REMARK ID 691860 DOMAINID 682971 MODEL 1 pep6_AB
MODEL     1
REMARK    Rerank model01.pdb score: 23.366
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 60 cluster_threshold: 1.575896
REMARK    SCORE    fa_intra_rep:           0.475
REMARK    SCORE     total_score:         -91.977
REMARK    SCORE     hbond_sr_bb:         -30.392
REMARK    SCORE     hbond_lr_bb:          -3.783
REMARK    SCORE         fa_elec:         -80.754
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     cart_bonded:          20.907
REMARK    SCORE          fa_dun:          58.964
REMARK    SCORE             ref:           6.830
REMARK    SCORE         p_aa_pp:          -5.192
REMARK    SCORE          fa_atr:        -229.014
REMARK    SCORE          fa_rep:          22.735
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE          fa_sol:         152.015
REMARK    SCORE            time:           0.000
REMARK    SCORE        hbond_sc:          -2.847
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE fa_intra_sol_xover4:           8.638
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE     hbond_bb_sc:           0.000
REMARK    SCORE           omega:           0.469
REMARK    SCORE           score:         -91.977
REMARK    SCORE     lk_ball_wtd:          -5.913
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     rama_prepro:          -5.116
ATOM      1  N   ASP A   1      -0.141  -0.043  -0.357  1.00  1.510          N  
ATOM      2  CA  ASP A   1       1.303   0.057  -0.582  1.00  1.100          C  
ATOM      3  C   ASP A   1       1.898   1.457  -0.432  1.00  0.950          C  
ATOM      4  O   ASP A   1       2.815   1.666   0.369  1.00  0.870          O  
ATOM      5  CB  ASP A   1       1.661  -0.469  -1.974  1.00  1.700          C  
ATOM      6  CG  ASP A   1       1.409  -1.937  -2.084  1.00  1.700          C  
ATOM      7  OD1 ASP A   1       1.188  -2.526  -1.061  1.00  1.700          O  
ATOM      8  OD2 ASP A   1       1.409  -2.450  -3.162  1.00  1.700          O  
ATOM      9 1H   ASP A   1      -0.563  -0.529  -1.134  1.00  1.810          H  
ATOM     10 2H   ASP A   1      -0.310  -0.586   0.479  1.00  1.810          H  
ATOM     11 3H   ASP A   1      -0.625   0.836  -0.213  1.00  1.810          H  
ATOM     12  HA  ASP A   1       1.790  -0.582   0.156  1.00  1.320          H  
ATOM     13 1HB  ASP A   1       1.072   0.046  -2.731  1.00  2.040          H  
ATOM     14 2HB  ASP A   1       2.714  -0.274  -2.184  1.00  2.040          H  
ATOM     15  N   TRP A   2       1.372   2.441  -1.170  1.00  0.990          N  
ATOM     16  CA  TRP A   2       1.939   3.796  -1.101  1.00  0.930          C  
ATOM     17  C   TRP A   2       2.037   4.304   0.316  1.00  0.770          C  
ATOM     18  O   TRP A   2       3.044   4.899   0.704  1.00  0.720          O  
ATOM     19  CB  TRP A   2       1.119   4.802  -1.904  1.00  1.330          C  
ATOM     20  CG  TRP A   2       1.684   6.191  -1.787  1.00  1.330          C  
ATOM     21  CD1 TRP A   2       2.680   6.710  -2.548  1.00  1.330          C  
ATOM     22  CD2 TRP A   2       1.294   7.254  -0.862  1.00  1.330          C  
ATOM     23  NE1 TRP A   2       2.949   7.996  -2.165  1.00  1.330          N  
ATOM     24  CE2 TRP A   2       2.111   8.344  -1.138  1.00  1.330          C  
ATOM     25  CE3 TRP A   2       0.338   7.360   0.155  1.00  1.330          C  
ATOM     26  CZ2 TRP A   2       2.011   9.529  -0.436  1.00  1.330          C  
ATOM     27  CZ3 TRP A   2       0.246   8.549   0.856  1.00  1.330          C  
ATOM     28  CH2 TRP A   2       1.055   9.599   0.569  1.00  1.330          C  
ATOM     29  H   TRP A   2       0.614   2.254  -1.812  1.00  1.190          H  
ATOM     30  HA  TRP A   2       2.944   3.766  -1.520  1.00  1.120          H  
ATOM     31 1HB  TRP A   2       1.110   4.518  -2.955  1.00  1.590          H  
ATOM     32 2HB  TRP A   2       0.091   4.814  -1.549  1.00  1.590          H  
ATOM     33  HD1 TRP A   2       3.196   6.175  -3.343  1.00  1.590          H  
ATOM     34  HE1 TRP A   2       3.651   8.592  -2.575  1.00  1.590          H  
ATOM     35  HE3 TRP A   2      -0.316   6.528   0.391  1.00  1.590          H  
ATOM     36  HZ2 TRP A   2       2.650  10.383  -0.647  1.00  1.590          H  
ATOM     37  HZ3 TRP A   2      -0.487   8.631   1.643  1.00  1.590          H  
ATOM     38  HH2 TRP A   2       0.952  10.519   1.145  1.00  1.590          H  
ATOM     39  N   PHE A   3       0.989   4.072   1.088  1.00  0.760          N  
ATOM     40  CA  PHE A   3       0.939   4.555   2.441  1.00  0.690          C  
ATOM     41  C   PHE A   3       2.027   3.998   3.326  1.00  0.590          C  
ATOM     42  O   PHE A   3       2.478   4.700   4.223  1.00  0.570          O  
ATOM     43  CB  PHE A   3      -0.384   4.237   3.093  1.00  0.990          C  
ATOM     44  CG  PHE A   3      -1.488   5.071   2.681  1.00  0.990          C  
ATOM     45  CD1 PHE A   3      -2.484   4.573   1.872  1.00  0.990          C  
ATOM     46  CD2 PHE A   3      -1.556   6.381   3.111  1.00  0.990          C  
ATOM     47  CE1 PHE A   3      -3.532   5.377   1.496  1.00  0.990          C  
ATOM     48  CE2 PHE A   3      -2.598   7.184   2.740  1.00  0.990          C  
ATOM     49  CZ  PHE A   3      -3.588   6.684   1.930  1.00  0.990          C  
ATOM     50  H   PHE A   3       0.209   3.567   0.700  1.00  0.910          H  
ATOM     51  HA  PHE A   3       1.045   5.635   2.410  1.00  0.830          H  
ATOM     52 1HB  PHE A   3      -0.648   3.200   2.904  1.00  1.190          H  
ATOM     53 2HB  PHE A   3      -0.268   4.365   4.143  1.00  1.190          H  
ATOM     54  HD1 PHE A   3      -2.449   3.527   1.534  1.00  1.190          H  
ATOM     55  HD2 PHE A   3      -0.768   6.777   3.750  1.00  1.190          H  
ATOM     56  HE1 PHE A   3      -4.321   4.978   0.858  1.00  1.190          H  
ATOM     57  HE2 PHE A   3      -2.645   8.219   3.082  1.00  1.190          H  
ATOM     58  HZ  PHE A   3      -4.420   7.320   1.632  1.00  1.190          H  
ATOM     59  N   LYS A   4       2.431   2.736   3.172  1.00  0.600          N  
ATOM     60  CA  LYS A   4       3.430   2.280   4.124  1.00  0.590          C  
ATOM     61  C   LYS A   4       4.780   2.838   3.719  1.00  0.560          C  
ATOM     62  O   LYS A   4       5.607   3.166   4.577  1.00  0.580          O  
ATOM     63  CB  LYS A   4       3.442   0.754   4.256  1.00  0.830          C  
ATOM     64  CG  LYS A   4       3.946  -0.041   3.075  1.00  0.830          C  
ATOM     65  CD  LYS A   4       3.778  -1.506   3.366  1.00  0.830          C  
ATOM     66  CE  LYS A   4       4.281  -2.399   2.260  1.00  0.830          C  
ATOM     67  NZ  LYS A   4       4.036  -3.832   2.584  1.00  0.830          N  
ATOM     68  H   LYS A   4       2.124   2.161   2.389  1.00  0.720          H  
ATOM     69  HA  LYS A   4       3.182   2.683   5.106  1.00  0.710          H  
ATOM     70 1HB  LYS A   4       4.062   0.474   5.102  1.00  1.000          H  
ATOM     71 2HB  LYS A   4       2.442   0.402   4.477  1.00  1.000          H  
ATOM     72 1HG  LYS A   4       3.379   0.201   2.196  1.00  1.000          H  
ATOM     73 2HG  LYS A   4       4.998   0.170   2.892  1.00  1.000          H  
ATOM     74 1HD  LYS A   4       4.294  -1.762   4.297  1.00  1.000          H  
ATOM     75 2HD  LYS A   4       2.714  -1.710   3.502  1.00  1.000          H  
ATOM     76 1HE  LYS A   4       3.764  -2.152   1.331  1.00  1.000          H  
ATOM     77 2HE  LYS A   4       5.349  -2.243   2.124  1.00  1.000          H  
ATOM     78 1HZ  LYS A   4       4.374  -4.412   1.835  1.00  1.000          H  
ATOM     79 2HZ  LYS A   4       4.519  -4.073   3.446  1.00  1.000          H  
ATOM     80 3HZ  LYS A   4       3.037  -3.984   2.703  1.00  1.000          H  
ATOM     81  N   ALA A   5       4.998   3.005   2.405  1.00  0.560          N  
ATOM     82  CA  ALA A   5       6.255   3.583   1.955  1.00  0.580          C  
ATOM     83  C   ALA A   5       6.355   5.006   2.487  1.00  0.520          C  
ATOM     84  O   ALA A   5       7.407   5.441   2.967  1.00  0.530          O  
ATOM     85  CB  ALA A   5       6.331   3.572   0.440  1.00  0.800          C  
ATOM     86  H   ALA A   5       4.294   2.683   1.728  1.00  0.670          H  
ATOM     87  HA  ALA A   5       7.077   2.999   2.370  1.00  0.700          H  
ATOM     88 1HB  ALA A   5       7.276   4.005   0.120  1.00  0.960          H  
ATOM     89 2HB  ALA A   5       6.256   2.547   0.083  1.00  0.960          H  
ATOM     90 3HB  ALA A   5       5.504   4.158   0.032  1.00  0.960          H  
ATOM     91  N   PHE A   6       5.225   5.714   2.390  1.00  0.510          N  
ATOM     92  CA  PHE A   6       5.054   7.069   2.858  1.00  0.490          C  
ATOM     93  C   PHE A   6       5.250   7.220   4.346  1.00  0.470          C  
ATOM     94  O   PHE A   6       6.053   8.052   4.776  1.00  0.470          O  
ATOM     95  CB  PHE A   6       3.675   7.556   2.465  1.00  0.690          C  
ATOM     96  CG  PHE A   6       3.279   8.813   3.084  1.00  0.690          C  
ATOM     97  CD1 PHE A   6       3.790  10.018   2.665  1.00  0.690          C  
ATOM     98  CD2 PHE A   6       2.352   8.790   4.108  1.00  0.690          C  
ATOM     99  CE1 PHE A   6       3.386  11.181   3.264  1.00  0.690          C  
ATOM    100  CE2 PHE A   6       1.950   9.941   4.707  1.00  0.690          C  
ATOM    101  CZ  PHE A   6       2.466  11.143   4.289  1.00  0.690          C  
ATOM    102  H   PHE A   6       4.422   5.279   1.929  1.00  0.610          H  
ATOM    103  HA  PHE A   6       5.793   7.691   2.356  1.00  0.590          H  
ATOM    104 1HB  PHE A   6       3.627   7.666   1.386  1.00  0.830          H  
ATOM    105 2HB  PHE A   6       2.956   6.814   2.734  1.00  0.830          H  
ATOM    106  HD1 PHE A   6       4.516  10.041   1.853  1.00  0.830          H  
ATOM    107  HD2 PHE A   6       1.944   7.830   4.434  1.00  0.830          H  
ATOM    108  HE1 PHE A   6       3.794  12.136   2.932  1.00  0.830          H  
ATOM    109  HE2 PHE A   6       1.221   9.912   5.514  1.00  0.830          H  
ATOM    110  HZ  PHE A   6       2.147  12.067   4.766  1.00  0.830          H  
ATOM    111  N   TYR A   7       4.533   6.420   5.142  1.00  0.490          N  
ATOM    112  CA  TYR A   7       4.624   6.548   6.580  1.00  0.520          C  
ATOM    113  C   TYR A   7       6.026   6.265   7.062  1.00  0.560          C  
ATOM    114  O   TYR A   7       6.526   6.978   7.933  1.00  0.650          O  
ATOM    115  CB  TYR A   7       3.559   5.711   7.299  1.00  0.720          C  
ATOM    116  CG  TYR A   7       2.207   6.415   7.287  1.00  0.720          C  
ATOM    117  CD1 TYR A   7       1.122   5.920   6.591  1.00  0.720          C  
ATOM    118  CD2 TYR A   7       2.087   7.599   7.970  1.00  0.720          C  
ATOM    119  CE1 TYR A   7      -0.061   6.619   6.568  1.00  0.720          C  
ATOM    120  CE2 TYR A   7       0.912   8.298   7.956  1.00  0.720          C  
ATOM    121  CZ  TYR A   7      -0.160   7.819   7.255  1.00  0.720          C  
ATOM    122  OH  TYR A   7      -1.340   8.523   7.249  1.00  0.720          O  
ATOM    123  H   TYR A   7       3.889   5.739   4.742  1.00  0.590          H  
ATOM    124  HA  TYR A   7       4.403   7.577   6.822  1.00  0.620          H  
ATOM    125 1HB  TYR A   7       3.455   4.740   6.811  1.00  0.860          H  
ATOM    126 2HB  TYR A   7       3.855   5.546   8.328  1.00  0.860          H  
ATOM    127  HD1 TYR A   7       1.192   4.991   6.068  1.00  0.860          H  
ATOM    128  HD2 TYR A   7       2.937   7.975   8.519  1.00  0.860          H  
ATOM    129  HE1 TYR A   7      -0.915   6.228   6.023  1.00  0.860          H  
ATOM    130  HE2 TYR A   7       0.825   9.233   8.498  1.00  0.860          H  
ATOM    131  HH  TYR A   7      -2.014   8.026   6.778  1.00  0.860          H  
ATOM    132  N   ASP A   8       6.702   5.273   6.477  1.00  0.560          N  
ATOM    133  CA  ASP A   8       8.062   4.991   6.890  1.00  0.650          C  
ATOM    134  C   ASP A   8       8.968   6.186   6.602  1.00  0.630          C  
ATOM    135  O   ASP A   8       9.706   6.638   7.485  1.00  0.750          O  
ATOM    136  CB  ASP A   8       8.595   3.751   6.168  1.00  0.870          C  
ATOM    137  CG  ASP A   8      10.001   3.325   6.623  1.00  0.870          C  
ATOM    138  OD1 ASP A   8      10.176   3.051   7.805  1.00  0.870          O  
ATOM    139  OD2 ASP A   8      10.883   3.274   5.795  1.00  0.870          O  
ATOM    140  H   ASP A   8       6.264   4.676   5.767  1.00  0.670          H  
ATOM    141  HA  ASP A   8       8.061   4.799   7.962  1.00  0.780          H  
ATOM    142 1HB  ASP A   8       7.907   2.928   6.316  1.00  1.050          H  
ATOM    143 2HB  ASP A   8       8.616   3.951   5.093  1.00  1.050          H  
ATOM    144  N   LYS A   9       8.916   6.718   5.371  1.00  0.540          N  
ATOM    145  CA  LYS A   9       9.792   7.825   5.017  1.00  0.580          C  
ATOM    146  C   LYS A   9       9.572   9.063   5.874  1.00  0.610          C  
ATOM    147  O   LYS A   9      10.545   9.714   6.284  1.00  0.770          O  
ATOM    148  CB  LYS A   9       9.620   8.182   3.542  1.00  0.800          C  
ATOM    149  CG  LYS A   9      10.203   7.149   2.577  1.00  0.800          C  
ATOM    150  CD  LYS A   9       9.950   7.533   1.123  1.00  0.800          C  
ATOM    151  CE  LYS A   9      10.512   6.489   0.162  1.00  0.800          C  
ATOM    152  NZ  LYS A   9      10.252   6.846  -1.266  1.00  0.800          N  
ATOM    153  H   LYS A   9       8.280   6.329   4.666  1.00  0.650          H  
ATOM    154  HA  LYS A   9      10.819   7.496   5.173  1.00  0.700          H  
ATOM    155 1HB  LYS A   9       8.551   8.274   3.324  1.00  0.960          H  
ATOM    156 2HB  LYS A   9      10.083   9.146   3.342  1.00  0.960          H  
ATOM    157 1HG  LYS A   9      11.277   7.076   2.744  1.00  0.960          H  
ATOM    158 2HG  LYS A   9       9.766   6.175   2.776  1.00  0.960          H  
ATOM    159 1HD  LYS A   9       8.872   7.616   0.961  1.00  0.960          H  
ATOM    160 2HD  LYS A   9      10.409   8.497   0.913  1.00  0.960          H  
ATOM    161 1HE  LYS A   9      11.586   6.406   0.316  1.00  0.960          H  
ATOM    162 2HE  LYS A   9      10.048   5.524   0.375  1.00  0.960          H  
ATOM    163 1HZ  LYS A   9      10.638   6.132  -1.869  1.00  0.960          H  
ATOM    164 2HZ  LYS A   9       9.255   6.913  -1.420  1.00  0.960          H  
ATOM    165 3HZ  LYS A   9      10.686   7.734  -1.478  1.00  0.960          H  
ATOM    166  N   VAL A  10       8.313   9.397   6.170  1.00  0.550          N  
ATOM    167  CA  VAL A  10       8.113  10.592   6.963  1.00  0.630          C  
ATOM    168  C   VAL A  10       8.487  10.313   8.408  1.00  0.590          C  
ATOM    169  O   VAL A  10       9.066  11.176   9.066  1.00  0.580          O  
ATOM    170  CB  VAL A  10       6.681  11.179   6.823  1.00  0.850          C  
ATOM    171  CG1 VAL A  10       6.408  11.475   5.358  1.00  0.850          C  
ATOM    172  CG2 VAL A  10       5.621  10.246   7.382  1.00  0.850          C  
ATOM    173  H   VAL A  10       7.532   8.843   5.804  1.00  0.660          H  
ATOM    174  HA  VAL A  10       8.789  11.359   6.589  1.00  0.760          H  
ATOM    175  HB  VAL A  10       6.647  12.118   7.343  1.00  1.020          H  
ATOM    176 1HG1 VAL A  10       5.424  11.926   5.259  1.00  1.020          H  
ATOM    177 2HG1 VAL A  10       7.163  12.162   4.983  1.00  1.020          H  
ATOM    178 3HG1 VAL A  10       6.440  10.553   4.781  1.00  1.020          H  
ATOM    179 1HG2 VAL A  10       4.640  10.695   7.253  1.00  1.020          H  
ATOM    180 2HG2 VAL A  10       5.669   9.335   6.842  1.00  1.020          H  
ATOM    181 3HG2 VAL A  10       5.784  10.055   8.431  1.00  1.020          H  
ATOM    182  N   ALA A  11       8.205   9.110   8.921  1.00  0.600          N  
ATOM    183  CA  ALA A  11       8.562   8.842  10.294  1.00  0.600          C  
ATOM    184  C   ALA A  11      10.057   9.022  10.491  1.00  0.600          C  
ATOM    185  O   ALA A  11      10.481   9.652  11.468  1.00  0.640          O  
ATOM    186  CB  ALA A  11       8.183   7.424  10.669  1.00  0.840          C  
ATOM    187  H   ALA A  11       7.709   8.395   8.382  1.00  0.720          H  
ATOM    188  HA  ALA A  11       8.030   9.545  10.927  1.00  0.720          H  
ATOM    189 1HB  ALA A  11       8.438   7.244  11.705  1.00  1.010          H  
ATOM    190 2HB  ALA A  11       7.134   7.260  10.528  1.00  1.010          H  
ATOM    191 3HB  ALA A  11       8.727   6.735  10.026  1.00  1.010          H  
ATOM    192  N   GLU A  12      10.861   8.548   9.534  1.00  0.640          N  
ATOM    193  CA  GLU A  12      12.297   8.684   9.685  1.00  0.710          C  
ATOM    194  C   GLU A  12      12.693  10.159   9.686  1.00  0.700          C  
ATOM    195  O   GLU A  12      13.510  10.576  10.501  1.00  0.820          O  
ATOM    196  CB  GLU A  12      13.022   7.921   8.573  1.00  0.970          C  
ATOM    197  CG  GLU A  12      12.932   6.367   8.667  1.00  0.970          C  
ATOM    198  CD  GLU A  12      13.665   5.774   9.855  1.00  0.970          C  
ATOM    199  OE1 GLU A  12      14.796   6.170  10.080  1.00  0.970          O  
ATOM    200  OE2 GLU A  12      13.113   4.917  10.529  1.00  0.970          O  
ATOM    201  H   GLU A  12      10.470   8.028   8.740  1.00  0.770          H  
ATOM    202  HA  GLU A  12      12.586   8.252  10.642  1.00  0.850          H  
ATOM    203 1HB  GLU A  12      12.600   8.216   7.609  1.00  1.160          H  
ATOM    204 2HB  GLU A  12      14.074   8.201   8.570  1.00  1.160          H  
ATOM    205 1HG  GLU A  12      11.882   6.086   8.737  1.00  1.160          H  
ATOM    206 2HG  GLU A  12      13.326   5.936   7.746  1.00  1.160          H  
ATOM    207  N   LYS A  13      12.060  10.985   8.848  1.00  0.680          N  
ATOM    208  CA  LYS A  13      12.379  12.415   8.864  1.00  0.770          C  
ATOM    209  C   LYS A  13      12.051  13.045  10.231  1.00  0.740          C  
ATOM    210  O   LYS A  13      12.800  13.884  10.743  1.00  0.980          O  
ATOM    211  CB  LYS A  13      11.627  13.151   7.751  1.00  1.040          C  
ATOM    212  CG  LYS A  13      12.128  12.841   6.337  1.00  1.040          C  
ATOM    213  CD  LYS A  13      11.309  13.578   5.274  1.00  1.040          C  
ATOM    214  CE  LYS A  13      11.792  13.240   3.868  1.00  1.040          C  
ATOM    215  NZ  LYS A  13      10.977  13.922   2.819  1.00  1.040          N  
ATOM    216  H   LYS A  13      11.416  10.598   8.147  1.00  0.820          H  
ATOM    217  HA  LYS A  13      13.449  12.529   8.692  1.00  0.920          H  
ATOM    218 1HB  LYS A  13      10.570  12.892   7.800  1.00  1.250          H  
ATOM    219 2HB  LYS A  13      11.707  14.225   7.912  1.00  1.250          H  
ATOM    220 1HG  LYS A  13      13.173  13.136   6.254  1.00  1.250          H  
ATOM    221 2HG  LYS A  13      12.060  11.769   6.162  1.00  1.250          H  
ATOM    222 1HD  LYS A  13      10.260  13.288   5.366  1.00  1.250          H  
ATOM    223 2HD  LYS A  13      11.388  14.653   5.431  1.00  1.250          H  
ATOM    224 1HE  LYS A  13      12.830  13.549   3.766  1.00  1.250          H  
ATOM    225 2HE  LYS A  13      11.726  12.161   3.721  1.00  1.250          H  
ATOM    226 1HZ  LYS A  13      11.328  13.672   1.904  1.00  1.250          H  
ATOM    227 2HZ  LYS A  13      10.012  13.632   2.899  1.00  1.250          H  
ATOM    228 3HZ  LYS A  13      11.038  14.923   2.939  1.00  1.250          H  
ATOM    229  N   PHE A  14      10.939  12.612  10.827  1.00  0.600          N  
ATOM    230  CA  PHE A  14      10.471  13.115  12.114  1.00  0.700          C  
ATOM    231  C   PHE A  14      11.215  12.615  13.362  1.00  0.610          C  
ATOM    232  O   PHE A  14      11.213  13.308  14.379  1.00  0.610          O  
ATOM    233  CB  PHE A  14       8.990  12.769  12.326  1.00  0.940          C  
ATOM    234  CG  PHE A  14       7.993  13.557  11.493  1.00  0.940          C  
ATOM    235  CD1 PHE A  14       7.193  12.936  10.544  1.00  0.940          C  
ATOM    236  CD2 PHE A  14       7.853  14.918  11.664  1.00  0.940          C  
ATOM    237  CE1 PHE A  14       6.289  13.661   9.800  1.00  0.940          C  
ATOM    238  CE2 PHE A  14       6.958  15.647  10.928  1.00  0.940          C  
ATOM    239  CZ  PHE A  14       6.172  15.017   9.989  1.00  0.940          C  
ATOM    240  H   PHE A  14      10.355  11.950  10.305  1.00  0.720          H  
ATOM    241  HA  PHE A  14      10.569  14.198  12.086  1.00  0.840          H  
ATOM    242 1HB  PHE A  14       8.851  11.714  12.096  1.00  1.130          H  
ATOM    243 2HB  PHE A  14       8.742  12.896  13.371  1.00  1.130          H  
ATOM    244  HD1 PHE A  14       7.271  11.868  10.398  1.00  1.130          H  
ATOM    245  HD2 PHE A  14       8.454  15.409  12.385  1.00  1.130          H  
ATOM    246  HE1 PHE A  14       5.666  13.164   9.067  1.00  1.130          H  
ATOM    247  HE2 PHE A  14       6.870  16.723  11.088  1.00  1.130          H  
ATOM    248  HZ  PHE A  14       5.459  15.592   9.402  1.00  1.130          H  
ATOM    249  N   LYS A  15      11.903  11.470  13.307  1.00  0.650          N  
ATOM    250  CA  LYS A  15      12.498  10.912  14.534  1.00  0.640          C  
ATOM    251  C   LYS A  15      13.503  11.792  15.282  1.00  0.620          C  
ATOM    252  O   LYS A  15      13.714  11.556  16.471  1.00  0.720          O  
ATOM    253  CB  LYS A  15      13.191   9.574  14.255  1.00  0.900          C  
ATOM    254  CG  LYS A  15      14.516   9.612  13.526  1.00  0.900          C  
ATOM    255  CD  LYS A  15      14.975   8.187  13.204  1.00  0.900          C  
ATOM    256  CE  LYS A  15      16.341   8.156  12.525  1.00  0.900          C  
ATOM    257  NZ  LYS A  15      16.726   6.763  12.126  1.00  0.900          N  
ATOM    258  H   LYS A  15      11.881  10.910  12.445  1.00  0.780          H  
ATOM    259  HA  LYS A  15      11.690  10.724  15.232  1.00  0.770          H  
ATOM    260 1HB  LYS A  15      13.297   9.006  15.177  1.00  1.080          H  
ATOM    261 2HB  LYS A  15      12.565   9.018  13.596  1.00  1.080          H  
ATOM    262 1HG  LYS A  15      14.439  10.195  12.629  1.00  1.080          H  
ATOM    263 2HG  LYS A  15      15.268  10.072  14.167  1.00  1.080          H  
ATOM    264 1HD  LYS A  15      15.016   7.603  14.122  1.00  1.080          H  
ATOM    265 2HD  LYS A  15      14.249   7.718  12.531  1.00  1.080          H  
ATOM    266 1HE  LYS A  15      16.314   8.785  11.634  1.00  1.080          H  
ATOM    267 2HE  LYS A  15      17.089   8.549  13.212  1.00  1.080          H  
ATOM    268 1HZ  LYS A  15      17.626   6.771  11.677  1.00  1.080          H  
ATOM    269 2HZ  LYS A  15      16.759   6.164  12.934  1.00  1.080          H  
ATOM    270 3HZ  LYS A  15      16.015   6.407  11.457  1.00  1.080          H  
ATOM    271  N   GLU A  16      14.179  12.740  14.621  1.00  0.710          N  
ATOM    272  CA  GLU A  16      15.143  13.562  15.348  1.00  0.870          C  
ATOM    273  C   GLU A  16      14.505  14.776  16.040  1.00  0.890          C  
ATOM    274  O   GLU A  16      14.765  15.045  17.213  1.00  1.110          O  
ATOM    275  CB  GLU A  16      16.246  14.032  14.398  1.00  1.150          C  
ATOM    276  CG  GLU A  16      17.142  12.907  13.882  1.00  1.150          C  
ATOM    277  CD  GLU A  16      18.199  13.385  12.926  1.00  1.150          C  
ATOM    278  OE1 GLU A  16      18.178  14.543  12.582  1.00  1.150          O  
ATOM    279  OE2 GLU A  16      19.021  12.591  12.535  1.00  1.150          O  
ATOM    280  H   GLU A  16      14.045  12.883  13.626  1.00  0.850          H  
ATOM    281  HA  GLU A  16      15.602  12.942  16.119  1.00  1.040          H  
ATOM    282 1HB  GLU A  16      15.796  14.523  13.535  1.00  1.380          H  
ATOM    283 2HB  GLU A  16      16.875  14.764  14.904  1.00  1.380          H  
ATOM    284 1HG  GLU A  16      17.624  12.424  14.732  1.00  1.380          H  
ATOM    285 2HG  GLU A  16      16.520  12.165  13.384  1.00  1.380          H  
ATOM    286  N   ALA A  17      13.683  15.527  15.304  1.00  0.860          N  
ATOM    287  CA  ALA A  17      13.057  16.739  15.835  1.00  0.990          C  
ATOM    288  C   ALA A  17      11.716  16.469  16.520  1.00  0.840          C  
ATOM    289  O   ALA A  17      11.341  17.172  17.460  1.00  1.010          O  
ATOM    290  CB  ALA A  17      12.865  17.746  14.717  1.00  1.330          C  
ATOM    291  H   ALA A  17      13.519  15.261  14.345  1.00  1.030          H  
ATOM    292  HA  ALA A  17      13.725  17.164  16.582  1.00  1.190          H  
ATOM    293 1HB  ALA A  17      12.427  18.659  15.123  1.00  1.600          H  
ATOM    294 2HB  ALA A  17      13.828  17.971  14.265  1.00  1.600          H  
ATOM    295 3HB  ALA A  17      12.209  17.330  13.969  1.00  1.600          H  
ATOM    296  N   PHE A  18      10.980  15.467  16.035  1.00  0.600          N  
ATOM    297  CA  PHE A  18       9.655  15.161  16.534  1.00  0.540          C  
ATOM    298  C   PHE A  18       9.445  13.669  16.843  1.00  0.410          C  
ATOM    299  O   PHE A  18       8.565  13.065  16.218  1.00  0.400          O  
ATOM    300  CB  PHE A  18       8.628  15.571  15.488  1.00  0.780          C  
ATOM    301  CG  PHE A  18       8.686  16.997  15.088  1.00  0.780          C  
ATOM    302  CD1 PHE A  18       9.401  17.375  13.966  1.00  0.780          C  
ATOM    303  CD2 PHE A  18       8.031  17.966  15.808  1.00  0.780          C  
ATOM    304  CE1 PHE A  18       9.463  18.686  13.576  1.00  0.780          C  
ATOM    305  CE2 PHE A  18       8.091  19.283  15.424  1.00  0.780          C  
ATOM    306  CZ  PHE A  18       8.809  19.642  14.304  1.00  0.780          C  
ATOM    307  H   PHE A  18      11.328  14.887  15.278  1.00  0.720          H  
ATOM    308  HA  PHE A  18       9.490  15.733  17.445  1.00  0.650          H  
ATOM    309 1HB  PHE A  18       8.761  14.960  14.608  1.00  0.940          H  
ATOM    310 2HB  PHE A  18       7.649  15.382  15.875  1.00  0.940          H  
ATOM    311  HD1 PHE A  18       9.931  16.619  13.392  1.00  0.940          H  
ATOM    312  HD2 PHE A  18       7.465  17.688  16.687  1.00  0.940          H  
ATOM    313  HE1 PHE A  18      10.034  18.969  12.691  1.00  0.940          H  
ATOM    314  HE2 PHE A  18       7.571  20.045  16.002  1.00  0.940          H  
ATOM    315  HZ  PHE A  18       8.857  20.687  13.999  1.00  0.940          H  
ATOM    316  N   PRO A  19      10.167  13.056  17.811  1.00  0.510          N  
ATOM    317  CA  PRO A  19      10.076  11.646  18.179  1.00  0.560          C  
ATOM    318  C   PRO A  19       8.640  11.145  18.384  1.00  0.650          C  
ATOM    319  O   PRO A  19       8.346   9.987  18.077  1.00  0.770          O  
ATOM    320  CB  PRO A  19      10.842  11.614  19.504  1.00  0.840          C  
ATOM    321  CG  PRO A  19      11.867  12.711  19.370  1.00  0.840          C  
ATOM    322  CD  PRO A  19      11.167  13.810  18.617  1.00  0.840          C  
ATOM    323  HA  PRO A  19      10.599  11.046  17.421  1.00  0.670          H  
ATOM    324 1HB  PRO A  19      10.150  11.772  20.344  1.00  1.010          H  
ATOM    325 2HB  PRO A  19      11.300  10.623  19.648  1.00  1.010          H  
ATOM    326 1HG  PRO A  19      12.227  13.035  20.357  1.00  1.010          H  
ATOM    327 2HG  PRO A  19      12.751  12.341  18.815  1.00  1.010          H  
ATOM    328 1HD  PRO A  19      10.689  14.544  19.281  1.00  1.010          H  
ATOM    329 2HD  PRO A  19      11.945  14.244  18.007  1.00  1.010          H  
ATOM    330  N   HIS A  20       7.736  12.001  18.887  1.00  0.720          N  
ATOM    331  CA  HIS A  20       6.361  11.583  19.081  1.00  0.910          C  
ATOM    332  C   HIS A  20       5.582  11.428  17.773  1.00  0.900          C  
ATOM    333  O   HIS A  20       4.604  10.666  17.713  1.00  1.130          O  
ATOM    334  CB  HIS A  20       5.700  12.594  19.995  1.00  1.200          C  
ATOM    335  CG  HIS A  20       5.842  13.961  19.467  1.00  1.200          C  
ATOM    336  ND1 HIS A  20       7.045  14.647  19.531  1.00  1.200          N  
ATOM    337  CD2 HIS A  20       4.966  14.793  18.872  1.00  1.200          C  
ATOM    338  CE1 HIS A  20       6.892  15.842  18.990  1.00  1.200          C  
ATOM    339  NE2 HIS A  20       5.640  15.958  18.585  1.00  1.200          N  
ATOM    340  H   HIS A  20       7.957  12.963  19.163  1.00  0.860          H  
ATOM    341  HA  HIS A  20       6.348  10.617  19.579  1.00  1.090          H  
ATOM    342 1HB  HIS A  20       4.639  12.367  20.097  1.00  1.440          H  
ATOM    343 2HB  HIS A  20       6.151  12.552  20.984  1.00  1.440          H  
ATOM    344  HD2 HIS A  20       3.918  14.581  18.656  1.00  1.440          H  
ATOM    345  HE1 HIS A  20       7.665  16.604  18.902  1.00  1.440          H  
ATOM    346  HE2 HIS A  20       5.232  16.768  18.135  1.00  1.440          H  
ATOM    347  N   VAL A  21       6.035  12.104  16.712  1.00  0.760          N  
ATOM    348  CA  VAL A  21       5.380  12.010  15.429  1.00  0.870          C  
ATOM    349  C   VAL A  21       5.902  10.727  14.840  1.00  0.780          C  
ATOM    350  O   VAL A  21       5.140   9.920  14.325  1.00  0.820          O  
ATOM    351  CB  VAL A  21       5.642  13.214  14.520  1.00  1.170          C  
ATOM    352  CG1 VAL A  21       5.013  12.961  13.183  1.00  1.170          C  
ATOM    353  CG2 VAL A  21       5.067  14.452  15.140  1.00  1.170          C  
ATOM    354  H   VAL A  21       6.873  12.676  16.777  1.00  0.910          H  
ATOM    355  HA  VAL A  21       4.305  11.921  15.575  1.00  1.040          H  
ATOM    356  HB  VAL A  21       6.703  13.343  14.381  1.00  1.410          H  
ATOM    357 1HG1 VAL A  21       5.185  13.811  12.543  1.00  1.410          H  
ATOM    358 2HG1 VAL A  21       5.446  12.080  12.735  1.00  1.410          H  
ATOM    359 3HG1 VAL A  21       3.945  12.820  13.312  1.00  1.410          H  
ATOM    360 1HG2 VAL A  21       5.258  15.308  14.488  1.00  1.410          H  
ATOM    361 2HG2 VAL A  21       3.996  14.327  15.277  1.00  1.410          H  
ATOM    362 3HG2 VAL A  21       5.531  14.614  16.093  1.00  1.410          H  
ATOM    363  N   PHE A  22       7.209  10.513  14.956  1.00  0.710          N  
ATOM    364  CA  PHE A  22       7.814   9.275  14.481  1.00  0.680          C  
ATOM    365  C   PHE A  22       7.072   8.068  15.013  1.00  0.640          C  
ATOM    366  O   PHE A  22       6.672   7.196  14.235  1.00  0.650          O  
ATOM    367  CB  PHE A  22       9.261   9.231  14.928  1.00  0.960          C  
ATOM    368  CG  PHE A  22       9.969   7.907  14.882  1.00  0.960          C  
ATOM    369  CD1 PHE A  22      10.514   7.389  13.749  1.00  0.960          C  
ATOM    370  CD2 PHE A  22      10.115   7.191  16.059  1.00  0.960          C  
ATOM    371  CE1 PHE A  22      11.194   6.216  13.758  1.00  0.960          C  
ATOM    372  CE2 PHE A  22      10.784   5.996  16.076  1.00  0.960          C  
ATOM    373  CZ  PHE A  22      11.329   5.509  14.918  1.00  0.960          C  
ATOM    374  H   PHE A  22       7.783  11.238  15.395  1.00  0.850          H  
ATOM    375  HA  PHE A  22       7.775   9.264  13.392  1.00  0.820          H  
ATOM    376 1HB  PHE A  22       9.798   9.901  14.279  1.00  1.160          H  
ATOM    377 2HB  PHE A  22       9.346   9.621  15.916  1.00  1.160          H  
ATOM    378  HD1 PHE A  22      10.427   7.914  12.855  1.00  1.160          H  
ATOM    379  HD2 PHE A  22       9.691   7.594  16.984  1.00  1.160          H  
ATOM    380  HE1 PHE A  22      11.639   5.843  12.833  1.00  1.160          H  
ATOM    381  HE2 PHE A  22      10.892   5.442  17.007  1.00  1.160          H  
ATOM    382  HZ  PHE A  22      11.874   4.567  14.922  1.00  1.160          H  
ATOM    383  N   ARG A  23       6.836   8.026  16.329  1.00  0.630          N  
ATOM    384  CA  ARG A  23       6.127   6.892  16.891  1.00  0.640          C  
ATOM    385  C   ARG A  23       4.724   6.743  16.284  1.00  0.610          C  
ATOM    386  O   ARG A  23       4.331   5.629  15.920  1.00  0.670          O  
ATOM    387  CB  ARG A  23       6.036   7.014  18.405  1.00  0.890          C  
ATOM    388  CG  ARG A  23       7.367   6.792  19.133  1.00  0.890          C  
ATOM    389  CD  ARG A  23       7.197   6.608  20.608  1.00  0.890          C  
ATOM    390  NE  ARG A  23       6.676   7.809  21.282  1.00  0.890          N  
