29       9.973  -9.212 -10.217  1.00  1.00           N  
ATOM    455  CA  ASN A  29      10.539 -10.532  -9.949  1.00  1.00           C  
ATOM    456  C   ASN A  29       9.956 -11.617 -10.865  1.00  1.00           C  
ATOM    457  O   ASN A  29      10.715 -12.333 -11.520  1.00  1.00           O  
ATOM    458  CB  ASN A  29      10.382 -10.933  -8.450  1.00  1.00           C  
ATOM    459  CG  ASN A  29      11.404 -10.260  -7.523  1.00  1.00           C  
ATOM    460  OD1 ASN A  29      12.603 -10.517  -7.608  1.00  1.00           O  
ATOM    461  ND2 ASN A  29      10.953  -9.406  -6.614  1.00  1.00           N  
ATOM    462  H   ASN A  29       9.382  -8.794  -9.512  1.00  1.00           H  
ATOM    463  HA  ASN A  29      11.610 -10.503 -10.147  1.00  1.00           H  
ATOM    464  HB1 ASN A  29      10.543 -12.004  -8.324  1.00  1.00           H  
ATOM    465  HB2 ASN A  29       9.373 -10.723  -8.093  1.00  1.00           H  
ATOM    466 1HD2 ASN A  29       9.962  -9.264  -6.482  1.00  1.00           H  
ATOM    467 2HD2 ASN A  29      11.594  -8.992  -5.952  1.00  1.00           H  
ATOM    468  N   TYR A  30       8.627 -11.705 -11.002  1.00  1.04           N  
ATOM    469  CA  TYR A  30       7.963 -12.700 -11.844  1.00  1.04           C  
ATOM    470  C   TYR A  30       8.089 -12.372 -13.345  1.00  1.04           C  
ATOM    471  O   TYR A  30       7.870 -13.242 -14.182  1.00  1.04           O  
ATOM    472  CB  TYR A  30       6.463 -12.816 -11.433  1.00  1.04           C  
ATOM    473  CG  TYR A  30       5.769 -14.068 -11.965  1.00  1.04           C  
ATOM    474  CD1 TYR A  30       6.127 -15.337 -11.469  1.00  1.04           C  
ATOM    475  CE1 TYR A  30       5.500 -16.501 -11.970  1.00  1.04           C  
ATOM    476  CZ  TYR A  30       4.522 -16.400 -12.976  1.00  1.04           C  
ATOM    477  OH  TYR A  30       3.956 -17.516 -13.499  1.00  1.04           O  
ATOM    478  CE2 TYR A  30       4.169 -15.136 -13.468  1.00  1.04           C  
ATOM    479  CD2 TYR A  30       4.775 -13.974 -12.964  1.00  1.04           C  
ATOM    480  H   TYR A  30       8.059 -11.133 -10.393  1.00  1.04           H  
ATOM    481  HA  TYR A  30       8.434 -13.667 -11.667  1.00  1.04           H  
ATOM    482  HB1 TYR A  30       5.912 -11.945 -11.786  1.00  1.04           H  
ATOM    483  HB2 TYR A  30       6.371 -12.870 -10.348  1.00  1.04           H  
ATOM    484  HD1 TYR A  30       6.891 -15.420 -10.710  1.00  1.04           H  
ATOM    485  HE1 TYR A  30       5.767 -17.473 -11.583  1.00  1.04           H  
ATOM    486  HH  TYR A  30       3.387 -17.328 -14.229  1.00  1.04           H  
ATOM    487  HE2 TYR A  30       3.433 -15.075 -14.257  1.00  1.04           H  
ATOM    488  HD2 TYR A  30       4.481 -13.023 -13.383  1.00  1.04           H  
ATOM    489  N   ASN A  31       8.504 -11.148 -13.711  1.00  1.43           N  
ATOM    490  CA  ASN A  31       8.760 -10.714 -15.109  1.00  1.43           C  
ATOM    491  C   ASN A  31      10.282 -10.582 -15.353  1.00  1.43           C  