ATOM    391  CZ  ARG A  23       7.423   8.835  21.769  1.00  0.890          C  
ATOM    392  NH1 ARG A  23       8.736   8.839  21.649  1.00  0.890          N  
ATOM    393  NH2 ARG A  23       6.819   9.844  22.381  1.00  0.890          N  
ATOM    394  H   ARG A  23       7.203   8.766  16.936  1.00  0.760          H  
ATOM    395  HA  ARG A  23       6.697   5.993  16.658  1.00  0.770          H  
ATOM    396 1HB  ARG A  23       5.686   8.016  18.659  1.00  1.070          H  
ATOM    397 2HB  ARG A  23       5.311   6.301  18.789  1.00  1.070          H  
ATOM    398 1HG  ARG A  23       7.853   5.904  18.729  1.00  1.070          H  
ATOM    399 2HG  ARG A  23       8.008   7.653  18.970  1.00  1.070          H  
ATOM    400 1HD  ARG A  23       6.490   5.796  20.779  1.00  1.070          H  
ATOM    401 2HD  ARG A  23       8.151   6.342  21.055  1.00  1.070          H  
ATOM    402  HE  ARG A  23       5.674   7.864  21.414  1.00  1.070          H  
ATOM    403 1HH1 ARG A  23       9.208   8.078  21.187  1.00  1.070          H  
ATOM    404 2HH1 ARG A  23       9.273   9.602  22.033  1.00  1.070          H  
ATOM    405 1HH2 ARG A  23       5.812   9.841  22.483  1.00  1.070          H  
ATOM    406 2HH2 ARG A  23       7.362  10.609  22.753  1.00  1.070          H  
ATOM    407  N   LEU A  24       3.984   7.852  16.118  1.00  0.570          N  
ATOM    408  CA  LEU A  24       2.664   7.757  15.501  1.00  0.590          C  
ATOM    409  C   LEU A  24       2.716   7.269  14.064  1.00  0.580          C  
ATOM    410  O   LEU A  24       1.908   6.426  13.665  1.00  0.610          O  
ATOM    411  CB  LEU A  24       1.944   9.111  15.499  1.00  0.820          C  
ATOM    412  CG  LEU A  24       0.538   9.149  14.778  1.00  0.820          C  
ATOM    413  CD1 LEU A  24      -0.457   8.178  15.453  1.00  0.820          C  
ATOM    414  CD2 LEU A  24       0.021  10.576  14.793  1.00  0.820          C  
ATOM    415  H   LEU A  24       4.318   8.758  16.470  1.00  0.680          H  
ATOM    416  HA  LEU A  24       2.086   7.049  16.086  1.00  0.710          H  
ATOM    417 1HB  LEU A  24       1.811   9.433  16.531  1.00  0.980          H  
ATOM    418 2HB  LEU A  24       2.592   9.837  15.003  1.00  0.980          H  
ATOM    419  HG  LEU A  24       0.655   8.831  13.744  1.00  0.980          H  
ATOM    420 1HD1 LEU A  24      -1.412   8.223  14.929  1.00  0.980          H  
ATOM    421 2HD1 LEU A  24      -0.083   7.159  15.410  1.00  0.980          H  
ATOM    422 3HD1 LEU A  24      -0.601   8.468  16.492  1.00  0.980          H  
ATOM    423 1HD2 LEU A  24      -0.939  10.622  14.276  1.00  0.980          H  
ATOM    424 2HD2 LEU A  24      -0.104  10.911  15.823  1.00  0.980          H  
ATOM    425 3HD2 LEU A  24       0.738  11.223  14.285  1.00  0.980          H  
ATOM    426  N   LYS A  25       3.631   7.816  13.272  1.00  0.570          N  
ATOM    427  CA  LYS A  25       3.711   7.470  11.868  1.00  0.610          C  
ATOM    428  C   LYS A  25       4.116   5.994  11.714  1.00  0.620          C  
ATOM    429  O   LYS A  25       3.581   5.310  10.839  1.00  0.610          O  
ATOM    430  CB  LYS A  25       4.675   8.424  11.156  1.00  0.840          C  
ATOM    431  CG  LYS A  25       4.245   9.936  11.146  1.00  0.840          C  
ATOM    432  CD  LYS A  25       3.000  10.278  10.332  1.00  0.840          C  
ATOM    433  CE  LYS A  25       2.715  11.782  10.414  1.00  0.840          C  
ATOM    434  NZ  LYS A  25       1.480  12.191   9.665  1.00  0.840          N  
ATOM    435  H   LYS A  25       4.262   8.513  13.665  1.00  0.680          H  
ATOM    436  HA  LYS A  25       2.723   7.580  11.427  1.00  0.730          H  
ATOM    437 1HB  LYS A  25       5.617   8.404  11.696  1.00  1.010          H  
ATOM    438 2HB  LYS A  25       4.858   8.092  10.132  1.00  1.010          H  
ATOM    439 1HG  LYS A  25       4.032  10.225  12.164  1.00  1.010          H  
ATOM    440 2HG  LYS A  25       5.080  10.536  10.791  1.00  1.010          H  
ATOM    441 1HD  LYS A  25       3.167  10.029   9.296  1.00  1.010          H  
ATOM    442 2HD  LYS A  25       2.137   9.731  10.703  1.00  1.010          H  
ATOM    443 1HE  LYS A  25       2.595  12.059  11.457  1.00  1.010          H  
ATOM    444 2HE  LYS A  25       3.566  12.317  10.003  1.00  1.010          H  
ATOM    445 1HZ  LYS A  25       1.354  13.191   9.755  1.00  1.010          H  
ATOM    446 2HZ  LYS A  25       1.579  11.954   8.688  1.00  1.010          H  
ATOM    447 3HZ  LYS A  25       0.667  11.724  10.041  1.00  1.010          H  
ATOM    448  N   LYS A  26       5.007   5.479  12.590  1.00  0.650          N  
ATOM    449  CA  LYS A  26       5.383   4.060  12.525  1.00  0.720          C  
ATOM    450  C   LYS A  26       4.182   3.190  12.900  1.00  0.640          C  
ATOM    451  O   LYS A  26       3.959   2.139  12.292  1.00  0.630          O  
ATOM    452  CB  LYS A  26       6.565   3.729  13.446  1.00  0.980          C  
ATOM    453  CG  LYS A  26       7.941   4.259  13.011  1.00  0.980          C  
ATOM    454  CD  LYS A  26       8.497   3.548  11.741  1.00  0.980          C  
ATOM    455  CE  LYS A  26       9.914   4.021  11.458  1.00  0.980          C  
ATOM    456  NZ  LYS A  26      10.555   3.400  10.264  1.00  0.980          N  
ATOM    457  H   LYS A  26       5.455   6.102  13.269  1.00  0.780          H  
ATOM    458  HA  LYS A  26       5.656   3.821  11.499  1.00  0.860          H  
ATOM    459 1HB  LYS A  26       6.363   4.146  14.437  1.00  1.180          H  
ATOM    460 2HB  LYS A  26       6.642   2.649  13.557  1.00  1.180          H  
ATOM    461 1HG  LYS A  26       7.846   5.317  12.811  1.00  1.180          H  
ATOM    462 2HG  LYS A  26       8.647   4.137  13.832  1.00  1.180          H  
ATOM    463 1HD  LYS A  26       8.490   2.466  11.874  1.00  1.180          H  
ATOM    464 2HD  LYS A  26       7.885   3.794  10.872  1.00  1.180          H  
ATOM    465 1HE  LYS A  26       9.887   5.091  11.305  1.00  1.180          H  
ATOM    466 2HE  LYS A  26      10.529   3.801  12.322  1.00  1.180          H  
ATOM    467 1HZ  LYS A  26      11.502   3.830  10.187  1.00  1.180          H  
ATOM    468 2HZ  LYS A  26      10.637   2.410  10.359  1.00  1.180          H  
ATOM    469 3HZ  LYS A  26      10.031   3.586   9.393  1.00  1.180          H  
ATOM    470  N   TRP A  27       3.399   3.620  13.896  1.00  0.600          N  
ATOM    471  CA  TRP A  27       2.202   2.887  14.274  1.00  0.570          C  
ATOM    472  C   TRP A  27       1.244   2.819  13.096  1.00  0.490          C  
ATOM    473  O   TRP A  27       0.680   1.756  12.812  1.00  0.490          O  
ATOM    474  CB  TRP A  27       1.517   3.509  15.488  1.00  0.810          C  
ATOM    475  CG  TRP A  27       0.227   2.842  15.835  1.00  0.810          C  
ATOM    476  CD1 TRP A  27       0.057   1.727  16.590  1.00  0.810          C  
ATOM    477  CD2 TRP A  27      -1.098   3.268  15.445  1.00  0.810          C  
ATOM    478  NE1 TRP A  27      -1.275   1.423  16.685  1.00  0.810          N  
ATOM    479  CE2 TRP A  27      -1.994   2.359  15.990  1.00  0.810          C  
ATOM    480  CE3 TRP A  27      -1.578   4.330  14.692  1.00  0.810          C  
ATOM    481  CZ2 TRP A  27      -3.360   2.480  15.803  1.00  0.810          C  
ATOM    482  CZ3 TRP A  27      -2.935   4.461  14.496  1.00  0.810          C  
ATOM    483  CH2 TRP A  27      -3.810   3.558  15.037  1.00  0.810          C  
ATOM    484  H   TRP A  27       3.666   4.456  14.432  1.00  0.720          H  
ATOM    485  HA  TRP A  27       2.490   1.871  14.537  1.00  0.680          H  
ATOM    486 1HB  TRP A  27       2.183   3.458  16.347  1.00  0.970          H  
ATOM    487 2HB  TRP A  27       1.321   4.558  15.296  1.00  0.970          H  
ATOM    488  HD1 TRP A  27       0.861   1.154  17.047  1.00  0.970          H  
ATOM    489  HE1 TRP A  27      -1.664   0.640  17.187  1.00  0.970          H  
ATOM    490  HE3 TRP A  27      -0.893   5.038  14.279  1.00  0.970          H  
ATOM    491  HZ2 TRP A  27      -4.068   1.770  16.229  1.00  0.970          H  
ATOM    492  HZ3 TRP A  27      -3.292   5.300  13.901  1.00  0.970          H  
ATOM    493  HH2 TRP A  27      -4.878   3.686  14.866  1.00  0.970          H  
ATOM    494  N   ILE A  28       1.047   3.950  12.409  1.00  0.470          N  
ATOM    495  CA  ILE A  28       0.138   3.966  11.282  1.00  0.460          C  
ATOM    496  C   ILE A  28       0.676   3.016  10.217  1.00  0.480          C  
ATOM    497  O   ILE A  28      -0.095   2.262   9.635  1.00  0.470          O  
ATOM    498  CB  ILE A  28      -0.070   5.359  10.671  1.00  0.650          C  
ATOM    499  CG1 ILE A  28      -0.773   6.285  11.666  1.00  0.650          C  
ATOM    500  CG2 ILE A  28      -1.012   5.165   9.465  1.00  0.650          C  
ATOM    501  CD1 ILE A  28      -0.740   7.745  11.288  1.00  0.650          C  
ATOM    502  H   ILE A  28       1.513   4.812  12.716  1.00  0.560          H  
ATOM    503  HA  ILE A  28      -0.831   3.600  11.618  1.00  0.550          H  
ATOM    504  HB  ILE A  28       0.879   5.811  10.372  1.00  0.780          H  
ATOM    505 1HG1 ILE A  28      -1.809   5.974  11.772  1.00  0.780          H  
ATOM    506 2HG1 ILE A  28      -0.286   6.202  12.613  1.00  0.780          H  
ATOM    507 1HG2 ILE A  28      -1.233   6.101   9.021  1.00  0.780          H  
ATOM    508 2HG2 ILE A  28      -0.558   4.529   8.722  1.00  0.780          H  
ATOM    509 3HG2 ILE A  28      -1.944   4.711   9.802  1.00  0.780          H  
ATOM    510 1HD1 ILE A  28      -1.244   8.323  12.060  1.00  0.780          H  
ATOM    511 2HD1 ILE A  28       0.295   8.070  11.213  1.00  0.780          H  
ATOM    512 3HD1 ILE A  28      -1.237   7.914  10.341  1.00  0.780          H  
ATOM    513  N   GLN A  29       1.987   3.054   9.931  1.00  0.540          N  
ATOM    514  CA  GLN A  29       2.580   2.151   8.943  1.00  0.610          C  
ATOM    515  C   GLN A  29       2.206   0.693   9.244  1.00  0.580          C  
ATOM    516  O   GLN A  29       1.866  -0.069   8.329  1.00  0.620          O  
ATOM    517  CB  GLN A  29       4.104   2.256   8.966  1.00  0.830          C  
ATOM    518  CG  GLN A  29       4.820   1.406   7.959  1.00  0.830          C  
ATOM    519  CD  GLN A  29       6.290   1.431   8.188  1.00  0.830          C  
ATOM    520  OE1 GLN A  29       6.808   2.325   8.865  1.00  0.830          O  
ATOM    521  NE2 GLN A  29       6.988   0.442   7.640  1.00  0.830          N  
ATOM    522  H   GLN A  29       2.584   3.741  10.401  1.00  0.650          H  
ATOM    523  HA  GLN A  29       2.204   2.416   7.956  1.00  0.730          H  
ATOM    524 1HB  GLN A  29       4.405   3.288   8.826  1.00  0.990          H  
ATOM    525 2HB  GLN A  29       4.467   1.950   9.934  1.00  0.990          H  
ATOM    526 1HG  GLN A  29       4.481   0.371   8.013  1.00  0.990          H  
ATOM    527 2HG  GLN A  29       4.634   1.817   6.973  1.00  0.990          H  
ATOM    528 1HE2 GLN A  29       7.984   0.401   7.762  1.00  0.990          H  
ATOM    529 2HE2 GLN A  29       6.524  -0.270   7.107  1.00  0.990          H  
ATOM    530  N   LYS A  30       2.307   0.289  10.522  1.00  0.540          N  
ATOM    531  CA  LYS A  30       1.935  -1.072  10.908  1.00  0.550          C  
ATOM    532  C   LYS A  30       0.456  -1.332  10.604  1.00  0.460          C  
ATOM    533  O   LYS A  30       0.106  -2.412  10.109  1.00  0.510          O  
ATOM    534  CB  LYS A  30       2.237  -1.323  12.387  1.00  0.770          C  
ATOM    535  CG  LYS A  30       3.731  -1.410  12.714  1.00  0.770          C  
ATOM    536  CD  LYS A  30       3.973  -1.637  14.209  1.00  0.770          C  
ATOM    537  CE  LYS A  30       5.464  -1.700  14.526  1.00  0.770          C  
ATOM    538  NZ  LYS A  30       5.719  -1.898  15.986  1.00  0.770          N  
ATOM    539  H   LYS A  30       2.684   0.946  11.217  1.00  0.650          H  
ATOM    540  HA  LYS A  30       2.524  -1.770  10.313  1.00  0.660          H  
ATOM    541 1HB  LYS A  30       1.813  -0.515  12.983  1.00  0.920          H  
ATOM    542 2HB  LYS A  30       1.762  -2.248  12.704  1.00  0.920          H  
ATOM    543 1HG  LYS A  30       4.175  -2.229  12.148  1.00  0.920          H  
ATOM    544 2HG  LYS A  30       4.215  -0.481  12.410  1.00  0.920          H  
ATOM    545 1HD  LYS A  30       3.524  -0.815  14.772  1.00  0.920          H  
ATOM    546 2HD  LYS A  30       3.502  -2.568  14.519  1.00  0.920          H  
ATOM    547 1HE  LYS A  30       5.910  -2.526  13.975  1.00  0.920          H  
ATOM    548 2HE  LYS A  30       5.933  -0.767  14.210  1.00  0.920          H  
ATOM    549 1HZ  LYS A  30       6.715  -1.934  16.152  1.00  0.920          H  
ATOM    550 2HZ  LYS A  30       5.319  -1.131  16.509  1.00  0.920          H  
ATOM    551 3HZ  LYS A  30       5.297  -2.765  16.288  1.00  0.920          H  
ATOM    552  N   VAL A  31      -0.391  -0.328  10.861  1.00  0.400          N  
ATOM    553  CA  VAL A  31      -1.821  -0.397  10.571  1.00  0.390          C  
ATOM    554  C   VAL A  31      -2.057  -0.546   9.065  1.00  0.420          C  
ATOM    555  O   VAL A  31      -2.918  -1.314   8.644  1.00  0.490          O  
ATOM    556  CB  VAL A  31      -2.585   0.810  11.142  1.00  0.550          C  
ATOM    557  CG1 VAL A  31      -4.004   0.803  10.651  1.00  0.550          C  
ATOM    558  CG2 VAL A  31      -2.568   0.727  12.661  1.00  0.550          C  
ATOM    559  H   VAL A  31      -0.009   0.500  11.336  1.00  0.480          H  
ATOM    560  HA  VAL A  31      -2.220  -1.277  11.072  1.00  0.470          H  
ATOM    561  HB  VAL A  31      -2.126   1.724  10.817  1.00  0.660          H  
ATOM    562 1HG1 VAL A  31      -4.536   1.651  11.072  1.00  0.660          H  
ATOM    563 2HG1 VAL A  31      -4.041   0.869   9.564  1.00  0.660          H  
ATOM    564 3HG1 VAL A  31      -4.479  -0.127  10.973  1.00  0.660          H  
ATOM    565 1HG2 VAL A  31      -3.104   1.570  13.064  1.00  0.660          H  
ATOM    566 2HG2 VAL A  31      -3.049  -0.200  12.978  1.00  0.660          H  
ATOM    567 3HG2 VAL A  31      -1.548   0.742  13.025  1.00  0.660          H  
ATOM    568  N   ILE A  32      -1.297   0.168   8.242  1.00  0.470          N  
ATOM    569  CA  ILE A  32      -1.467   0.045   6.801  1.00  0.590          C  
ATOM    570  C   ILE A  32      -1.257  -1.422   6.408  1.00  0.670          C  
ATOM    571  O   ILE A  32      -2.051  -1.968   5.627  1.00  0.770          O  
ATOM    572  CB  ILE A  32      -0.452   0.936   6.039  1.00  0.780          C  
ATOM    573  CG1 ILE A  32      -0.693   2.446   6.335  1.00  0.780          C  
ATOM    574  CG2 ILE A  32      -0.483   0.664   4.548  1.00  0.780          C  
ATOM    575  CD1 ILE A  32      -2.050   3.030   5.936  1.00  0.780          C  
ATOM    576  H   ILE A  32      -0.640   0.831   8.654  1.00  0.560          H  
ATOM    577  HA  ILE A  32      -2.483   0.323   6.535  1.00  0.710          H  
ATOM    578  HB  ILE A  32       0.545   0.706   6.398  1.00  0.930          H  
ATOM    579 1HG1 ILE A  32      -0.580   2.600   7.373  1.00  0.930          H  
ATOM    580 2HG1 ILE A  32       0.087   2.990   5.836  1.00  0.930          H  
ATOM    581 1HG2 ILE A  32       0.247   1.275   4.057  1.00  0.930          H  
ATOM    582 2HG2 ILE A  32      -0.261  -0.382   4.336  1.00  0.930          H  
ATOM    583 3HG2 ILE A  32      -1.440   0.895   4.165  1.00  0.930          H  
ATOM    584 1HD1 ILE A  32      -2.074   4.084   6.200  1.00  0.930          H  
ATOM    585 2HD1 ILE A  32      -2.222   2.933   4.872  1.00  0.930          H  
ATOM    586 3HD1 ILE A  32      -2.856   2.523   6.465  1.00  0.930          H  
ATOM    587  N   ASP A  33      -0.204  -2.077   6.934  1.00  0.680          N  
ATOM    588  CA  ASP A  33      -0.028  -3.505   6.635  1.00  0.820          C  
ATOM    589  C   ASP A  33      -1.181  -4.354   7.175  1.00  0.840          C  
ATOM    590  O   ASP A  33      -1.669  -5.252   6.487  1.00  1.020          O  
ATOM    591  CB  ASP A  33       1.285  -4.056   7.206  1.00  1.090          C  
ATOM    592  CG  ASP A  33       2.547  -3.686   6.435  1.00  1.090          C  
ATOM    593  OD1 ASP A  33       2.463  -3.335   5.282  1.00  1.090          O  
ATOM    594  OD2 ASP A  33       3.602  -3.768   7.010  1.00  1.090          O  
ATOM    595  H   ASP A  33       0.470  -1.562   7.517  1.00  0.820          H  
ATOM    596  HA  ASP A  33      -0.001  -3.620   5.551  1.00  0.980          H  
ATOM    597 1HB  ASP A  33       1.397  -3.690   8.229  1.00  1.310          H  
ATOM    598 2HB  ASP A  33       1.221  -5.143   7.263  1.00  1.310          H  
ATOM    599  N   GLN A  34      -1.658  -4.027   8.380  1.00  0.750          N  
ATOM    600  CA  GLN A  34      -2.764  -4.737   9.027  1.00  0.890          C  
ATOM    601  C   GLN A  34      -4.028  -4.707   8.181  1.00  1.050          C  
ATOM    602  O   GLN A  34      -4.730  -5.711   8.047  1.00  1.240          O  
ATOM    603  CB  GLN A  34      -3.093  -4.080  10.369  1.00  1.190          C  
ATOM    604  CG  GLN A  34      -4.167  -4.737  11.183  1.00  1.190          C  
ATOM    605  CD  GLN A  34      -4.478  -3.915  12.405  1.00  1.190          C  
ATOM    606  OE1 GLN A  34      -3.846  -2.885  12.656  1.00  1.190          O  
ATOM    607  NE2 GLN A  34      -5.456  -4.358  13.177  1.00  1.190          N  
ATOM    608  H   GLN A  34      -1.181  -3.286   8.903  1.00  0.900          H  
ATOM    609  HA  GLN A  34      -2.470  -5.774   9.179  1.00  1.070          H  
ATOM    610 1HB  GLN A  34      -2.187  -3.998  10.969  1.00  1.430          H  
ATOM    611 2HB  GLN A  34      -3.451  -3.082  10.189  1.00  1.430          H  
ATOM    612 1HG  GLN A  34      -5.075  -4.837  10.596  1.00  1.430          H  
ATOM    613 2HG  GLN A  34      -3.821  -5.717  11.505  1.00  1.430          H  
ATOM    614 1HE2 GLN A  34      -5.709  -3.856  14.008  1.00  1.430          H  
ATOM    615 2HE2 GLN A  34      -5.943  -5.200  12.939  1.00  1.430          H  
ATOM    616  N   PHE A  35      -4.326  -3.532   7.632  1.00  1.070          N  
ATOM    617  CA  PHE A  35      -5.516  -3.316   6.833  1.00  1.350          C  
ATOM    618  C   PHE A  35      -5.339  -3.618   5.342  1.00  1.450          C  
ATOM    619  O   PHE A  35      -6.332  -3.841   4.645  1.00  1.720          O  
ATOM    620  CB  PHE A  35      -5.988  -1.871   6.994  1.00  1.780          C  
ATOM    621  CG  PHE A  35      -6.474  -1.471   8.391  1.00  1.780          C  
ATOM    622  CD1 PHE A  35      -6.651  -2.389   9.438  1.00  1.780          C  
ATOM    623  CD2 PHE A  35      -6.777  -0.146   8.640  1.00  1.780          C  
ATOM    624  CE1 PHE A  35      -7.098  -1.976  10.670  1.00  1.780          C  
ATOM    625  CE2 PHE A  35      -7.233   0.262   9.876  1.00  1.780          C  
ATOM    626  CZ  PHE A  35      -7.389  -0.656  10.892  1.00  1.780          C  
ATOM    627  H   PHE A  35      -3.717  -2.740   7.847  1.00  1.280          H  
ATOM    628  HA  PHE A  35      -6.295  -3.984   7.195  1.00  1.620          H  
ATOM    629 1HB  PHE A  35      -5.158  -1.207   6.735  1.00  2.130          H  
ATOM    630 2HB  PHE A  35      -6.791  -1.670   6.288  1.00  2.130          H  
ATOM    631  HD1 PHE A  35      -6.435  -3.437   9.293  1.00  2.130          H  
ATOM    632  HD2 PHE A  35      -6.654   0.590   7.835  1.00  2.130          H  
ATOM    633  HE1 PHE A  35      -7.225  -2.702  11.471  1.00  2.130          H  
ATOM    634  HE2 PHE A  35      -7.465   1.312  10.049  1.00  2.130          H  
ATOM    635  HZ  PHE A  35      -7.746  -0.333  11.869  1.00  2.130          H  
ATOM    636  N   GLY A  36      -4.100  -3.651   4.839  1.00  1.430          N  
ATOM    637  CA  GLY A  36      -3.876  -3.896   3.419  1.00  1.780          C  
ATOM    638  C   GLY A  36      -4.036  -2.637   2.566  1.00  1.940          C  
ATOM    639  O   GLY A  36      -4.469  -2.715   1.411  1.00  2.560          O  
ATOM    640  H   GLY A  36      -3.285  -3.444   5.418  1.00  1.720          H  
ATOM    641 1HA  GLY A  36      -2.868  -4.290   3.291  1.00  2.140          H  
ATOM    642 2HA  GLY A  36      -4.564  -4.664   3.073  1.00  2.140          H  
ATOM    643  N   GLU A  37      -3.744  -1.481   3.160  1.00  1.850          N  
ATOM    644  CA  GLU A  37      -3.866  -0.199   2.477  1.00  2.190          C  
ATOM    645  C   GLU A  37      -2.534   0.158   1.810  1.00  3.020          C  
ATOM    646  O   GLU A  37      -2.465   1.020   0.929  1.00  3.430          O  
ATOM    647  OXT GLU A  37      -1.613  -0.653   1.912  1.00  3.290          O  
ATOM    648  CB  GLU A  37      -4.324   0.877   3.471  1.00  2.750          C  
ATOM    649  CG  GLU A  37      -5.727   0.636   4.023  1.00  2.750          C  
ATOM    650  CD  GLU A  37      -6.179   1.665   5.035  1.00  2.750          C  
ATOM    651  OE1 GLU A  37      -5.474   2.614   5.251  1.00  2.750          O  
ATOM    652  OE2 GLU A  37      -7.227   1.480   5.603  1.00  2.750          O  
ATOM    653  H   GLU A  37      -3.368  -1.521   4.111  1.00  2.220          H  
ATOM    654  HA  GLU A  37      -4.625  -0.288   1.699  1.00  2.630          H  
ATOM    655 1HB  GLU A  37      -3.663   0.891   4.324  1.00  3.300          H  
ATOM    656 2HB  GLU A  37      -4.289   1.863   3.004  1.00  3.300          H  
ATOM    657 1HG  GLU A  37      -6.428   0.633   3.190  1.00  3.300          H  
ATOM    658 2HG  GLU A  37      -5.751  -0.349   4.472  1.00  3.300          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -229.016 22.7425 181.432 -16.752 3.70342 10.164 92.7281 -96.242 -0.2736 -1.49108 -88.0661 -7.76682 -34.4317 -4.28618 0 -2.94699 0 0.5528 3.23744 18.599 45.5995 -5.2753 0.01308 -5.71984 -5.68741 20.9101 -98.2726
ASP:NtermProteinFull_1 -2.70186 0.37195 4.67013 -0.12596 0.03248 0.42783 2.86257 -2.03404 -0.07227 -0.29118 -3.92283 -0.90497 0 0 0 0 0 0.03449 0.0198 0 2.2262 0 0 -2.3716 0 0.35787 -1.42139
TRP_2 -5.33442 0.53287 1.96728 -1.41483 0.13657 0.66672 1.5731 -1.64861 -0 -0 -1.6024 -0.27948 0 0 0 0 0 -0.03462 0.01226 0 1.93075 -0.15904 0 1.6906 -0.03439 0.4728 -1.52484
PHE_3 -7.55716 1.16067 3.29484 -0.64187 0.05192 0.28588 1.88659 -2.36574 -0.07792 -0.28517 -1.50214 -0.06802 0 0 0 0 0 -0.04931 0.01304 0 2.5218 0.21634 0 1.0402 -0.16727 0.72245 -1.52088
LYS_4 -6.41374 0.61529 6.91812 -0.38962 0.0514 0.18741 2.88308 -3.02951 -0 -0 -3.27818 0.16195 0 0 0 0 0 0.16672 0.03269 2.29413 0 -0.14461 0 -1.5107 -0.27547 0.91315 -0.81788
ALA_5 -3.90136 0.21821 4.24354 -0.02072 0 0 2.16057 -2.19408 -0.00514 -0.06913 -1.55433 -0.38221 0 0 0 0 0 0.08128 0 0 0 -0.12937 0 1.8394 -0.25039 0.47063 0.5069
PHE_6 -8.49647 0.67852 3.56443 -0.97405 0.06882 0.28999 2.81881 -2.81547 -0.00194 -0.02101 -2.38753 -0.07731 0 0 0 0 0 0.00963 0.27816 0 1.78351 -0.41563 0 1.0402 -0.02225 0.3606 -4.31899
TYR_7 -11.0265 1.25242 4.23891 -0.64726 0.15889 0.28759 3.26381 -3.26974 -0 -0 -2.41614 -0.26831 0 0 0 0 0 0.04347 0.1286 0 2.59526 0.14934 0.01308 1.2797 -0.05249 0.56889 -3.7005
ASP_8 -5.78644 0.38654 8.11081 -0.21771 0.00093 0.70489 3.67803 -3.58337 -0.00514 -0.06913 -4.93016 -0.11995 0 0 0 0 0 -0.00934 0.00356 0 2.97895 0.30568 0 -2.3716 0.02909 0.4604 -0.43396
LYS_9 -4.62583 0.21808 5.41385 -0.30657 0.02784 0.1379 2.2864 -2.50417 -0 -0 -1.97873 0.00248 0 0 0 0 0 -0.04468 0.0215 1.71967 0 -0.00406 0 -1.5107 -0.05259 0.2568 -0.9428
VAL_10 -7.36573 1.00655 3.84626 -0.26282 0.11476 0.04271 2.87252 -2.83819 -0 -0 -2.0324 0.28396 0 0 0 0 0 -0.0371 0.01476 0.88055 0 -0.15336 0 1.9342 -0.25809 0.60347 -1.34795
ALA_11 -7.35896 1.03118 4.38936 -0.02144 0 0 3.10756 -3.09439 -0.00022 -0.00149 -2.25303 -0.36159 0 0 0 0 0 -0.03586 0 0 0 -0.25979 0 1.8394 -0.22419 0.61798 -2.62547
GLU_12 -5.71687 0.43581 8.06408 -0.39601 0.03613 0.75374 3.79804 -3.32573 -0.02119 -0.1275 -4.93015 -0.42992 0 0 0 -1.4735 0 0.12344 0.03188 0 3.38253 -0.27201 0 -2.7348 -0.46457 0.41745 -2.84915
LYS_13 -3.36809 0.17026 3.93094 -0.29793 0.02568 0.13064 1.63486 -1.79416 -0.01372 -0.11121 -0.99633 -0.00519 0 0 0 0 0 -0.04735 0.00489 1.71854 0 -0.03052 0 -1.5107 -0.53303 0.3698 -0.72262
PHE_14 -8.99389 1.12487 4.72017 -0.56871 0.04805 0.26472 2.95238 -2.95127 -0 -0 -2.74388 -0.04382 0 0 0 0 0 0.08804 0.00766 0 2.4269 0.01174 0 1.0402 -0.34615 0.70375 -2.25924
LYS_15 -6.11299 0.66073 5.74867 -0.42274 0.06133 0.22537 2.59584 -2.43275 -0 -0 -3.08379 0.0345 0 0 0 -0.67041 0 -0.11714 0.38615 1.52841 0 -0.03457 0 -1.5107 -0.37794 1.20264 -2.31938
GLU_16 -2.20106 0.14724 2.44098 -0.20795 0.03431 0.29713 0.3757 -1.05282 -0.02119 -0.1275 0.39979 -0.54655 0 0 0 0 0 -0.03431 0.00241 0 3.09728 -0.04779 0 -2.7348 -0.11821 0.68816 0.39082
ALA_17 -2.55468 0.33106 1.04924 -0.02329 0 0 0.21559 -0.88719 -0.01372 -0.11121 0.20793 -0.34443 0 0 0 0 0 -0.04909 0 0 0 0.21129 0 1.8394 0.3045 0.13873 0.31411
PHE_18 -7.36565 1.07148 4.40025 -0.65761 0.08535 0.41514 3.03618 -2.7622 -0 -0 -3.1409 0.04208 0 0 0 0 0 0.06187 0.03484 0 1.86072 -0.3211 0 1.0402 -0.20437 0.89592 -1.50777
PRO_19 -5.46974 0.72428 4.33427 -0.06814 0 0.0426 1.8764 -1.98435 -0 -0 -1.59195 0.6048 0 0 0 0 0 -0.12622 0.03219 0.17733 0 -0.59325 0 -2.4119 -0.18574 1.1464 -3.49303
HIS_20 -5.75392 0.34343 4.86963 -0.74101 0.0227 0.82515 1.1237 -2.54798 -0 -0 -0.84206 -2.73837 0 0 0 0 0 0.02081 0.42843 0 2.04261 -0.08714 0 -0.45461 -0.0245 0.59919 -2.91395
VAL_21 -7.46561 0.95087 4.63004 -0.30228 0.18045 0.06779 2.80671 -2.74745 -0.00281 -0.01832 -2.21309 -0.27019 0 0 0 0 0 0.13936 0.01494 0.33201 0 -0.37031 0 1.9342 -0.18318 0.65653 -1.86032
PHE_22 -9.94306 1.32986 5.96598 -0.85408 0.04372 0.23569 2.78012 -3.34362 -0 -0 -1.90318 -0.15637 0 0 0 0 0 0.00199 0.80531 0 1.77553 -0.51664 0 1.0402 0.1405 0.76173 -1.83631
ARG_23 -5.70161 0.26645 6.17681 -0.7478 0.09654 0.4875 2.1782 -2.93819 -0 -0 -1.89293 0.35533 0 0 0 0 0 0.08225 0.00597 1.45118 0 -0.08507 0 -1.2888 -0.02802 0.57383 -1.00836
LEU_24 -5.64664 0.30866 4.88875 -0.71077 0.2655 0.30802 2.69176 -2.55198 -0 -0 -2.00992 0.09558 0 0 0 0 0 -0.01444 0.06401 0.87677 0 -0.22758 0 0.18072 -0.23382 0.36505 -1.35031
LYS_25 -9.10619 0.69388 6.27116 -0.46884 0.11104 0.28658 2.95453 -3.16549 -0 -0 -2.42405 0.1162 0 0 0 0 0 0.14755 0.10978 2.25681 0 -0.04834 0 -1.5107 -0.30293 0.56641 -3.51262
LYS_26 -7.70093 0.6873 9.01642 -0.46483 0.11041 0.26483 4.90867 -3.89254 -0.00281 -0.01832 -6.9603 0.08361 0 0 0 -0.80309 0 0.17662 0.10383 2.2531 0 -0.04123 0 -1.5107 -0.437 0.77836 -3.44861
TRP_27 -6.46621 0.556 4.60723 -1.34039 0.08726 0.55469 2.75615 -2.68535 -0 -0 -2.23553 -0.33298 0 0 0 0 0 -0.01966 0.06821 0 1.76037 -0.20922 0 1.6906 -0.25423 0.49224 -0.97082
ILE_28 -8.92729 1.17383 4.81961 -0.50872 0.51028 0.10292 3.11392 -3.12711 -0 -0 -2.41556 -0.11119 0 0 0 0 0 -0.02015 0.10732 0.59426 0 -0.40119 0 0.73287 -0.07514 0.55934 -3.872
GLN_29 -8.00108 0.51299 7.83422 -0.40275 0.11835 0.28207 3.11246 -3.52723 -0 -0 -2.18885 -0.65789 0 0 0 0 0 0.05867 0.17526 0 3.16819 0.03595 0 -0.18838 0.09287 0.64383 1.0687
LYS_30 -4.6505 0.24902 5.45914 -0.29696 0.0263 0.12963 2.61305 -2.53349 -0 -0 -2.51518 -0.01963 0 0 0 0 0 0.13094 0.00155 1.71311 0 -0.01704 0 -1.5107 -0.12678 0.34621 -1.00132
VAL_31 -7.54981 0.85607 4.71906 -0.31845 0.24621 0.07289 3.53362 -3.09353 -0 -0 -2.6935 -0.19489 0 0 0 0 0 -0.04178 0.00167 0.20885 0 -0.18256 0 1.9342 -0.35607 0.35841 -2.4996
ILE_32 -9.617 1.12075 6.11842 -0.65406 0.44862 0.14257 3.44646 -3.57243 -0 -0 -3.40741 0.32926 0 0 0 0 0 0.11103 0.01131 0.59428 0 -0.34277 0 0.73287 -0.07067 0.64314 -3.96564
ASP_33 -3.90611 0.3294 5.88586 -0.10585 0.01215 0.32529 2.13296 -2.56464 -0 -0 -2.38463 -0.30132 0 0 0 0 0 -0.00074 0.16634 0 1.81722 0.21693 0 -2.3716 -0.08721 0.62096 -0.21497
GLN_34 -4.49007 0.31861 3.62413 -0.39215 0.10714 0.2665 1.773 -1.93073 -0 -0 -0.82774 -0.63696 0 0 0 0 0 -0.03564 0.10875 0 3.26795 0.0246 0 -0.18838 -0.16927 0.40245 1.22219
PHE_35 -5.36827 0.39053 3.17016 -0.55796 0.34126 0.2861 1.26437 -1.89703 -0 -0 -1.40463 -0.22801 0 0 0 0 0 -0.0332 0.02997 0 3.42333 0.03055 0 1.0402 -0.10067 0.48339 0.87009
GLY_36 -1.73129 0.05322 2.50208 -5e-05 0 0 1.2412 -1.17018 -0 -0 -0.93672 -0.3701 0 0 0 0 0 -0.17474 0 0 0 -1.38352 0 0.83697 -0.15261 0.36132 -0.92441
GLU:CtermProteinFull_37 -4.63883 0.46361 5.52757 -0.2198 0.04104 0.36548 2.41917 -2.38526 -0.03553 -0.23991 -5.07372 -0.02691 0 0 0 0 0 0 0.01036 0 3.5404 0 0 -2.7348 -0.08513 0.32979 -2.74246
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691860 DOMAINID 682971 MODEL 2 pep6_AB
MODEL     2
REMARK    Rerank model04.pdb to model02.pdb score: 21.174
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 6 cluster_threshold: 1.575896
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE     hbond_sr_bb:         -29.824
REMARK    SCORE     total_score:         -88.161
REMARK    SCORE    fa_intra_rep:           0.482
REMARK    SCORE          fa_rep:          21.087
REMARK    SCORE          fa_atr:        -214.267
REMARK    SCORE         p_aa_pp:          -5.436
REMARK    SCORE             ref:           6.830
REMARK    SCORE          fa_dun:          53.865
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     cart_bonded:          19.668
REMARK    SCORE         fa_elec:         -75.742
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE fa_intra_sol_xover4:           9.791
REMARK    SCORE        hbond_sc:          -2.857
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_sol:         138.527
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     rama_prepro:          -2.576
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     lk_ball_wtd:          -6.229
REMARK    SCORE           omega:          -0.111
REMARK    SCORE           score:         -88.161
REMARK    SCORE     hbond_bb_sc:          -1.370
ATOM      1  N   ASP A   1      -0.718   1.352   0.569  1.00  1.790          N  
ATOM      2  CA  ASP A   1       0.722   1.122   0.587  1.00  1.210          C  
ATOM      3  C   ASP A   1       1.503   2.410   0.382  1.00  1.110          C  
ATOM      4  O   ASP A   1       1.506   2.983  -0.717  1.00  1.020          O  
ATOM      5  CB  ASP A   1       1.134   0.087  -0.468  1.00  1.930          C  
ATOM      6  CG  ASP A   1       2.653  -0.238  -0.451  1.00  1.930          C  
ATOM      7  OD1 ASP A   1       3.430   0.547   0.107  1.00  1.930          O  
ATOM      8  OD2 ASP A   1       3.023  -1.238  -0.996  1.00  1.930          O  
ATOM      9 1H   ASP A   1      -1.163   0.741   1.240  1.00  2.150          H  
ATOM     10 2H   ASP A   1      -0.910   2.314   0.813  1.00  2.150          H  
ATOM     11 3H   ASP A   1      -1.082   1.159  -0.353  1.00  2.150          H  
ATOM     12  HA  ASP A   1       0.988   0.724   1.566  1.00  1.450          H  
ATOM     13 1HB  ASP A   1       0.577  -0.839  -0.308  1.00  2.310          H  
ATOM     14 2HB  ASP A   1       0.871   0.457  -1.460  1.00  2.310          H  
ATOM     15  N   TRP A   2       2.109   2.889   1.470  1.00  1.140          N  
ATOM     16  CA  TRP A   2       2.883   4.115   1.435  1.00  1.120          C  
ATOM     17  C   TRP A   2       4.211   4.003   0.733  1.00  1.070          C  
ATOM     18  O   TRP A   2       4.704   4.999   0.216  1.00  1.030          O  
ATOM     19  CB  TRP A   2       3.124   4.670   2.830  1.00  1.580          C  
ATOM     20  CG  TRP A   2       1.996   5.449   3.323  1.00  1.580          C  
ATOM     21  CD1 TRP A   2       1.145   5.170   4.345  1.00  1.580          C  
ATOM     22  CD2 TRP A   2       1.571   6.704   2.770  1.00  1.580          C  
ATOM     23  NE1 TRP A   2       0.221   6.175   4.467  1.00  1.580          N  
ATOM     24  CE2 TRP A   2       0.471   7.122   3.504  1.00  1.580          C  
ATOM     25  CE3 TRP A   2       2.033   7.494   1.715  1.00  1.580          C  
ATOM     26  CZ2 TRP A   2      -0.180   8.305   3.225  1.00  1.580          C  
ATOM     27  CZ3 TRP A   2       1.389   8.670   1.433  1.00  1.580          C  
ATOM     28  CH2 TRP A   2       0.309   9.072   2.165  1.00  1.580          C  
ATOM     29  H   TRP A   2       2.054   2.370   2.335  1.00  1.370          H  
ATOM     30  HA  TRP A   2       2.291   4.844   0.896  1.00  1.340          H  
ATOM     31 1HB  TRP A   2       3.315   3.853   3.521  1.00  1.890          H  
ATOM     32 2HB  TRP A   2       3.998   5.297   2.820  1.00  1.890          H  
ATOM     33  HD1 TRP A   2       1.191   4.283   4.974  1.00  1.890          H  
ATOM     34  HE1 TRP A   2      -0.523   6.213   5.150  1.00  1.890          H  
ATOM     35  HE3 TRP A   2       2.900   7.184   1.127  1.00  1.890          H  
ATOM     36  HZ2 TRP A   2      -1.045   8.640   3.799  1.00  1.890          H  
ATOM     37  HZ3 TRP A   2       1.764   9.273   0.611  1.00  1.890          H  
ATOM     38  HH2 TRP A   2      -0.182  10.012   1.919  1.00  1.890          H  
ATOM     39  N   PHE A   3       4.831   2.826   0.707  1.00  1.100          N  
ATOM     40  CA  PHE A   3       6.128   2.775   0.069  1.00  1.070          C  
ATOM     41  C   PHE A   3       5.901   2.876  -1.402  1.00  0.940          C  
ATOM     42  O   PHE A   3       6.685   3.504  -2.110  1.00  0.860          O  
ATOM     43  CB  PHE A   3       6.908   1.532   0.449  1.00  1.510          C  
ATOM     44  CG  PHE A   3       7.475   1.655   1.812  1.00  1.510          C  
ATOM     45  CD1 PHE A   3       6.871   1.053   2.898  1.00  1.510          C  
ATOM     46  CD2 PHE A   3       8.622   2.407   2.013  1.00  1.510          C  
ATOM     47  CE1 PHE A   3       7.405   1.196   4.163  1.00  1.510          C  
ATOM     48  CE2 PHE A   3       9.156   2.557   3.271  1.00  1.510          C  
ATOM     49  CZ  PHE A   3       8.548   1.950   4.347  1.00  1.510          C  
ATOM     50  H   PHE A   3       4.401   1.965   1.056  1.00  1.320          H  
ATOM     51  HA  PHE A   3       6.709   3.642   0.383  1.00  1.280          H  
ATOM     52 1HB  PHE A   3       6.246   0.661   0.418  1.00  1.810          H  
ATOM     53 2HB  PHE A   3       7.720   1.366  -0.258  1.00  1.810          H  
ATOM     54  HD1 PHE A   3       5.963   0.461   2.749  1.00  1.810          H  
ATOM     55  HD2 PHE A   3       9.102   2.885   1.156  1.00  1.810          H  
ATOM     56  HE1 PHE A   3       6.923   0.718   5.016  1.00  1.810          H  
ATOM     57  HE2 PHE A   3      10.066   3.159   3.426  1.00  1.810          H  
ATOM     58  HZ  PHE A   3       8.973   2.069   5.343  1.00  1.810          H  
ATOM     59  N   LYS A   4       4.815   2.273  -1.872  1.00  0.940          N  
ATOM     60  CA  LYS A   4       4.502   2.377  -3.281  1.00  0.860          C  
ATOM     61  C   LYS A   4       4.135   3.824  -3.593  1.00  0.730          C  
ATOM     62  O   LYS A   4       4.692   4.425  -4.509  1.00  0.640          O  
ATOM     63  CB  LYS A   4       3.348   1.462  -3.679  1.00  1.240          C  
ATOM     64  CG  LYS A   4       2.967   1.502  -5.194  1.00  1.240          C  
ATOM     65  CD  LYS A   4       4.092   0.950  -6.089  1.00  1.240          C  
ATOM     66  CE  LYS A   4       3.602   0.636  -7.529  1.00  1.240          C  
ATOM     67  NZ  LYS A   4       3.386   1.870  -8.380  1.00  1.240          N  
ATOM     68  H   LYS A   4       4.236   1.718  -1.222  1.00  1.130          H  
ATOM     69  HA  LYS A   4       5.387   2.112  -3.855  1.00  1.030          H  
ATOM     70 1HB  LYS A   4       3.593   0.432  -3.411  1.00  1.480          H  
ATOM     71 2HB  LYS A   4       2.463   1.739  -3.106  1.00  1.480          H  
ATOM     72 1HG  LYS A   4       2.066   0.910  -5.346  1.00  1.480          H  
ATOM     73 2HG  LYS A   4       2.755   2.533  -5.494  1.00  1.480          H  
ATOM     74 1HD  LYS A   4       4.884   1.704  -6.171  1.00  1.480          H  
ATOM     75 2HD  LYS A   4       4.511   0.049  -5.646  1.00  1.480          H  
ATOM     76 1HE  LYS A   4       4.334  -0.002  -8.020  1.00  1.480          H  
ATOM     77 2HE  LYS A   4       2.658   0.096  -7.458  1.00  1.480          H  
ATOM     78 1HZ  LYS A   4       3.071   1.607  -9.290  1.00  1.480          H  
ATOM     79 2HZ  LYS A   4       2.717   2.541  -7.991  1.00  1.480          H  
ATOM     80 3HZ  LYS A   4       4.252   2.409  -8.482  1.00  1.480          H  
ATOM     81  N   ALA A   5       3.249   4.433  -2.787  1.00  0.750          N  
ATOM     82  CA  ALA A   5       2.852   5.805  -3.076  1.00  0.680          C  
ATOM     83  C   ALA A   5       4.049   6.747  -3.096  1.00  0.600          C  
ATOM     84  O   ALA A   5       4.147   7.613  -3.978  1.00  0.520          O  
ATOM     85  CB  ALA A   5       1.860   6.284  -2.034  1.00  0.980          C  
ATOM     86  H   ALA A   5       2.797   3.925  -2.020  1.00  0.900          H  
ATOM     87  HA  ALA A   5       2.388   5.821  -4.061  1.00  0.820          H  
ATOM     88 1HB  ALA A   5       1.547   7.299  -2.264  1.00  1.180          H  
ATOM     89 2HB  ALA A   5       0.993   5.624  -2.028  1.00  1.180          H  
ATOM     90 3HB  ALA A   5       2.335   6.264  -1.061  1.00  1.180          H  
ATOM     91  N   PHE A   6       4.980   6.564  -2.156  1.00  0.640          N  
ATOM     92  CA  PHE A   6       6.141   7.416  -2.101  1.00  0.620          C  
ATOM     93  C   PHE A   6       7.046   7.093  -3.287  1.00  0.520          C  
ATOM     94  O   PHE A   6       7.478   7.995  -3.993  1.00  0.470          O  
ATOM     95  CB  PHE A   6       6.893   7.232  -0.781  1.00  0.880          C  
ATOM     96  CG  PHE A   6       6.209   7.721   0.511  1.00  0.880          C  
ATOM     97  CD1 PHE A   6       6.356   6.993   1.697  1.00  0.880          C  
ATOM     98  CD2 PHE A   6       5.473   8.891   0.568  1.00  0.880          C  
ATOM     99  CE1 PHE A   6       5.791   7.419   2.873  1.00  0.880          C  
ATOM    100  CE2 PHE A   6       4.909   9.311   1.756  1.00  0.880          C  
ATOM    101  CZ  PHE A   6       5.070   8.574   2.904  1.00  0.880          C  
ATOM    102  H   PHE A   6       4.855   5.857  -1.427  1.00  0.770          H  
ATOM    103  HA  PHE A   6       5.828   8.453  -2.196  1.00  0.740          H  
ATOM    104 1HB  PHE A   6       7.159   6.183  -0.657  1.00  1.050          H  
ATOM    105 2HB  PHE A   6       7.797   7.805  -0.857  1.00  1.050          H  
ATOM    106  HD1 PHE A   6       6.926   6.066   1.683  1.00  1.050          H  
ATOM    107  HD2 PHE A   6       5.349   9.500  -0.326  1.00  1.050          H  
ATOM    108  HE1 PHE A   6       5.920   6.833   3.781  1.00  1.050          H  
ATOM    109  HE2 PHE A   6       4.339  10.239   1.788  1.00  1.050          H  
ATOM    110  HZ  PHE A   6       4.623   8.919   3.835  1.00  1.050          H  
ATOM    111  N   TYR A   7       7.258   5.811  -3.599  1.00  0.560          N  
ATOM    112  CA  TYR A   7       8.113   5.421  -4.718  1.00  0.560          C  
ATOM    113  C   TYR A   7       7.670   6.100  -5.996  1.00  0.500          C  
ATOM    114  O   TYR A   7       8.485   6.707  -6.698  1.00  0.490          O  
ATOM    115  CB  TYR A   7       8.076   3.893  -4.921  1.00  0.780          C  
ATOM    116  CG  TYR A   7       8.901   3.364  -6.091  1.00  0.780          C  
ATOM    117  CD1 TYR A   7      10.196   2.901  -5.893  1.00  0.780          C  
ATOM    118  CD2 TYR A   7       8.367   3.369  -7.373  1.00  0.780          C  
ATOM    119  CE1 TYR A   7      10.933   2.453  -6.973  1.00  0.780          C  
ATOM    120  CE2 TYR A   7       9.108   2.930  -8.432  1.00  0.780          C  
ATOM    121  CZ  TYR A   7      10.380   2.474  -8.243  1.00  0.780          C  
ATOM    122  OH  TYR A   7      11.107   2.052  -9.323  1.00  0.780          O  
ATOM    123  H   TYR A   7       6.863   5.064  -3.027  1.00  0.670          H  
ATOM    124  HA  TYR A   7       9.128   5.749  -4.519  1.00  0.670          H  
ATOM    125 1HB  TYR A   7       8.426   3.402  -4.013  1.00  0.940          H  
ATOM    126 2HB  TYR A   7       7.049   3.581  -5.073  1.00  0.940          H  
ATOM    127  HD1 TYR A   7      10.633   2.894  -4.892  1.00  0.940          H  
ATOM    128  HD2 TYR A   7       7.352   3.728  -7.548  1.00  0.940          H  
ATOM    129  HE1 TYR A   7      11.937   2.097  -6.832  1.00  0.940          H  
ATOM    130  HE2 TYR A   7       8.680   2.943  -9.431  1.00  0.940          H  
ATOM    131  HH  TYR A   7      11.949   1.698  -9.029  1.00  0.940          H  
ATOM    132  N   ASP A   8       6.373   6.003  -6.308  1.00  0.480          N  
ATOM    133  CA  ASP A   8       5.871   6.586  -7.538  1.00  0.460          C  
ATOM    134  C   ASP A   8       6.102   8.095  -7.589  1.00  0.370          C  
ATOM    135  O   ASP A   8       6.502   8.618  -8.637  1.00  0.380          O  
ATOM    136  CB  ASP A   8       4.373   6.294  -7.684  1.00  0.650          C  
ATOM    137  CG  ASP A   8       4.043   4.828  -8.026  1.00  0.650          C  
ATOM    138  OD1 ASP A   8       4.914   4.087  -8.431  1.00  0.650          O  
ATOM    139  OD2 ASP A   8       2.905   4.421  -7.874  1.00  0.650          O  
ATOM    140  H   ASP A   8       5.747   5.487  -5.680  1.00  0.580          H  
ATOM    141  HA  ASP A   8       6.402   6.131  -8.373  1.00  0.550          H  
ATOM    142 1HB  ASP A   8       3.876   6.541  -6.738  1.00  0.780          H  
ATOM    143 2HB  ASP A   8       3.950   6.941  -8.451  1.00  0.780          H  
ATOM    144  N   LYS A   9       5.862   8.790  -6.467  1.00  0.350          N  
ATOM    145  CA  LYS A   9       6.055  10.236  -6.415  1.00  0.330          C  
ATOM    146  C   LYS A   9       7.524  10.645  -6.485  1.00  0.330          C  
ATOM    147  O   LYS A   9       7.865  11.607  -7.180  1.00  0.360          O  
ATOM    148  CB  LYS A   9       5.390  10.810  -5.167  1.00  0.470          C  
ATOM    149  CG  LYS A   9       3.860  10.787  -5.230  1.00  0.470          C  
ATOM    150  CD  LYS A   9       3.219  11.340  -3.961  1.00  0.470          C  
ATOM    151  CE  LYS A   9       1.696  11.317  -4.065  1.00  0.470          C  
ATOM    152  NZ  LYS A   9       1.040  11.846  -2.836  1.00  0.470          N  
ATOM    153  H   LYS A   9       5.474   8.299  -5.651  1.00  0.420          H  
ATOM    154  HA  LYS A   9       5.560  10.667  -7.284  1.00  0.400          H  
ATOM    155 1HB  LYS A   9       5.703  10.224  -4.295  1.00  0.560          H  
ATOM    156 2HB  LYS A   9       5.721  11.835  -5.012  1.00  0.560          H  
ATOM    157 1HG  LYS A   9       3.532  11.379  -6.083  1.00  0.560          H  
ATOM    158 2HG  LYS A   9       3.528   9.759  -5.377  1.00  0.560          H  
ATOM    159 1HD  LYS A   9       3.530  10.727  -3.109  1.00  0.560          H  
ATOM    160 2HD  LYS A   9       3.554  12.362  -3.795  1.00  0.560          H  
ATOM    161 1HE  LYS A   9       1.391  11.924  -4.916  1.00  0.560          H  
ATOM    162 2HE  LYS A   9       1.367  10.290  -4.227  1.00  0.560          H  
ATOM    163 1HZ  LYS A   9       0.035  11.813  -2.949  1.00  0.560          H  
ATOM    164 2HZ  LYS A   9       1.307  11.281  -2.044  1.00  0.560          H  
ATOM    165 3HZ  LYS A   9       1.329  12.802  -2.681  1.00  0.560          H  
ATOM    166  N   VAL A  10       8.397   9.914  -5.792  1.00  0.370          N  
ATOM    167  CA  VAL A  10       9.816  10.215  -5.797  1.00  0.410          C  
ATOM    168  C   VAL A  10      10.366  10.036  -7.194  1.00  0.400          C  
ATOM    169  O   VAL A  10      11.107  10.893  -7.672  1.00  0.460          O  
ATOM    170  CB  VAL A  10      10.598   9.333  -4.802  1.00  0.560          C  
ATOM    171  CG1 VAL A  10      12.109   9.522  -4.999  1.00  0.560          C  
ATOM    172  CG2 VAL A  10      10.251   9.706  -3.356  1.00  0.560          C  
ATOM    173  H   VAL A  10       8.047   9.143  -5.225  1.00  0.440          H  
ATOM    174  HA  VAL A  10       9.948  11.256  -5.501  1.00  0.490          H  
ATOM    175  HB  VAL A  10      10.329   8.299  -4.976  1.00  0.670          H  
ATOM    176 1HG1 VAL A  10      12.645   8.894  -4.292  1.00  0.670          H  
ATOM    177 2HG1 VAL A  10      12.398   9.243  -6.009  1.00  0.670          H  
ATOM    178 3HG1 VAL A  10      12.369  10.563  -4.828  1.00  0.670          H  
ATOM    179 1HG2 VAL A  10      10.803   9.068  -2.665  1.00  0.670          H  
ATOM    180 2HG2 VAL A  10      10.518  10.745  -3.170  1.00  0.670          H  
ATOM    181 3HG2 VAL A  10       9.186   9.583  -3.175  1.00  0.670          H  
ATOM    182  N   ALA A  11      10.004   8.928  -7.850  1.00  0.420          N  
ATOM    183  CA  ALA A  11      10.485   8.691  -9.196  1.00  0.510          C  
ATOM    184  C   ALA A  11      10.035   9.812 -10.133  1.00  0.500          C  
ATOM    185  O   ALA A  11      10.859  10.328 -10.894  1.00  0.580          O  
ATOM    186  CB  ALA A  11       9.978   7.351  -9.699  1.00  0.680          C  
ATOM    187  H   ALA A  11       9.409   8.236  -7.393  1.00  0.500          H  
ATOM    188  HA  ALA A  11      11.574   8.670  -9.174  1.00  0.610          H  
ATOM    189 1HB  ALA A  11      10.361   7.166 -10.701  1.00  0.810          H  
ATOM    190 2HB  ALA A  11      10.319   6.564  -9.030  1.00  0.810          H  
ATOM    191 3HB  ALA A  11       8.886   7.362  -9.720  1.00  0.810          H  
ATOM    192  N   GLU A  12       8.784  10.296 -10.024  1.00  0.450          N  
ATOM    193  CA  GLU A  12       8.388  11.390 -10.911  1.00  0.540          C  
ATOM    194  C   GLU A  12       9.201  12.652 -10.616  1.00  0.610          C  
ATOM    195  O   GLU A  12       9.646  13.334 -11.543  1.00  0.750          O  
ATOM    196  CB  GLU A  12       6.894  11.689 -10.781  1.00  0.720          C  
ATOM    197  CG  GLU A  12       5.983  10.609 -11.359  1.00  0.720          C  
ATOM    198  CD  GLU A  12       6.043  10.475 -12.863  1.00  0.720          C  
ATOM    199  OE1 GLU A  12       5.826  11.446 -13.548  1.00  0.720          O  
ATOM    200  OE2 GLU A  12       6.327   9.396 -13.313  1.00  0.720          O  
ATOM    201  H   GLU A  12       8.095   9.859  -9.399  1.00  0.540          H  
ATOM    202  HA  GLU A  12       8.584  11.090 -11.938  1.00  0.650          H  
ATOM    203 1HB  GLU A  12       6.644  11.804  -9.724  1.00  0.860          H  
ATOM    204 2HB  GLU A  12       6.667  12.631 -11.278  1.00  0.860          H  
ATOM    205 1HG  GLU A  12       6.270   9.656 -10.927  1.00  0.860          H  
ATOM    206 2HG  GLU A  12       4.959  10.815 -11.054  1.00  0.860          H  
ATOM    207  N   LYS A  13       9.461  12.932  -9.333  1.00  0.630          N  
ATOM    208  CA  LYS A  13      10.268  14.097  -8.996  1.00  0.840          C  
ATOM    209  C   LYS A  13      11.660  13.958  -9.599  1.00  0.980          C  
ATOM    210  O   LYS A  13      12.235  14.936 -10.075  1.00  1.230          O  
ATOM    211  CB  LYS A  13      10.307  14.315  -7.485  1.00  1.090          C  
ATOM    212  CG  LYS A  13       8.974  14.824  -6.931  1.00  1.090          C  
ATOM    213  CD  LYS A  13       8.987  14.994  -5.422  1.00  1.090          C  
ATOM    214  CE  LYS A  13       7.641  15.537  -4.930  1.00  1.090          C  
ATOM    215  NZ  LYS A  13       7.586  15.650  -3.450  1.00  1.090          N  
ATOM    216  H   LYS A  13       9.043  12.356  -8.594  1.00  0.760          H  
ATOM    217  HA  LYS A  13       9.805  14.976  -9.446  1.00  1.010          H  
ATOM    218 1HB  LYS A  13      10.547  13.374  -6.988  1.00  1.310          H  
ATOM    219 2HB  LYS A  13      11.087  15.033  -7.238  1.00  1.310          H  
ATOM    220 1HG  LYS A  13       8.744  15.784  -7.395  1.00  1.310          H  
ATOM    221 2HG  LYS A  13       8.188  14.123  -7.201  1.00  1.310          H  
ATOM    222 1HD  LYS A  13       9.168  14.024  -4.951  1.00  1.310          H  
ATOM    223 2HD  LYS A  13       9.781  15.679  -5.130  1.00  1.310          H  
ATOM    224 1HE  LYS A  13       7.476  16.522  -5.365  1.00  1.310          H  
ATOM    225 2HE  LYS A  13       6.848  14.867  -5.262  1.00  1.310          H  
ATOM    226 1HZ  LYS A  13       6.681  16.006  -3.154  1.00  1.310          H  
ATOM    227 2HZ  LYS A  13       7.722  14.735  -3.045  1.00  1.310          H  
ATOM    228 3HZ  LYS A  13       8.301  16.271  -3.095  1.00  1.310          H  
ATOM    229  N   PHE A  14      12.222  12.744  -9.604  1.00  0.870          N  
ATOM    230  CA  PHE A  14      13.521  12.554 -10.232  1.00  1.070          C  
ATOM    231  C   PHE A  14      13.406  12.820 -11.733  1.00  1.030          C  
ATOM    232  O   PHE A  14      14.196  13.566 -12.299  1.00  1.140          O  
ATOM    233  CB  PHE A  14      14.058  11.129 -10.049  1.00  1.420          C  
ATOM    234  CG  PHE A  14      14.493  10.717  -8.648  1.00  1.420          C  
ATOM    235  CD1 PHE A  14      14.731   9.381  -8.393  1.00  1.420          C  
ATOM    236  CD2 PHE A  14      14.655  11.619  -7.589  1.00  1.420          C  
ATOM    237  CE1 PHE A  14      15.132   8.962  -7.165  1.00  1.420          C  
ATOM    238  CE2 PHE A  14      15.046  11.168  -6.346  1.00  1.420          C  
ATOM    239  CZ  PHE A  14      15.286   9.832  -6.151  1.00  1.420          C  
ATOM    240  H   PHE A  14      11.750  11.972  -9.116  1.00  1.040          H  
ATOM    241  HA  PHE A  14      14.225  13.271  -9.821  1.00  1.280          H  
ATOM    242 1HB  PHE A  14      13.290  10.430 -10.363  1.00  1.700          H  
ATOM    243 2HB  PHE A  14      14.906  10.984 -10.720  1.00  1.700          H  
ATOM    244  HD1 PHE A  14      14.608   8.651  -9.197  1.00  1.700          H  
ATOM    245  HD2 PHE A  14      14.468  12.679  -7.731  1.00  1.700          H  
ATOM    246  HE1 PHE A  14      15.339   7.925  -6.992  1.00  1.700          H  
ATOM    247  HE2 PHE A  14      15.170  11.869  -5.521  1.00  1.700          H  
ATOM    248  HZ  PHE A  14      15.605   9.454  -5.187  1.00  1.700          H  
ATOM    249  N   LYS A  15      12.351  12.319 -12.379  1.00  1.010          N  
ATOM    250  CA  LYS A  15      12.169  12.502 -13.828  1.00  1.110          C  
ATOM    251  C   LYS A  15      12.328  13.973 -14.234  1.00  1.250          C  
ATOM    252  O   LYS A  15      12.925  14.284 -15.269  1.00  1.380          O  
ATOM    253  CB  LYS A  15      10.782  12.022 -14.249  1.00  1.510          C  
ATOM    254  CG  LYS A  15      10.485  12.015 -15.728  1.00  1.510          C  
ATOM    255  CD  LYS A  15       9.081  11.452 -15.951  1.00  1.510          C  
ATOM    256  CE  LYS A  15       8.678  11.464 -17.406  1.00  1.510          C  
ATOM    257  NZ  LYS A  15       7.281  10.964 -17.587  1.00  1.510          N  
ATOM    258  H   LYS A  15      11.699  11.725 -11.854  1.00  1.210          H  
ATOM    259  HA  LYS A  15      12.920  11.919 -14.349  1.00  1.330          H  
ATOM    260 1HB  LYS A  15      10.589  11.066 -13.842  1.00  1.820          H  
ATOM    261 2HB  LYS A  15      10.046  12.689 -13.824  1.00  1.820          H  
ATOM    262 1HG  LYS A  15      10.542  13.030 -16.127  1.00  1.820          H  
ATOM    263 2HG  LYS A  15      11.216  11.391 -16.244  1.00  1.820          H  
ATOM    264 1HD  LYS A  15       9.045  10.425 -15.585  1.00  1.820          H  
ATOM    265 2HD  LYS A  15       8.359  12.038 -15.375  1.00  1.820          H  
ATOM    266 1HE  LYS A  15       8.744  12.481 -17.789  1.00  1.820          H  
ATOM    267 2HE  LYS A  15       9.358  10.827 -17.971  1.00  1.820          H  
ATOM    268 1HZ  LYS A  15       7.037  10.982 -18.566  1.00  1.820          H  
ATOM    269 2HZ  LYS A  15       7.206  10.016 -17.239  1.00  1.820          H  
ATOM    270 3HZ  LYS A  15       6.640  11.557 -17.069  1.00  1.820          H  
ATOM    271  N   GLU A  16      11.772  14.866 -13.412  1.00  1.350          N  
ATOM    272  CA  GLU A  16      11.789  16.312 -13.634  1.00  1.620          C  
ATOM    273  C   GLU A  16      13.172  17.006 -13.636  1.00  1.620          C  
ATOM    274  O   GLU A  16      13.279  18.118 -14.161  1.00  1.880          O  
ATOM    275  CB  GLU A  16      10.897  17.019 -12.603  1.00  2.160          C  
ATOM    276  CG  GLU A  16       9.392  16.766 -12.772  1.00  2.160          C  
ATOM    277  CD  GLU A  16       8.541  17.501 -11.750  1.00  2.160          C  
ATOM    278  OE1 GLU A  16       9.095  18.096 -10.856  1.00  2.160          O  
ATOM    279  OE2 GLU A  16       7.339  17.465 -11.872  1.00  2.160          O  
ATOM    280  H   GLU A  16      11.254  14.492 -12.607  1.00  1.620          H  
ATOM    281  HA  GLU A  16      11.346  16.484 -14.612  1.00  1.940          H  
ATOM    282 1HB  GLU A  16      11.175  16.692 -11.604  1.00  2.590          H  
ATOM    283 2HB  GLU A  16      11.066  18.093 -12.653  1.00  2.590          H  
ATOM    284 1HG  GLU A  16       9.094  17.075 -13.771  1.00  2.590          H  
ATOM    285 2HG  GLU A  16       9.209  15.694 -12.685  1.00  2.590          H  
ATOM    286  N   ALA A  17      14.208  16.442 -12.990  1.00  1.480          N  
ATOM    287  CA  ALA A  17      15.500  17.138 -12.961  1.00  1.640          C  
ATOM    288  C   ALA A  17      16.665  16.166 -13.012  1.00  1.480          C  
ATOM    289  O   ALA A  17      17.768  16.510 -13.442  1.00  1.730          O  
ATOM    290  CB  ALA A  17      15.606  18.003 -11.717  1.00  2.230          C  
ATOM    291  H   ALA A  17      14.135  15.504 -12.583  1.00  1.780          H  
ATOM    292  HA  ALA A  17      15.562  17.774 -13.844  1.00  1.970          H  
ATOM    293 1HB  ALA A  17      16.557  18.532 -11.720  1.00  2.680          H  
ATOM    294 2HB  ALA A  17      14.786  18.720 -11.707  1.00  2.680          H  
ATOM    295 3HB  ALA A  17      15.545  17.372 -10.840  1.00  2.680          H  
ATOM    296  N   PHE A  18      16.410  14.952 -12.558  1.00  1.130          N  
ATOM    297  CA  PHE A  18      17.399  13.901 -12.426  1.00  1.070          C  
ATOM    298  C   PHE A  18      16.944  12.600 -13.107  1.00  0.740          C  
ATOM    299  O   PHE A  18      16.948  11.556 -12.460  1.00  0.640          O  
ATOM    300  CB  PHE A  18      17.608  13.594 -10.946  1.00  1.520          C  
ATOM    301  CG  PHE A  18      17.927  14.789 -10.140  1.00  1.520          C  
ATOM    302  CD1 PHE A  18      16.955  15.315  -9.304  1.00  1.520          C  
ATOM    303  CD2 PHE A  18      19.148  15.424 -10.219  1.00  1.520          C  
ATOM    304  CE1 PHE A  18      17.200  16.439  -8.559  1.00  1.520          C  
ATOM    305  CE2 PHE A  18      19.397  16.555  -9.476  1.00  1.520          C  
ATOM    306  CZ  PHE A  18      18.420  17.063  -8.644  1.00  1.520          C  
ATOM    307  H   PHE A  18      15.473  14.754 -12.245  1.00  1.360          H  
ATOM    308  HA  PHE A  18      18.331  14.239 -12.873  1.00  1.280          H  
ATOM    309 1HB  PHE A  18      16.710  13.131 -10.539  1.00  1.830          H  
ATOM    310 2HB  PHE A  18      18.426  12.887 -10.836  1.00  1.830          H  
ATOM    311  HD1 PHE A  18      15.985  14.828  -9.243  1.00  1.830          H  
ATOM    312  HD2 PHE A  18      19.915  15.032 -10.876  1.00  1.830          H  
ATOM    313  HE1 PHE A  18      16.423  16.839  -7.905  1.00  1.830          H  
ATOM    314  HE2 PHE A  18      20.364  17.052  -9.546  1.00  1.830          H  
ATOM    315  HZ  PHE A  18      18.617  17.958  -8.057  1.00  1.830          H  
ATOM    316  N   PRO A  19      16.549  12.593 -14.390  1.00  0.790          N  
ATOM    317  CA  PRO A  19      15.992  11.432 -15.059  1.00  0.750          C  
ATOM    318  C   PRO A  19      16.920  10.225 -15.085  1.00  0.910          C  
ATOM    319  O   PRO A  19      16.446   9.090 -15.128  1.00  1.130          O  
ATOM    320  CB  PRO A  19      15.721  11.959 -16.476  1.00  1.120          C  
ATOM    321  CG  PRO A  19      16.642  13.160 -16.630  1.00  1.120          C  
ATOM    322  CD  PRO A  19      16.695  13.774 -15.249  1.00  1.120          C  
ATOM    323  HA  PRO A  19      15.050  11.169 -14.562  1.00  0.900          H  
ATOM    324 1HB  PRO A  19      15.915  11.170 -17.217  1.00  1.350          H  
ATOM    325 2HB  PRO A  19      14.656  12.237 -16.569  1.00  1.350          H  
ATOM    326 1HG  PRO A  19      17.630  12.847 -16.997  1.00  1.350          H  
ATOM    327 2HG  PRO A  19      16.231  13.856 -17.380  1.00  1.350          H  
ATOM    328 1HD  PRO A  19      17.655  14.284 -15.089  1.00  1.350          H  
ATOM    329 2HD  PRO A  19      15.826  14.444 -15.125  1.00  1.350          H  
ATOM    330  N   HIS A  20      18.237  10.429 -14.967  1.00  1.150          N  
ATOM    331  CA  HIS A  20      19.172   9.317 -14.980  1.00  1.560          C  
ATOM    332  C   HIS A  20      19.052   8.375 -13.777  1.00  1.650          C  
ATOM    333  O   HIS A  20      19.659   7.300 -13.764  1.00  2.010          O  
ATOM    334  CB  HIS A  20      20.580   9.877 -15.113  1.00  2.020          C  
ATOM    335  CG  HIS A  20      20.917  10.832 -14.041  1.00  2.020          C  
ATOM    336  ND1 HIS A  20      20.403  12.114 -14.015  1.00  2.020          N  
ATOM    337  CD2 HIS A  20      21.720  10.727 -12.965  1.00  2.020          C  
ATOM    338  CE1 HIS A  20      20.876  12.747 -12.956  1.00  2.020          C  
ATOM    339  NE2 HIS A  20      21.674  11.931 -12.304  1.00  2.020          N  
ATOM    340  H   HIS A  20      18.658  11.357 -14.906  1.00  1.380          H  
ATOM    341  HA  HIS A  20      18.982   8.716 -15.868  1.00  1.870          H  
ATOM    342 1HB  HIS A  20      21.303   9.061 -15.089  1.00  2.420          H  
ATOM    343 2HB  HIS A  20      20.682  10.383 -16.071  1.00  2.420          H  
ATOM    344  HD2 HIS A  20      22.296   9.849 -12.675  1.00  2.420          H  
ATOM    345  HE1 HIS A  20      20.651  13.770 -12.677  1.00  2.420          H  
ATOM    346  HE2 HIS A  20      22.180  12.148 -11.454  1.00  2.420          H  
ATOM    347  N   VAL A  21      18.243   8.756 -12.784  1.00  1.390          N  
ATOM    348  CA  VAL A  21      17.989   7.907 -11.632  1.00  1.540          C  
ATOM    349  C   VAL A  21      16.492   7.642 -11.474  1.00  1.380          C  
ATOM    350  O   VAL A  21      16.056   7.181 -10.418  1.00  1.370          O  
ATOM    351  CB  VAL A  21      18.575   8.495 -10.328  1.00  2.100          C  
ATOM    352  CG1 VAL A  21      20.065   8.548 -10.410  1.00  2.100          C  
ATOM    353  CG2 VAL A  21      18.059   9.885 -10.090  1.00  2.100          C  
ATOM    354  H   VAL A  21      17.782   9.672 -12.846  1.00  1.670          H  
ATOM    355  HA  VAL A  21      18.482   6.952 -11.801  1.00  1.850          H  
ATOM    356  HB  VAL A  21      18.299   7.848  -9.508  1.00  2.520          H  
ATOM    357 1HG1 VAL A  21      20.470   8.943  -9.479  1.00  2.520          H  
ATOM    358 2HG1 VAL A  21      20.456   7.564 -10.587  1.00  2.520          H  
ATOM    359 3HG1 VAL A  21      20.340   9.186 -11.220  1.00  2.520          H  
ATOM    360 1HG2 VAL A  21      18.470  10.280  -9.168  1.00  2.520          H  
ATOM    361 2HG2 VAL A  21      18.370  10.504 -10.908  1.00  2.520          H  
ATOM    362 3HG2 VAL A  21      16.986   9.876 -10.027  1.00  2.520          H  
ATOM    363  N   PHE A  22      15.711   7.890 -12.530  1.00  1.350          N  
ATOM    364  CA  PHE A  22      14.254   7.755 -12.516  1.00  1.320          C  
ATOM    365  C   PHE A  22      13.744   6.452 -11.917  1.00  1.380          C  
ATOM    366  O   PHE A  22      12.803   6.472 -11.134  1.00  1.590          O  
ATOM    367  CB  PHE A  22      13.700   7.997 -13.924  1.00  1.860          C  
ATOM    368  CG  PHE A  22      12.230   7.781 -14.089  1.00  1.860          C  
ATOM    369  CD1 PHE A  22      11.351   8.514 -13.370  1.00  1.860          C  
ATOM    370  CD2 PHE A  22      11.737   6.904 -15.025  1.00  1.860          C  
ATOM    371  CE1 PHE A  22       9.995   8.377 -13.523  1.00  1.860          C  
ATOM    372  CE2 PHE A  22      10.381   6.764 -15.201  1.00  1.860          C  
ATOM    373  CZ  PHE A  22       9.511   7.509 -14.435  1.00  1.860          C  
ATOM    374  H   PHE A  22      16.143   8.235 -13.394  1.00  1.620          H  
ATOM    375  HA  PHE A  22      13.870   8.560 -11.888  1.00  1.580          H  
ATOM    376 1HB  PHE A  22      13.916   9.020 -14.212  1.00  2.230          H  
ATOM    377 2HB  PHE A  22      14.221   7.355 -14.632  1.00  2.230          H  
ATOM    378  HD1 PHE A  22      11.746   9.213 -12.658  1.00  2.230          H  
ATOM    379  HD2 PHE A  22      12.434   6.326 -15.633  1.00  2.230          H  
ATOM    380  HE1 PHE A  22       9.305   8.977 -12.921  1.00  2.230          H  
ATOM    381  HE2 PHE A  22       9.997   6.069 -15.946  1.00  2.230          H  
ATOM    382  HZ  PHE A  22       8.432   7.411 -14.562  1.00  2.230          H  
ATOM    383  N   ARG A  23      14.334   5.319 -12.295  1.00  1.410          N  
ATOM    384  CA  ARG A  23      13.913   4.030 -11.746  1.00  1.650          C  
ATOM    385  C   ARG A  23      15.005   3.390 -10.898  1.00  1.440          C  
ATOM    386  O   ARG A  23      15.026   2.167 -10.698  1.00  1.570          O  
ATOM    387  CB  ARG A  23      13.474   3.050 -12.825  1.00  2.210          C  
ATOM    388  CG  ARG A  23      12.280   3.479 -13.667  1.00  2.210          C  
ATOM    389  CD  ARG A  23      11.060   3.660 -12.830  1.00  2.210          C  
ATOM    390  NE  ARG A  23       9.874   3.916 -13.608  1.00  2.210          N  
ATOM    391  CZ  ARG A  23       8.711   4.350 -13.087  1.00  2.210          C  
ATOM    392  NH1 ARG A  23       8.621   4.580 -11.797  1.00  2.210          N  
ATOM    393  NH2 ARG A  23       7.667   4.546 -13.876  1.00  2.210          N  
ATOM    394  H   ARG A  23      15.102   5.363 -12.950  1.00  1.690          H  
ATOM    395  HA  ARG A  23      13.071   4.197 -11.083  1.00  1.980          H  
ATOM    396 1HB  ARG A  23      14.304   2.868 -13.505  1.00  2.660          H  
ATOM    397 2HB  ARG A  23      13.216   2.098 -12.363  1.00  2.660          H  
ATOM    398 1HG  ARG A  23      12.510   4.412 -14.146  1.00  2.660          H  
ATOM    399 2HG  ARG A  23      12.069   2.723 -14.421  1.00  2.660          H  
ATOM    400 1HD  ARG A  23      10.892   2.771 -12.220  1.00  2.660          H  
ATOM    401 2HD  ARG A  23      11.206   4.524 -12.189  1.00  2.660          H  
ATOM    402  HE  ARG A  23       9.919   3.753 -14.604  1.00  2.660          H  
ATOM    403 1HH1 ARG A  23       9.429   4.422 -11.209  1.00  2.660          H  
ATOM    404 2HH1 ARG A  23       7.755   4.911 -11.393  1.00  2.660          H  
ATOM    405 1HH2 ARG A  23       7.743   4.368 -14.868  1.00  2.660          H  
ATOM    406 2HH2 ARG A  23       6.792   4.875 -13.491  1.00  2.660          H  
ATOM    407  N   LEU A  24      15.927   4.194 -10.386  1.00  1.170          N  
ATOM    408  CA  LEU A  24      16.990   3.636  -9.575  1.00  1.050          C  
ATOM    409  C   LEU A  24      16.451   3.383  -8.190  1.00  0.820          C  
ATOM    410  O   LEU A  24      16.670   4.189  -7.283  1.00  0.710          O  
ATOM    411  CB  LEU A  24      18.188   4.600  -9.522  1.00  1.520          C  
ATOM    412  CG  LEU A  24      19.481   4.123  -8.774  1.00  1.520          C  
ATOM    413  CD1 LEU A  24      20.071   2.873  -9.432  1.00  1.520          C  
ATOM    414  CD2 LEU A  24      20.500   5.251  -8.804  1.00  1.520          C  
ATOM    415  H   LEU A  24      15.870   5.207 -10.528  1.00  1.400          H  
ATOM    416  HA  LEU A  24      17.297   2.691 -10.015  1.00  1.260          H  
ATOM    417 1HB  LEU A  24      18.473   4.835 -10.544  1.00  1.820          H  
ATOM    418 2HB  LEU A  24      17.853   5.523  -9.051  1.00  1.820          H  
ATOM    419  HG  LEU A  24      19.238   3.884  -7.742  1.00  1.820          H  
ATOM    420 1HD1 LEU A  24      20.970   2.575  -8.892  1.00  1.820          H  
ATOM    421 2HD1 LEU A  24      19.360   2.056  -9.403  1.00  1.820          H  
ATOM    422 3HD1 LEU A  24      20.328   3.093 -10.470  1.00  1.820          H  
ATOM    423 1HD2 LEU A  24      21.400   4.945  -8.275  1.00  1.820          H  
ATOM    424 2HD2 LEU A  24      20.746   5.471  -9.837  1.00  1.820          H  
ATOM    425 3HD2 LEU A  24      20.088   6.139  -8.331  1.00  1.820          H  
ATOM    426  N   LYS A  25      15.772   2.242  -8.040  1.00  0.850          N  
ATOM    427  CA  LYS A  25      15.065   1.868  -6.815  1.00  0.840          C  
ATOM    428  C   LYS A  25      15.884   2.055  -5.563  1.00  0.680          C  
ATOM    429  O   LYS A  25      15.351   2.480  -4.542  1.00  0.750          O  
ATOM    430  CB  LYS A  25      14.557   0.430  -6.877  1.00  1.180          C  
ATOM    431  CG  LYS A  25      13.782  -0.011  -5.615  1.00  1.180          C  
ATOM    432  CD  LYS A  25      13.197  -1.406  -5.766  1.00  1.180          C  
ATOM    433  CE  LYS A  25      12.467  -1.836  -4.495  1.00  1.180          C  
ATOM    434  NZ  LYS A  25      11.876  -3.200  -4.623  1.00  1.180          N  
ATOM    435  H   LYS A  25      15.669   1.678  -8.889  1.00  1.020          H  
ATOM    436  HA  LYS A  25      14.198   2.505  -6.725  1.00  1.010          H  
ATOM    437 1HB  LYS A  25      13.901   0.315  -7.741  1.00  1.420          H  
ATOM    438 2HB  LYS A  25      15.399  -0.249  -7.010  1.00  1.420          H  
ATOM    439 1HG  LYS A  25      14.461  -0.027  -4.759  1.00  1.420          H  
ATOM    440 2HG  LYS A  25      12.986   0.695  -5.393  1.00  1.420          H  
ATOM    441 1HD  LYS A  25      12.495  -1.418  -6.602  1.00  1.420          H  
ATOM    442 2HD  LYS A  25      13.997  -2.116  -5.974  1.00  1.420          H  
ATOM    443 1HE  LYS A  25      13.171  -1.832  -3.663  1.00  1.420          H  
ATOM    444 2HE  LYS A  25      11.669  -1.123  -4.284  1.00  1.420          H  
ATOM    445 1HZ  LYS A  25      11.404  -3.444  -3.762  1.00  1.420          H  