ATOM    492  O   ASN A  31      10.715  -9.836 -16.237  1.00  1.43           O  
ATOM    493  CB  ASN A  31       8.031  -9.373 -15.410  1.00  1.43           C  
ATOM    494  CG  ASN A  31       7.539  -9.261 -16.859  1.00  1.43           C  
ATOM    495  OD1 ASN A  31       6.347  -9.372 -17.129  1.00  1.43           O  
ATOM    496  ND2 ASN A  31       8.438  -9.016 -17.797  1.00  1.43           N  
ATOM    497  H   ASN A  31       8.771 -10.504 -12.980  1.00  1.43           H  
ATOM    498  HA  ASN A  31       8.397 -11.466 -15.811  1.00  1.43           H  
ATOM    499  HB1 ASN A  31       8.625  -8.502 -15.133  1.00  1.43           H  
ATOM    500  HB2 ASN A  31       7.139  -9.320 -14.786  1.00  1.43           H  
ATOM    501 1HD2 ASN A  31       9.417  -9.007 -17.552  1.00  1.43           H  
ATOM    502 2HD2 ASN A  31       8.155  -8.962 -18.765  1.00  1.43           H  
ATOM    503  N   THR A  32      11.095 -11.298 -14.563  1.00  1.88           N  
ATOM    504  CA  THR A  32      12.537 -11.479 -14.728  1.00  1.88           C  
ATOM    505  C   THR A  32      12.876 -12.970 -14.466  1.00  1.88           C  
ATOM    506  O   THR A  32      13.346 -13.656 -15.371  1.00  1.88           O  
ATOM    507  CB  THR A  32      13.337 -10.417 -13.917  1.00  1.88           C  
ATOM    508  CG2 THR A  32      13.289  -8.986 -14.470  1.00  1.88           C  
ATOM    509  OG1 THR A  32      12.937 -10.373 -12.569  1.00  1.88           O  
ATOM    510  H   THR A  32      10.666 -11.832 -13.821  1.00  1.88           H  
ATOM    511  HA  THR A  32      12.779 -11.312 -15.777  1.00  1.88           H  
ATOM    512  HB  THR A  32      14.383 -10.724 -13.924  1.00  1.88           H  
ATOM    513 1HG2 THR A  32      13.903  -8.307 -13.879  1.00  1.88           H  
ATOM    514 2HG2 THR A  32      13.639  -8.926 -15.501  1.00  1.88           H  
ATOM    515 3HG2 THR A  32      12.278  -8.577 -14.459  1.00  1.88           H  
ATOM    516  HG1 THR A  32      12.100  -9.933 -12.550  1.00  1.88           H  
ATOM    517  N   ASN A  33      12.504 -13.510 -13.300  1.00  1.87           N  
ATOM    518  CA  ASN A  33      12.469 -14.943 -12.996  1.00  1.87           C  
ATOM    519  C   ASN A  33      11.071 -15.423 -13.442  1.00  1.87           C  
ATOM    520  O   ASN A  33      10.196 -15.746 -12.636  1.00  1.87           O  
ATOM    521  CB  ASN A  33      12.658 -15.123 -11.469  1.00  1.87           C  
ATOM    522  CG  ASN A  33      12.747 -16.584 -11.002  1.00  1.87           C  
ATOM    523  OD1 ASN A  33      13.656 -17.335 -11.371  1.00  1.87           O  
ATOM    524  ND2 ASN A  33      11.802 -17.050 -10.185  1.00  1.87           N  
ATOM    525  H   ASN A  33      12.080 -12.899 -12.616  1.00  1.87           H  
ATOM    526  HA  ASN A  33      13.246 -15.484 -13.537  1.00  1.87           H  
ATOM    527  HB1 ASN A  33      11.859 -14.616 -10.928  1.00  1.87           H  
ATOM    528  HB2 ASN A  33      13.588 -14.651 -11.150  1.00  1.87           H  