ATOM    446 2HZ  LYS A  25      11.211  -3.211  -5.384  1.00  1.420          H  
ATOM    447 3HZ  LYS A  25      12.607  -3.872  -4.805  1.00  1.420          H  
ATOM    448  N   LYS A  26      17.166   1.721  -5.595  1.00  0.600          N  
ATOM    449  CA  LYS A  26      17.954   1.876  -4.380  1.00  0.690          C  
ATOM    450  C   LYS A  26      17.976   3.336  -3.905  1.00  0.620          C  
ATOM    451  O   LYS A  26      17.918   3.603  -2.700  1.00  0.710          O  
ATOM    452  CB  LYS A  26      19.381   1.383  -4.612  1.00  0.930          C  
ATOM    453  CG  LYS A  26      19.504  -0.130  -4.757  1.00  0.930          C  
ATOM    454  CD  LYS A  26      20.949  -0.550  -5.018  1.00  0.930          C  
ATOM    455  CE  LYS A  26      21.073  -2.067  -5.168  1.00  0.930          C  
ATOM    456  NZ  LYS A  26      22.477  -2.486  -5.455  1.00  0.930          N  
ATOM    457  H   LYS A  26      17.568   1.355  -6.446  1.00  0.720          H  
ATOM    458  HA  LYS A  26      17.496   1.276  -3.594  1.00  0.830          H  
ATOM    459 1HB  LYS A  26      19.782   1.846  -5.515  1.00  1.120          H  
ATOM    460 2HB  LYS A  26      20.009   1.695  -3.778  1.00  1.120          H  
ATOM    461 1HG  LYS A  26      19.156  -0.606  -3.839  1.00  1.120          H  
ATOM    462 2HG  LYS A  26      18.874  -0.471  -5.578  1.00  1.120          H  
ATOM    463 1HD  LYS A  26      21.306  -0.073  -5.933  1.00  1.120          H  
ATOM    464 2HD  LYS A  26      21.577  -0.225  -4.190  1.00  1.120          H  
ATOM    465 1HE  LYS A  26      20.744  -2.544  -4.247  1.00  1.120          H  
ATOM    466 2HE  LYS A  26      20.434  -2.398  -5.986  1.00  1.120          H  
ATOM    467 1HZ  LYS A  26      22.516  -3.492  -5.546  1.00  1.120          H  
ATOM    468 2HZ  LYS A  26      22.790  -2.059  -6.316  1.00  1.120          H  
ATOM    469 3HZ  LYS A  26      23.079  -2.195  -4.697  1.00  1.120          H  
ATOM    470  N   TRP A  27      18.101   4.272  -4.852  1.00  0.590          N  
ATOM    471  CA  TRP A  27      18.155   5.694  -4.551  1.00  0.640          C  
ATOM    472  C   TRP A  27      16.784   6.197  -4.176  1.00  0.480          C  
ATOM    473  O   TRP A  27      16.635   7.029  -3.277  1.00  0.550          O  
ATOM    474  CB  TRP A  27      18.791   6.477  -5.697  1.00  0.880          C  
ATOM    475  CG  TRP A  27      18.842   7.975  -5.513  1.00  0.880          C  
ATOM    476  CD1 TRP A  27      18.440   8.874  -6.429  1.00  0.880          C  
ATOM    477  CD2 TRP A  27      19.266   8.756  -4.355  1.00  0.880          C  
ATOM    478  NE1 TRP A  27      18.598  10.147  -5.955  1.00  0.880          N  
ATOM    479  CE2 TRP A  27      19.089  10.095  -4.691  1.00  0.880          C  
ATOM    480  CE3 TRP A  27      19.766   8.434  -3.083  1.00  0.880          C  
ATOM    481  CZ2 TRP A  27      19.389  11.116  -3.812  1.00  0.880          C  
ATOM    482  CZ3 TRP A  27      20.060   9.453  -2.204  1.00  0.880          C  
ATOM    483  CH2 TRP A  27      19.878  10.762  -2.558  1.00  0.880          C  
ATOM    484  H   TRP A  27      18.068   3.987  -5.827  1.00  0.710          H  
ATOM    485  HA  TRP A  27      18.796   5.813  -3.687  1.00  0.770          H  
ATOM    486 1HB  TRP A  27      19.806   6.120  -5.852  1.00  1.050          H  
ATOM    487 2HB  TRP A  27      18.230   6.274  -6.611  1.00  1.050          H  
ATOM    488  HD1 TRP A  27      18.051   8.623  -7.404  1.00  1.050          H  
ATOM    489  HE1 TRP A  27      18.371  10.991  -6.462  1.00  1.050          H  
ATOM    490  HE3 TRP A  27      19.919   7.416  -2.788  1.00  1.050          H  
ATOM    491  HZ2 TRP A  27      19.249  12.164  -4.074  1.00  1.050          H  
ATOM    492  HZ3 TRP A  27      20.442   9.191  -1.219  1.00  1.050          H  
ATOM    493  HH2 TRP A  27      20.123  11.542  -1.838  1.00  1.050          H  
ATOM    494  N   ILE A  28      15.775   5.668  -4.863  1.00  0.400          N  
ATOM    495  CA  ILE A  28      14.412   6.084  -4.617  1.00  0.420          C  
ATOM    496  C   ILE A  28      14.090   5.731  -3.175  1.00  0.370          C  
ATOM    497  O   ILE A  28      13.542   6.564  -2.454  1.00  0.360          O  
ATOM    498  CB  ILE A  28      13.407   5.382  -5.567  1.00  0.580          C  
ATOM    499  CG1 ILE A  28      13.646   5.848  -7.008  1.00  0.580          C  
ATOM    500  CG2 ILE A  28      11.994   5.766  -5.155  1.00  0.580          C  
ATOM    501  CD1 ILE A  28      12.979   5.055  -8.081  1.00  0.580          C  
ATOM    502  H   ILE A  28      15.996   4.988  -5.595  1.00  0.480          H  
ATOM    503  HA  ILE A  28      14.335   7.161  -4.741  1.00  0.500          H  
ATOM    504  HB  ILE A  28      13.527   4.311  -5.519  1.00  0.700          H  
ATOM    505 1HG1 ILE A  28      13.285   6.866  -7.098  1.00  0.700          H  
ATOM    506 2HG1 ILE A  28      14.709   5.823  -7.208  1.00  0.700          H  
ATOM    507 1HG2 ILE A  28      11.274   5.329  -5.805  1.00  0.700          H  
ATOM    508 2HG2 ILE A  28      11.790   5.446  -4.138  1.00  0.700          H  
ATOM    509 3HG2 ILE A  28      11.912   6.811  -5.217  1.00  0.700          H  
ATOM    510 1HD1 ILE A  28      13.240   5.500  -9.018  1.00  0.700          H  
ATOM    511 2HD1 ILE A  28      13.320   4.039  -8.072  1.00  0.700          H  
ATOM    512 3HD1 ILE A  28      11.909   5.075  -7.967  1.00  0.700          H  
ATOM    513  N   GLN A  29      14.435   4.504  -2.757  1.00  0.460          N  
ATOM    514  CA  GLN A  29      14.173   4.054  -1.402  1.00  0.580          C  
ATOM    515  C   GLN A  29      14.934   4.866  -0.363  1.00  0.560          C  
ATOM    516  O   GLN A  29      14.357   5.201   0.674  1.00  0.640          O  
ATOM    517  CB  GLN A  29      14.531   2.575  -1.268  1.00  0.760          C  
ATOM    518  CG  GLN A  29      14.175   1.927   0.080  1.00  0.760          C  
ATOM    519  CD  GLN A  29      12.684   1.901   0.348  1.00  0.760          C  
ATOM    520  OE1 GLN A  29      11.884   1.639  -0.563  1.00  0.760          O  
ATOM    521  NE2 GLN A  29      12.308   2.144   1.592  1.00  0.760          N  
ATOM    522  H   GLN A  29      14.866   3.855  -3.418  1.00  0.550          H  
ATOM    523  HA  GLN A  29      13.117   4.169  -1.205  1.00  0.700          H  
ATOM    524 1HB  GLN A  29      14.033   2.015  -2.059  1.00  0.920          H  
ATOM    525 2HB  GLN A  29      15.607   2.456  -1.425  1.00  0.920          H  
ATOM    526 1HG  GLN A  29      14.536   0.903   0.076  1.00  0.920          H  
ATOM    527 2HG  GLN A  29      14.650   2.485   0.894  1.00  0.920          H  
ATOM    528 1HE2 GLN A  29      11.343   2.135   1.847  1.00  0.920          H  
ATOM    529 2HE2 GLN A  29      13.007   2.362   2.330  1.00  0.920          H  
ATOM    530  N   LYS A  30      16.197   5.238  -0.631  1.00  0.560          N  
ATOM    531  CA  LYS A  30      16.907   6.063   0.342  1.00  0.720          C  
ATOM    532  C   LYS A  30      16.180   7.384   0.548  1.00  0.660          C  
ATOM    533  O   LYS A  30      16.037   7.839   1.686  1.00  0.770          O  
ATOM    534  CB  LYS A  30      18.355   6.309  -0.081  1.00  0.940          C  
ATOM    535  CG  LYS A  30      19.260   5.084   0.049  1.00  0.940          C  
ATOM    536  CD  LYS A  30      20.689   5.365  -0.423  1.00  0.940          C  
ATOM    537  CE  LYS A  30      21.570   4.124  -0.285  1.00  0.940          C  
ATOM    538  NZ  LYS A  30      22.964   4.366  -0.766  1.00  0.940          N  
ATOM    539  H   LYS A  30      16.676   4.897  -1.472  1.00  0.670          H  
ATOM    540  HA  LYS A  30      16.916   5.535   1.295  1.00  0.860          H  
ATOM    541 1HB  LYS A  30      18.363   6.618  -1.124  1.00  1.130          H  
ATOM    542 2HB  LYS A  30      18.777   7.123   0.507  1.00  1.130          H  
ATOM    543 1HG  LYS A  30      19.290   4.779   1.095  1.00  1.130          H  
ATOM    544 2HG  LYS A  30      18.845   4.266  -0.526  1.00  1.130          H  
ATOM    545 1HD  LYS A  30      20.668   5.656  -1.470  1.00  1.130          H  
ATOM    546 2HD  LYS A  30      21.117   6.181   0.159  1.00  1.130          H  
ATOM    547 1HE  LYS A  30      21.604   3.827   0.762  1.00  1.130          H  
ATOM    548 2HE  LYS A  30      21.131   3.313  -0.869  1.00  1.130          H  
ATOM    549 1HZ  LYS A  30      23.510   3.521  -0.658  1.00  1.130          H  
ATOM    550 2HZ  LYS A  30      22.944   4.630  -1.741  1.00  1.130          H  
ATOM    551 3HZ  LYS A  30      23.388   5.108  -0.225  1.00  1.130          H  
ATOM    552  N   VAL A  31      15.691   7.977  -0.547  1.00  0.530          N  
ATOM    553  CA  VAL A  31      14.942   9.223  -0.482  1.00  0.570          C  
ATOM    554  C   VAL A  31      13.631   9.037   0.289  1.00  0.530          C  
ATOM    555  O   VAL A  31      13.261   9.892   1.097  1.00  0.660          O  
ATOM    556  CB  VAL A  31      14.715   9.798  -1.895  1.00  0.780          C  
ATOM    557  CG1 VAL A  31      13.757  10.992  -1.870  1.00  0.780          C  
ATOM    558  CG2 VAL A  31      16.070  10.248  -2.442  1.00  0.780          C  
ATOM    559  H   VAL A  31      15.897   7.554  -1.461  1.00  0.640          H  
ATOM    560  HA  VAL A  31      15.551   9.947   0.061  1.00  0.680          H  
ATOM    561  HB  VAL A  31      14.286   9.029  -2.533  1.00  0.940          H  
ATOM    562 1HG1 VAL A  31      13.632  11.367  -2.882  1.00  0.940          H  
ATOM    563 2HG1 VAL A  31      12.782  10.691  -1.480  1.00  0.940          H  
ATOM    564 3HG1 VAL A  31      14.168  11.773  -1.251  1.00  0.940          H  
ATOM    565 1HG2 VAL A  31      15.958  10.657  -3.426  1.00  0.940          H  
ATOM    566 2HG2 VAL A  31      16.489  11.013  -1.789  1.00  0.940          H  
ATOM    567 3HG2 VAL A  31      16.752   9.402  -2.479  1.00  0.940          H  
ATOM    568  N   ILE A  32      12.916   7.931   0.050  1.00  0.460          N  
ATOM    569  CA  ILE A  32      11.653   7.717   0.752  1.00  0.580          C  
ATOM    570  C   ILE A  32      11.888   7.663   2.253  1.00  0.750          C  
ATOM    571  O   ILE A  32      11.166   8.299   3.029  1.00  0.890          O  
ATOM    572  CB  ILE A  32      10.983   6.360   0.395  1.00  0.760          C  
ATOM    573  CG1 ILE A  32      10.524   6.347  -1.059  1.00  0.760          C  
ATOM    574  CG2 ILE A  32       9.779   6.121   1.350  1.00  0.760          C  
ATOM    575  CD1 ILE A  32      10.105   4.963  -1.562  1.00  0.760          C  
ATOM    576  H   ILE A  32      13.233   7.282  -0.675  1.00  0.550          H  
ATOM    577  HA  ILE A  32      10.976   8.536   0.522  1.00  0.700          H  
ATOM    578  HB  ILE A  32      11.703   5.548   0.515  1.00  0.920          H  
ATOM    579 1HG1 ILE A  32       9.733   7.032  -1.188  1.00  0.920          H  
ATOM    580 2HG1 ILE A  32      11.336   6.685  -1.665  1.00  0.920          H  
ATOM    581 1HG2 ILE A  32       9.294   5.192   1.125  1.00  0.920          H  
ATOM    582 2HG2 ILE A  32      10.092   6.083   2.391  1.00  0.920          H  
ATOM    583 3HG2 ILE A  32       9.085   6.938   1.218  1.00  0.920          H  
ATOM    584 1HD1 ILE A  32       9.840   5.033  -2.579  1.00  0.920          H  
ATOM    585 2HD1 ILE A  32      10.922   4.265  -1.465  1.00  0.920          H  
ATOM    586 3HD1 ILE A  32       9.252   4.585  -1.009  1.00  0.920          H  
ATOM    587  N   ASP A  33      12.881   6.893   2.677  1.00  0.850          N  
ATOM    588  CA  ASP A  33      13.134   6.751   4.097  1.00  1.130          C  
ATOM    589  C   ASP A  33      13.718   8.009   4.721  1.00  1.170          C  
ATOM    590  O   ASP A  33      13.368   8.361   5.848  1.00  1.330          O  
ATOM    591  CB  ASP A  33      14.034   5.549   4.327  1.00  1.470          C  
ATOM    592  CG  ASP A  33      13.289   4.242   4.090  1.00  1.470          C  
ATOM    593  OD1 ASP A  33      12.080   4.231   4.172  1.00  1.470          O  
ATOM    594  OD2 ASP A  33      13.922   3.267   3.772  1.00  1.470          O  
ATOM    595  H   ASP A  33      13.446   6.375   1.995  1.00  1.020          H  
ATOM    596  HA  ASP A  33      12.182   6.553   4.587  1.00  1.360          H  
ATOM    597 1HB  ASP A  33      14.883   5.603   3.636  1.00  1.760          H  
ATOM    598 2HB  ASP A  33      14.426   5.567   5.342  1.00  1.760          H  
ATOM    599  N   GLN A  34      14.590   8.710   3.996  1.00  1.090          N  
ATOM    600  CA  GLN A  34      15.176   9.934   4.509  1.00  1.240          C  
ATOM    601  C   GLN A  34      14.139  11.015   4.776  1.00  1.230          C  
ATOM    602  O   GLN A  34      14.237  11.724   5.781  1.00  1.430          O  
ATOM    603  CB  GLN A  34      16.226  10.484   3.546  1.00  1.680          C  
ATOM    604  CG  GLN A  34      16.922  11.746   4.045  1.00  1.680          C  
ATOM    605  CD  GLN A  34      17.983  12.226   3.104  1.00  1.680          C  
ATOM    606  OE1 GLN A  34      18.157  11.690   2.005  1.00  1.680          O  
ATOM    607  NE2 GLN A  34      18.715  13.249   3.523  1.00  1.680          N  
ATOM    608  H   GLN A  34      14.893   8.380   3.077  1.00  1.310          H  
ATOM    609  HA  GLN A  34      15.666   9.701   5.452  1.00  1.490          H  
ATOM    610 1HB  GLN A  34      16.982   9.723   3.359  1.00  2.010          H  
ATOM    611 2HB  GLN A  34      15.751  10.710   2.592  1.00  2.010          H  
ATOM    612 1HG  GLN A  34      16.185  12.544   4.143  1.00  2.010          H  
ATOM    613 2HG  GLN A  34      17.379  11.543   5.011  1.00  2.010          H  
ATOM    614 1HE2 GLN A  34      19.443  13.617   2.943  1.00  2.010          H  
ATOM    615 2HE2 GLN A  34      18.540  13.655   4.421  1.00  2.010          H  
ATOM    616  N   PHE A  35      13.147  11.160   3.887  1.00  1.030          N  
ATOM    617  CA  PHE A  35      12.188  12.239   4.065  1.00  1.090          C  
ATOM    618  C   PHE A  35      10.764  11.876   4.513  1.00  1.120          C  
ATOM    619  O   PHE A  35      10.078  12.747   5.050  1.00  1.160          O  
ATOM    620  CB  PHE A  35      12.110  13.023   2.762  1.00  1.500          C  
ATOM    621  CG  PHE A  35      13.438  13.623   2.390  1.00  1.500          C  
ATOM    622  CD1 PHE A  35      14.208  13.037   1.412  1.00  1.500          C  
ATOM    623  CD2 PHE A  35      13.926  14.753   3.026  1.00  1.500          C  
ATOM    624  CE1 PHE A  35      15.426  13.546   1.060  1.00  1.500          C  
ATOM    625  CE2 PHE A  35      15.153  15.274   2.678  1.00  1.500          C  
ATOM    626  CZ  PHE A  35      15.903  14.668   1.691  1.00  1.500          C  
ATOM    627  H   PHE A  35      13.123  10.580   3.041  1.00  1.240          H  
ATOM    628  HA  PHE A  35      12.595  12.906   4.822  1.00  1.310          H  
ATOM    629 1HB  PHE A  35      11.790  12.357   1.954  1.00  1.800          H  
ATOM    630 2HB  PHE A  35      11.373  13.821   2.848  1.00  1.800          H  
ATOM    631  HD1 PHE A  35      13.835  12.154   0.923  1.00  1.800          H  
ATOM    632  HD2 PHE A  35      13.332  15.228   3.809  1.00  1.800          H  
ATOM    633  HE1 PHE A  35      16.020  13.057   0.285  1.00  1.800          H  
ATOM    634  HE2 PHE A  35      15.532  16.164   3.182  1.00  1.800          H  
ATOM    635  HZ  PHE A  35      16.875  15.074   1.416  1.00  1.800          H  
ATOM    636  N   GLY A  36      10.288  10.634   4.313  1.00  1.200          N  
ATOM    637  CA  GLY A  36       8.897  10.324   4.657  1.00  1.380          C  
ATOM    638  C   GLY A  36       7.963  10.930   3.617  1.00  1.400          C  
ATOM    639  O   GLY A  36       6.846  11.361   3.928  1.00  1.730          O  
ATOM    640  H   GLY A  36      10.839   9.892   3.884  1.00  1.440          H  
ATOM    641 1HA  GLY A  36       8.767   9.241   4.684  1.00  1.660          H  
ATOM    642 2HA  GLY A  36       8.664  10.712   5.647  1.00  1.660          H  
ATOM    643  N   GLU A  37       8.471  11.012   2.398  1.00  1.240          N  
ATOM    644  CA  GLU A  37       7.796  11.594   1.263  1.00  1.350          C  
ATOM    645  C   GLU A  37       8.269  10.924  -0.013  1.00  1.520          C  
ATOM    646  O   GLU A  37       7.563  10.938  -1.019  1.00  1.700          O  
ATOM    647  OXT GLU A  37       9.224  10.153   0.051  1.00  2.030          O  
ATOM    648  CB  GLU A  37       8.078  13.099   1.200  1.00  1.760          C  
ATOM    649  CG  GLU A  37       7.386  13.823   0.052  1.00  1.760          C  
ATOM    650  CD  GLU A  37       7.620  15.321   0.033  1.00  1.760          C  
ATOM    651  OE1 GLU A  37       8.126  15.857   0.984  1.00  1.760          O  
ATOM    652  OE2 GLU A  37       7.313  15.921  -0.984  1.00  1.760          O  
ATOM    653  H   GLU A  37       9.382  10.600   2.248  1.00  1.490          H  
ATOM    654  HA  GLU A  37       6.725  11.442   1.367  1.00  1.620          H  
ATOM    655 1HB  GLU A  37       7.760  13.564   2.135  1.00  2.110          H  
ATOM    656 2HB  GLU A  37       9.151  13.261   1.105  1.00  2.110          H  
ATOM    657 1HG  GLU A  37       7.749  13.415  -0.887  1.00  2.110          H  
ATOM    658 2HG  GLU A  37       6.317  13.623   0.109  1.00  2.110          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -214.262 21.0809 166.498 -17.0497 4.30661 11.336 85.9631 -91.6653 -0.44063 -2.7482 -85.6249 -9.21633 -33.7893 0 -1.38416 -2.90809 0 -0.13386 2.29584 18.7021 45.7807 -5.5159 0.01198 -5.71984 -2.87334 19.6709 -97.6855
ASP:NtermProteinFull_1 -3.06928 0.06582 4.66227 -0.24078 0.13005 0.77451 2.55224 -2.01143 -0 -0 -4.41197 -0.62544 0 0 -0.69208 0 0 -0.10794 0.00091 0 2.04187 0 0 -2.3716 0 0.08879 -3.21406
TRP_2 -5.04639 0.56027 2.41811 -1.15868 0.21968 0.3739 1.96644 -1.88016 -0 -0 -0.79815 -0.52286 0 0 0 0 0 -0.05056 0.38929 0 1.56517 -0.05349 0 1.6906 -0.17108 0.57525 0.07735
PHE_3 -5.08539 0.29276 4.46843 -0.63188 0.04308 0.28673 2.87185 -2.41571 -0 -0 -3.12139 0.00292 0 0 -0.15165 0 0 0.17416 0.05026 0 2.31012 0.03901 0 1.0402 -0.19549 0.78669 0.76469
LYS_4 -5.42641 0.62153 8.33983 -0.74524 0.12766 0.69526 3.71701 -3.47251 -0.00529 -0.0427 -6.20914 0.04408 0 0 -0.54043 -0.77159 0 -0.01901 0.27127 2.85804 0 0.03426 0 -1.5107 -0.02582 0.78266 -1.27723
ALA_5 -4.48508 0.18489 4.07758 -0.02182 0 0 2.06979 -2.3326 -0 -0 -1.59368 -0.35809 0 0 0 0 0 -0.0316 0 0 0 -0.29366 0 1.8394 -0.2134 0.5883 -0.56997
PHE_6 -10.1602 1.18416 5.57014 -0.50443 0.1505 0.22536 2.95869 -3.70141 -0.02557 -0.14843 -2.94478 -0.11578 0 0 0 0 0 0.00345 0.06545 0 3.17435 -0.07944 0 1.0402 -0.21678 0.50519 -3.01937
TYR_7 -8.70147 0.92467 5.45745 -0.87022 0.15005 0.3312 3.5353 -3.37441 -0.01581 -0.13406 -2.85945 -0.29504 0 0 0 0 0 -0.0119 0.00657 0 2.12001 -0.47644 0.01198 1.2797 0.08478 0.5195 -2.31759
ASP_8 -5.16739 0.50462 7.87107 -0.10663 0.00922 0.32353 3.68404 -3.41474 -0.01099 -0.10627 -6.5041 -0.30157 0 0 0 -0.77159 0 -0.01164 0.0018 0 1.71745 0.26153 0 -2.3716 0.02055 0.30855 -4.06415
LYS_9 -4.80387 0.18593 5.60733 -0.30507 0.03203 0.13833 2.59429 -2.56922 -0.00529 -0.0427 -2.15865 -0.02605 0 0 0 0 0 0.01648 0.01041 1.81915 0 -0.05276 0 -1.5107 -0.21009 0.28705 -0.99339
VAL_10 -8.01584 0.67574 4.07481 -0.30959 0.21088 0.07114 3.17628 -2.97638 -0 -0 -2.45616 -0.14375 0 0 0 0 0 -0.05394 0.01709 0.05524 0 -0.32052 0 1.9342 -0.17871 0.24849 -3.99103
ALA_11 -6.54141 0.52782 4.13123 -0.02061 0 0 3.01732 -3.02428 -0.01287 -0.07775 -3.12356 -0.35129 0 0 0 0 0 0.04052 0 0 0 -0.25034 0 1.8394 -0.23641 0.44705 -3.63516
GLU_12 -5.40129 0.41522 6.6328 -0.41495 0.04431 0.78722 2.667 -2.98112 -0.07759 -0.39279 -2.10488 -0.48225 0 0 0 0 0 0.09232 0.05232 0 3.42357 -0.26804 0 -2.7348 -0.46375 0.43023 -0.77647
LYS_13 -4.9825 0.40239 6.75106 -0.3047 0.03246 0.13746 2.76112 -2.95592 -0.0289 -0.21732 -3.68234 -0.05118 0 0 0 0 0 0.16164 0.03926 1.71331 0 -0.03876 0 -1.5107 -0.52774 0.38874 -1.9126
PHE_14 -11.5023 1.53804 5.19435 -0.51945 0.20352 0.2247 3.57985 -3.75045 -0 -0 -3.69512 -0.20093 0 0 0 0 0 -0.03063 0.0453 0 3.36533 -0.08629 0 1.0402 -0.338 0.69592 -4.23592
LYS_15 -5.69666 0.5641 5.2305 -0.41505 0.05163 0.22712 2.06053 -2.38641 -0.06659 -0.28651 -1.87862 -0.15009 0 0 0 0 0 -0.05067 0.10635 1.82098 0 -0.05752 0 -1.5107 -0.12575 0.69197 -1.87138
GLU_16 -2.84574 0.24133 3.34086 -0.22906 0.02734 0.32878 1.17266 -1.50811 -0.02052 -0.15599 -0.76888 -0.56959 0 0 0 0 0 -0.07725 0.01248 0 3.17456 -0.3035 0 -2.7348 -0.41841 0.74999 -0.58386
ALA_17 -2.96347 0.32046 1.54818 -0.02211 5e-05 0 1.07776 -1.16877 -0 -0 -0.68122 -0.32851 0 0 0 0 0 0.02553 0 0 0 0.22412 0 1.8394 0.85476 0.59797 1.32415
PHE_18 -6.28931 0.91252 3.9123 -0.69238 0.07516 0.45895 2.39009 -2.53693 -0.00838 -0.06132 -2.04106 0.1231 0 0 0 0 0 0.15042 0.28965 0 2.03555 -0.25365 0 1.0402 1.14568 0.93289 1.58347
PRO_19 -4.63983 0.76178 3.18689 -0.08441 0 0.05216 1.528 -1.48181 -0 -0 -1.05214 0.70901 0 0 0 0 0 -0.14586 0.00078 0.59002 0 -0.37975 0 -2.4119 -0.30481 1.12134 -2.55052
HIS_20 -3.92133 0.4143 2.67084 -0.72965 0.01181 0.83582 0.67061 -1.56751 -0 -0 -0.30565 -2.31447 0 0 0 0 0 0.03672 0.30971 0 1.5076 -0.04577 0 -0.45461 -0.22087 0.48728 -2.61517
VAL_21 -6.8736 1.1295 3.14553 -0.31256 0.16979 0.06853 1.88898 -2.31726 -0.0161 -0.09971 -1.82421 -0.45054 0 0 0 0 0 0.04076 0.00757 0.11481 0 0.09414 0 1.9342 0.08918 0.41408 -2.79689
PHE_22 -8.29817 1.0115 4.11813 -0.91175 0.09214 0.36621 2.08184 -2.59806 -0.02552 -0.19572 -1.05283 -0.02508 0 0 0 0 0 0.02878 0.04209 0 2.66249 -0.37727 0 1.0402 0.24013 0.55066 -1.25024
ARG_23 -4.94368 0.49835 3.16643 -0.72544 0.34201 0.41743 0.94485 -1.81288 -0.03822 -0.26696 -1.26287 0.13254 0 0 0 0 0 -0.0585 0.29872 2.63615 0 -0.19544 0 -1.2888 0.14119 0.50378 -1.51135
LEU_24 -5.65492 0.42748 4.62229 -0.63943 0.24673 0.24832 2.7547 -2.3058 -0.0165 -0.10372 -2.60696 -0.04429 0 0 0 0 0 -0.01124 0.03167 0.75695 0 0.00225 0 0.18072 0.21603 0.49301 -1.40269
LYS_25 -4.38983 0.5215 4.10515 -0.45877 0.10689 0.2853 2.19304 -1.9954 -0 -0 -1.83745 -0.23298 0 0 0 0 0 -0.05552 0.0271 1.7446 0 -0.06166 0 -1.5107 0.2507 0.52319 -0.78484
LYS_26 -3.25084 0.26993 3.68703 -0.30341 0.02791 0.13644 1.35029 -1.66143 -0 -0 -0.6689 -0.02279 0 0 0 0 0 -0.04205 0.00149 1.7089 0 -0.01088 0 -1.5107 -0.20473 0.34698 -0.14674
TRP_27 -8.05002 0.71007 4.49182 -1.39915 0.29446 0.69229 2.50349 -2.75958 -0 -0 -1.66152 -0.16117 0 0 0 0 0 -0.0272 0.05952 0 3.23021 0.06196 0 1.6906 -0.23105 0.41045 -0.14482
ILE_28 -11.0113 1.54221 4.08485 -0.49827 0.35494 0.09816 3.21212 -3.52359 -0 -0 -1.98557 0.01417 0 0 0 0 0 -0.05153 0.03948 0.52054 0 -0.42677 0 0.73287 0.01548 0.62712 -6.25511
GLN_29 -6.32445 0.35969 6.94203 -0.79365 0.08676 0.82019 3.20417 -3.27932 -0.0004 -0.004 -3.48489 -0.75796 0 0 0 -0.68246 0 0.11574 0.00406 0 3.01821 -0.1372 0 -0.18838 -0.12096 0.64418 -0.57865
LYS_30 -5.03639 0.2723 5.30347 -0.29585 0.0235 0.12693 2.53079 -2.48203 -0 -0 -2.26851 -0.03022 0 0 0 0 0 0.06505 0.0322 1.72074 0 -0.00015 0 -1.5107 -0.35794 0.38274 -1.52408
VAL_31 -7.31059 0.63944 3.76758 -0.31135 0.16831 0.07058 2.77915 -2.74216 -0.01807 -0.12831 -2.26832 -0.18003 0 0 0 0 0 -0.06918 0.00544 0.14393 0 -0.25559 0 1.9342 -0.30599 0.35346 -3.7275
ILE_32 -9.21581 1.05446 5.07772 -0.50733 0.55479 0.09912 3.17308 -3.34011 -0 -0 -3.12268 0.07146 0 0 0 0 0 -0.02405 0.01849 0.49879 0 -0.41218 0 0.73287 -0.03553 0.62677 -4.75014
ASP_33 -3.87042 0.20926 5.50694 -0.11749 0.033 0.36763 2.0483 -2.46245 -0 -0 -2.51641 -0.14116 0 0 0 -0.68246 0 0.05569 0.00971 0 1.96871 0.00149 0 -2.3716 -0.06483 0.53047 -1.49561
GLN_34 -4.32075 0.22204 3.17693 -0.40347 0.10515 0.276 1.35433 -1.74414 -0 -0 -1.19085 -0.69493 0 0 0 0 0 -0.01873 0.00545 0 3.54069 -0.10748 0 -0.18838 -0.25443 0.32849 0.08592
PHE_35 -5.01908 0.46018 2.73587 -0.67203 0.05356 0.39978 1.16592 -1.73373 -0 -0 -1.07751 0.21138 0 0 0 0 0 -0.05183 0.02732 0 2.01191 -0.10162 0 1.0402 -0.05318 0.73071 0.12786
GLY_36 -1.95325 0.03908 1.97015 -5e-05 0 0 0.98575 -1.06845 -0.00863 -0.04248 -1.25181 -0.40493 0 0 0 0 0 -0.14028 0 0 0 -1.1885 0 0.83697 -0.1885 0.68795 -1.72698
GLU:CtermProteinFull_37 -3.9939 0.41559 5.45002 -0.37301 0.12723 0.59092 1.74146 -2.32899 -0.0394 -0.24147 -3.15265 -0.54203 0 0 0 0 0 0 0.01661 0 2.9129 0 0 -2.7348 -0.26759 0.28303 -2.13609
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691860 DOMAINID 682971 MODEL 3 pep6_AB
MODEL     3
REMARK    Rerank model03.pdb score: 17.669
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 7 cluster_threshold: 1.575896
REMARK    SCORE        hbond_sc:          -1.833
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE fa_intra_sol_xover4:           8.727
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE          fa_sol:         138.866
REMARK    SCORE            time:           0.000
REMARK    SCORE     lk_ball_wtd:          -7.184
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     rama_prepro:          -4.038
REMARK    SCORE     hbond_bb_sc:           0.000
REMARK    SCORE           omega:           0.676
REMARK    SCORE           score:         -93.350
REMARK    SCORE     hbond_sr_bb:         -29.174
REMARK    SCORE     hbond_lr_bb:          -6.501
REMARK    SCORE    fa_intra_rep:           0.474
REMARK    SCORE     total_score:         -93.350
REMARK    SCORE          fa_atr:        -209.467
REMARK    SCORE          fa_rep:          19.963
REMARK    SCORE         fa_elec:         -74.268
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     cart_bonded:          17.022
REMARK    SCORE          fa_dun:          51.751
REMARK    SCORE             ref:           6.830
REMARK    SCORE         p_aa_pp:          -5.193
ATOM      1  N   ASP A   1       0.065   0.189   0.200  1.00  1.660          N  
ATOM      2  CA  ASP A   1       1.502   0.240  -0.016  1.00  0.980          C  
ATOM      3  C   ASP A   1       2.017   1.672   0.084  1.00  0.810          C  
ATOM      4  O   ASP A   1       3.043   2.019  -0.520  1.00  0.710          O  
ATOM      5  CB  ASP A   1       1.851  -0.327  -1.398  1.00  1.640          C  
ATOM      6  CG  ASP A   1       1.504  -1.815  -1.553  1.00  1.640          C  
ATOM      7  OD1 ASP A   1       1.247  -2.475  -0.553  1.00  1.640          O  
ATOM      8  OD2 ASP A   1       1.514  -2.284  -2.649  1.00  1.640          O  
ATOM      9 1H   ASP A   1      -0.231  -0.779   0.208  1.00  1.990          H  
ATOM     10 2H   ASP A   1      -0.141   0.617   1.096  1.00  1.990          H  
ATOM     11 3H   ASP A   1      -0.416   0.684  -0.536  1.00  1.990          H  
ATOM     12  HA  ASP A   1       1.988  -0.349   0.758  1.00  1.180          H  
ATOM     13 1HB  ASP A   1       1.315   0.234  -2.165  1.00  1.970          H  
ATOM     14 2HB  ASP A   1       2.918  -0.196  -1.589  1.00  1.970          H  
ATOM     15  N   TRP A   2       1.290   2.517   0.821  1.00  0.850          N  
ATOM     16  CA  TRP A   2       1.667   3.928   0.946  1.00  0.780          C  
ATOM     17  C   TRP A   2       3.027   4.104   1.575  1.00  0.660          C  
ATOM     18  O   TRP A   2       3.927   4.735   0.997  1.00  0.610          O  
ATOM     19  CB  TRP A   2       0.642   4.693   1.781  1.00  1.120          C  
ATOM     20  CG  TRP A   2       1.060   6.093   2.055  1.00  1.120          C  
ATOM     21  CD1 TRP A   2       1.520   6.579   3.240  1.00  1.120          C  
ATOM     22  CD2 TRP A   2       1.088   7.200   1.131  1.00  1.120          C  
ATOM     23  NE1 TRP A   2       1.823   7.903   3.120  1.00  1.120          N  
ATOM     24  CE2 TRP A   2       1.568   8.302   1.837  1.00  1.120          C  
ATOM     25  CE3 TRP A   2       0.751   7.343  -0.221  1.00  1.120          C  
ATOM     26  CZ2 TRP A   2       1.722   9.541   1.241  1.00  1.120          C  
ATOM     27  CZ3 TRP A   2       0.908   8.584  -0.818  1.00  1.120          C  
ATOM     28  CH2 TRP A   2       1.381   9.655  -0.104  1.00  1.120          C  
ATOM     29  H   TRP A   2       0.492   2.173   1.367  1.00  1.020          H  
ATOM     30  HA  TRP A   2       1.695   4.363  -0.051  1.00  0.940          H  
ATOM     31 1HB  TRP A   2      -0.313   4.710   1.265  1.00  1.340          H  
ATOM     32 2HB  TRP A   2       0.493   4.186   2.736  1.00  1.340          H  
ATOM     33  HD1 TRP A   2       1.630   5.995   4.145  1.00  1.340          H  
ATOM     34  HE1 TRP A   2       2.180   8.493   3.857  1.00  1.340          H  
ATOM     35  HE3 TRP A   2       0.377   6.498  -0.793  1.00  1.340          H  
ATOM     36  HZ2 TRP A   2       2.097  10.404   1.791  1.00  1.340          H  
ATOM     37  HZ3 TRP A   2       0.645   8.688  -1.869  1.00  1.340          H  
ATOM     38  HH2 TRP A   2       1.492  10.617  -0.604  1.00  1.340          H  
ATOM     39  N   PHE A   3       3.194   3.522   2.755  1.00  0.710          N  
ATOM     40  CA  PHE A   3       4.463   3.675   3.403  1.00  0.710          C  
ATOM     41  C   PHE A   3       5.544   2.864   2.744  1.00  0.580          C  
ATOM     42  O   PHE A   3       6.709   3.220   2.844  1.00  0.520          O  
ATOM     43  CB  PHE A   3       4.406   3.408   4.892  1.00  0.990          C  
ATOM     44  CG  PHE A   3       3.891   4.529   5.664  1.00  0.990          C  
ATOM     45  CD1 PHE A   3       2.679   4.459   6.282  1.00  0.990          C  
ATOM     46  CD2 PHE A   3       4.643   5.691   5.774  1.00  0.990          C  
ATOM     47  CE1 PHE A   3       2.198   5.523   7.010  1.00  0.990          C  
ATOM     48  CE2 PHE A   3       4.180   6.759   6.490  1.00  0.990          C  
ATOM     49  CZ  PHE A   3       2.948   6.679   7.114  1.00  0.990          C  
ATOM     50  H   PHE A   3       2.426   2.999   3.195  1.00  0.850          H  
ATOM     51  HA  PHE A   3       4.730   4.721   3.304  1.00  0.850          H  
ATOM     52 1HB  PHE A   3       3.759   2.557   5.070  1.00  1.190          H  
ATOM     53 2HB  PHE A   3       5.376   3.180   5.261  1.00  1.190          H  
ATOM     54  HD1 PHE A   3       2.099   3.547   6.199  1.00  1.190          H  
ATOM     55  HD2 PHE A   3       5.613   5.751   5.286  1.00  1.190          H  
ATOM     56  HE1 PHE A   3       1.222   5.442   7.505  1.00  1.190          H  
ATOM     57  HE2 PHE A   3       4.784   7.666   6.569  1.00  1.190          H  
ATOM     58  HZ  PHE A   3       2.571   7.522   7.690  1.00  1.190          H  
ATOM     59  N   LYS A   4       5.220   1.759   2.079  1.00  0.580          N  
ATOM     60  CA  LYS A   4       6.313   1.041   1.450  1.00  0.550          C  
ATOM     61  C   LYS A   4       6.962   1.938   0.405  1.00  0.450          C  
ATOM     62  O   LYS A   4       8.189   1.967   0.298  1.00  0.490          O  
ATOM     63  CB  LYS A   4       5.862  -0.285   0.863  1.00  0.780          C  
ATOM     64  CG  LYS A   4       5.563  -1.322   1.936  1.00  0.780          C  
ATOM     65  CD  LYS A   4       5.300  -2.711   1.387  1.00  0.780          C  
ATOM     66  CE  LYS A   4       3.976  -2.708   0.689  1.00  0.780          C  
ATOM     67  NZ  LYS A   4       3.448  -4.021   0.389  1.00  0.780          N  
ATOM     68  H   LYS A   4       4.260   1.451   2.003  1.00  0.700          H  
ATOM     69  HA  LYS A   4       7.065   0.825   2.208  1.00  0.660          H  
ATOM     70 1HB  LYS A   4       4.969  -0.114   0.265  1.00  0.940          H  
ATOM     71 2HB  LYS A   4       6.636  -0.677   0.205  1.00  0.940          H  
ATOM     72 1HG  LYS A   4       6.376  -1.357   2.647  1.00  0.940          H  
ATOM     73 2HG  LYS A   4       4.683  -1.014   2.455  1.00  0.940          H  
ATOM     74 1HD  LYS A   4       6.087  -3.009   0.696  1.00  0.940          H  
ATOM     75 2HD  LYS A   4       5.260  -3.434   2.214  1.00  0.940          H  
ATOM     76 1HE  LYS A   4       3.260  -2.202   1.326  1.00  0.940          H  
ATOM     77 2HE  LYS A   4       4.074  -2.168  -0.243  1.00  0.940          H  
ATOM     78 1HZ  LYS A   4       2.528  -3.839  -0.061  1.00  0.940          H  
ATOM     79 2HZ  LYS A   4       4.046  -4.541  -0.218  1.00  0.940          H  
ATOM     80 3HZ  LYS A   4       3.313  -4.525   1.275  1.00  0.940          H  
ATOM     81  N   ALA A   5       6.149   2.677  -0.372  1.00  0.430          N  
ATOM     82  CA  ALA A   5       6.715   3.586  -1.362  1.00  0.490          C  
ATOM     83  C   ALA A   5       7.567   4.665  -0.685  1.00  0.480          C  
ATOM     84  O   ALA A   5       8.676   4.977  -1.140  1.00  0.560          O  
ATOM     85  CB  ALA A   5       5.602   4.232  -2.160  1.00  0.660          C  
ATOM     86  H   ALA A   5       5.129   2.573  -0.295  1.00  0.520          H  
ATOM     87  HA  ALA A   5       7.357   3.012  -2.028  1.00  0.590          H  
ATOM     88 1HB  ALA A   5       6.025   4.895  -2.908  1.00  0.790          H  
ATOM     89 2HB  ALA A   5       5.012   3.455  -2.647  1.00  0.790          H  
ATOM     90 3HB  ALA A   5       4.960   4.801  -1.484  1.00  0.790          H  
ATOM     91  N   PHE A   6       7.055   5.197   0.434  1.00  0.490          N  
ATOM     92  CA  PHE A   6       7.746   6.222   1.206  1.00  0.610          C  
ATOM     93  C   PHE A   6       9.095   5.731   1.683  1.00  0.550          C  
ATOM     94  O   PHE A   6      10.121   6.368   1.427  1.00  0.620          O  
ATOM     95  CB  PHE A   6       6.900   6.615   2.414  1.00  0.810          C  
ATOM     96  CG  PHE A   6       7.521   7.567   3.375  1.00  0.810          C  
ATOM     97  CD1 PHE A   6       7.548   8.924   3.145  1.00  0.810          C  
ATOM     98  CD2 PHE A   6       8.071   7.084   4.544  1.00  0.810          C  
ATOM     99  CE1 PHE A   6       8.113   9.772   4.076  1.00  0.810          C  
ATOM    100  CE2 PHE A   6       8.632   7.910   5.468  1.00  0.810          C  
ATOM    101  CZ  PHE A   6       8.653   9.260   5.241  1.00  0.810          C  
ATOM    102  H   PHE A   6       6.117   4.906   0.730  1.00  0.590          H  
ATOM    103  HA  PHE A   6       7.898   7.092   0.570  1.00  0.730          H  
ATOM    104 1HB  PHE A   6       5.949   7.025   2.077  1.00  0.970          H  
ATOM    105 2HB  PHE A   6       6.684   5.726   2.963  1.00  0.970          H  
ATOM    106  HD1 PHE A   6       7.118   9.326   2.228  1.00  0.970          H  
ATOM    107  HD2 PHE A   6       8.050   6.028   4.721  1.00  0.970          H  
ATOM    108  HE1 PHE A   6       8.133  10.846   3.892  1.00  0.970          H  
ATOM    109  HE2 PHE A   6       9.059   7.498   6.382  1.00  0.970          H  
ATOM    110  HZ  PHE A   6       9.100   9.929   5.975  1.00  0.970          H  
ATOM    111  N   TYR A   7       9.102   4.577   2.346  1.00  0.500          N  
ATOM    112  CA  TYR A   7      10.324   4.043   2.898  1.00  0.520          C  
ATOM    113  C   TYR A   7      11.265   3.553   1.831  1.00  0.470          C  
ATOM    114  O   TYR A   7      12.469   3.642   2.001  1.00  0.520          O  
ATOM    115  CB  TYR A   7      10.041   2.968   3.941  1.00  0.720          C  
ATOM    116  CG  TYR A   7       9.632   3.568   5.265  1.00  0.720          C  
ATOM    117  CD1 TYR A   7       8.326   3.553   5.659  1.00  0.720          C  
ATOM    118  CD2 TYR A   7      10.593   4.144   6.077  1.00  0.720          C  
ATOM    119  CE1 TYR A   7       7.944   4.105   6.861  1.00  0.720          C  
ATOM    120  CE2 TYR A   7      10.230   4.700   7.281  1.00  0.720          C  
ATOM    121  CZ  TYR A   7       8.903   4.681   7.674  1.00  0.720          C  
ATOM    122  OH  TYR A   7       8.531   5.231   8.874  1.00  0.720          O  
ATOM    123  H   TYR A   7       8.229   4.078   2.486  1.00  0.600          H  
ATOM    124  HA  TYR A   7      10.822   4.851   3.418  1.00  0.620          H  
ATOM    125 1HB  TYR A   7       9.231   2.319   3.588  1.00  0.860          H  
ATOM    126 2HB  TYR A   7      10.926   2.350   4.092  1.00  0.860          H  
ATOM    127  HD1 TYR A   7       7.598   3.109   5.019  1.00  0.860          H  
ATOM    128  HD2 TYR A   7      11.635   4.158   5.760  1.00  0.860          H  
ATOM    129  HE1 TYR A   7       6.898   4.089   7.168  1.00  0.860          H  
ATOM    130  HE2 TYR A   7      10.988   5.153   7.922  1.00  0.860          H  
ATOM    131  HH  TYR A   7       9.309   5.550   9.337  1.00  0.860          H  
ATOM    132  N   ASP A   8      10.786   3.084   0.690  1.00  0.450          N  
ATOM    133  CA  ASP A   8      11.749   2.702  -0.328  1.00  0.540          C  
ATOM    134  C   ASP A   8      12.569   3.947  -0.708  1.00  0.560          C  
ATOM    135  O   ASP A   8      13.811   3.909  -0.757  1.00  0.630          O  
ATOM    136  CB  ASP A   8      11.028   2.113  -1.553  1.00  0.720          C  
ATOM    137  CG  ASP A   8      11.958   1.530  -2.642  1.00  0.720          C  
ATOM    138  OD1 ASP A   8      12.643   0.546  -2.380  1.00  0.720          O  
ATOM    139  OD2 ASP A   8      11.963   2.059  -3.722  1.00  0.720          O  
ATOM    140  H   ASP A   8       9.783   2.937   0.543  1.00  0.540          H  
ATOM    141  HA  ASP A   8      12.423   1.962   0.087  1.00  0.650          H  
ATOM    142 1HB  ASP A   8      10.349   1.329  -1.218  1.00  0.860          H  
ATOM    143 2HB  ASP A   8      10.405   2.894  -2.001  1.00  0.860          H  
ATOM    144  N   LYS A   9      11.874   5.073  -0.938  1.00  0.580          N  
ATOM    145  CA  LYS A   9      12.545   6.310  -1.315  1.00  0.740          C  
ATOM    146  C   LYS A   9      13.444   6.856  -0.202  1.00  0.720          C  
ATOM    147  O   LYS A   9      14.585   7.259  -0.469  1.00  0.840          O  
ATOM    148  CB  LYS A   9      11.503   7.362  -1.697  1.00  0.970          C  
ATOM    149  CG  LYS A   9      10.770   7.079  -3.009  1.00  0.970          C  
ATOM    150  CD  LYS A   9       9.709   8.139  -3.297  1.00  0.970          C  
ATOM    151  CE  LYS A   9       8.956   7.842  -4.590  1.00  0.970          C  
ATOM    152  NZ  LYS A   9       7.887   8.849  -4.857  1.00  0.970          N  
ATOM    153  H   LYS A   9      10.846   5.044  -0.887  1.00  0.700          H  
ATOM    154  HA  LYS A   9      13.173   6.102  -2.182  1.00  0.890          H  
ATOM    155 1HB  LYS A   9      10.749   7.418  -0.907  1.00  1.170          H  
ATOM    156 2HB  LYS A   9      11.978   8.338  -1.768  1.00  1.170          H  
ATOM    157 1HG  LYS A   9      11.490   7.055  -3.827  1.00  1.170          H  
ATOM    158 2HG  LYS A   9      10.289   6.102  -2.944  1.00  1.170          H  
ATOM    159 1HD  LYS A   9       8.993   8.159  -2.470  1.00  1.170          H  
ATOM    160 2HD  LYS A   9      10.178   9.119  -3.373  1.00  1.170          H  
ATOM    161 1HE  LYS A   9       9.660   7.846  -5.420  1.00  1.170          H  
ATOM    162 2HE  LYS A   9       8.500   6.854  -4.516  1.00  1.170          H  
ATOM    163 1HZ  LYS A   9       7.411   8.618  -5.719  1.00  1.170          H  
ATOM    164 2HZ  LYS A   9       7.222   8.843  -4.095  1.00  1.170          H  
ATOM    165 3HZ  LYS A   9       8.298   9.768  -4.937  1.00  1.170          H  
ATOM    166  N   VAL A  10      12.928   6.867   1.034  1.00  0.640          N  
ATOM    167  CA  VAL A  10      13.649   7.379   2.191  1.00  0.710          C  
ATOM    168  C   VAL A  10      14.828   6.499   2.569  1.00  0.620          C  
ATOM    169  O   VAL A  10      15.907   7.001   2.858  1.00  0.700          O  
ATOM    170  CB  VAL A  10      12.713   7.575   3.397  1.00  0.970          C  
ATOM    171  CG1 VAL A  10      13.507   7.940   4.622  1.00  0.970          C  
ATOM    172  CG2 VAL A  10      11.735   8.699   3.095  1.00  0.970          C  
ATOM    173  H   VAL A  10      11.969   6.527   1.163  1.00  0.770          H  
ATOM    174  HA  VAL A  10      14.030   8.363   1.929  1.00  0.850          H  
ATOM    175  HB  VAL A  10      12.181   6.656   3.594  1.00  1.160          H  
ATOM    176 1HG1 VAL A  10      12.837   8.085   5.467  1.00  1.160          H  
ATOM    177 2HG1 VAL A  10      14.220   7.173   4.867  1.00  1.160          H  
ATOM    178 3HG1 VAL A  10      14.036   8.865   4.410  1.00  1.160          H  
ATOM    179 1HG2 VAL A  10      11.083   8.833   3.939  1.00  1.160          H  
ATOM    180 2HG2 VAL A  10      12.286   9.619   2.909  1.00  1.160          H  
ATOM    181 3HG2 VAL A  10      11.143   8.455   2.220  1.00  1.160          H  
ATOM    182  N   ALA A  11      14.640   5.184   2.583  1.00  0.540          N  
ATOM    183  CA  ALA A  11      15.701   4.272   2.952  1.00  0.610          C  
ATOM    184  C   ALA A  11      16.912   4.483   2.075  1.00  0.680          C  
ATOM    185  O   ALA A  11      18.031   4.499   2.587  1.00  0.770          O  
ATOM    186  CB  ALA A  11      15.200   2.841   2.816  1.00  0.830          C  
ATOM    187  H   ALA A  11      13.740   4.793   2.341  1.00  0.650          H  
ATOM    188  HA  ALA A  11      15.998   4.474   3.977  1.00  0.730          H  
ATOM    189 1HB  ALA A  11      15.950   2.151   3.064  1.00  0.990          H  
ATOM    190 2HB  ALA A  11      14.341   2.690   3.467  1.00  0.990          H  
ATOM    191 3HB  ALA A  11      14.901   2.671   1.781  1.00  0.990          H  
ATOM    192  N   GLU A  12      16.716   4.708   0.772  1.00  0.720          N  
ATOM    193  CA  GLU A  12      17.873   4.961  -0.069  1.00  0.910          C  
ATOM    194  C   GLU A  12      18.412   6.382   0.190  1.00  0.950          C  
ATOM    195  O   GLU A  12      19.615   6.579   0.369  1.00  1.020          O  
ATOM    196  CB  GLU A  12      17.501   4.790  -1.542  1.00  1.200          C  
ATOM    197  CG  GLU A  12      18.673   4.887  -2.529  1.00  1.200          C  
ATOM    198  CD  GLU A  12      19.655   3.743  -2.397  1.00  1.200          C  
ATOM    199  OE1 GLU A  12      19.280   2.721  -1.866  1.00  1.200          O  
ATOM    200  OE2 GLU A  12      20.771   3.888  -2.836  1.00  1.200          O  
ATOM    201  H   GLU A  12      15.775   4.636   0.361  1.00  0.860          H  
ATOM    202  HA  GLU A  12      18.652   4.241   0.183  1.00  1.090          H  
ATOM    203 1HB  GLU A  12      17.021   3.820  -1.681  1.00  1.440          H  
ATOM    204 2HB  GLU A  12      16.766   5.552  -1.815  1.00  1.440          H  
ATOM    205 1HG  GLU A  12      18.274   4.893  -3.542  1.00  1.440          H  
ATOM    206 2HG  GLU A  12      19.197   5.830  -2.372  1.00  1.440          H  
ATOM    207  N   LYS A  13      17.514   7.376   0.280  1.00  1.000          N  
ATOM    208  CA  LYS A  13      17.897   8.777   0.485  1.00  1.210          C  
ATOM    209  C   LYS A  13      18.774   8.959   1.715  1.00  1.040          C  
ATOM    210  O   LYS A  13      19.734   9.731   1.709  1.00  1.140          O  
ATOM    211  CB  LYS A  13      16.644   9.645   0.640  1.00  1.610          C  
ATOM    212  CG  LYS A  13      16.881  11.145   0.786  1.00  1.610          C  
ATOM    213  CD  LYS A  13      15.545  11.889   0.890  1.00  1.610          C  
ATOM    214  CE  LYS A  13      15.746  13.390   1.066  1.00  1.610          C  
ATOM    215  NZ  LYS A  13      14.444  14.123   1.156  1.00  1.610          N  
ATOM    216  H   LYS A  13      16.518   7.176   0.147  1.00  1.200          H  
ATOM    217  HA  LYS A  13      18.460   9.108  -0.386  1.00  1.450          H  
ATOM    218 1HB  LYS A  13      15.980   9.479  -0.207  1.00  1.930          H  
ATOM    219 2HB  LYS A  13      16.115   9.328   1.533  1.00  1.930          H  
ATOM    220 1HG  LYS A  13      17.471  11.345   1.675  1.00  1.930          H  
ATOM    221 2HG  LYS A  13      17.431  11.509  -0.080  1.00  1.930          H  
ATOM    222 1HD  LYS A  13      14.958  11.711  -0.013  1.00  1.930          H  
ATOM    223 2HD  LYS A  13      14.989  11.499   1.747  1.00  1.930          H  
ATOM    224 1HE  LYS A  13      16.315  13.567   1.976  1.00  1.930          H  
ATOM    225 2HE  LYS A  13      16.309  13.776   0.217  1.00  1.930          H  
ATOM    226 1HZ  LYS A  13      14.620  15.112   1.271  1.00  1.930          H  
ATOM    227 2HZ  LYS A  13      13.911  13.975   0.309  1.00  1.930          H  
ATOM    228 3HZ  LYS A  13      13.916  13.783   1.947  1.00  1.930          H  
ATOM    229  N   PHE A  14      18.429   8.243   2.774  1.00  0.840          N  
ATOM    230  CA  PHE A  14      19.098   8.302   4.053  1.00  0.840          C  
ATOM    231  C   PHE A  14      20.079   7.171   4.312  1.00  0.630          C  
ATOM    232  O   PHE A  14      20.528   7.005   5.453  1.00  0.850          O  
ATOM    233  CB  PHE A  14      18.071   8.247   5.176  1.00  1.180          C  
ATOM    234  CG  PHE A  14      17.140   9.420   5.330  1.00  1.180          C  
ATOM    235  CD1 PHE A  14      17.283  10.610   4.619  1.00  1.180          C  
ATOM    236  CD2 PHE A  14      16.116   9.336   6.259  1.00  1.180          C  
ATOM    237  CE1 PHE A  14      16.425  11.656   4.833  1.00  1.180          C  
ATOM    238  CE2 PHE A  14      15.263  10.387   6.474  1.00  1.180          C  
ATOM    239  CZ  PHE A  14      15.415  11.547   5.757  1.00  1.180          C  
ATOM    240  H   PHE A  14      17.597   7.656   2.695  1.00  1.010          H  
ATOM    241  HA  PHE A  14      19.654   9.232   4.097  1.00  1.010          H  
ATOM    242 1HB  PHE A  14      17.452   7.356   5.026  1.00  1.410          H  
ATOM    243 2HB  PHE A  14      18.587   8.111   6.088  1.00  1.410          H  
ATOM    244  HD1 PHE A  14      18.076  10.729   3.890  1.00  1.410          H  
ATOM    245  HD2 PHE A  14      15.996   8.420   6.831  1.00  1.410          H  
ATOM    246  HE1 PHE A  14      16.550  12.577   4.272  1.00  1.410          H  
ATOM    247  HE2 PHE A  14      14.465  10.301   7.211  1.00  1.410          H  
ATOM    248  HZ  PHE A  14      14.738  12.382   5.928  1.00  1.410          H  
ATOM    249  N   LYS A  15      20.495   6.432   3.284  1.00  0.500          N  
ATOM    250  CA  LYS A  15      21.408   5.305   3.482  1.00  0.700          C  
ATOM    251  C   LYS A  15      22.611   5.632   4.363  1.00  0.890          C  
ATOM    252  O   LYS A  15      23.042   4.788   5.149  1.00  1.180          O  
ATOM    253  CB  LYS A  15      21.880   4.763   2.134  1.00  0.900          C  
ATOM    254  CG  LYS A  15      22.829   3.565   2.216  1.00  0.900          C  
ATOM    255  CD  LYS A  15      23.168   3.049   0.828  1.00  0.900          C  
ATOM    256  CE  LYS A  15      24.151   1.895   0.888  1.00  0.900          C  
ATOM    257  NZ  LYS A  15      24.485   1.385  -0.473  1.00  0.900          N  
ATOM    258  H   LYS A  15      20.133   6.611   2.339  1.00  0.600          H  
ATOM    259  HA  LYS A  15      20.856   4.517   3.979  1.00  0.840          H  
ATOM    260 1HB  LYS A  15      21.004   4.455   1.552  1.00  1.080          H  
ATOM    261 2HB  LYS A  15      22.374   5.558   1.576  1.00  1.080          H  
ATOM    262 1HG  LYS A  15      23.754   3.859   2.714  1.00  1.080          H  
ATOM    263 2HG  LYS A  15      22.365   2.774   2.795  1.00  1.080          H  
ATOM    264 1HD  LYS A  15      22.250   2.717   0.331  1.00  1.080          H  
ATOM    265 2HD  LYS A  15      23.602   3.857   0.240  1.00  1.080          H  
ATOM    266 1HE  LYS A  15      25.064   2.232   1.375  1.00  1.080          H  
ATOM    267 2HE  LYS A  15      23.718   1.087   1.472  1.00  1.080          H  
ATOM    268 1HZ  LYS A  15      25.141   0.619  -0.398  1.00  1.080          H  
ATOM    269 2HZ  LYS A  15      23.638   1.063  -0.927  1.00  1.080          H  
ATOM    270 3HZ  LYS A  15      24.897   2.127  -1.021  1.00  1.080          H  
ATOM    271  N   GLU A  16      23.201   6.820   4.192  1.00  0.820          N  
ATOM    272  CA  GLU A  16      24.364   7.225   4.978  1.00  1.030          C  
ATOM    273  C   GLU A  16      24.057   8.346   5.989  1.00  1.030          C  
ATOM    274  O   GLU A  16      24.975   8.920   6.573  1.00  1.330          O  
ATOM    275  CB  GLU A  16      25.497   7.667   4.043  1.00  1.360          C  
ATOM    276  CG  GLU A  16      26.022   6.559   3.121  1.00  1.360          C  
ATOM    277  CD  GLU A  16      27.161   7.007   2.219  1.00  1.360          C  
ATOM    278  OE1 GLU A  16      27.499   8.167   2.246  1.00  1.360          O  
ATOM    279  OE2 GLU A  16      27.688   6.182   1.509  1.00  1.360          O  
ATOM    280  H   GLU A  16      22.826   7.458   3.501  1.00  0.980          H  
ATOM    281  HA  GLU A  16      24.709   6.359   5.544  1.00  1.240          H  
ATOM    282 1HB  GLU A  16      25.148   8.488   3.418  1.00  1.630          H  
ATOM    283 2HB  GLU A  16      26.335   8.037   4.634  1.00  1.630          H  
ATOM    284 1HG  GLU A  16      26.362   5.726   3.736  1.00  1.630          H  
ATOM    285 2HG  GLU A  16      25.200   6.199   2.503  1.00  1.630          H  
ATOM    286  N   ALA A  17      22.781   8.719   6.131  1.00  0.850          N  
ATOM    287  CA  ALA A  17      22.398   9.826   7.021  1.00  1.000          C  
ATOM    288  C   ALA A  17      21.710   9.314   8.273  1.00  1.180          C  
ATOM    289  O   ALA A  17      22.019   9.720   9.394  1.00  1.530          O  
ATOM    290  CB  ALA A  17      21.476  10.791   6.293  1.00  1.340          C  
ATOM    291  H   ALA A  17      22.069   8.162   5.669  1.00  1.020          H  
ATOM    292  HA  ALA A  17      23.302  10.352   7.324  1.00  1.200          H  
ATOM    293 1HB  ALA A  17      21.219  11.613   6.960  1.00  1.610          H  
ATOM    294 2HB  ALA A  17      21.980  11.179   5.410  1.00  1.610          H  
ATOM    295 3HB  ALA A  17      20.578  10.274   5.997  1.00  1.610          H  
ATOM    296  N   PHE A  18      20.767   8.416   8.051  1.00  0.990          N  
ATOM    297  CA  PHE A  18      19.959   7.784   9.068  1.00  1.220          C  
ATOM    298  C   PHE A  18      19.970   6.310   8.695  1.00  1.000          C  
ATOM    299  O   PHE A  18      18.902   5.774   8.387  1.00  0.980          O  
ATOM    300  CB  PHE A  18      18.536   8.353   9.075  1.00  1.620          C  
ATOM    301  CG  PHE A  18      18.469   9.836   9.322  1.00  1.620          C  
ATOM    302  CD1 PHE A  18      18.507  10.729   8.274  1.00  1.620          C  
ATOM    303  CD2 PHE A  18      18.348  10.339  10.596  1.00  1.620          C  
ATOM    304  CE1 PHE A  18      18.432  12.075   8.470  1.00  1.620          C  
ATOM    305  CE2 PHE A  18      18.275  11.699  10.807  1.00  1.620          C  
ATOM    306  CZ  PHE A  18      18.317  12.567   9.738  1.00  1.620          C  
ATOM    307  H   PHE A  18      20.607   8.116   7.090  1.00  1.190          H  
ATOM    308  HA  PHE A  18      20.395   7.947  10.049  1.00  1.460          H  
ATOM    309 1HB  PHE A  18      18.046   8.140   8.161  1.00  1.940          H  
ATOM    310 2HB  PHE A  18      17.959   7.865   9.838  1.00  1.940          H  
ATOM    311  HD1 PHE A  18      18.604  10.354   7.281  1.00  1.940          H  
ATOM    312  HD2 PHE A  18      18.314   9.656  11.443  1.00  1.940          H  
ATOM    313  HE1 PHE A  18      18.467  12.751   7.616  1.00  1.940          H  
ATOM    314  HE2 PHE A  18      18.182  12.089  11.820  1.00  1.940          H  
ATOM    315  HZ  PHE A  18      18.258  13.641   9.904  1.00  1.940          H  
ATOM    316  N   PRO A  19      21.153   5.645   8.741  1.00  1.050          N  
ATOM    317  CA  PRO A  19      21.461   4.345   8.161  1.00  1.070          C  
ATOM    318  C   PRO A  19      20.603   3.211   8.682  1.00  1.140          C  
ATOM    319  O   PRO A  19      20.501   2.173   8.019  1.00  1.170          O  
ATOM    320  CB  PRO A  19      22.934   4.141   8.541  1.00  1.600          C  
ATOM    321  CG  PRO A  19      23.159   5.010   9.752  1.00  1.600          C  
ATOM    322  CD  PRO A  19      22.288   6.210   9.532  1.00  1.600          C  
ATOM    323  HA  PRO A  19      21.363   4.422   7.067  1.00  1.280          H  
ATOM    324 1HB  PRO A  19      23.126   3.081   8.728  1.00  1.930          H  
ATOM    325 2HB  PRO A  19      23.571   4.433   7.688  1.00  1.930          H  
ATOM    326 1HG  PRO A  19      22.906   4.464  10.673  1.00  1.930          H  
ATOM    327 2HG  PRO A  19      24.224   5.279   9.823  1.00  1.930          H  
ATOM    328 1HD  PRO A  19      21.974   6.594  10.509  1.00  1.930          H  
ATOM    329 2HD  PRO A  19      22.855   6.945   8.951  1.00  1.930          H  
ATOM    330  N   HIS A  20      19.997   3.388   9.857  1.00  1.270          N  
ATOM    331  CA  HIS A  20      19.135   2.367  10.384  1.00  1.390          C  
ATOM    332  C   HIS A  20      17.849   2.258   9.573  1.00  1.120          C  
ATOM    333  O   HIS A  20      17.225   1.198   9.567  1.00  1.060          O  
ATOM    334  CB  HIS A  20      18.820   2.683  11.832  1.00  1.900          C  
ATOM    335  CG  HIS A  20      18.221   4.015  11.974  1.00  1.900          C  
ATOM    336  ND1 HIS A  20      18.983   5.169  11.926  1.00  1.900          N  
ATOM    337  CD2 HIS A  20      16.943   4.412  12.151  1.00  1.900          C  
ATOM    338  CE1 HIS A  20      18.194   6.214  12.082  1.00  1.900          C  
ATOM    339  NE2 HIS A  20      16.953   5.784  12.218  1.00  1.900          N  
ATOM    340  H   HIS A  20      20.095   4.238  10.412  1.00  1.520          H  
ATOM    341  HA  HIS A  20      19.641   1.407  10.346  1.00  1.670          H  
ATOM    342 1HB  HIS A  20      18.125   1.941  12.230  1.00  2.280          H  
ATOM    343 2HB  HIS A  20      19.729   2.647  12.425  1.00  2.280          H  
ATOM    344  HD2 HIS A  20      16.071   3.762  12.225  1.00  2.280          H  
ATOM    345  HE1 HIS A  20      18.515   7.251  12.096  1.00  2.280          H  
ATOM    346  HE2 HIS A  20      16.134   6.366  12.350  1.00  2.280          H  
ATOM    347  N   VAL A  21      17.457   3.322   8.851  1.00  1.060          N  
ATOM    348  CA  VAL A  21      16.227   3.252   8.072  1.00  0.910          C  
ATOM    349  C   VAL A  21      16.472   2.272   6.947  1.00  0.630          C  
ATOM    350  O   VAL A  21      15.609   1.469   6.603  1.00  0.650          O  
ATOM    351  CB  VAL A  21      15.799   4.617   7.489  1.00  1.330          C  
ATOM    352  CG1 VAL A  21      14.565   4.422   6.563  1.00  1.330          C  
ATOM    353  CG2 VAL A  21      15.486   5.590   8.619  1.00  1.330          C  
ATOM    354  H   VAL A  21      18.008   4.189   8.839  1.00  1.270          H  
ATOM    355  HA  VAL A  21      15.425   2.875   8.708  1.00  1.090          H  
ATOM    356  HB  VAL A  21      16.612   5.019   6.881  1.00  1.600          H  
ATOM    357 1HG1 VAL A  21      14.271   5.367   6.149  1.00  1.600          H  
ATOM    358 2HG1 VAL A  21      14.788   3.741   5.758  1.00  1.600          H  
ATOM    359 3HG1 VAL A  21      13.741   4.015   7.147  1.00  1.600          H  
ATOM    360 1HG2 VAL A  21      15.193   6.552   8.203  1.00  1.600          H  
ATOM    361 2HG2 VAL A  21      14.676   5.194   9.226  1.00  1.600          H  
ATOM    362 3HG2 VAL A  21      16.373   5.720   9.239  1.00  1.600          H  
ATOM    363  N   PHE A  22      17.640   2.408   6.329  1.00  0.710          N  
ATOM    364  CA  PHE A  22      18.067   1.544   5.252  1.00  0.740          C  
ATOM    365  C   PHE A  22      18.158   0.099   5.733  1.00  0.710          C  
ATOM    366  O   PHE A  22      17.552  -0.801   5.145  1.00  0.790          O  
ATOM    367  CB  PHE A  22      19.391   2.042   4.697  1.00  1.020          C  
ATOM    368  CG  PHE A  22      19.934   1.264   3.562  1.00  1.020          C  
ATOM    369  CD1 PHE A  22      19.491   1.524   2.274  1.00  1.020          C  
ATOM    370  CD2 PHE A  22      20.884   0.278   3.755  1.00  1.020          C  
ATOM    371  CE1 PHE A  22      19.979   0.826   1.207  1.00  1.020          C  
ATOM    372  CE2 PHE A  22      21.374  -0.431   2.686  1.00  1.020          C  
ATOM    373  CZ  PHE A  22      20.922  -0.157   1.408  1.00  1.020          C  
ATOM    374  H   PHE A  22      18.256   3.146   6.646  1.00  0.850          H  
ATOM    375  HA  PHE A  22      17.338   1.580   4.469  1.00  0.890          H  
ATOM    376 1HB  PHE A  22      19.237   3.057   4.358  1.00  1.230          H  
ATOM    377 2HB  PHE A  22      20.141   2.074   5.483  1.00  1.230          H  
ATOM    378  HD1 PHE A  22      18.751   2.296   2.109  1.00  1.230          H  
ATOM    379  HD2 PHE A  22      21.241   0.066   4.762  1.00  1.230          H  
ATOM    380  HE1 PHE A  22      19.619   1.054   0.192  1.00  1.230          H  
ATOM    381  HE2 PHE A  22      22.120  -1.210   2.845  1.00  1.230          H  
ATOM    382  HZ  PHE A  22      21.309  -0.717   0.562  1.00  1.230          H  
ATOM    383  N   ARG A  23      18.864  -0.135   6.848  1.00  0.670          N  
ATOM    384  CA  ARG A  23      19.013  -1.501   7.356  1.00  0.760          C  
ATOM    385  C   ARG A  23      17.659  -2.146   7.667  1.00  0.720          C  
ATOM    386  O   ARG A  23      17.446  -3.333   7.408  1.00  1.020          O  
ATOM    387  CB  ARG A  23      19.873  -1.553   8.609  1.00  1.030          C  
ATOM    388  CG  ARG A  23      21.357  -1.276   8.400  1.00  1.030          C  
ATOM    389  CD  ARG A  23      22.174  -1.682   9.592  1.00  1.030          C  
ATOM    390  NE  ARG A  23      21.846  -0.931  10.816  1.00  1.030          N  
ATOM    391  CZ  ARG A  23      22.400   0.241  11.208  1.00  1.030          C  
ATOM    392  NH1 ARG A  23      23.316   0.839  10.478  1.00  1.030          N  
ATOM    393  NH2 ARG A  23      22.016   0.783  12.354  1.00  1.030          N  
ATOM    394  H   ARG A  23      19.343   0.642   7.314  1.00  0.800          H  
ATOM    395  HA  ARG A  23      19.505  -2.095   6.585  1.00  0.910          H  
ATOM    396 1HB  ARG A  23      19.499  -0.818   9.319  1.00  1.230          H  
ATOM    397 2HB  ARG A  23      19.776  -2.532   9.073  1.00  1.230          H  
ATOM    398 1HG  ARG A  23      21.711  -1.832   7.533  1.00  1.230          H  
ATOM    399 2HG  ARG A  23      21.503  -0.210   8.229  1.00  1.230          H  
ATOM    400 1HD  ARG A  23      21.992  -2.738   9.792  1.00  1.230          H  
ATOM    401 2HD  ARG A  23      23.229  -1.546   9.373  1.00  1.230          H  
ATOM    402  HE  ARG A  23      21.155  -1.340  11.431  1.00  1.230          H  
ATOM    403 1HH1 ARG A  23      23.619   0.433   9.607  1.00  1.230          H  
ATOM    404 2HH1 ARG A  23      23.729   1.703  10.801  1.00  1.230          H  
ATOM    405 1HH2 ARG A  23      21.321   0.319  12.926  1.00  1.230          H  
ATOM    406 2HH2 ARG A  23      22.422   1.654  12.666  1.00  1.230          H  
ATOM    407  N   LEU A  24      16.727  -1.350   8.183  1.00  0.600          N  
ATOM    408  CA  LEU A  24      15.391  -1.787   8.537  1.00  0.890          C  
ATOM    409  C   LEU A  24      14.415  -1.795   7.372  1.00  0.920          C  
ATOM    410  O   LEU A  24      13.229  -2.043   7.582  1.00  0.920          O  
ATOM    411  CB  LEU A  24      14.798  -0.893   9.637  1.00  1.130          C  
ATOM    412  CG  LEU A  24      15.439  -0.930  11.047  1.00  1.130          C  
ATOM    413  CD1 LEU A  24      14.804   0.177  11.899  1.00  1.130          C  
ATOM    414  CD2 LEU A  24      15.186  -2.300  11.704  1.00  1.130          C  
ATOM    415  H   LEU A  24      16.974  -0.382   8.407  1.00  0.720          H  
ATOM    416  HA  LEU A  24      15.465  -2.805   8.902  1.00  1.070          H  
ATOM    417 1HB  LEU A  24      14.860   0.139   9.282  1.00  1.360          H  
ATOM    418 2HB  LEU A  24      13.763  -1.137   9.747  1.00  1.360          H  
ATOM    419  HG  LEU A  24      16.509  -0.749  10.973  1.00  1.360          H  
ATOM    420 1HD1 LEU A  24      15.245   0.168  12.894  1.00  1.360          H  
ATOM    421 2HD1 LEU A  24      14.990   1.144  11.427  1.00  1.360          H  
ATOM    422 3HD1 LEU A  24      13.732   0.009  11.977  1.00  1.360          H  
ATOM    423 1HD2 LEU A  24      15.628  -2.306  12.698  1.00  1.360          H  
ATOM    424 2HD2 LEU A  24      14.117  -2.474  11.787  1.00  1.360          H  
ATOM    425 3HD2 LEU A  24      15.634  -3.093  11.116  1.00  1.360          H  
ATOM    426  N   LYS A  25      14.849  -1.524   6.141  1.00  0.990          N  
ATOM    427  CA  LYS A  25      13.900  -1.503   5.037  1.00  1.010          C  
ATOM    428  C   LYS A  25      12.998  -2.748   5.013  1.00  0.830          C  
ATOM    429  O   LYS A  25      11.780  -2.624   4.899  1.00  0.850          O  
ATOM    430  CB  LYS A  25      14.643  -1.346   3.711  1.00  1.410          C  
ATOM    431  CG  LYS A  25      13.750  -1.266   2.480  1.00  1.410          C  
ATOM    432  CD  LYS A  25      14.576  -1.043   1.212  1.00  1.410          C  
ATOM    433  CE  LYS A  25      13.685  -1.006  -0.011  1.00  1.410          C  
ATOM    434  NZ  LYS A  25      14.437  -0.719  -1.261  1.00  1.410          N  
ATOM    435  H   LYS A  25      15.837  -1.312   5.963  1.00  1.190          H  
ATOM    436  HA  LYS A  25      13.262  -0.628   5.162  1.00  1.210          H  
ATOM    437 1HB  LYS A  25      15.247  -0.435   3.751  1.00  1.690          H  
ATOM    438 2HB  LYS A  25      15.332  -2.180   3.583  1.00  1.690          H  
ATOM    439 1HG  LYS A  25      13.182  -2.195   2.375  1.00  1.690          H  
ATOM    440 2HG  LYS A  25      13.044  -0.441   2.598  1.00  1.690          H  
ATOM    441 1HD  LYS A  25      15.118  -0.098   1.286  1.00  1.690          H  
ATOM    442 2HD  LYS A  25      15.299  -1.850   1.102  1.00  1.690          H  
ATOM    443 1HE  LYS A  25      13.186  -1.964  -0.117  1.00  1.690          H  
ATOM    444 2HE  LYS A  25      12.938  -0.240   0.131  1.00  1.690          H  
ATOM    445 1HZ  LYS A  25      13.758  -0.686  -2.043  1.00  1.690          H  
ATOM    446 2HZ  LYS A  25      14.885   0.181  -1.194  1.00  1.690          H  
ATOM    447 3HZ  LYS A  25      15.124  -1.426  -1.436  1.00  1.690          H  
ATOM    448  N   LYS A  26      13.568  -3.953   5.139  1.00  0.770          N  
ATOM    449  CA  LYS A  26      12.719  -5.152   5.101  1.00  0.730          C  
ATOM    450  C   LYS A  26      11.766  -5.205   6.298  1.00  0.740          C  
ATOM    451  O   LYS A  26      10.587  -5.555   6.164  1.00  0.800          O  
ATOM    452  CB  LYS A  26      13.575  -6.417   5.054  1.00  1.040          C  
ATOM    453  CG  LYS A  26      14.300  -6.629   3.728  1.00  1.040          C  
ATOM    454  CD  LYS A  26      15.153  -7.899   3.752  1.00  1.040          C  
ATOM    455  CE  LYS A  26      15.881  -8.114   2.425  1.00  1.040          C  
ATOM    456  NZ  LYS A  26      16.746  -9.332   2.453  1.00  1.040          N  
ATOM    457  H   LYS A  26      14.572  -4.018   5.244  1.00  0.920          H  
ATOM    458  HA  LYS A  26      12.110  -5.112   4.195  1.00  0.880          H  
ATOM    459 1HB  LYS A  26      14.322  -6.379   5.847  1.00  1.250          H  
ATOM    460 2HB  LYS A  26      12.943  -7.286   5.238  1.00  1.250          H  
ATOM    461 1HG  LYS A  26      13.561  -6.708   2.928  1.00  1.250          H  
ATOM    462 2HG  LYS A  26      14.935  -5.768   3.523  1.00  1.250          H  
ATOM    463 1HD  LYS A  26      15.891  -7.828   4.552  1.00  1.250          H  
ATOM    464 2HD  LYS A  26      14.515  -8.761   3.947  1.00  1.250          H  
ATOM    465 1HE  LYS A  26      15.146  -8.223   1.629  1.00  1.250          H  
ATOM    466 2HE  LYS A  26      16.504  -7.245   2.214  1.00  1.250          H  
ATOM    467 1HZ  LYS A  26      17.208  -9.438   1.560  1.00  1.250          H  
ATOM    468 2HZ  LYS A  26      17.441  -9.238   3.181  1.00  1.250          H  
ATOM    469 3HZ  LYS A  26      16.178 -10.147   2.635  1.00  1.250          H  
ATOM    470  N   TRP A  27      12.280  -4.835   7.470  1.00  0.740          N  
ATOM    471  CA  TRP A  27      11.498  -4.829   8.695  1.00  0.820          C  
ATOM    472  C   TRP A  27      10.310  -3.893   8.613  1.00  0.900          C  
ATOM    473  O   TRP A  27       9.192  -4.278   8.975  1.00  1.160          O  
ATOM    474  CB  TRP A  27      12.382  -4.439   9.879  1.00  1.120          C  
ATOM    475  CG  TRP A  27      11.641  -4.260  11.152  1.00  1.120          C  
ATOM    476  CD1 TRP A  27      11.301  -5.221  12.045  1.00  1.120          C  
ATOM    477  CD2 TRP A  27      11.156  -3.011  11.704  1.00  1.120          C  
ATOM    478  NE1 TRP A  27      10.636  -4.666  13.104  1.00  1.120          N  
ATOM    479  CE2 TRP A  27      10.543  -3.312  12.909  1.00  1.120          C  
ATOM    480  CE3 TRP A  27      11.201  -1.683  11.276  1.00  1.120          C  
ATOM    481  CZ2 TRP A  27       9.972  -2.335  13.697  1.00  1.120          C  
ATOM    482  CZ3 TRP A  27      10.636  -0.711  12.059  1.00  1.120          C  
ATOM    483  CH2 TRP A  27      10.035  -1.023  13.239  1.00  1.120          C  
ATOM    484  H   TRP A  27      13.257  -4.577   7.502  1.00  0.890          H  
ATOM    485  HA  TRP A  27      11.123  -5.836   8.864  1.00  0.980          H  
ATOM    486 1HB  TRP A  27      13.138  -5.204  10.032  1.00  1.340          H  
ATOM    487 2HB  TRP A  27      12.899  -3.516   9.657  1.00  1.340          H  
ATOM    488  HD1 TRP A  27      11.524  -6.281  11.934  1.00  1.340          H  
ATOM    489  HE1 TRP A  27      10.274  -5.169  13.901  1.00  1.340          H  
ATOM    490  HE3 TRP A  27      11.672  -1.423  10.344  1.00  1.340          H  
ATOM    491  HZ2 TRP A  27       9.488  -2.567  14.645  1.00  1.340          H  
ATOM    492  HZ3 TRP A  27      10.687   0.316  11.715  1.00  1.340          H  
ATOM    493  HH2 TRP A  27       9.596  -0.225  13.838  1.00  1.340          H  
ATOM    494  N   ILE A  28      10.536  -2.665   8.145  1.00  0.820          N  
ATOM    495  CA  ILE A  28       9.444  -1.723   8.099  1.00  1.100          C  
ATOM    496  C   ILE A  28       8.426  -2.170   7.061  1.00  1.000          C  
ATOM    497  O   ILE A  28       7.232  -2.014   7.286  1.00  0.810          O  
ATOM    498  CB  ILE A  28       9.921  -0.255   7.886  1.00  1.430          C  