ATOM    529 1HD2 ASN A  33      10.995 -16.481  -9.970  1.00  1.87           H  
ATOM    530 2HD2 ASN A  33      11.832 -18.009  -9.870  1.00  1.87           H  
ATOM    531  N   ILE A  34      10.882 -15.444 -14.763  1.00  1.97           N  
ATOM    532  CA  ILE A  34       9.663 -15.887 -15.441  1.00  1.97           C  
ATOM    533  C   ILE A  34       9.554 -17.395 -15.204  1.00  1.97           C  
ATOM    534  O   ILE A  34      10.369 -18.181 -15.691  1.00  1.97           O  
ATOM    535  CB  ILE A  34       9.741 -15.500 -16.946  1.00  1.97           C  
ATOM    536  CG2 ILE A  34       8.536 -16.049 -17.745  1.00  1.97           C  
ATOM    537  CG1 ILE A  34       9.820 -13.961 -17.118  1.00  1.97           C  
ATOM    538  CD1 ILE A  34      10.254 -13.506 -18.520  1.00  1.97           C  
ATOM    539  H   ILE A  34      11.655 -15.168 -15.351  1.00  1.97           H  
ATOM    540  HA  ILE A  34       8.807 -15.395 -14.978  1.00  1.97           H  
ATOM    541  HB  ILE A  34      10.651 -15.931 -17.364  1.00  1.97           H  
ATOM    542 1HG2 ILE A  34       8.592 -15.766 -18.796  1.00  1.97           H  
ATOM    543 2HG2 ILE A  34       8.501 -17.138 -17.723  1.00  1.97           H  
ATOM    544 3HG2 ILE A  34       7.592 -15.667 -17.355  1.00  1.97           H  
ATOM    545 1HG1 ILE A  34      10.503 -13.531 -16.385  1.00  1.97           H  
ATOM    546 2HG1 ILE A  34       8.847 -13.531 -16.882  1.00  1.97           H  
ATOM    547  HD1 ILE A  34      10.461 -12.436 -18.547  1.00  1.97           H  
ATOM    548  HD2 ILE A  34      11.162 -14.016 -18.840  1.00  1.97           H  
ATOM    549  HD3 ILE A  34       9.497 -13.730 -19.271  1.00  1.97           H  
ATOM    550  N   THR A  35       8.573 -17.773 -14.372  1.00  3.68           N  
ATOM    551  CA  THR A  35       8.352 -19.091 -13.807  1.00  3.68           C  
ATOM    552  C   THR A  35       6.855 -19.384 -13.760  1.00  3.68           C  
ATOM    553  O   THR A  35       6.287 -19.989 -12.849  1.00  3.68           O  
ATOM    554  CB  THR A  35       9.133 -19.219 -12.471  1.00  3.68           C  
ATOM    555  CG2 THR A  35      10.650 -19.389 -12.631  1.00  3.68           C  
ATOM    556  OG1 THR A  35       8.885 -18.108 -11.613  1.00  3.68           O  
ATOM    557  H   THR A  35       8.002 -17.041 -13.974  1.00  3.68           H  
ATOM    558  HA  THR A  35       8.770 -19.808 -14.514  1.00  3.68           H  
ATOM    559  HB  THR A  35       8.771 -20.107 -11.953  1.00  3.68           H  
ATOM    560 1HG2 THR A  35      11.115 -19.582 -11.664  1.00  3.68           H  
ATOM    561 2HG2 THR A  35      10.864 -20.239 -13.279  1.00  3.68           H  
ATOM    562 3HG2 THR A  35      11.107 -18.496 -13.058  1.00  3.68           H  
ATOM    563  HG1 THR A  35       9.244 -17.330 -12.011  1.00  3.68           H  
ATOM    564  HXT THR A  35       6.312 -18.996 -14.622  1.00  0.00           H  
CONECT    6   11   12   13
CONECT   11    6
CONECT   12    6
CONECT   13    6
CONECT    7   14   15
CONECT   14    7
CONECT   15    7
CONECT    8   16   17   18
CONECT   16    8
CONECT   17    8
CONECT   18    8
CONECT   26   33
CONECT   33   26
CONECT   27   35
CONECT   35   27
CONECT   41   48
CONECT   48   41
CONECT   42   50
CONECT   50   42
CONECT   56   63
CONECT   63   56
CONECT   57   65
CONECT   65   57
CONECT   60   67   68
CONECT   67   60
CONECT   68   60
CONECT   83   90
CONECT   90   83
CONECT   84   92
CONECT   92   84
CONECT   85   94
CONECT   94   85
CONECT   86   96
CONECT   96   86
CONECT  106  111  112  113
CONECT  111  106
CONECT  112  106
CONECT  113  106
CONECT  119  128
CONECT  128  119
CONECT  139  145
CONECT  145  139
CONECT  141  148  149  150
CONECT  148  141
CONECT  149  141
CONECT  150  141
CONECT  142  151  152  153
CONECT  151  142
CONECT  152  142
CONECT  153  142
CONECT  158  164
CONECT  164  158
CONECT  170  177
CONECT  177  170
CONECT  171  179
CONECT  179  171
CONECT  172  181
CONECT  181  172
CONECT  173  183
CONECT  183  173
CONECT  192  201
CONECT  201  192
CONECT  212  218
CONECT  218  212
CONECT  215  220  221
CONECT  220  215
CONECT  221  215
CONECT  226  234
CONECT  234  226
CONECT  243  250
CONECT  250  243
CONECT  244  252
CONECT  252  244
CONECT  268  275
CONECT  275  268
CONECT  269  277
CONECT  277  269
CONECT  283  289
CONECT  289  283
CONECT  295  301
CONECT  301  295
CONECT  297  304  305  306
CONECT  304  297
CONECT  305  297
CONECT  306  297
CONECT  298  307  308  309
CONECT  307  298
CONECT  308  298
CONECT  309  298
CONECT  314  323
CONECT  323  314
CONECT  334  344
CONECT  344  334
CONECT  355  362
CONECT  362  355
CONECT  356  364
CONECT  364  356
CONECT  359  366  367
CONECT  366  359
CONECT  367  359
CONECT  372  376
CONECT  376  372
CONECT  383  387
CONECT  387  383
CONECT  394  400
CONECT  400  394
CONECT  396  403  404  405
CONECT  403  396
CONECT  404  396
CONECT  405  396
CONECT  397  406  407  408
CONECT  406  397
CONECT  407  397
CONECT  408  397
CONECT  423  427
CONECT  427  423
CONECT  434  446
CONECT  446  434
CONECT  458  464
CONECT  464  458
CONECT  461  466  467
CONECT  466  461
CONECT  467  461
CONECT  472  482
CONECT  482  472
CONECT  493  499
CONECT  499  493
CONECT  496  501  502
CONECT  501  496
CONECT  502  496
CONECT  508  513  514  515
CONECT  513  508
CONECT  514  508
CONECT  515  508
CONECT  521  527
CONECT  527  521
CONECT  524  529  530
CONECT  529  524
CONECT  530  524
CONECT  536  542  543  544
CONECT  542  536
CONECT  543  536
CONECT  544  536
CONECT  537  545  546
CONECT  545  537
CONECT  546  537
CONECT  538  547  548  549
CONECT  547  538
CONECT  548  538
CONECT  549  538
CONECT  555  560  561  562
CONECT  560  555
CONECT  561  555
CONECT  562  555
CONECT  552  564
CONECT  564  552
ENDMDL
END   



If you find results from this site helpful for your research, please cite one of our papers:

elNémo is maintained by Yves-Henri Sanejouand.
It was developed by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Last modification: October 18th, 2018.