ATOM    499  CG1 ILE A  28       8.792   0.760   8.207  1.00  1.430          C  
ATOM    500  CG2 ILE A  28      10.399  -0.004   6.473  1.00  1.430          C  
ATOM    501  CD1 ILE A  28       8.323   0.846   9.645  1.00  1.430          C  
ATOM    502  H   ILE A  28      11.478  -2.406   7.859  1.00  0.980          H  
ATOM    503  HA  ILE A  28       8.962  -1.760   9.066  1.00  1.320          H  
ATOM    504  HB  ILE A  28      10.750  -0.062   8.562  1.00  1.710          H  
ATOM    505 1HG1 ILE A  28       9.139   1.735   7.919  1.00  1.710          H  
ATOM    506 2HG1 ILE A  28       7.941   0.510   7.615  1.00  1.710          H  
ATOM    507 1HG2 ILE A  28      10.753   1.019   6.392  1.00  1.710          H  
ATOM    508 2HG2 ILE A  28      11.204  -0.675   6.261  1.00  1.710          H  
ATOM    509 3HG2 ILE A  28       9.596  -0.155   5.757  1.00  1.710          H  
ATOM    510 1HD1 ILE A  28       7.540   1.600   9.712  1.00  1.710          H  
ATOM    511 2HD1 ILE A  28       7.928  -0.092   9.990  1.00  1.710          H  
ATOM    512 3HD1 ILE A  28       9.150   1.138  10.272  1.00  1.710          H  
ATOM    513  N   GLN A  29       8.857  -2.776   5.943  1.00  1.150          N  
ATOM    514  CA  GLN A  29       7.875  -3.247   4.970  1.00  1.100          C  
ATOM    515  C   GLN A  29       6.932  -4.264   5.610  1.00  0.920          C  
ATOM    516  O   GLN A  29       5.720  -4.204   5.385  1.00  0.750          O  
ATOM    517  CB  GLN A  29       8.565  -3.866   3.760  1.00  1.560          C  
ATOM    518  CG  GLN A  29       9.277  -2.873   2.860  1.00  1.560          C  
ATOM    519  CD  GLN A  29      10.098  -3.568   1.800  1.00  1.560          C  
ATOM    520  OE1 GLN A  29      10.387  -4.763   1.912  1.00  1.560          O  
ATOM    521  NE2 GLN A  29      10.472  -2.837   0.767  1.00  1.560          N  
ATOM    522  H   GLN A  29       9.862  -2.855   5.749  1.00  1.380          H  
ATOM    523  HA  GLN A  29       7.282  -2.406   4.634  1.00  1.320          H  
ATOM    524 1HB  GLN A  29       9.305  -4.588   4.107  1.00  1.870          H  
ATOM    525 2HB  GLN A  29       7.834  -4.408   3.162  1.00  1.870          H  
ATOM    526 1HG  GLN A  29       8.532  -2.271   2.354  1.00  1.870          H  
ATOM    527 2HG  GLN A  29       9.918  -2.234   3.448  1.00  1.870          H  
ATOM    528 1HE2 GLN A  29      11.011  -3.249   0.033  1.00  1.870          H  
ATOM    529 2HE2 GLN A  29      10.212  -1.872   0.713  1.00  1.870          H  
ATOM    530  N   LYS A  30       7.471  -5.166   6.446  1.00  1.010          N  
ATOM    531  CA  LYS A  30       6.621  -6.137   7.132  1.00  0.980          C  
ATOM    532  C   LYS A  30       5.632  -5.431   8.070  1.00  0.740          C  
ATOM    533  O   LYS A  30       4.445  -5.773   8.088  1.00  0.700          O  
ATOM    534  CB  LYS A  30       7.472  -7.145   7.903  1.00  1.380          C  
ATOM    535  CG  LYS A  30       8.245  -8.121   7.010  1.00  1.380          C  
ATOM    536  CD  LYS A  30       9.104  -9.079   7.834  1.00  1.380          C  
ATOM    537  CE  LYS A  30       9.893 -10.032   6.943  1.00  1.380          C  
ATOM    538  NZ  LYS A  30      10.764 -10.946   7.740  1.00  1.380          N  
ATOM    539  H   LYS A  30       8.496  -5.203   6.542  1.00  1.210          H  
ATOM    540  HA  LYS A  30       6.042  -6.674   6.380  1.00  1.180          H  
ATOM    541 1HB  LYS A  30       8.198  -6.609   8.516  1.00  1.660          H  
ATOM    542 2HB  LYS A  30       6.836  -7.721   8.575  1.00  1.660          H  
ATOM    543 1HG  LYS A  30       7.540  -8.693   6.408  1.00  1.660          H  
ATOM    544 2HG  LYS A  30       8.890  -7.554   6.338  1.00  1.660          H  
ATOM    545 1HD  LYS A  30       9.805  -8.499   8.439  1.00  1.660          H  
ATOM    546 2HD  LYS A  30       8.467  -9.659   8.500  1.00  1.660          H  
ATOM    547 1HE  LYS A  30       9.198 -10.630   6.355  1.00  1.660          H  
ATOM    548 2HE  LYS A  30      10.519  -9.449   6.264  1.00  1.660          H  
ATOM    549 1HZ  LYS A  30      11.270 -11.561   7.117  1.00  1.660          H  
ATOM    550 2HZ  LYS A  30      11.422 -10.402   8.280  1.00  1.660          H  
ATOM    551 3HZ  LYS A  30      10.194 -11.500   8.364  1.00  1.660          H  
ATOM    552  N   VAL A  31       6.107  -4.408   8.792  1.00  0.640          N  
ATOM    553  CA  VAL A  31       5.269  -3.638   9.714  1.00  0.580          C  
ATOM    554  C   VAL A  31       4.129  -2.946   8.966  1.00  0.400          C  
ATOM    555  O   VAL A  31       2.984  -2.944   9.423  1.00  0.570          O  
ATOM    556  CB  VAL A  31       6.125  -2.585  10.456  1.00  0.840          C  
ATOM    557  CG1 VAL A  31       5.260  -1.642  11.246  1.00  0.840          C  
ATOM    558  CG2 VAL A  31       7.104  -3.281  11.393  1.00  0.840          C  
ATOM    559  H   VAL A  31       7.115  -4.216   8.735  1.00  0.770          H  
ATOM    560  HA  VAL A  31       4.843  -4.323  10.448  1.00  0.700          H  
ATOM    561  HB  VAL A  31       6.665  -2.007   9.728  1.00  1.000          H  
ATOM    562 1HG1 VAL A  31       5.886  -0.909  11.749  1.00  1.000          H  
ATOM    563 2HG1 VAL A  31       4.568  -1.122  10.590  1.00  1.000          H  
ATOM    564 3HG1 VAL A  31       4.698  -2.211  11.986  1.00  1.000          H  
ATOM    565 1HG2 VAL A  31       7.710  -2.534  11.890  1.00  1.000          H  
ATOM    566 2HG2 VAL A  31       6.553  -3.857  12.134  1.00  1.000          H  
ATOM    567 3HG2 VAL A  31       7.745  -3.946  10.840  1.00  1.000          H  
ATOM    568  N   ILE A  32       4.452  -2.357   7.824  1.00  0.330          N  
ATOM    569  CA  ILE A  32       3.495  -1.653   6.993  1.00  0.520          C  
ATOM    570  C   ILE A  32       2.418  -2.615   6.503  1.00  0.540          C  
ATOM    571  O   ILE A  32       1.228  -2.266   6.525  1.00  0.720          O  
ATOM    572  CB  ILE A  32       4.230  -1.003   5.825  1.00  0.650          C  
ATOM    573  CG1 ILE A  32       5.138   0.085   6.380  1.00  0.650          C  
ATOM    574  CG2 ILE A  32       3.184  -0.376   4.859  1.00  0.650          C  
ATOM    575  CD1 ILE A  32       6.185   0.520   5.416  1.00  0.650          C  
ATOM    576  H   ILE A  32       5.437  -2.378   7.544  1.00  0.400          H  
ATOM    577  HA  ILE A  32       3.022  -0.874   7.590  1.00  0.620          H  
ATOM    578  HB  ILE A  32       4.844  -1.734   5.303  1.00  0.780          H  
ATOM    579 1HG1 ILE A  32       4.525   0.943   6.633  1.00  0.780          H  
ATOM    580 2HG1 ILE A  32       5.611  -0.256   7.287  1.00  0.780          H  
ATOM    581 1HG2 ILE A  32       3.662   0.122   4.045  1.00  0.780          H  
ATOM    582 2HG2 ILE A  32       2.526  -1.141   4.455  1.00  0.780          H  
ATOM    583 3HG2 ILE A  32       2.585   0.351   5.409  1.00  0.780          H  
ATOM    584 1HD1 ILE A  32       6.763   1.286   5.868  1.00  0.780          H  
ATOM    585 2HD1 ILE A  32       6.827  -0.307   5.175  1.00  0.780          H  
ATOM    586 3HD1 ILE A  32       5.746   0.874   4.541  1.00  0.780          H  
ATOM    587  N   ASP A  33       2.818  -3.807   6.012  1.00  0.470          N  
ATOM    588  CA  ASP A  33       1.835  -4.793   5.564  1.00  0.540          C  
ATOM    589  C   ASP A  33       0.901  -5.206   6.697  1.00  0.610          C  
ATOM    590  O   ASP A  33      -0.306  -5.347   6.485  1.00  0.810          O  
ATOM    591  CB  ASP A  33       2.501  -6.067   5.024  1.00  0.730          C  
ATOM    592  CG  ASP A  33       3.158  -5.943   3.640  1.00  0.730          C  
ATOM    593  OD1 ASP A  33       2.914  -4.985   2.934  1.00  0.730          O  
ATOM    594  OD2 ASP A  33       3.880  -6.837   3.280  1.00  0.730          O  
ATOM    595  H   ASP A  33       3.821  -4.018   5.938  1.00  0.560          H  
ATOM    596  HA  ASP A  33       1.238  -4.348   4.770  1.00  0.650          H  
ATOM    597 1HB  ASP A  33       3.274  -6.380   5.733  1.00  0.870          H  
ATOM    598 2HB  ASP A  33       1.763  -6.865   4.986  1.00  0.870          H  
ATOM    599  N   GLN A  34       1.449  -5.356   7.913  1.00  0.620          N  
ATOM    600  CA  GLN A  34       0.645  -5.719   9.079  1.00  0.870          C  
ATOM    601  C   GLN A  34      -0.366  -4.625   9.412  1.00  1.020          C  
ATOM    602  O   GLN A  34      -1.517  -4.917   9.744  1.00  1.260          O  
ATOM    603  CB  GLN A  34       1.546  -5.973  10.290  1.00  1.120          C  
ATOM    604  CG  GLN A  34       2.390  -7.235  10.194  1.00  1.120          C  
ATOM    605  CD  GLN A  34       3.409  -7.326  11.312  1.00  1.120          C  
ATOM    606  OE1 GLN A  34       3.644  -6.342  12.022  1.00  1.120          O  
ATOM    607  NE2 GLN A  34       4.015  -8.494  11.477  1.00  1.120          N  
ATOM    608  H   GLN A  34       2.467  -5.275   8.006  1.00  0.740          H  
ATOM    609  HA  GLN A  34       0.096  -6.630   8.849  1.00  1.040          H  
ATOM    610 1HB  GLN A  34       2.222  -5.131  10.414  1.00  1.340          H  
ATOM    611 2HB  GLN A  34       0.937  -6.035  11.189  1.00  1.340          H  
ATOM    612 1HG  GLN A  34       1.728  -8.095  10.271  1.00  1.340          H  
ATOM    613 2HG  GLN A  34       2.907  -7.259   9.245  1.00  1.340          H  
ATOM    614 1HE2 GLN A  34       4.696  -8.607  12.202  1.00  1.340          H  
ATOM    615 2HE2 GLN A  34       3.792  -9.266  10.880  1.00  1.340          H  
ATOM    616  N   PHE A  35       0.061  -3.362   9.293  1.00  0.990          N  
ATOM    617  CA  PHE A  35      -0.813  -2.224   9.548  1.00  1.260          C  
ATOM    618  C   PHE A  35      -1.816  -2.031   8.409  1.00  1.170          C  
ATOM    619  O   PHE A  35      -2.934  -1.559   8.634  1.00  1.460          O  
ATOM    620  CB  PHE A  35      -0.010  -0.931   9.694  1.00  1.660          C  
ATOM    621  CG  PHE A  35       0.892  -0.829  10.898  1.00  1.660          C  
ATOM    622  CD1 PHE A  35       0.880  -1.758  11.948  1.00  1.660          C  
ATOM    623  CD2 PHE A  35       1.756   0.247  10.989  1.00  1.660          C  
ATOM    624  CE1 PHE A  35       1.715  -1.601  13.027  1.00  1.660          C  
ATOM    625  CE2 PHE A  35       2.582   0.403  12.074  1.00  1.660          C  
ATOM    626  CZ  PHE A  35       2.563  -0.522  13.093  1.00  1.660          C  
ATOM    627  H   PHE A  35       1.054  -3.197   9.095  1.00  1.190          H  
ATOM    628  HA  PHE A  35      -1.381  -2.409  10.455  1.00  1.510          H  
ATOM    629 1HB  PHE A  35       0.605  -0.794   8.803  1.00  1.990          H  
ATOM    630 2HB  PHE A  35      -0.699  -0.095   9.734  1.00  1.990          H  
ATOM    631  HD1 PHE A  35       0.220  -2.619  11.923  1.00  1.990          H  
ATOM    632  HD2 PHE A  35       1.772   0.988  10.181  1.00  1.990          H  
ATOM    633  HE1 PHE A  35       1.703  -2.335  13.832  1.00  1.990          H  
ATOM    634  HE2 PHE A  35       3.254   1.258  12.126  1.00  1.990          H  
ATOM    635  HZ  PHE A  35       3.222  -0.400  13.950  1.00  1.990          H  
ATOM    636  N   GLY A  36      -1.418  -2.389   7.183  1.00  0.970          N  
ATOM    637  CA  GLY A  36      -2.260  -2.220   6.009  1.00  1.160          C  
ATOM    638  C   GLY A  36      -2.198  -0.791   5.483  1.00  1.190          C  
ATOM    639  O   GLY A  36      -3.191  -0.262   4.978  1.00  1.970          O  
ATOM    640  H   GLY A  36      -0.469  -2.737   7.053  1.00  1.160          H  
ATOM    641 1HA  GLY A  36      -1.929  -2.913   5.236  1.00  1.390          H  
ATOM    642 2HA  GLY A  36      -3.288  -2.479   6.258  1.00  1.390          H  
ATOM    643  N   GLU A  37      -1.033  -0.161   5.651  1.00  1.000          N  
ATOM    644  CA  GLU A  37      -0.826   1.229   5.240  1.00  1.390          C  
ATOM    645  C   GLU A  37       0.067   1.392   4.005  1.00  2.090          C  
ATOM    646  O   GLU A  37      -0.449   1.414   2.879  1.00  2.710          O  
ATOM    647  OXT GLU A  37       1.126   1.999   4.189  1.00  2.080          O  
ATOM    648  CB  GLU A  37      -0.231   2.026   6.400  1.00  1.640          C  
ATOM    649  CG  GLU A  37      -1.137   2.180   7.602  1.00  1.640          C  
ATOM    650  CD  GLU A  37      -0.479   2.935   8.741  1.00  1.640          C  
ATOM    651  OE1 GLU A  37       0.714   2.809   8.903  1.00  1.640          O  
ATOM    652  OE2 GLU A  37      -1.168   3.642   9.436  1.00  1.640          O  
ATOM    653  H   GLU A  37      -0.272  -0.714   6.058  1.00  1.200          H  
ATOM    654  HA  GLU A  37      -1.799   1.657   5.004  1.00  1.670          H  
ATOM    655 1HB  GLU A  37       0.702   1.565   6.727  1.00  1.970          H  
ATOM    656 2HB  GLU A  37      -0.013   3.029   6.052  1.00  1.970          H  
ATOM    657 1HG  GLU A  37      -2.031   2.718   7.293  1.00  1.970          H  
ATOM    658 2HG  GLU A  37      -1.448   1.196   7.938  1.00  1.970          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -209.458 19.9663 167.353 -16.3267 3.70984 10.2226 83.8927 -89.6983 -0.23082 -1.65659 -81.9195 -8.83705 -33.0542 -7.36733 0 -1.89676 0 0.81005 2.23957 17.4321 45.0006 -5.28999 0.004 -5.71984 -4.49874 17.0113 -98.3117
ASP:NtermProteinFull_1 -3.28268 0.21574 4.86424 -0.14202 0.03031 0.45057 2.31811 -2.04747 -0.01234 -0.11111 -4.13125 -1.03447 0 0 0 -0.21368 0 0.09513 0.0641 0 2.77763 0 0 -2.3716 0 0.13332 -2.39744
TRP_2 -4.00643 0.21691 4.11042 -1.27503 0.05674 0.56686 2.11004 -2.05716 -0 -0 -2.29525 -0.30577 0 0 0 0 0 0.01258 0.09647 0 1.8611 -0.3756 0 1.6906 0.23805 0.27147 0.916
PHE_3 -8.31567 1.15688 4.5462 -0.65011 0.10362 0.28113 2.75916 -2.83513 -0 -0 -2.94686 -0.08441 0 0 0 0 0 0.04667 0.22403 0 2.31655 0.00133 0 1.0402 0.16308 0.67209 -1.52124
LYS_4 -7.35893 0.67261 8.31105 -0.48962 0.18836 0.25569 3.42279 -3.48234 -0 -6e-05 -6.24484 0.06083 0 0 0 -0.94838 0 0.07662 0.15054 2.56125 0 0.0055 0 -1.5107 -0.28286 1.0179 -3.59457
ALA_5 -3.71671 0.19334 4.32326 -0.02087 0 0 2.24049 -2.21709 -0.00069 -0.01141 -1.59823 -0.35272 0 0 0 0 0 0.01733 0 0 0 -0.18118 0 1.8394 -0.35866 0.57499 0.73123
PHE_6 -6.98512 0.69085 3.9434 -0.84642 0.05106 0.23825 2.66596 -2.58653 -0 -0 -2.15483 -0.06531 0 0 0 0 0 0.00907 0.02131 0 1.73425 -0.47258 0 1.0402 -0.07342 0.24702 -2.54283
TYR_7 -8.75147 1.09922 3.55616 -0.64957 0.05086 0.30191 2.81323 -2.78986 -0 -0 -2.68544 -0.25072 0 0 0 0 0 0.23926 0.13703 0 2.27687 0.03732 0.004 1.2797 -0.03517 0.62687 -2.73979
ASP_8 -4.46636 0.47477 6.64027 -0.19034 9e-05 0.62318 3.11843 -2.92796 -0.03463 -0.17248 -4.95406 -0.24304 0 0 0 0 0 -0.01082 0.00286 0 3.05501 0.32129 0 -2.3716 -0.05367 0.64742 -0.54164
LYS_9 -4.0984 0.16727 5.06938 -0.3034 0.0302 0.13573 2.22266 -2.33652 -0 -0 -2.09919 0.01719 0 0 0 0 0 -0.0251 0.01252 1.81096 0 0.03179 0 -1.5107 -0.04582 0.26139 -0.66002
VAL_10 -6.98876 0.7566 3.83121 -0.31897 0.25962 0.07283 2.871 -2.70818 -0 -0 -2.28786 -0.17629 0 0 0 0 0 -0.06658 0 0.15163 0 -0.3463 0 1.9342 -0.14387 0.22915 -2.93058
ALA_11 -5.98931 0.74705 3.6456 -0.02158 0 0 2.11035 -2.66035 -0 -0 -1.67123 -0.35607 0 0 0 0 0 0.08256 0 0 0 -0.31971 0 1.8394 -0.23815 0.38836 -2.44308
GLU_12 -3.85456 0.27946 4.71513 -0.56349 0.08727 1.00781 1.74348 -2.19095 -2e-05 -0.00026 -1.72792 -0.67358 0 0 0 0 0 -0.03356 0.0816 0 3.28936 -0.17695 0 -2.7348 -0.24201 0.3831 -0.6109
LYS_13 -4.0088 0.21409 3.52978 -0.41736 0.06019 0.2362 1.6741 -1.69607 -0 -0 -0.80438 -0.14756 0 0 0 0 0 -0.05461 0.01335 2.01009 0 -0.04579 0 -1.5107 -0.21508 0.29184 -0.87069
PHE_14 -8.66693 1.11052 3.86663 -0.57384 0.34638 0.29956 2.94311 -2.77851 -0 -0 -3.50185 -0.25733 0 0 0 0 0 -0.03241 0.02269 0 3.41634 -0.21614 0 1.0402 -0.40666 0.58735 -2.80089
LYS_15 -5.45839 0.35698 4.45638 -0.45029 0.08746 0.27401 1.78718 -1.95105 -0.01633 -0.13062 -1.40072 -0.19522 0 0 0 0 0 -0.03731 0.00995 1.73662 0 -0.06174 0 -1.5107 -0.21213 0.57178 -2.14413
GLU_16 -2.02113 0.19915 1.74728 -0.23085 0.04909 0.38257 0.04663 -0.81361 -2e-05 -0.00026 0.1471 -0.50983 0 0 0 0 0 -0.02057 0.00157 0 2.91891 0.15283 0 -2.7348 0.02721 0.3095 -0.34923
ALA_17 -3.37515 0.33217 1.18736 -0.01968 0 0 0.88221 -1.12976 -0 -0 -0.23637 -0.29681 0 0 0 0 0 0.00071 0 0 0 0.64108 0 1.8394 0.70655 0.30329 0.835
PHE_18 -6.7394 1.10709 3.33512 -0.61516 0.06339 0.37033 2.42539 -2.28952 -0 -0 -1.56761 -0.08008 0 0 0 0 0 0.79514 0.0002 0 1.92709 -0.29131 0 1.0402 0.38133 1.02298 0.8852
PRO_19 -5.42581 0.68268 4.42296 -0.08873 0.00033 0.05524 1.93266 -2.00267 -0.01633 -0.13062 -1.67341 0.69122 0 0 0 0 0 -0.06649 0.00211 0.61198 0 -0.49728 0 -2.4119 -0.53349 1.12098 -3.32658
HIS_20 -6.62383 0.50768 5.56906 -0.76513 0.02027 0.83414 1.9002 -2.90062 -0 -0 -0.95796 -2.40715 0 0 0 0 0 -0.03659 0.31058 0 1.94051 -0.06447 0 -0.45461 -0.39646 0.44644 -3.07793
VAL_21 -6.37833 0.43769 3.52288 -0.30681 0.22491 0.07138 1.92506 -2.47619 -0 -0 -0.79526 -0.26309 0 0 0 0 0 -0.00961 0.02958 0.14906 0 -0.34149 0 1.9342 -0.22637 0.48739 -2.01499
PHE_22 -7.21824 0.8124 4.74359 -0.81869 0.03765 0.23009 1.96604 -2.61533 -0.0053 -0.05542 -1.2225 -0.06611 0 0 0 0 0 -0.00043 0.07665 0 1.80159 -0.40751 0 1.0402 -0.00484 0.44103 -1.26513
ARG_23 -4.6067 0.20411 4.85674 -0.74908 0.09143 0.47701 1.47946 -2.2673 -0 -0 -0.55741 0.35894 0 0 0 0 0 -0.03643 0.04967 1.47865 0 -0.17104 0 -1.2888 -0.21709 0.34478 -0.55309
LEU_24 -6.34574 0.57681 4.85557 -0.51915 0.21748 0.16538 2.9293 -2.66491 -0.01976 -0.12257 -2.82198 0.1133 0 0 0 0 0 -0.07199 0.12173 0.06011 0 -0.06169 0 0.18072 -0.40963 0.50482 -3.31223
LYS_25 -6.11939 0.8032 7.22275 -0.41251 0.05621 0.21186 3.66194 -3.22537 -0.03394 -0.16107 -4.67603 -0.09019 0 0 0 0 0 -0.02066 0.02958 1.7243 0 -0.03014 0 -1.5107 -0.05478 0.51321 -2.11172
LYS_26 -3.44074 0.18978 3.97994 -0.29754 0.02672 0.13039 1.30615 -1.85482 -0.0191 -0.17584 -0.86022 -0.03932 0 0 0 0 0 -0.00112 0.00181 1.76474 0 -0.01123 0 -1.5107 -0.0979 0.23726 -0.67173
TRP_27 -7.01722 0.68764 3.29837 -1.31864 0.08559 0.50782 2.12984 -2.39283 -0 -0 -1.28189 -0.36525 0 0 0 0 0 -0.01638 0.12658 0 1.69873 -0.29169 0 1.6906 -0.19073 0.14226 -2.50721
ILE_28 -8.86013 1.10719 4.07184 -0.69253 0.37259 0.24088 3.00473 -2.99573 -0 -0 -2.48323 0.34633 0 0 0 0 0 0.00532 0.03479 1.01081 0 -0.08025 0 0.73287 -0.07034 0.65807 -3.59679
GLN_29 -7.09713 0.54553 6.88191 -0.26527 0.04835 0.20317 2.69245 -3.14634 -0.03356 -0.24306 -1.76458 -0.47263 0 0 0 0 0 0.08838 0.07345 0 2.71975 -0.08813 0 -0.18838 -0.19038 0.71717 0.48071
LYS_30 -4.80761 0.31299 5.64917 -0.29825 0.02762 0.13046 2.52097 -2.6142 -0 -0 -2.35063 -0.00253 0 0 0 0 0 0.0156 0.00264 1.74657 0 0.00812 0 -1.5107 -0.31331 0.27616 -1.20692
VAL_31 -7.34418 0.60806 4.15679 -0.30945 0.22376 0.07009 2.89125 -2.86597 -0.01323 -0.11534 -2.09503 -0.05898 0 0 0 0 0 -0.05495 0.00459 0.0875 0 -0.24944 0 1.9342 -0.27641 0.23507 -3.17168
ILE_32 -10.0796 1.37988 5.67633 -0.52451 0.39866 0.10518 3.28866 -3.63222 -0 -0 -3.2372 -0.00555 0 0 0 0 0 0.00487 0.27215 0.52788 0 -0.43108 0 0.73287 -0.06014 0.47163 -5.11219
ASP_33 -4.1489 0.14206 6.32132 -0.10543 0.00672 0.31905 2.7506 -2.76638 -0.01234 -0.11111 -3.34262 -0.35901 0 0 0 -0.7347 0 0.03517 0.03809 0 1.68261 0.17771 0 -2.3716 -0.12814 0.56133 -2.04557
GLN_34 -3.78183 0.26764 3.96987 -0.26455 0.04871 0.20565 1.47076 -1.94712 -0.01323 -0.11534 -0.93925 -0.48532 0 0 0 0 0 0.06402 0.08945 0 2.7263 -0.12422 0 -0.18838 -0.28052 0.32507 1.02771
PHE_35 -4.991 0.30756 3.43479 -0.55485 0.29276 0.26219 1.46136 -1.93901 -0 -0 -0.86198 -0.26438 0 0 0 0 0 -0.04618 0.1189 0 3.16374 0.02778 0 1.0402 -0.16941 0.32111 1.60358
GLY_36 -1.84015 0.09874 2.45354 -5e-05 0 0 1.14844 -1.16264 -0 -0 -0.87841 -0.38397 0 0 0 0 0 -0.13659 0 0 0 -1.35779 0 0.83697 -0.06032 0.25096 -1.03128
GLU:CtermProteinFull_37 -5.24689 0.30389 6.5865 -0.25693 0.06545 0.50601 3.27848 -2.73065 -0 -0 -6.95915 -0.1322 0 0 0 0 0 0 0.01899 0 3.69421 0 0 -2.7348 -0.02718 0.41678 -3.21747
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691860 DOMAINID 682971 MODEL 4 pep6_AB
MODEL     4
REMARK    Rerank model02.pdb to model04.pdb score: 16.092
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 8 cluster_threshold: 1.575896
REMARK    SCORE     cart_bonded:          47.747
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE         fa_elec:         -75.790
REMARK    SCORE             ref:           6.830
REMARK    SCORE         p_aa_pp:          -5.195
REMARK    SCORE          fa_dun:          55.928
REMARK    SCORE          fa_atr:        -219.403
REMARK    SCORE          fa_rep:          21.718
REMARK    SCORE     total_score:         -60.799
REMARK    SCORE    fa_intra_rep:           0.493
REMARK    SCORE     hbond_sr_bb:         -30.537
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE     hbond_bb_sc:          -7.279
REMARK    SCORE           score:         -60.799
REMARK    SCORE           omega:           7.386
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     lk_ball_wtd:          -6.326
REMARK    SCORE     rama_prepro:          -5.267
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE          fa_sol:         144.704
REMARK    SCORE            time:           0.000
REMARK    SCORE        hbond_sc:          -4.423
REMARK    SCORE     description: cluster0002_0001
REMARK    SCORE fa_intra_sol_xover4:           8.615
REMARK    SCORE       dslf_fa13:           0.000
ATOM      1  N   ASP A   1      -0.250  -0.436   1.063  1.00  1.930          N  
ATOM      2  CA  ASP A   1       1.039  -0.275   0.402  1.00  1.150          C  
ATOM      3  C   ASP A   1       1.544   1.162   0.455  1.00  0.950          C  
ATOM      4  O   ASP A   1       2.562   1.440   1.100  1.00  0.930          O  
ATOM      5  CB  ASP A   1       0.942  -0.719  -1.058  1.00  1.920          C  
ATOM      6  CG  ASP A   1       0.683  -2.186  -1.161  1.00  1.920          C  
ATOM      7  OD1 ASP A   1       0.777  -2.835  -0.147  1.00  1.920          O  
ATOM      8  OD2 ASP A   1       0.380  -2.646  -2.220  1.00  1.920          O  
ATOM      9 1H   ASP A   1      -0.467  -1.427   1.079  1.00  2.320          H  
ATOM     10 2H   ASP A   1      -0.195  -0.091   2.023  1.00  2.320          H  
ATOM     11 3H   ASP A   1      -0.972   0.055   0.565  1.00  2.320          H  
ATOM     12  HA  ASP A   1       1.766  -0.907   0.913  1.00  1.380          H  
ATOM     13 1HB  ASP A   1       0.140  -0.188  -1.563  1.00  2.310          H  
ATOM     14 2HB  ASP A   1       1.872  -0.483  -1.577  1.00  2.310          H  
ATOM     15  N   TRP A   2       0.830   2.085  -0.201  1.00  0.830          N  
ATOM     16  CA  TRP A   2       1.282   3.473  -0.212  1.00  0.710          C  
ATOM     17  C   TRP A   2       1.305   4.130   1.141  1.00  0.610          C  
ATOM     18  O   TRP A   2       2.276   4.798   1.483  1.00  0.580          O  
ATOM     19  CB  TRP A   2       0.438   4.329  -1.141  1.00  1.040          C  
ATOM     20  CG  TRP A   2       0.902   4.296  -2.520  1.00  1.040          C  
ATOM     21  CD1 TRP A   2       0.291   3.774  -3.616  1.00  1.040          C  
ATOM     22  CD2 TRP A   2       2.152   4.839  -2.971  1.00  1.040          C  
ATOM     23  NE1 TRP A   2       1.078   3.965  -4.722  1.00  1.040          N  
ATOM     24  CE2 TRP A   2       2.223   4.618  -4.338  1.00  1.040          C  
ATOM     25  CE3 TRP A   2       3.206   5.492  -2.323  1.00  1.040          C  
ATOM     26  CZ2 TRP A   2       3.309   5.027  -5.084  1.00  1.040          C  
ATOM     27  CZ3 TRP A   2       4.286   5.902  -3.059  1.00  1.040          C  
ATOM     28  CH2 TRP A   2       4.342   5.679  -4.408  1.00  1.040          C  
ATOM     29  H   TRP A   2       0.000   1.835  -0.719  1.00  1.000          H  
ATOM     30  HA  TRP A   2       2.300   3.474  -0.593  1.00  0.850          H  
ATOM     31 1HB  TRP A   2      -0.595   3.992  -1.116  1.00  1.250          H  
ATOM     32 2HB  TRP A   2       0.453   5.346  -0.804  1.00  1.250          H  
ATOM     33  HD1 TRP A   2      -0.681   3.282  -3.620  1.00  1.250          H  
ATOM     34  HE1 TRP A   2       0.854   3.674  -5.664  1.00  1.250          H  
ATOM     35  HE3 TRP A   2       3.169   5.676  -1.247  1.00  1.250          H  
ATOM     36  HZ2 TRP A   2       3.370   4.857  -6.158  1.00  1.250          H  
ATOM     37  HZ3 TRP A   2       5.095   6.411  -2.542  1.00  1.250          H  
ATOM     38  HH2 TRP A   2       5.213   6.017  -4.967  1.00  1.250          H  
ATOM     39  N   PHE A   3       0.292   3.904   1.963  1.00  0.670          N  
ATOM     40  CA  PHE A   3       0.324   4.570   3.248  1.00  0.730          C  
ATOM     41  C   PHE A   3       1.560   4.181   4.048  1.00  0.730          C  
ATOM     42  O   PHE A   3       2.225   5.069   4.601  1.00  0.720          O  
ATOM     43  CB  PHE A   3      -0.939   4.285   4.035  1.00  1.000          C  
ATOM     44  CG  PHE A   3      -2.188   5.052   3.685  1.00  1.000          C  
ATOM     45  CD1 PHE A   3      -2.198   6.240   2.927  1.00  1.000          C  
ATOM     46  CD2 PHE A   3      -3.390   4.588   4.179  1.00  1.000          C  
ATOM     47  CE1 PHE A   3      -3.373   6.902   2.686  1.00  1.000          C  
ATOM     48  CE2 PHE A   3      -4.562   5.259   3.933  1.00  1.000          C  
ATOM     49  CZ  PHE A   3      -4.553   6.414   3.188  1.00  1.000          C  
ATOM     50  H   PHE A   3      -0.488   3.325   1.693  1.00  0.800          H  
ATOM     51  HA  PHE A   3       0.406   5.628   3.083  1.00  0.880          H  
ATOM     52 1HB  PHE A   3      -1.170   3.228   3.931  1.00  1.200          H  
ATOM     53 2HB  PHE A   3      -0.737   4.449   5.060  1.00  1.200          H  
ATOM     54  HD1 PHE A   3      -1.297   6.654   2.522  1.00  1.200          H  
ATOM     55  HD2 PHE A   3      -3.401   3.671   4.780  1.00  1.200          H  
ATOM     56  HE1 PHE A   3      -3.372   7.820   2.097  1.00  1.200          H  
ATOM     57  HE2 PHE A   3      -5.504   4.876   4.331  1.00  1.200          H  
ATOM     58  HZ  PHE A   3      -5.486   6.943   2.995  1.00  1.200          H  
ATOM     59  N   LYS A   4       1.922   2.886   4.065  1.00  0.820          N  
ATOM     60  CA  LYS A   4       3.123   2.490   4.772  1.00  0.860          C  
ATOM     61  C   LYS A   4       4.336   3.169   4.156  1.00  0.720          C  
ATOM     62  O   LYS A   4       5.175   3.690   4.886  1.00  0.680          O  
ATOM     63  CB  LYS A   4       3.329   0.976   4.706  1.00  1.190          C  
ATOM     64  CG  LYS A   4       4.564   0.424   5.467  1.00  1.190          C  
ATOM     65  CD  LYS A   4       4.427   0.611   6.989  1.00  1.190          C  
ATOM     66  CE  LYS A   4       5.374  -0.328   7.780  1.00  1.190          C  
ATOM     67  NZ  LYS A   4       6.833   0.046   7.668  1.00  1.190          N  
ATOM     68  H   LYS A   4       1.317   2.162   3.669  1.00  0.980          H  
ATOM     69  HA  LYS A   4       3.030   2.806   5.813  1.00  1.030          H  
ATOM     70 1HB  LYS A   4       2.454   0.478   5.093  1.00  1.430          H  
ATOM     71 2HB  LYS A   4       3.424   0.679   3.661  1.00  1.430          H  
ATOM     72 1HG  LYS A   4       4.672  -0.636   5.246  1.00  1.430          H  
ATOM     73 2HG  LYS A   4       5.468   0.940   5.131  1.00  1.430          H  
ATOM     74 1HD  LYS A   4       4.693   1.644   7.241  1.00  1.430          H  
ATOM     75 2HD  LYS A   4       3.393   0.438   7.298  1.00  1.430          H  
ATOM     76 1HE  LYS A   4       5.089  -0.308   8.830  1.00  1.430          H  
ATOM     77 2HE  LYS A   4       5.247  -1.339   7.400  1.00  1.430          H  
ATOM     78 1HZ  LYS A   4       7.396  -0.590   8.194  1.00  1.430          H  
ATOM     79 2HZ  LYS A   4       7.183   0.067   6.704  1.00  1.430          H  
ATOM     80 3HZ  LYS A   4       7.000   0.993   8.020  1.00  1.430          H  
ATOM     81  N   ALA A   5       4.427   3.194   2.814  1.00  0.730          N  
ATOM     82  CA  ALA A   5       5.580   3.804   2.158  1.00  0.740          C  
ATOM     83  C   ALA A   5       5.736   5.273   2.525  1.00  0.630          C  
ATOM     84  O   ALA A   5       6.856   5.736   2.779  1.00  0.640          O  
ATOM     85  CB  ALA A   5       5.443   3.690   0.650  1.00  1.030          C  
ATOM     86  H   ALA A   5       3.706   2.732   2.247  1.00  0.880          H  
ATOM     87  HA  ALA A   5       6.471   3.270   2.485  1.00  0.890          H  
ATOM     88 1HB  ALA A   5       6.316   4.122   0.170  1.00  1.240          H  
ATOM     89 2HB  ALA A   5       5.350   2.641   0.374  1.00  1.240          H  
ATOM     90 3HB  ALA A   5       4.552   4.227   0.331  1.00  1.240          H  
ATOM     91  N   PHE A   6       4.616   5.997   2.598  1.00  0.600          N  
ATOM     92  CA  PHE A   6       4.658   7.410   2.935  1.00  0.650          C  
ATOM     93  C   PHE A   6       5.154   7.547   4.358  1.00  0.550          C  
ATOM     94  O   PHE A   6       6.037   8.356   4.648  1.00  0.580          O  
ATOM     95  CB  PHE A   6       3.262   8.028   2.850  1.00  0.890          C  
ATOM     96  CG  PHE A   6       2.644   8.124   1.470  1.00  0.890          C  
ATOM     97  CD1 PHE A   6       3.367   8.439   0.332  1.00  0.890          C  
ATOM     98  CD2 PHE A   6       1.300   7.879   1.333  1.00  0.890          C  
ATOM     99  CE1 PHE A   6       2.739   8.504  -0.895  1.00  0.890          C  
ATOM    100  CE2 PHE A   6       0.671   7.941   0.125  1.00  0.890          C  
ATOM    101  CZ  PHE A   6       1.392   8.253  -0.997  1.00  0.890          C  
ATOM    102  H   PHE A   6       3.728   5.557   2.338  1.00  0.720          H  
ATOM    103  HA  PHE A   6       5.355   7.919   2.276  1.00  0.780          H  
ATOM    104 1HB  PHE A   6       2.584   7.448   3.477  1.00  1.070          H  
ATOM    105 2HB  PHE A   6       3.304   9.026   3.262  1.00  1.070          H  
ATOM    106  HD1 PHE A   6       4.431   8.639   0.398  1.00  1.070          H  
ATOM    107  HD2 PHE A   6       0.740   7.634   2.214  1.00  1.070          H  
ATOM    108  HE1 PHE A   6       3.313   8.751  -1.788  1.00  1.070          H  
ATOM    109  HE2 PHE A   6      -0.397   7.742   0.050  1.00  1.070          H  
ATOM    110  HZ  PHE A   6       0.902   8.300  -1.970  1.00  1.070          H  
ATOM    111  N   TYR A   7       4.614   6.735   5.264  1.00  0.520          N  
ATOM    112  CA  TYR A   7       5.052   6.791   6.643  1.00  0.570          C  
ATOM    113  C   TYR A   7       6.531   6.526   6.791  1.00  0.420          C  
ATOM    114  O   TYR A   7       7.248   7.302   7.423  1.00  0.390          O  
ATOM    115  CB  TYR A   7       4.295   5.797   7.517  1.00  0.780          C  
ATOM    116  CG  TYR A   7       4.940   5.673   8.860  1.00  0.780          C  
ATOM    117  CD1 TYR A   7       4.780   6.638   9.779  1.00  0.780          C  
ATOM    118  CD2 TYR A   7       5.724   4.575   9.145  1.00  0.780          C  
ATOM    119  CE1 TYR A   7       5.400   6.543  10.999  1.00  0.780          C  
ATOM    120  CE2 TYR A   7       6.347   4.466  10.356  1.00  0.780          C  
ATOM    121  CZ  TYR A   7       6.190   5.445  11.286  1.00  0.780          C  
ATOM    122  OH  TYR A   7       6.819   5.329  12.502  1.00  0.780          O  
ATOM    123  H   TYR A   7       3.867   6.084   4.989  1.00  0.620          H  
ATOM    124  HA  TYR A   7       4.859   7.796   7.016  1.00  0.680          H  
ATOM    125 1HB  TYR A   7       3.259   6.121   7.649  1.00  0.930          H  
ATOM    126 2HB  TYR A   7       4.275   4.815   7.046  1.00  0.930          H  
ATOM    127  HD1 TYR A   7       4.160   7.477   9.543  1.00  0.930          H  
ATOM    128  HD2 TYR A   7       5.853   3.792   8.398  1.00  0.930          H  
ATOM    129  HE1 TYR A   7       5.254   7.331  11.728  1.00  0.930          H  
ATOM    130  HE2 TYR A   7       6.968   3.599  10.571  1.00  0.930          H  
ATOM    131  HH  TYR A   7       6.596   6.082  13.051  1.00  0.930          H  
ATOM    132  N   ASP A   8       7.015   5.419   6.229  1.00  0.420          N  
ATOM    133  CA  ASP A   8       8.410   5.075   6.426  1.00  0.440          C  
ATOM    134  C   ASP A   8       9.356   6.125   5.878  1.00  0.370          C  
ATOM    135  O   ASP A   8      10.316   6.515   6.548  1.00  0.370          O  
ATOM    136  CB  ASP A   8       8.742   3.737   5.749  1.00  0.610          C  
ATOM    137  CG  ASP A   8       8.196   2.487   6.453  1.00  0.610          C  
ATOM    138  OD1 ASP A   8       7.806   2.544   7.599  1.00  0.610          O  
ATOM    139  OD2 ASP A   8       8.165   1.432   5.842  1.00  0.610          O  
ATOM    140  H   ASP A   8       6.390   4.807   5.696  1.00  0.500          H  
ATOM    141  HA  ASP A   8       8.587   4.983   7.498  1.00  0.530          H  
ATOM    142 1HB  ASP A   8       8.328   3.756   4.734  1.00  0.730          H  
ATOM    143 2HB  ASP A   8       9.822   3.642   5.653  1.00  0.730          H  
ATOM    144  N   LYS A   9       9.068   6.646   4.688  1.00  0.380          N  
ATOM    145  CA  LYS A   9       9.972   7.621   4.110  1.00  0.430          C  
ATOM    146  C   LYS A   9       9.970   8.926   4.886  1.00  0.410          C  
ATOM    147  O   LYS A   9      11.031   9.509   5.142  1.00  0.440          O  
ATOM    148  CB  LYS A   9       9.610   7.857   2.649  1.00  0.580          C  
ATOM    149  CG  LYS A   9       9.934   6.669   1.746  1.00  0.580          C  
ATOM    150  CD  LYS A   9       9.527   6.921   0.306  1.00  0.580          C  
ATOM    151  CE  LYS A   9       9.866   5.723  -0.576  1.00  0.580          C  
ATOM    152  NZ  LYS A   9       9.477   5.945  -1.996  1.00  0.580          N  
ATOM    153  H   LYS A   9       8.247   6.323   4.166  1.00  0.460          H  
ATOM    154  HA  LYS A   9      10.982   7.216   4.152  1.00  0.520          H  
ATOM    155 1HB  LYS A   9       8.535   8.049   2.575  1.00  0.700          H  
ATOM    156 2HB  LYS A   9      10.132   8.735   2.277  1.00  0.700          H  
ATOM    157 1HG  LYS A   9      11.003   6.468   1.789  1.00  0.700          H  
ATOM    158 2HG  LYS A   9       9.404   5.791   2.116  1.00  0.700          H  
ATOM    159 1HD  LYS A   9       8.449   7.097   0.267  1.00  0.700          H  
ATOM    160 2HD  LYS A   9      10.039   7.803  -0.074  1.00  0.700          H  
ATOM    161 1HE  LYS A   9      10.938   5.539  -0.529  1.00  0.700          H  
ATOM    162 2HE  LYS A   9       9.339   4.844  -0.200  1.00  0.700          H  
ATOM    163 1HZ  LYS A   9       9.718   5.130  -2.544  1.00  0.700          H  
ATOM    164 2HZ  LYS A   9       8.481   6.104  -2.049  1.00  0.700          H  
ATOM    165 3HZ  LYS A   9       9.967   6.751  -2.360  1.00  0.700          H  
ATOM    166  N   VAL A  10       8.787   9.395   5.266  1.00  0.410          N  
ATOM    167  CA  VAL A  10       8.694  10.653   5.962  1.00  0.460          C  
ATOM    168  C   VAL A  10       9.256  10.548   7.371  1.00  0.420          C  
ATOM    169  O   VAL A  10       9.984  11.442   7.805  1.00  0.440          O  
ATOM    170  CB  VAL A  10       7.258  11.152   5.964  1.00  0.620          C  
ATOM    171  CG1 VAL A  10       7.155  12.372   6.812  1.00  0.620          C  
ATOM    172  CG2 VAL A  10       6.818  11.465   4.540  1.00  0.620          C  
ATOM    173  H   VAL A  10       7.925   8.880   5.048  1.00  0.490          H  
ATOM    174  HA  VAL A  10       9.289  11.383   5.416  1.00  0.550          H  
ATOM    175  HB  VAL A  10       6.628  10.376   6.378  1.00  0.750          H  
ATOM    176 1HG1 VAL A  10       6.135  12.736   6.826  1.00  0.750          H  
ATOM    177 2HG1 VAL A  10       7.457  12.127   7.809  1.00  0.750          H  
ATOM    178 3HG1 VAL A  10       7.807  13.150   6.418  1.00  0.750          H  
ATOM    179 1HG2 VAL A  10       5.783  11.808   4.546  1.00  0.750          H  
ATOM    180 2HG2 VAL A  10       7.459  12.241   4.126  1.00  0.750          H  
ATOM    181 3HG2 VAL A  10       6.896  10.571   3.926  1.00  0.750          H  
ATOM    182  N   ALA A  11       8.905   9.484   8.099  1.00  0.400          N  
ATOM    183  CA  ALA A  11       9.388   9.308   9.453  1.00  0.410          C  
ATOM    184  C   ALA A  11      10.917   9.276   9.490  1.00  0.400          C  
ATOM    185  O   ALA A  11      11.510   9.874  10.394  1.00  0.410          O  
ATOM    186  CB  ALA A  11       8.816   8.033  10.041  1.00  0.570          C  
ATOM    187  H   ALA A  11       8.280   8.779   7.709  1.00  0.480          H  
ATOM    188  HA  ALA A  11       9.049  10.157  10.043  1.00  0.490          H  
ATOM    189 1HB  ALA A  11       9.155   7.909  11.065  1.00  0.680          H  
ATOM    190 2HB  ALA A  11       7.730   8.088  10.018  1.00  0.680          H  
ATOM    191 3HB  ALA A  11       9.145   7.179   9.441  1.00  0.680          H  
ATOM    192  N   GLU A  12      11.572   8.626   8.511  1.00  0.390          N  
ATOM    193  CA  GLU A  12      13.033   8.627   8.520  1.00  0.420          C  
ATOM    194  C   GLU A  12      13.573  10.037   8.246  1.00  0.420          C  
ATOM    195  O   GLU A  12      14.570  10.458   8.850  1.00  0.470          O  
ATOM    196  CB  GLU A  12      13.590   7.613   7.519  1.00  0.580          C  
ATOM    197  CG  GLU A  12      13.355   6.139   7.915  1.00  0.580          C  
ATOM    198  CD  GLU A  12      14.022   5.758   9.215  1.00  0.580          C  
ATOM    199  OE1 GLU A  12      15.181   6.038   9.376  1.00  0.580          O  
ATOM    200  OE2 GLU A  12      13.357   5.196  10.065  1.00  0.580          O  
ATOM    201  H   GLU A  12      11.060   8.084   7.806  1.00  0.470          H  
ATOM    202  HA  GLU A  12      13.368   8.328   9.512  1.00  0.500          H  
ATOM    203 1HB  GLU A  12      13.113   7.774   6.546  1.00  0.690          H  
ATOM    204 2HB  GLU A  12      14.659   7.771   7.393  1.00  0.690          H  
ATOM    205 1HG  GLU A  12      12.287   5.972   8.018  1.00  0.690          H  
ATOM    206 2HG  GLU A  12      13.719   5.494   7.117  1.00  0.690          H  
ATOM    207  N   LYS A  13      12.916  10.788   7.346  1.00  0.390          N  
ATOM    208  CA  LYS A  13      13.353  12.155   7.094  1.00  0.430          C  
ATOM    209  C   LYS A  13      13.234  12.982   8.369  1.00  0.410          C  
ATOM    210  O   LYS A  13      14.127  13.775   8.666  1.00  0.480          O  
ATOM    211  CB  LYS A  13      12.557  12.809   5.961  1.00  0.590          C  
ATOM    212  CG  LYS A  13      12.874  12.269   4.561  1.00  0.590          C  
ATOM    213  CD  LYS A  13      12.005  12.938   3.488  1.00  0.590          C  
ATOM    214  CE  LYS A  13      12.301  12.381   2.100  1.00  0.590          C  
ATOM    215  NZ  LYS A  13      11.441  13.009   1.052  1.00  0.590          N  
ATOM    216  H   LYS A  13      12.146  10.383   6.800  1.00  0.470          H  
ATOM    217  HA  LYS A  13      14.404  12.135   6.809  1.00  0.520          H  
ATOM    218 1HB  LYS A  13      11.494  12.662   6.139  1.00  0.700          H  
ATOM    219 2HB  LYS A  13      12.742  13.881   5.962  1.00  0.700          H  
ATOM    220 1HG  LYS A  13      13.922  12.462   4.338  1.00  0.700          H  
ATOM    221 2HG  LYS A  13      12.717  11.198   4.540  1.00  0.700          H  
ATOM    222 1HD  LYS A  13      10.951  12.761   3.721  1.00  0.700          H  
ATOM    223 2HD  LYS A  13      12.185  14.012   3.488  1.00  0.700          H  
ATOM    224 1HE  LYS A  13      13.346  12.565   1.858  1.00  0.700          H  
ATOM    225 2HE  LYS A  13      12.122  11.304   2.105  1.00  0.700          H  
ATOM    226 1HZ  LYS A  13      11.666  12.613   0.149  1.00  0.700          H  
ATOM    227 2HZ  LYS A  13      10.469  12.833   1.263  1.00  0.700          H  
ATOM    228 3HZ  LYS A  13      11.605  14.005   1.031  1.00  0.700          H  
ATOM    229  N   PHE A  14      12.155  12.769   9.139  1.00  0.360          N  
ATOM    230  CA  PHE A  14      11.942  13.478  10.398  1.00  0.340          C  
ATOM    231  C   PHE A  14      13.032  13.152  11.405  1.00  0.300          C  
ATOM    232  O   PHE A  14      13.523  14.031  12.106  1.00  0.320          O  
ATOM    233  CB  PHE A  14      10.598  13.119  11.026  1.00  0.480          C  
ATOM    234  CG  PHE A  14       9.365  13.638  10.349  1.00  0.480          C  
ATOM    235  CD1 PHE A  14       9.364  14.717   9.465  1.00  0.480          C  
ATOM    236  CD2 PHE A  14       8.172  13.048  10.633  1.00  0.480          C  
ATOM    237  CE1 PHE A  14       8.199  15.167   8.911  1.00  0.480          C  
ATOM    238  CE2 PHE A  14       7.020  13.507  10.081  1.00  0.480          C  
ATOM    239  CZ  PHE A  14       7.027  14.562   9.225  1.00  0.480          C  
ATOM    240  H   PHE A  14      11.430  12.132   8.789  1.00  0.430          H  
ATOM    241  HA  PHE A  14      11.990  14.541  10.210  1.00  0.410          H  
ATOM    242 1HB  PHE A  14      10.514  12.040  11.083  1.00  0.580          H  
ATOM    243 2HB  PHE A  14      10.586  13.486  12.045  1.00  0.580          H  
ATOM    244  HD1 PHE A  14      10.280  15.218   9.198  1.00  0.580          H  
ATOM    245  HD2 PHE A  14       8.147  12.212  11.321  1.00  0.580          H  
ATOM    246  HE1 PHE A  14       8.211  16.009   8.222  1.00  0.580          H  
ATOM    247  HE2 PHE A  14       6.091  13.035  10.324  1.00  0.580          H  
ATOM    248  HZ  PHE A  14       6.095  14.916   8.789  1.00  0.580          H  
ATOM    249  N   LYS A  15      13.459  11.893  11.481  1.00  0.350          N  
ATOM    250  CA  LYS A  15      14.518  11.541  12.430  1.00  0.450          C  
ATOM    251  C   LYS A  15      15.759  12.402  12.202  1.00  0.550          C  
ATOM    252  O   LYS A  15      16.454  12.763  13.155  1.00  0.590          O  
ATOM    253  CB  LYS A  15      14.870  10.057  12.337  1.00  0.590          C  
ATOM    254  CG  LYS A  15      13.799   9.115  12.892  1.00  0.590          C  
ATOM    255  CD  LYS A  15      14.193   7.661  12.708  1.00  0.590          C  
ATOM    256  CE  LYS A  15      13.128   6.712  13.228  1.00  0.590          C  
ATOM    257  NZ  LYS A  15      13.474   5.292  12.926  1.00  0.590          N  
ATOM    258  H   LYS A  15      12.983  11.171  10.927  1.00  0.420          H  
ATOM    259  HA  LYS A  15      14.177  11.743  13.436  1.00  0.540          H  
ATOM    260 1HB  LYS A  15      15.036   9.792  11.292  1.00  0.710          H  
ATOM    261 2HB  LYS A  15      15.797   9.871  12.872  1.00  0.710          H  
ATOM    262 1HG  LYS A  15      13.656   9.306  13.944  1.00  0.710          H  
ATOM    263 2HG  LYS A  15      12.863   9.295  12.381  1.00  0.710          H  
ATOM    264 1HD  LYS A  15      14.348   7.458  11.646  1.00  0.710          H  
ATOM    265 2HD  LYS A  15      15.126   7.464  13.231  1.00  0.710          H  
ATOM    266 1HE  LYS A  15      13.034   6.835  14.305  1.00  0.710          H  
ATOM    267 2HE  LYS A  15      12.171   6.950  12.758  1.00  0.710          H  
ATOM    268 1HZ  LYS A  15      12.757   4.678  13.270  1.00  0.710          H  
ATOM    269 2HZ  LYS A  15      13.544   5.194  11.893  1.00  0.710          H  
ATOM    270 3HZ  LYS A  15      14.355   5.050  13.348  1.00  0.710          H  
ATOM    271  N   GLU A  16      16.062  12.716  10.942  1.00  0.660          N  
ATOM    272  CA  GLU A  16      17.208  13.577  10.669  1.00  0.860          C  
ATOM    273  C   GLU A  16      16.870  15.082  10.782  1.00  0.880          C  
ATOM    274  O   GLU A  16      17.656  15.856  11.331  1.00  1.020          O  
ATOM    275  CB  GLU A  16      17.778  13.288   9.277  1.00  1.120          C  
ATOM    276  CG  GLU A  16      18.431  11.913   9.131  1.00  1.120          C  
ATOM    277  CD  GLU A  16      19.018  11.678   7.757  1.00  1.120          C  
ATOM    278  OE1 GLU A  16      18.816  12.505   6.898  1.00  1.120          O  
ATOM    279  OE2 GLU A  16      19.676  10.680   7.572  1.00  1.120          O  
ATOM    280  H   GLU A  16      15.486  12.331  10.182  1.00  0.790          H  
ATOM    281  HA  GLU A  16      17.979  13.355  11.403  1.00  1.030          H  
ATOM    282 1HB  GLU A  16      16.971  13.353   8.542  1.00  1.350          H  
ATOM    283 2HB  GLU A  16      18.517  14.046   9.021  1.00  1.350          H  
ATOM    284 1HG  GLU A  16      19.219  11.815   9.877  1.00  1.350          H  
ATOM    285 2HG  GLU A  16      17.677  11.150   9.335  1.00  1.350          H  
ATOM    286  N   ALA A  17      15.725  15.495  10.215  1.00  0.790          N  
ATOM    287  CA  ALA A  17      15.269  16.892  10.165  1.00  0.900          C  
ATOM    288  C   ALA A  17      14.850  17.488  11.510  1.00  0.900          C  
ATOM    289  O   ALA A  17      15.097  18.666  11.783  1.00  1.060          O  
ATOM    290  CB  ALA A  17      14.088  17.003   9.216  1.00  1.220          C  
ATOM    291  H   ALA A  17      15.138  14.794   9.765  1.00  0.950          H  
ATOM    292  HA  ALA A  17      16.095  17.488   9.782  1.00  1.080          H  
ATOM    293 1HB  ALA A  17      13.779  18.045   9.141  1.00  1.460          H  
ATOM    294 2HB  ALA A  17      14.375  16.632   8.235  1.00  1.460          H  
ATOM    295 3HB  ALA A  17      13.269  16.411   9.599  1.00  1.460          H  
ATOM    296  N   PHE A  18      14.185  16.687  12.335  1.00  0.740          N  
ATOM    297  CA  PHE A  18      13.633  17.118  13.603  1.00  0.750          C  
ATOM    298  C   PHE A  18      14.011  16.167  14.740  1.00  0.800          C  
ATOM    299  O   PHE A  18      13.104  15.696  15.410  1.00  0.940          O  
ATOM    300  CB  PHE A  18      12.110  17.130  13.518  1.00  1.050          C  
ATOM    301  CG  PHE A  18      11.575  17.940  12.392  1.00  1.050          C  
ATOM    302  CD1 PHE A  18      11.674  19.315  12.374  1.00  1.050          C  
ATOM    303  CD2 PHE A  18      10.940  17.309  11.348  1.00  1.050          C  
ATOM    304  CE1 PHE A  18      11.161  20.034  11.321  1.00  1.050          C  
ATOM    305  CE2 PHE A  18      10.426  18.024  10.300  1.00  1.050          C  
ATOM    306  CZ  PHE A  18      10.539  19.384  10.283  1.00  1.050          C  
ATOM    307  H   PHE A  18      14.033  15.723  12.068  1.00  0.890          H  
ATOM    308  HA  PHE A  18      13.988  18.121  13.824  1.00  0.900          H  
ATOM    309 1HB  PHE A  18      11.749  16.104  13.400  1.00  1.260          H  
ATOM    310 2HB  PHE A  18      11.695  17.518  14.446  1.00  1.260          H  
ATOM    311  HD1 PHE A  18      12.168  19.829  13.197  1.00  1.260          H  
ATOM    312  HD2 PHE A  18      10.848  16.234  11.375  1.00  1.260          H  
ATOM    313  HE1 PHE A  18      11.248  21.120  11.310  1.00  1.260          H  
ATOM    314  HE2 PHE A  18       9.925  17.522   9.485  1.00  1.260          H  
ATOM    315  HZ  PHE A  18      10.130  19.953   9.452  1.00  1.260          H  
ATOM    316  N   PRO A  19      15.307  15.918  15.014  1.00  1.160          N  
ATOM    317  CA  PRO A  19      15.855  14.913  15.930  1.00  1.470          C  
ATOM    318  C   PRO A  19      15.487  15.040  17.421  1.00  1.150          C  
ATOM    319  O   PRO A  19      15.683  14.096  18.183  1.00  1.440          O  
ATOM    320  CB  PRO A  19      17.368  15.105  15.753  1.00  2.210          C  
ATOM    321  CG  PRO A  19      17.532  16.523  15.270  1.00  2.210          C  
ATOM    322  CD  PRO A  19      16.349  16.760  14.395  1.00  2.210          C  
ATOM    323  HA  PRO A  19      15.570  13.920  15.554  1.00  1.760          H  
ATOM    324 1HB  PRO A  19      17.887  14.906  16.701  1.00  2.650          H  
ATOM    325 2HB  PRO A  19      17.741  14.369  15.018  1.00  2.650          H  
ATOM    326 1HG  PRO A  19      17.592  17.218  16.117  1.00  2.650          H  
ATOM    327 2HG  PRO A  19      18.478  16.619  14.711  1.00  2.650          H  
ATOM    328 1HD  PRO A  19      16.091  17.821  14.388  1.00  2.650          H  
ATOM    329 2HD  PRO A  19      16.593  16.389  13.410  1.00  2.650          H  
ATOM    330  N   HIS A  20      15.014  16.208  17.856  1.00  0.740          N  
ATOM    331  CA  HIS A  20      14.674  16.411  19.269  1.00  0.570          C  
ATOM    332  C   HIS A  20      13.752  15.314  19.746  1.00  0.560          C  
ATOM    333  O   HIS A  20      12.771  14.987  19.094  1.00  1.060          O  
ATOM    334  CB  HIS A  20      13.998  17.763  19.452  1.00  0.870          C  
ATOM    335  CG  HIS A  20      13.686  18.162  20.874  1.00  0.870          C  
ATOM    336  ND1 HIS A  20      12.584  17.661  21.614  1.00  0.870          N  
ATOM    337  CD2 HIS A  20      14.325  19.030  21.690  1.00  0.870          C  
ATOM    338  CE1 HIS A  20      12.601  18.246  22.817  1.00  0.870          C  
ATOM    339  NE2 HIS A  20      13.640  19.062  22.875  1.00  0.870          N  
ATOM    340  H   HIS A  20      14.863  16.960  17.206  1.00  0.890          H  
ATOM    341  HA  HIS A  20      15.579  16.386  19.875  1.00  0.680          H  
ATOM    342 1HB  HIS A  20      14.640  18.531  19.029  1.00  1.040          H  
ATOM    343 2HB  HIS A  20      13.104  17.769  18.894  1.00  1.040          H  
ATOM    344  HD2 HIS A  20      15.220  19.605  21.446  1.00  1.040          H  
ATOM    345  HE1 HIS A  20      11.896  18.097  23.625  1.00  1.040          H  
ATOM    346  HE2 HIS A  20      13.897  19.635  23.676  1.00  1.040          H  
ATOM    347  N   VAL A  21      13.981  14.795  20.939  1.00  0.970          N  
ATOM    348  CA  VAL A  21      13.170  13.669  21.381  1.00  1.540          C  
ATOM    349  C   VAL A  21      11.672  13.894  21.370  1.00  1.250          C  
ATOM    350  O   VAL A  21      10.926  13.023  20.913  1.00  1.380          O  
ATOM    351  CB  VAL A  21      13.570  13.262  22.823  1.00  1.930          C  
ATOM    352  CG1 VAL A  21      12.571  12.219  23.409  1.00  1.930          C  
ATOM    353  CG2 VAL A  21      14.972  12.682  22.802  1.00  1.930          C  
ATOM    354  H   VAL A  21      14.758  15.130  21.489  1.00  1.160          H  
ATOM    355  HA  VAL A  21      13.388  12.835  20.712  1.00  1.850          H  
ATOM    356  HB  VAL A  21      13.543  14.142  23.465  1.00  2.310          H  
ATOM    357 1HG1 VAL A  21      12.882  11.959  24.420  1.00  2.310          H  
ATOM    358 2HG1 VAL A  21      11.559  12.619  23.456  1.00  2.310          H  
ATOM    359 3HG1 VAL A  21      12.577  11.329  22.786  1.00  2.310          H  
ATOM    360 1HG2 VAL A  21      15.267  12.403  23.814  1.00  2.310          H  
ATOM    361 2HG2 VAL A  21      14.986  11.799  22.163  1.00  2.310          H  
ATOM    362 3HG2 VAL A  21      15.671  13.416  22.413  1.00  2.310          H  
ATOM    363  N   PHE A  22      11.207  15.017  21.882  1.00  0.950          N  
ATOM    364  CA  PHE A  22       9.777  15.162  21.993  1.00  0.770          C  
ATOM    365  C   PHE A  22       9.212  15.688  20.712  1.00  0.660          C  
ATOM    366  O   PHE A  22       8.152  15.234  20.263  1.00  0.590          O  
ATOM    367  CB  PHE A  22       9.431  16.003  23.200  1.00  1.150          C  
ATOM    368  CG  PHE A  22       9.771  15.243  24.447  1.00  1.150          C  
ATOM    369  CD1 PHE A  22      11.003  15.405  25.072  1.00  1.150          C  
ATOM    370  CD2 PHE A  22       8.874  14.340  24.987  1.00  1.150          C  
ATOM    371  CE1 PHE A  22      11.323  14.689  26.196  1.00  1.150          C  
ATOM    372  CE2 PHE A  22       9.194  13.622  26.117  1.00  1.150          C  
ATOM    373  CZ  PHE A  22      10.420  13.797  26.721  1.00  1.150          C  
ATOM    374  H   PHE A  22      11.833  15.781  22.133  1.00  1.140          H  
ATOM    375  HA  PHE A  22       9.346  14.175  22.161  1.00  0.920          H  
ATOM    376 1HB  PHE A  22       9.971  16.931  23.184  1.00  1.380          H  
ATOM    377 2HB  PHE A  22       8.367  16.231  23.206  1.00  1.380          H  
ATOM    378  HD1 PHE A  22      11.725  16.095  24.665  1.00  1.380          H  
ATOM    379  HD2 PHE A  22       7.905  14.197  24.505  1.00  1.380          H  
ATOM    380  HE1 PHE A  22      12.294  14.824  26.671  1.00  1.380          H  
ATOM    381  HE2 PHE A  22       8.478  12.913  26.535  1.00  1.380          H  
ATOM    382  HZ  PHE A  22      10.674  13.228  27.614  1.00  1.380          H  
ATOM    383  N   ARG A  23       9.912  16.641  20.097  1.00  0.770          N  
ATOM    384  CA  ARG A  23       9.353  17.153  18.856  1.00  0.860          C  
ATOM    385  C   ARG A  23       9.288  16.030  17.823  1.00  0.890          C  
ATOM    386  O   ARG A  23       8.312  15.942  17.074  1.00  0.900          O  
ATOM    387  CB  ARG A  23      10.115  18.339  18.294  1.00  1.170          C  
ATOM    388  CG  ARG A  23       9.973  19.620  19.111  1.00  1.170          C  
ATOM    389  CD  ARG A  23      10.440  20.846  18.371  1.00  1.170          C  
ATOM    390  NE  ARG A  23      11.885  20.869  18.092  1.00  1.170          N  
ATOM    391  CZ  ARG A  23      12.839  21.355  18.929  1.00  1.170          C  
ATOM    392  NH1 ARG A  23      12.516  21.832  20.117  1.00  1.170          N  
ATOM    393  NH2 ARG A  23      14.109  21.357  18.546  1.00  1.170          N  
ATOM    394  H   ARG A  23      10.787  16.997  20.513  1.00  0.920          H  
ATOM    395  HA  ARG A  23       8.335  17.488  19.054  1.00  1.030          H  
ATOM    396 1HB  ARG A  23      11.140  18.095  18.198  1.00  1.400          H  
ATOM    397 2HB  ARG A  23       9.747  18.550  17.292  1.00  1.400          H  
ATOM    398 1HG  ARG A  23       8.927  19.759  19.380  1.00  1.400          H  
ATOM    399 2HG  ARG A  23      10.568  19.520  20.021  1.00  1.400          H  
ATOM    400 1HD  ARG A  23       9.919  20.890  17.415  1.00  1.400          H  
ATOM    401 2HD  ARG A  23      10.184  21.733  18.945  1.00  1.400          H  
ATOM    402  HE  ARG A  23      12.187  20.525  17.190  1.00  1.400          H  
ATOM    403 1HH1 ARG A  23      11.555  21.839  20.420  1.00  1.400          H  
ATOM    404 2HH1 ARG A  23      13.233  22.191  20.730  1.00  1.400          H  
ATOM    405 1HH2 ARG A  23      14.364  21.003  17.636  1.00  1.400          H  
ATOM    406 2HH2 ARG A  23      14.822  21.722  19.162  1.00  1.400          H  
ATOM    407  N   LEU A  24      10.307  15.160  17.795  1.00  0.980          N  
ATOM    408  CA  LEU A  24      10.362  14.077  16.842  1.00  1.110          C  
ATOM    409  C   LEU A  24       9.221  13.114  17.044  1.00  0.850          C  
ATOM    410  O   LEU A  24       8.538  12.759  16.081  1.00  0.750          O  
ATOM    411  CB  LEU A  24      11.668  13.298  16.983  1.00  1.500          C  
ATOM    412  CG  LEU A  24      11.866  12.128  16.061  1.00  1.500          C  
ATOM    413  CD1 LEU A  24      11.820  12.606  14.611  1.00  1.500          C  
ATOM    414  CD2 LEU A  24      13.206  11.499  16.381  1.00  1.500          C  
ATOM    415  H   LEU A  24      11.100  15.256  18.427  1.00  1.180          H  
ATOM    416  HA  LEU A  24      10.302  14.520  15.854  1.00  1.330          H  
ATOM    417 1HB  LEU A  24      12.495  13.965  16.852  1.00  1.800          H  
ATOM    418 2HB  LEU A  24      11.720  12.917  18.004  1.00  1.800          H  
ATOM    419  HG  LEU A  24      11.083  11.404  16.212  1.00  1.800          H  
ATOM    420 1HD1 LEU A  24      11.970  11.768  13.956  1.00  1.800          H  
ATOM    421 2HD1 LEU A  24      10.863  13.045  14.382  1.00  1.800          H  
ATOM    422 3HD1 LEU A  24      12.607  13.345  14.451  1.00  1.800          H  
ATOM    423 1HD2 LEU A  24      13.376  10.651  15.739  1.00  1.800          H  
ATOM    424 2HD2 LEU A  24      13.998  12.233  16.231  1.00  1.800          H  
ATOM    425 3HD2 LEU A  24      13.210  11.172  17.420  1.00  1.800          H  
ATOM    426  N   LYS A  25       8.956  12.708  18.293  1.00  0.820          N  
ATOM    427  CA  LYS A  25       7.850  11.791  18.504  1.00  0.780          C  
ATOM    428  C   LYS A  25       6.548  12.393  17.986  1.00  0.560          C  
ATOM    429  O   LYS A  25       5.746  11.687  17.362  1.00  0.580          O  
ATOM    430  CB  LYS A  25       7.733  11.408  19.981  1.00  1.110          C  
ATOM    431  CG  LYS A  25       8.841  10.462  20.471  1.00  1.110          C  
ATOM    432  CD  LYS A  25       8.710  10.142  21.966  1.00  1.110          C  
ATOM    433  CE  LYS A  25       9.808   9.180  22.423  1.00  1.110          C  
ATOM    434  NZ  LYS A  25       9.712   8.864  23.877  1.00  1.110          N  
ATOM    435  H   LYS A  25       9.541  13.007  19.081  1.00  0.980          H  
ATOM    436  HA  LYS A  25       8.046  10.884  17.933  1.00  0.940          H  
ATOM    437 1HB  LYS A  25       7.782  12.318  20.589  1.00  1.330          H  
ATOM    438 2HB  LYS A  25       6.769  10.939  20.165  1.00  1.330          H  
ATOM    439 1HG  LYS A  25       8.784   9.533  19.906  1.00  1.330          H  
ATOM    440 2HG  LYS A  25       9.810  10.913  20.281  1.00  1.330          H  
ATOM    441 1HD  LYS A  25       8.799  11.072  22.536  1.00  1.330          H  
ATOM    442 2HD  LYS A  25       7.736   9.699  22.166  1.00  1.330          H  
ATOM    443 1HE  LYS A  25       9.728   8.255  21.857  1.00  1.330          H  
ATOM    444 2HE  LYS A  25      10.779   9.634  22.223  1.00  1.330          H  
ATOM    445 1HZ  LYS A  25      10.455   8.229  24.135  1.00  1.330          H  
ATOM    446 2HZ  LYS A  25       9.799   9.718  24.412  1.00  1.330          H  
ATOM    447 3HZ  LYS A  25       8.819   8.432  24.072  1.00  1.330          H  
ATOM    448  N   LYS A  26       6.338  13.699  18.214  1.00  0.470          N  
ATOM    449  CA  LYS A  26       5.128  14.342  17.717  1.00  0.540          C  
ATOM    450  C   LYS A  26       5.079  14.328  16.184  1.00  0.550          C  
ATOM    451  O   LYS A  26       4.029  14.032  15.599  1.00  0.640          O  
ATOM    452  CB  LYS A  26       5.033  15.778  18.235  1.00  0.730          C  
ATOM    453  CG  LYS A  26       4.742  15.890  19.730  1.00  0.730          C  
ATOM    454  CD  LYS A  26       4.698  17.348  20.187  1.00  0.730          C  
ATOM    455  CE  LYS A  26       4.428  17.457  21.684  1.00  0.730          C  
ATOM    456  NZ  LYS A  26       4.415  18.876  22.145  1.00  0.730          N  
ATOM    457  H   LYS A  26       7.015  14.228  18.777  1.00  0.560          H  
ATOM    458  HA  LYS A  26       4.267  13.783  18.083  1.00  0.650          H  
ATOM    459 1HB  LYS A  26       5.974  16.290  18.044  1.00  0.870          H  
ATOM    460 2HB  LYS A  26       4.255  16.310  17.693  1.00  0.870          H  
ATOM    461 1HG  LYS A  26       3.786  15.414  19.948  1.00  0.870          H  
ATOM    462 2HG  LYS A  26       5.521  15.366  20.283  1.00  0.870          H  
ATOM    463 1HD  LYS A  26       5.657  17.820  19.966  1.00  0.870          H  
ATOM    464 2HD  LYS A  26       3.916  17.877  19.643  1.00  0.870          H  
ATOM    465 1HE  LYS A  26       3.463  17.004  21.906  1.00  0.870          H  
ATOM    466 2HE  LYS A  26       5.206  16.916  22.225  1.00  0.870          H  
ATOM    467 1HZ  LYS A  26       4.235  18.908  23.139  1.00  0.870          H  
ATOM    468 2HZ  LYS A  26       5.311  19.302  21.953  1.00  0.870          H  
ATOM    469 3HZ  LYS A  26       3.691  19.385  21.657  1.00  0.870          H  
ATOM    470  N   TRP A  27       6.215  14.619  15.531  1.00  0.590          N  
ATOM    471  CA  TRP A  27       6.290  14.630  14.072  1.00  0.710          C  
ATOM    472  C   TRP A  27       6.017  13.254  13.461  1.00  0.600          C  
ATOM    473  O   TRP A  27       5.234  13.131  12.508  1.00  0.670          O  
ATOM    474  CB  TRP A  27       7.685  15.100  13.618  1.00  0.950          C  
ATOM    475  CG  TRP A  27       7.896  16.574  13.546  1.00  0.950          C  
ATOM    476  CD1 TRP A  27       8.649  17.364  14.358  1.00  0.950          C  
ATOM    477  CD2 TRP A  27       7.370  17.436  12.535  1.00  0.950          C  
ATOM    478  NE1 TRP A  27       8.601  18.659  13.927  1.00  0.950          N  
ATOM    479  CE2 TRP A  27       7.832  18.719  12.809  1.00  0.950          C  
ATOM    480  CE3 TRP A  27       6.565  17.226  11.432  1.00  0.950          C  
ATOM    481  CZ2 TRP A  27       7.512  19.791  12.012  1.00  0.950          C  
ATOM    482  CZ3 TRP A  27       6.245  18.293  10.625  1.00  0.950          C  
ATOM    483  CH2 TRP A  27       6.708  19.548  10.907  1.00  0.950          C  
ATOM    484  H   TRP A  27       7.034  14.906  16.078  1.00  0.710          H  
ATOM    485  HA  TRP A  27       5.544  15.329  13.699  1.00  0.850          H  
ATOM    486 1HB  TRP A  27       8.432  14.691  14.291  1.00  1.140          H  
ATOM    487 2HB  TRP A  27       7.889  14.717  12.659  1.00  1.140          H  
ATOM    488  HD1 TRP A  27       9.209  17.026  15.209  1.00  1.140          H  
ATOM    489  HE1 TRP A  27       9.071  19.447  14.342  1.00  1.140          H  
ATOM    490  HE3 TRP A  27       6.195  16.233  11.210  1.00  1.140          H  
ATOM    491  HZ2 TRP A  27       7.876  20.795  12.222  1.00  1.140          H  
ATOM    492  HZ3 TRP A  27       5.615  18.112   9.757  1.00  1.140          H  
ATOM    493  HH2 TRP A  27       6.439  20.373  10.251  1.00  1.140          H  
ATOM    494  N   ILE A  28       6.620  12.211  14.028  1.00  0.510          N  
ATOM    495  CA  ILE A  28       6.426  10.873  13.497  1.00  0.500          C  
ATOM    496  C   ILE A  28       4.988  10.414  13.685  1.00  0.430          C  
ATOM    497  O   ILE A  28       4.402   9.822  12.767  1.00  0.450          O  
ATOM    498  CB  ILE A  28       7.424   9.848  14.068  1.00  0.700          C  
ATOM    499  CG1 ILE A  28       8.854  10.197  13.560  1.00  0.700          C  
ATOM    500  CG2 ILE A  28       7.029   8.439  13.612  1.00  0.700          C  
ATOM    501  CD1 ILE A  28       9.971   9.434  14.226  1.00  0.700          C  
ATOM    502  H   ILE A  28       7.246  12.371  14.824  1.00  0.610          H  
ATOM    503  HA  ILE A  28       6.618  10.909  12.431  1.00  0.600          H  
ATOM    504  HB  ILE A  28       7.427   9.910  15.160  1.00  0.840          H  
ATOM    505 1HG1 ILE A  28       8.904  10.016  12.495  1.00  0.840          H  
ATOM    506 2HG1 ILE A  28       9.027  11.260  13.737  1.00  0.840          H  
ATOM    507 1HG2 ILE A  28       7.723   7.707  14.001  1.00  0.840          H  
ATOM    508 2HG2 ILE A  28       6.030   8.187  13.968  1.00  0.840          H  
ATOM    509 3HG2 ILE A  28       7.048   8.417  12.529  1.00  0.840          H  
ATOM    510 1HD1 ILE A  28      10.917   9.755  13.813  1.00  0.840          H  
ATOM    511 2HD1 ILE A  28       9.954   9.628  15.294  1.00  0.840          H  
ATOM    512 3HD1 ILE A  28       9.867   8.372  14.056  1.00  0.840          H  
ATOM    513  N   GLN A  29       4.413  10.631  14.872  1.00  0.450          N  
ATOM    514  CA  GLN A  29       3.042  10.198  15.058  1.00  0.530          C  
ATOM    515  C   GLN A  29       2.127  10.960  14.100  1.00  0.510          C  
ATOM    516  O   GLN A  29       1.229  10.370  13.499  1.00  0.590          O  
ATOM    517  CB  GLN A  29       2.576  10.419  16.494  1.00  0.710          C  
ATOM    518  CG  GLN A  29       1.182   9.820  16.828  1.00  0.710          C  
ATOM    519  CD  GLN A  29       1.170   8.294  16.765  1.00  0.710          C  
ATOM    520  OE1 GLN A  29       2.095   7.666  17.295  1.00  0.710          O  
ATOM    521  NE2 GLN A  29       0.147   7.688  16.161  1.00  0.710          N  
ATOM    522  H   GLN A  29       4.930  11.083  15.634  1.00  0.540          H  
ATOM    523  HA  GLN A  29       2.986   9.137  14.836  1.00  0.640          H  
ATOM    524 1HB  GLN A  29       3.308   9.993  17.179  1.00  0.850          H  
ATOM    525 2HB  GLN A  29       2.540  11.494  16.693  1.00  0.850          H  
ATOM    526 1HG  GLN A  29       0.901  10.121  17.834  1.00  0.850          H  
ATOM    527 2HG  GLN A  29       0.442  10.190  16.110  1.00  0.850          H  
ATOM    528 1HE2 GLN A  29       0.109   6.694  16.112  1.00  0.850          H  
ATOM    529 2HE2 GLN A  29      -0.624   8.222  15.717  1.00  0.850          H  
ATOM    530  N   LYS A  30       2.378  12.255  13.875  1.00  0.500          N  
ATOM    531  CA  LYS A  30       1.518  12.989  12.966  1.00  0.610          C  
ATOM    532  C   LYS A  30       1.491  12.342  11.586  1.00  0.550          C  
ATOM    533  O   LYS A  30       0.408  12.152  11.021  1.00  0.640          O  
ATOM    534  CB  LYS A  30       1.950  14.453  12.851  1.00  0.810          C  
ATOM    535  CG  LYS A  30       1.049  15.311  11.943  1.00  0.810          C  
ATOM    536  CD  LYS A  30       1.485  16.779  11.931  1.00  0.810          C  
ATOM    537  CE  LYS A  30       0.598  17.608  11.002  1.00  0.810          C  
ATOM    538  NZ  LYS A  30       0.986  19.048  10.989  1.00  0.810          N  
ATOM    539  H   LYS A  30       3.116  12.755  14.384  1.00  0.600          H  
ATOM    540  HA  LYS A  30       0.505  12.962  13.366  1.00  0.730          H  
ATOM    541 1HB  LYS A  30       1.969  14.902  13.845  1.00  0.970          H  
ATOM    542 2HB  LYS A  30       2.967  14.497  12.460  1.00  0.970          H  
ATOM    543 1HG  LYS A  30       1.090  14.924  10.921  1.00  0.970          H  
ATOM    544 2HG  LYS A  30       0.019  15.244  12.292  1.00  0.970          H  
ATOM    545 1HD  LYS A  30       1.424  17.186  12.942  1.00  0.970          H  
ATOM    546 2HD  LYS A  30       2.521  16.847  11.593  1.00  0.970          H  
ATOM    547 1HE  LYS A  30       0.678  17.211   9.990  1.00  0.970          H  
ATOM    548 2HE  LYS A  30      -0.437  17.525  11.333  1.00  0.970          H  
ATOM    549 1HZ  LYS A  30       0.375  19.555  10.364  1.00  0.970          H  
ATOM    550 2HZ  LYS A  30       0.904  19.430  11.921  1.00  0.970          H  
ATOM    551 3HZ  LYS A  30       1.940  19.140  10.672  1.00  0.970          H  
ATOM    552  N   VAL A  31       2.661  11.984  11.037  1.00  0.500          N  
ATOM    553  CA  VAL A  31       2.632  11.371   9.713  1.00  0.610          C  
ATOM    554  C   VAL A  31       1.971   9.987   9.693  1.00  0.660          C  
ATOM    555  O   VAL A  31       1.305   9.659   8.706  1.00  0.800          O  
ATOM    556  CB  VAL A  31       4.007  11.382   8.988  1.00  0.810          C  
ATOM    557  CG1 VAL A  31       5.049  10.475   9.630  1.00  0.810          C  
ATOM    558  CG2 VAL A  31       3.764  10.939   7.548  1.00  0.810          C  
ATOM    559  H   VAL A  31       3.531  12.189  11.543  1.00  0.600          H  
ATOM    560  HA  VAL A  31       2.013  12.021   9.094  1.00  0.730          H  
ATOM    561  HB  VAL A  31       4.386  12.396   8.994  1.00  0.970          H  
ATOM    562 1HG1 VAL A  31       5.983  10.529   9.073  1.00  0.970          H  
ATOM    563 2HG1 VAL A  31       5.215  10.798  10.635  1.00  0.970          H  
ATOM    564 3HG1 VAL A  31       4.708   9.483   9.633  1.00  0.970          H  
ATOM    565 1HG2 VAL A  31       4.650  10.973   6.995  1.00  0.970          H  
ATOM    566 2HG2 VAL A  31       3.391   9.925   7.526  1.00  0.970          H  
ATOM    567 3HG2 VAL A  31       3.034  11.610   7.093  1.00  0.970          H  
ATOM    568  N   ILE A  32       2.122   9.159  10.740  1.00  0.620          N  
ATOM    569  CA  ILE A  32       1.437   7.868  10.648  1.00  0.760          C  
ATOM    570  C   ILE A  32      -0.078   8.064  10.746  1.00  0.760          C  
ATOM    571  O   ILE A  32      -0.833   7.374  10.056  1.00  0.910          O  
ATOM    572  CB  ILE A  32       1.914   6.823  11.696  1.00  1.010          C  
ATOM    573  CG1 ILE A  32       1.503   5.397  11.189  1.00  1.010          C  
ATOM    574  CG2 ILE A  32       1.346   7.077  13.088  1.00  1.010          C  
ATOM    575  CD1 ILE A  32       2.178   4.234  11.894  1.00  1.010          C  
ATOM    576  H   ILE A  32       2.736   9.416  11.525  1.00  0.740          H  
ATOM    577  HA  ILE A  32       1.649   7.446   9.667  1.00  0.910          H  
ATOM    578  HB  ILE A  32       2.948   6.873  11.790  1.00  1.210          H  
ATOM    579 1HG1 ILE A  32       0.423   5.284  11.294  1.00  1.210          H  
ATOM    580 2HG1 ILE A  32       1.752   5.321  10.123  1.00  1.210          H  
ATOM    581 1HG2 ILE A  32       1.726   6.345  13.785  1.00  1.210          H  
ATOM    582 2HG2 ILE A  32       1.646   8.038  13.408  1.00  1.210          H  
ATOM    583 3HG2 ILE A  32       0.259   7.021  13.091  1.00  1.210          H  
ATOM    584 1HD1 ILE A  32       1.826   3.298  11.443  1.00  1.210          H  
ATOM    585 2HD1 ILE A  32       3.258   4.309  11.765  1.00  1.210          H  
ATOM    586 3HD1 ILE A  32       1.941   4.231  12.949  1.00  1.210          H  
ATOM    587  N   ASP A  33      -0.538   9.023  11.571  1.00  0.700          N  
ATOM    588  CA  ASP A  33      -1.969   9.281  11.669  1.00  0.800          C  
ATOM    589  C   ASP A  33      -2.498   9.790  10.329  1.00  0.850          C  
ATOM    590  O   ASP A  33      -3.586   9.407   9.892  1.00  0.980          O  
ATOM    591  CB  ASP A  33      -2.279  10.326  12.752  1.00  1.080          C  
ATOM    592  CG  ASP A  33      -2.099   9.846  14.214  1.00  1.080          C  
ATOM    593  OD1 ASP A  33      -1.974   8.666  14.455  1.00  1.080          O  
ATOM    594  OD2 ASP A  33      -2.122  10.684  15.080  1.00  1.080          O  
ATOM    595  H   ASP A  33       0.116   9.547  12.164  1.00  0.840          H  
ATOM    596  HA  ASP A  33      -2.475   8.350  11.916  1.00  0.960          H  
ATOM    597 1HB  ASP A  33      -1.618  11.185  12.601  1.00  1.300          H  
ATOM    598 2HB  ASP A  33      -3.300  10.681  12.623  1.00  1.300          H  
ATOM    599  N   GLN A  34      -1.698  10.635   9.666  1.00  0.830          N  
ATOM    600  CA  GLN A  34      -2.022  11.209   8.367  1.00  1.000          C  
ATOM    601  C   GLN A  34      -2.196  10.163   7.281  1.00  1.020          C  
ATOM    602  O   GLN A  34      -3.161  10.221   6.513  1.00  1.210          O  
ATOM    603  CB  GLN A  34      -0.908  12.158   7.931  1.00  1.330          C  
ATOM    604  CG  GLN A  34      -1.109  12.839   6.610  1.00  1.330          C  
ATOM    605  CD  GLN A  34       0.075  13.686   6.280  1.00  1.330          C  
ATOM    606  OE1 GLN A  34       1.045  13.740   7.046  1.00  1.330          O  
ATOM    607  NE2 GLN A  34       0.017  14.366   5.148  1.00  1.330          N  
ATOM    608  H   GLN A  34      -0.835  10.937  10.121  1.00  1.000          H  
ATOM    609  HA  GLN A  34      -2.954  11.762   8.461  1.00  1.200          H  
ATOM    610 1HB  GLN A  34      -0.752  12.915   8.698  1.00  1.600          H  
ATOM    611 2HB  GLN A  34       0.009  11.598   7.842  1.00  1.600          H  
ATOM    612 1HG  GLN A  34      -1.217  12.093   5.822  1.00  1.600          H  
ATOM    613 2HG  GLN A  34      -1.993  13.470   6.656  1.00  1.600          H  
ATOM    614 1HE2 GLN A  34       0.780  14.955   4.876  1.00  1.600          H  
ATOM    615 2HE2 GLN A  34      -0.789  14.292   4.559  1.00  1.600          H  
ATOM    616  N   PHE A  35      -1.249   9.226   7.190  1.00  0.940          N  
ATOM    617  CA  PHE A  35      -1.330   8.207   6.160  1.00  1.120          C  
ATOM    618  C   PHE A  35      -1.585   6.788   6.644  1.00  1.310          C  
ATOM    619  O   PHE A  35      -0.557   6.121   6.669  1.00  1.920          O  
ATOM    620  CB  PHE A  35      -0.042   8.166   5.350  1.00  1.500          C  
ATOM    621  CG  PHE A  35       0.265   9.390   4.602  1.00  1.500          C  
ATOM    622  CD1 PHE A  35       1.316  10.166   4.987  1.00  1.500          C  
ATOM    623  CD2 PHE A  35      -0.487   9.771   3.511  1.00  1.500          C  
ATOM    624  CE1 PHE A  35       1.646  11.300   4.297  1.00  1.500          C  
ATOM    625  CE2 PHE A  35      -0.170  10.905   2.811  1.00  1.500          C  
ATOM    626  CZ  PHE A  35       0.903  11.670   3.202  1.00  1.500          C  
ATOM    627  H   PHE A  35      -0.446   9.259   7.825  1.00  1.130          H  
ATOM    628  HA  PHE A  35      -2.149   8.472   5.494  1.00  1.340          H  
ATOM    629 1HB  PHE A  35       0.789   7.974   6.031  1.00  1.800          H  
ATOM    630 2HB  PHE A  35      -0.076   7.345   4.657  1.00  1.800          H  
ATOM    631  HD1 PHE A  35       1.892   9.859   5.847  1.00  1.800          H  
ATOM    632  HD2 PHE A  35      -1.332   9.160   3.203  1.00  1.800          H  
ATOM    633  HE1 PHE A  35       2.494  11.907   4.618  1.00  1.800          H  
ATOM    634  HE2 PHE A  35      -0.763  11.198   1.944  1.00  1.800          H  
ATOM    635  HZ  PHE A  35       1.160  12.570   2.648  1.00  1.800          H  
ATOM    636  N   GLY A  36      -2.337   6.673   7.721  1.00  1.180          N  
ATOM    637  CA  GLY A  36      -3.204   5.495   7.829  1.00  1.400          C  
ATOM    638  C   GLY A  36      -2.594   4.071   7.961  1.00  1.580          C  
ATOM    639  O   GLY A  36      -3.365   3.116   8.078  1.00  2.240          O  
ATOM    640  H   GLY A  36      -1.835   6.867   8.590  1.00  1.420          H  
ATOM    641 1HA  GLY A  36      -3.857   5.655   8.686  1.00  1.680          H  
ATOM    642 2HA  GLY A  36      -3.868   5.500   6.968  1.00  1.680          H  
ATOM    643  N   GLU A  37      -1.265   3.903   7.955  1.00  2.000          N  
ATOM    644  CA  GLU A  37      -0.691   2.551   7.978  1.00  2.670          C  
ATOM    645  C   GLU A  37       0.757   2.495   8.477  1.00  2.820          C  
ATOM    646  O   GLU A  37       1.128   1.560   9.187  1.00  3.480          O  
ATOM    647  OXT GLU A  37       1.598   3.258   8.004  1.00  4.000          O  
ATOM    648  CB  GLU A  37      -0.771   1.992   6.552  1.00  3.200          C  
ATOM    649  CG  GLU A  37      -0.372   0.577   6.298  1.00  3.200          C  
ATOM    650  CD  GLU A  37      -0.656   0.171   4.808  1.00  3.200          C  
ATOM    651  OE1 GLU A  37       0.038   0.618   3.876  1.00  3.200          O  
ATOM    652  OE2 GLU A  37      -1.582  -0.583   4.620  1.00  3.200          O  
ATOM    653  H   GLU A  37      -0.667   4.715   7.838  1.00  2.400          H  
ATOM    654  HA  GLU A  37      -1.300   1.935   8.638  1.00  3.200          H  
ATOM    655 1HB  GLU A  37      -1.767   2.148   6.141  1.00  3.840          H  
ATOM    656 2HB  GLU A  37      -0.079   2.546   5.969  1.00  3.840          H  
ATOM    657 1HG  GLU A  37       0.681   0.459   6.525  1.00  3.840          H  
ATOM    658 2HG  GLU A  37      -0.934  -0.072   6.966  1.00  3.840          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -219.403 21.7116 173.617 -16.1202 4.22815 9.89754 89.2065 -94.7539 -0.17971 -1.04534 -83.981 -7.74824 -34.5942 0 -7.41056 -4.5259 0 8.85045 2.35963 19.9291 45.6036 -5.28525 0.00107 -5.71984 -5.86079 47.7558 -63.4674
ASP:NtermProteinFull_1 -2.16329 0.05903 3.43698 -0.12489 0.02462 0.41442 1.98803 -1.57035 -0.01943 -0.09609 -2.02002 -1.15056 0 0 -1.15107 0 0 0.02674 0.08714 0 2.33139 0 0 -2.3716 0 0.12176 -2.17718
TRP_2 -4.72894 0.46331 2.44313 -1.14026 0.19491 0.3283 1.69722 -1.8026 -0.00394 -0.02854 -0.79625 -0.51609 0 0 0 0 0 -0.03898 0.45661 0 2.01307 -0.05272 0 1.6906 -0.10715 0.47801 0.54967
PHE_3 -8.11362 0.96093 4.94459 -0.51686 0.35222 0.20141 1.84518 -2.91791 -0 -0 -1.44067 -0.10243 0 0 0 0 0 0.10626 0.05963 0 3.27637 -0.14242 0 1.0402 -0.19649 0.88287 0.23926
LYS_4 -6.49067 0.64762 9.73182 -0.747 0.11534 0.69028 4.15825 -3.94858 -0.02972 -0.19294 -6.4041 -0.00182 0 0 -0.8566 -0.77897 0 -0.03174 0.21686 2.97901 0 0.0381 0 -1.5107 -0.24129 0.86868 -1.78817
ALA_5 -4.65282 0.21067 4.38935 -0.02198 0 0 2.48607 -2.48646 -0 -0 -2.0139 -0.35194 0 0 0 0 0 -0.03181 0 0 0 -0.289 0 1.8394 -0.37628 0.46381 -0.83487
PHE_6 -8.29274 0.82514 3.70208 -0.54591 0.14908 0.25559 2.5616 -2.72919 -0.00585 -0.03243 -2.38111 -0.16411 0 0 0 0 0 0.0432 0.1088 0 3.44024 -0.17109 0 1.0402 -0.26094 0.35705 -2.10039
TYR_7 -9.25989 1.12679 5.08371 -1.11181 0.12609 0.44691 3.57212 -3.41577 -0.01116 -0.06965 -2.96796 -0.2986 0 0 0 0 0 0.04833 0.31022 0 1.76032 -0.42628 0.00107 1.2797 0.06084 0.4816 -3.2634
ASP_8 -5.49202 0.57342 8.11552 -0.10441 0.00694 0.31488 3.91074 -3.53498 -0 -0 -6.54119 -0.31914 0 0 0 -0.77897 0 -0.04032 0.02507 0 1.73624 0.28281 0 -2.3716 0.03691 0.49519 -3.6849
LYS_9 -4.38557 0.19406 5.08617 -0.30962 0.03498 0.14161 2.16558 -2.33693 -0.00238 -0.01829 -2.13798 -0.02467 0 0 0 0 0 -0.03669 0.0108 1.81645 0 -0.01222 0 -1.5107 -0.17193 0.32892 -1.16841
VAL_10 -6.63485 0.90645 4.01879 -0.31816 0.31053 0.07193 2.69126 -2.65607 -0 -0 -2.11706 -0.17419 0 0 0 0 0 -0.0562 0.00418 0.15565 0 -0.36699 0 1.9342 -0.1344 0.2409 -2.12404
ALA_11 -6.25363 0.36236 3.60824 -0.02182 0 0 2.69712 -2.70543 -0.00585 -0.03243 -2.59491 -0.35908 0 0 0 0 0 0.05541 0 0 0 -0.32769 0 1.8394 -0.26785 0.36534 -3.64081
GLU_12 -4.96231 0.31972 6.93875 -0.44325 0.06325 0.87271 3.09138 -2.94313 -0.00722 -0.04111 -3.55506 -0.45074 0 0 0 -0.76596 0 0.15902 0.00811 0 3.26675 -0.30118 0 -2.7348 -0.48137 0.39094 -1.57548
LYS_13 -4.69076 0.25868 5.29063 -0.29381 0.02174 0.12599 2.94757 -2.55294 -0.00141 -0.02689 -2.50797 -0.03765 0 0 0 0 0 0.03604 0.01914 1.71869 0 -0.01959 0 -1.5107 -0.47783 0.32416 -1.37691
PHE_14 -11.3805 1.79285 4.02341 -0.5504 0.3002 0.23842 3.0011 -3.43698 -0 -0 -2.21515 -0.16874 0 0 0 0 0 0.00901 0.0278 0 2.97419 0.04833 0 1.0402 -0.35383 0.51598 -4.13409
LYS_15 -6.05307 0.50979 5.82759 -0.30579 0.02541 0.13783 2.61273 -2.70403 -0 -0 -3.41334 -0.00958 0 0 0 -0.76596 0 0.07223 0.05149 1.66432 0 -0.08013 0 -1.5107 -0.32605 0.53299 -3.73429
GLU_16 -2.96882 0.32333 3.50406 -0.2058 0.02604 0.28345 1.16513 -1.62246 -0.00141 -0.02689 -0.32523 -0.54906 0 0 0 0 0 -0.04491 0.02355 0 3.11531 -0.11551 0 -2.7348 -0.14298 0.30422 0.00721
ALA_17 -3.55856 0.23378 1.62449 -0.02337 0 0 1.24312 -1.39793 -0 -0 -1.03946 -0.3121 0 0 0 0 0 -0.01043 0 0 0 -0.04028 0 1.8394 -0.01855 0.3541 -1.1058
PHE_18 -7.81507 0.95539 2.57017 -0.66328 0.08754 0.43389 2.13781 -2.33949 -0 -0 -1.00077 0.09706 0 0 0 0 0 0.30492 0.16277 0 2.15193 -0.26175 0 1.0402 -0.29214 0.93796 -1.49285
PRO_19 -3.59246 0.61165 2.2615 -0.09014 0.00141 0.05609 0.64495 -1.06847 -0 -0 -0.37039 0.65836 0 0 0 0 0 -0.14625 0.00306 0.579 0 -0.49579 0 -2.4119 -0.38838 1.0777 -2.67007
HIS_20 -6.55264 0.76558 7.2127 -0.52729 0.03267 0.43764 3.11036 -3.28346 -0.0258 -0.12825 -2.72475 -0.77479 0 0 -1.6976 0 0 0.18017 0.02038 0 1.51871 -0.01245 0 -0.45461 -0.31259 0.72585 -2.49019
VAL_21 -4.35334 0.21413 3.09925 -0.31994 0.28078 0.07384 1.40428 -1.7993 -0 -0 -0.43182 -0.03933 0 0 0 0 0 0.20459 0.00261 0.10008 0 -0.16825 0 1.9342 -0.08705 0.82511 0.93983
PHE_22 -5.20142 0.40562 4.07671 -0.66441 0.06272 0.35141 2.12222 -2.20596 -0 -0 -1.07822 0.13545 0 0 -0.70617 0 0 0.02727 0.01268 0 2.42155 -0.04096 0 1.0402 0.20986 0.8482 1.81676
ARG_23 -5.97816 0.51474 6.21097 -0.71284 0.09963 0.45224 2.11337 -2.83568 -0 -0 -1.3862 0.22795 0 0 -0.99143 0 0 -0.05172 0.05469 1.45233 0 -0.12833 0 -1.2888 -0.07708 0.71259 -1.61173
LEU_24 -9.32242 1.28174 6.05588 -0.72035 0.37891 0.26561 3.21026 -3.65888 -0.00402 -0.02714 -3.2105 0.19259 0 0 0 0 0 0.02587 0.01088 0.84263 0 -0.21734 0 0.18072 -0.27922 0.5498 -4.445
LYS_25 -4.63659 0.22171 5.32295 -0.29431 0.0239 0.12607 2.24902 -2.45248 -0.0258 -0.12825 -1.88591 -0.03245 0 0 0 0 0 0.03612 0.0391 1.68821 0 -0.02568 0 -1.5107 -0.24821 0.36192 -1.17139
LYS_26 -4.23782 0.21676 5.0721 -0.29989 0.02775 0.13169 2.30663 -2.33021 -0 -0 -2.05912 -0.00431 0 0 0 0 0 0.00591 0.00285 1.7675 0 0.02005 0 -1.5107 -0.38674 0.23084 -1.04671
TRP_27 -9.26495 1.04668 4.31496 -0.92532 0.02881 0.25859 2.52818 -2.98656 -0 -0 -2.08441 -0.46166 0 0 0 0 0 -0.02066 0.30558 0 2.26509 -0.19763 0 1.6906 -0.21415 0.33763 -3.37921
ILE_28 -7.98465 0.68519 3.99678 -0.50772 0.42511 0.10376 2.73913 -2.74475 -0 -0 -2.34185 -0.08913 0 0 0 0 0 -0.06125 0.00994 0.60956 0 -0.44885 0 0.73287 -0.0514 0.53774 -4.38953
GLN_29 -5.28858 0.44173 6.24447 -0.74467 0.08008 0.74553 3.00677 -3.03245 -0.00539 -0.03686 -3.38906 -0.79375 0 0 0 -0.71802 0 -0.01698 0.04623 0 2.9068 -0.16973 0 -0.18838 -0.16959 0.62155 -0.46031
LYS_30 -4.42264 0.25075 5.38015 -0.4121 0.05739 0.22248 2.56239 -2.50847 -0 -0 -2.51277 -0.12739 0 0 0 0 0 -0.00977 0.0108 1.935 0 0.04552 0 -1.5107 -0.24442 0.46092 -0.82287
VAL_31 -8.40005 1.10087 3.2946 -0.36329 0.34639 0.08622 2.80404 -2.86289 -0 -0 -1.80924 -0.18498 0 0 0 0 0 -0.04207 0.03968 0.92555 0 -0.03626 0 1.9342 -0.20341 1.09082 -2.27982
ILE_32 -7.1405 1.00393 5.00208 -0.56534 0.27069 0.16183 2.58849 -3.00416 -0.01018 -0.03429 -2.24049 0.17761 0 0 0 0 0 0.00499 0.16459 1.69508 0 -0.14587 0 0.73287 -0.1762 1.41411 -0.10076
ASP_33 -4.04973 0.24364 5.52829 -0.10302 0.00464 0.30779 1.92033 -2.50903 -0 -0 -2.23075 -0.34132 0 0 0 -0.71802 0 0.02381 0.00072 0 1.71771 0.19122 0 -2.3716 -0.20368 0.64531 -1.94368
GLN_34 -4.99209 0.32204 3.69013 -0.3986 0.11245 0.2639 1.55614 -2.01032 -0.00138 -0.00972 -1.21785 -0.56754 0 0 0 0 0 -0.01568 0.02559 0 3.16512 0.16055 0 -0.18838 -0.07634 0.33706 0.15508
PHE_35 -8.67992 0.96149 3.02577 -0.6586 0.13499 0.38793 2.41003 -2.4068 -0.00034 -0.00136 -1.73346 0.00646 0 0 0 0 0 8.05376 0 0 2.04403 -0.27391 0 1.0402 0.1078 13.0396 17.4577
GLY_36 -2.12812 0.08631 2.10904 -7e-05 0 0 0.81061 -1.10427 -0 -0 -1.15382 -0.27965 0 0 0 0 0 0.08227 0 0 0 -1.10395 0 0.83697 0.36384 13.7406 12.2597
GLU:CtermProteinFull_37 -5.2799 0.61379 7.3794 -0.36394 0.02092 0.50729 3.14727 -2.84852 -0.01843 -0.1142 -4.64826 -0.55693 0 0 -2.00767 0 0 0 0.03808 0 3.49877 0 0 -2.7348 0.32752 1.75399 -1.28562
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691860 DOMAINID 682971 MODEL 5 pep6_AB
MODEL     5
REMARK    Rerank model05.pdb score: 14.438
REMARK    S_0000_0001
REMARK    SCORE     hbond_lr_bb:          -1.032
REMARK    SCORE     hbond_sr_bb:         -30.162
REMARK    SCORE    fa_intra_rep:           0.473
REMARK    SCORE     total_score:        -103.282
REMARK    SCORE          fa_rep:          20.824
REMARK    SCORE          fa_atr:        -211.625
REMARK    SCORE          fa_dun:          53.079
REMARK    SCORE         p_aa_pp:          -7.357
REMARK    SCORE             ref:           6.830
REMARK    SCORE         fa_elec:         -73.682
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     cart_bonded:          18.549
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE fa_intra_sol_xover4:           8.192
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE        hbond_sc:          -5.510
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_sol:         132.967
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     rama_prepro:          -6.672
REMARK    SCORE     lk_ball_wtd:          -6.539
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           omega:           0.747
REMARK    SCORE           score:        -103.282
REMARK    SCORE     hbond_bb_sc:          -2.365
ATOM      1  N   ASP A   1       0.010  -0.210   0.393  1.00  1.72           N  
ATOM      2  CA  ASP A   1       1.467  -0.176   0.368  1.00  1.11           C  
ATOM      3  C   ASP A   1       1.992   1.246   0.267  1.00  0.95           C  
ATOM      4  O   ASP A   1       1.293   2.143  -0.236  1.00  0.88           O  
ATOM      5  CB  ASP A   1       2.042  -0.983  -0.802  1.00  1.79           C  
ATOM      6  CG  ASP A   1       3.548  -1.260  -0.616  1.00  1.79           C  
ATOM      7  OD1 ASP A   1       3.857  -2.215   0.039  1.00  1.79           O  
ATOM      8  OD2 ASP A   1       4.364  -0.464  -1.060  1.00  1.79           O  
ATOM      9 1H   ASP A   1      -0.321  -1.008  -0.131  1.00  2.06           H  
ATOM     10 2H   ASP A   1      -0.307  -0.282   1.350  1.00  2.06           H  
ATOM     11 3H   ASP A   1      -0.352   0.640  -0.019  1.00  2.06           H  
ATOM     12  HA  ASP A   1       1.836  -0.609   1.299  1.00  1.33           H  
ATOM     13 1HB  ASP A   1       1.517  -1.936  -0.886  1.00  2.15           H  
ATOM     14 2HB  ASP A   1       1.892  -0.440  -1.734  1.00  2.15           H  
ATOM     15  N   TRP A   2       3.223   1.423   0.751  1.00  0.95           N  
ATOM     16  CA  TRP A   2       3.941   2.686   0.743  1.00  0.88           C  
ATOM     17  C   TRP A   2       4.120   3.210  -0.657  1.00  0.77           C  
ATOM     18  O   TRP A   2       4.008   4.405  -0.894  1.00  0.73           O  
ATOM     19  CB  TRP A   2       5.325   2.548   1.379  1.00  1.26           C  
ATOM     20  CG  TRP A   2       6.112   3.845   1.378  1.00  1.26           C  
ATOM     21  CD1 TRP A   2       6.062   4.807   2.335  1.00  1.26           C  
ATOM     22  CD2 TRP A   2       7.066   4.324   0.382  1.00  1.26           C  
ATOM     23  NE1 TRP A   2       6.900   5.842   2.011  1.00  1.26           N  
ATOM     24  CE2 TRP A   2       7.521   5.562   0.821  1.00  1.26           C  
ATOM     25  CE3 TRP A   2       7.554   3.811  -0.817  1.00  1.26           C  
ATOM     26  CZ2 TRP A   2       8.443   6.298   0.100  1.00  1.26           C  
ATOM     27  CZ3 TRP A   2       8.464   4.550  -1.541  1.00  1.26           C  
ATOM     28  CH2 TRP A   2       8.899   5.760  -1.097  1.00  1.26           C  
ATOM     29  H   TRP A   2       3.710   0.615   1.131  1.00  1.14           H  
ATOM     30  HA  TRP A   2       3.367   3.416   1.313  1.00  1.06           H  
ATOM     31 1HB  TRP A   2       5.224   2.208   2.407  1.00  1.51           H  
ATOM     32 2HB  TRP A   2       5.899   1.795   0.836  1.00  1.51           H  
ATOM     33  HD1 TRP A   2       5.443   4.765   3.229  1.00  1.51           H  
ATOM     34  HE1 TRP A   2       7.041   6.677   2.561  1.00  1.51           H  
ATOM     35  HE3 TRP A   2       7.219   2.851  -1.173  1.00  1.51           H  
ATOM     36  HZ2 TRP A   2       8.801   7.271   0.437  1.00  1.51           H  
ATOM     37  HZ3 TRP A   2       8.828   4.141  -2.474  1.00  1.51           H  
ATOM     38  HH2 TRP A   2       9.618   6.321  -1.692  1.00  1.51           H  
ATOM     39  N   PHE A   3       4.478   2.343  -1.600  1.00  0.81           N  
ATOM     40  CA  PHE A   3       4.766   2.861  -2.923  1.00  0.80           C  
ATOM     41  C   PHE A   3       3.586   3.546  -3.551  1.00  0.71           C  
ATOM     42  O   PHE A   3       3.723   4.648  -4.072  1.00  0.66           O  
ATOM     43  CB  PHE A   3       5.269   1.750  -3.831  1.00  1.12           C  
ATOM     44  CG  PHE A   3       6.705   1.484  -3.663  1.00  1.12           C  
ATOM     45  CD1 PHE A   3       7.168   0.532  -2.773  1.00  1.12           C  
ATOM     46  CD2 PHE A   3       7.615   2.195  -4.417  1.00  1.12           C  
ATOM     47  CE1 PHE A   3       8.521   0.309  -2.636  1.00  1.12           C  
ATOM     48  CE2 PHE A   3       8.964   1.975  -4.288  1.00  1.12           C  
ATOM     49  CZ  PHE A   3       9.419   1.032  -3.391  1.00  1.12           C  
ATOM     50  H   PHE A   3       4.527   1.334  -1.392  1.00  0.97           H  
ATOM     51  HA  PHE A   3       5.558   3.601  -2.832  1.00  0.96           H  
ATOM     52 1HB  PHE A   3       4.724   0.828  -3.614  1.00  1.34           H  
ATOM     53 2HB  PHE A   3       5.094   2.009  -4.860  1.00  1.34           H  
ATOM     54  HD1 PHE A   3       6.451  -0.044  -2.172  1.00  1.34           H  
ATOM     55  HD2 PHE A   3       7.248   2.934  -5.122  1.00  1.34           H  
ATOM     56  HE1 PHE A   3       8.878  -0.440  -1.929  1.00  1.34           H  
ATOM     57  HE2 PHE A   3       9.675   2.543  -4.887  1.00  1.34           H  
ATOM     58  HZ  PHE A   3      10.488   0.855  -3.283  1.00  1.34           H  
ATOM     59  N   LYS A   4       2.404   2.964  -3.490  1.00  0.73           N  
ATOM     60  CA  LYS A   4       1.319   3.669  -4.125  1.00  0.71           C  
ATOM     61  C   LYS A   4       0.989   4.907  -3.317  1.00  0.61           C  
ATOM     62  O   LYS A   4       0.892   5.997  -3.871  1.00  0.59           O  
ATOM     63  CB  LYS A   4       0.090   2.792  -4.314  1.00  1.01           C  
ATOM     64  CG  LYS A   4      -1.023   3.486  -5.114  1.00  1.01           C  
ATOM     65  CD  LYS A   4      -2.192   2.542  -5.398  1.00  1.01           C  
ATOM     66  CE  LYS A   4      -3.215   3.140  -6.408  1.00  1.01           C  
ATOM     67  NZ  LYS A   4      -4.006   4.300  -5.875  1.00  1.01           N  
ATOM     68  H   LYS A   4       2.280   2.064  -3.052  1.00  0.88           H  
ATOM     69  HA  LYS A   4       1.645   4.005  -5.109  1.00  0.85           H  
ATOM     70 1HB  LYS A   4       0.370   1.879  -4.830  1.00  1.21           H  
ATOM     71 2HB  LYS A   4      -0.313   2.516  -3.340  1.00  1.21           H  
ATOM     72 1HG  LYS A   4      -1.391   4.348  -4.549  1.00  1.21           H  
ATOM     73 2HG  LYS A   4      -0.615   3.857  -6.056  1.00  1.21           H  
ATOM     74 1HD  LYS A   4      -1.807   1.607  -5.806  1.00  1.21           H  
ATOM     75 2HD  LYS A   4      -2.710   2.324  -4.464  1.00  1.21           H  
ATOM     76 1HE  LYS A   4      -2.684   3.470  -7.298  1.00  1.21           H  
ATOM     77 2HE  LYS A   4      -3.911   2.352  -6.688  1.00  1.21           H  
ATOM     78 1HZ  LYS A   4      -4.662   4.597  -6.624  1.00  1.21           H  
ATOM     79 2HZ  LYS A   4      -4.531   4.024  -5.072  1.00  1.21           H  
ATOM     80 3HZ  LYS A   4      -3.410   5.114  -5.616  1.00  1.21           H  
ATOM     81  N   ALA A   5       0.861   4.782  -1.988  1.00  0.61           N  
ATOM     82  CA  ALA A   5       0.462   5.951  -1.217  1.00  0.62           C  
ATOM     83  C   ALA A   5       1.431   7.117  -1.379  1.00  0.55           C  
ATOM     84  O   ALA A   5       0.999   8.263  -1.531  1.00  0.56           O  
ATOM     85  CB  ALA A   5       0.368   5.585   0.250  1.00  0.86           C  
ATOM     86  H   ALA A   5       0.984   3.879  -1.520  1.00  0.73           H  
ATOM     87  HA  ALA A   5      -0.516   6.271  -1.575  1.00  0.74           H  
ATOM     88 1HB  ALA A   5       0.042   6.449   0.820  1.00  1.03           H  
ATOM     89 2HB  ALA A   5      -0.343   4.770   0.376  1.00  1.03           H  
ATOM     90 3HB  ALA A   5       1.351   5.263   0.598  1.00  1.03           H  
ATOM     91  N   PHE A   6       2.734   6.833  -1.368  1.00  0.56           N  
ATOM     92  CA  PHE A   6       3.750   7.850  -1.532  1.00  0.59           C  
ATOM     93  C   PHE A   6       3.619   8.532  -2.866  1.00  0.52           C  
ATOM     94  O   PHE A   6       3.538   9.760  -2.942  1.00  0.53           O  
ATOM     95  CB  PHE A   6       5.134   7.244  -1.401  1.00  0.81           C  
ATOM     96  CG  PHE A   6       6.237   8.188  -1.704  1.00  0.81           C  
ATOM     97  CD1 PHE A   6       6.637   9.139  -0.791  1.00  0.81           C  
ATOM     98  CD2 PHE A   6       6.884   8.119  -2.919  1.00  0.81           C  
ATOM     99  CE1 PHE A   6       7.668   9.999  -1.094  1.00  0.81           C  
ATOM    100  CE2 PHE A   6       7.901   8.965  -3.232  1.00  0.81           C  
ATOM    101  CZ  PHE A   6       8.300   9.912  -2.317  1.00  0.81           C  
ATOM    102  H   PHE A   6       3.047   5.874  -1.228  1.00  0.67           H  
ATOM    103  HA  PHE A   6       3.615   8.597  -0.750  1.00  0.71           H  
ATOM    104 1HB  PHE A   6       5.261   6.871  -0.389  1.00  0.97           H  
ATOM    105 2HB  PHE A   6       5.224   6.383  -2.067  1.00  0.97           H  
ATOM    106  HD1 PHE A   6       6.135   9.202   0.174  1.00  0.97           H  
ATOM    107  HD2 PHE A   6       6.573   7.379  -3.624  1.00  0.97           H  
ATOM    108  HE1 PHE A   6       7.983  10.751  -0.372  1.00  0.97           H  
ATOM    109  HE2 PHE A   6       8.397   8.892  -4.200  1.00  0.97           H  
ATOM    110  HZ  PHE A   6       9.114  10.593  -2.558  1.00  0.97           H  
ATOM    111  N   TYR A   7       3.591   7.739  -3.930  1.00  0.51           N  
ATOM    112  CA  TYR A   7       3.514   8.292  -5.256  1.00  0.54           C  
ATOM    113  C   TYR A   7       2.237   9.093  -5.484  1.00  0.48           C  
ATOM    114  O   TYR A   7       2.296  10.165  -6.095  1.00  0.51           O  
ATOM    115  CB  TYR A   7       3.692   7.171  -6.260  1.00  0.75           C  
ATOM    116  CG  TYR A   7       5.167   6.828  -6.565  1.00  0.75           C  
ATOM    117  CD1 TYR A   7       5.949   5.981  -5.783  1.00  0.75           C  
ATOM    118  CD2 TYR A   7       5.701   7.359  -7.676  1.00  0.75           C  
ATOM    119  CE1 TYR A   7       7.249   5.713  -6.138  1.00  0.75           C  
ATOM    120  CE2 TYR A   7       6.989   7.095  -8.049  1.00  0.75           C  
ATOM    121  CZ  TYR A   7       7.767   6.277  -7.285  1.00  0.75           C  
ATOM    122  OH  TYR A   7       9.066   6.021  -7.658  1.00  0.75           O  
ATOM    123  H   TYR A   7       3.629   6.721  -3.824  1.00  0.61           H  
ATOM    124  HA  TYR A   7       4.351   8.975  -5.374  1.00  0.65           H  
ATOM    125 1HB  TYR A   7       3.195   6.277  -5.890  1.00  0.90           H  
ATOM    126 2HB  TYR A   7       3.211   7.442  -7.171  1.00  0.90           H  
ATOM    127  HD1 TYR A   7       5.570   5.543  -4.895  1.00  0.90           H  
ATOM    128  HD2 TYR A   7       5.091   8.003  -8.271  1.00  0.90           H  
ATOM    129  HE1 TYR A   7       7.864   5.065  -5.520  1.00  0.90           H  
ATOM    130  HE2 TYR A   7       7.395   7.543  -8.958  1.00  0.90           H  
ATOM    131  HH  TYR A   7       9.477   5.431  -7.021  1.00  0.90           H  
ATOM    132  N   ASP A   8       1.085   8.613  -4.987  1.00  0.47           N  
ATOM    133  CA  ASP A   8      -0.152   9.361  -5.167  1.00  0.52           C  
ATOM    134  C   ASP A   8      -0.102  10.708  -4.456  1.00  0.48           C  
ATOM    135  O   ASP A   8      -0.532  11.718  -5.026  1.00  0.53           O  
ATOM    136  CB  ASP A   8      -1.368   8.600  -4.621  1.00  0.71           C  
ATOM    137  CG  ASP A   8      -1.846   7.394  -5.452  1.00  0.71           C  
ATOM    138  OD1 ASP A   8      -1.410   7.217  -6.561  1.00  0.71           O  
ATOM    139  OD2 ASP A   8      -2.703   6.674  -4.957  1.00  0.71           O  
ATOM    140  H   ASP A   8       1.066   7.707  -4.512  1.00  0.56           H  
ATOM    141  HA  ASP A   8      -0.296   9.535  -6.231  1.00  0.62           H  
ATOM    142 1HB  ASP A   8      -1.118   8.231  -3.621  1.00  0.85           H  
ATOM    143 2HB  ASP A   8      -2.201   9.292  -4.507  1.00  0.85           H  
ATOM    144  N   LYS A   9       0.440  10.739  -3.230  1.00  0.46           N  
ATOM    145  CA  LYS A   9       0.544  11.987  -2.484  1.00  0.52           C  
ATOM    146  C   LYS A   9       1.466  12.973  -3.183  1.00  0.51           C  
ATOM    147  O   LYS A   9       1.156  14.168  -3.271  1.00  0.60           O  
ATOM    148  CB  LYS A   9       1.024  11.727  -1.059  1.00  0.70           C  
ATOM    149  CG  LYS A   9      -0.014  11.047  -0.163  1.00  0.70           C  
ATOM    150  CD  LYS A   9       0.542  10.760   1.227  1.00  0.70           C  
ATOM    151  CE  LYS A   9      -0.490  10.058   2.107  1.00  0.70           C  
ATOM    152  NZ  LYS A   9       0.050   9.750   3.465  1.00  0.70           N  
ATOM    153  H   LYS A   9       0.742   9.859  -2.794  1.00  0.55           H  
ATOM    154  HA  LYS A   9      -0.448  12.440  -2.437  1.00  0.62           H  
ATOM    155 1HB  LYS A   9       1.906  11.078  -1.095  1.00  0.84           H  
ATOM    156 2HB  LYS A   9       1.324  12.664  -0.594  1.00  0.84           H  
ATOM    157 1HG  LYS A   9      -0.879  11.701  -0.070  1.00  0.84           H  
ATOM    158 2HG  LYS A   9      -0.342  10.121  -0.622  1.00  0.84           H  
ATOM    159 1HD  LYS A   9       1.420  10.116   1.134  1.00  0.84           H  
ATOM    160 2HD  LYS A   9       0.843  11.692   1.704  1.00  0.84           H  
ATOM    161 1HE  LYS A   9      -1.364  10.699   2.211  1.00  0.84           H  
ATOM    162 2HE  LYS A   9      -0.789   9.126   1.625  1.00  0.84           H  
ATOM    163 1HZ  LYS A   9      -0.661   9.285   4.014  1.00  0.84           H  
ATOM    164 2HZ  LYS A   9       0.855   9.145   3.378  1.00  0.84           H  
ATOM    165 3HZ  LYS A   9       0.321  10.607   3.926  1.00  0.84           H  
ATOM    166  N   VAL A  10       2.585  12.472  -3.709  1.00  0.49           N  
ATOM    167  CA  VAL A  10       3.518  13.319  -4.423  1.00  0.55           C  
ATOM    168  C   VAL A  10       2.863  13.875  -5.676  1.00  0.50           C  
ATOM    169  O   VAL A  10       3.040  15.054  -5.982  1.00  0.54           O  
ATOM    170  CB  VAL A  10       4.816  12.572  -4.750  1.00  0.75           C  
ATOM    171  CG1 VAL A  10       5.686  13.415  -5.676  1.00  0.75           C  
ATOM    172  CG2 VAL A  10       5.581  12.284  -3.470  1.00  0.75           C  
ATOM    173  H   VAL A  10       2.799  11.477  -3.578  1.00  0.59           H  
ATOM    174  HA  VAL A  10       3.779  14.154  -3.775  1.00  0.66           H  
ATOM    175  HB  VAL A  10       4.573  11.645  -5.231  1.00  0.90           H  
ATOM    176 1HG1 VAL A  10       6.603  12.877  -5.906  1.00  0.90           H  
ATOM    177 2HG1 VAL A  10       5.160  13.621  -6.600  1.00  0.90           H  
ATOM    178 3HG1 VAL A  10       5.931  14.358  -5.187  1.00  0.90           H  
ATOM    179 1HG2 VAL A  10       6.491  11.746  -3.711  1.00  0.90           H  
ATOM    180 2HG2 VAL A  10       5.832  13.220  -2.978  1.00  0.90           H  
ATOM    181 3HG2 VAL A  10       4.981  11.684  -2.802  1.00  0.90           H  
ATOM    182  N   ALA A  11       2.132  13.040  -6.427  1.00  0.49           N  
ATOM    183  CA  ALA A  11       1.473  13.532  -7.622  1.00  0.53           C  
ATOM    184  C   ALA A  11       0.504  14.660  -7.298  1.00  0.54           C  
ATOM    185  O   ALA A  11       0.494  15.671  -8.006  1.00  0.60           O  
ATOM    186  CB  ALA A  11       0.713  12.405  -8.304  1.00  0.73           C  
ATOM    187  H   ALA A  11       2.054  12.050  -6.171  1.00  0.59           H  
ATOM    188  HA  ALA A  11       2.236  13.928  -8.289  1.00  0.64           H  
ATOM    189 1HB  ALA A  11       0.231  12.779  -9.197  1.00  0.88           H  
ATOM    190 2HB  ALA A  11       1.385  11.593  -8.566  1.00  0.88           H  
ATOM    191 3HB  ALA A  11      -0.046  12.027  -7.620  1.00  0.88           H  
ATOM    192  N   GLU A  12      -0.270  14.534  -6.207  1.00  0.55           N  
ATOM    193  CA  GLU A  12      -1.211  15.604  -5.881  1.00  0.64           C  
ATOM    194  C   GLU A  12      -0.460  16.873  -5.492  1.00  0.67           C  
ATOM    195  O   GLU A  12      -0.856  17.984  -5.877  1.00  0.76           O  
ATOM    196  CB  GLU A  12      -2.168  15.175  -4.768  1.00  0.86           C  
ATOM    197  CG  GLU A  12      -3.151  14.075  -5.187  1.00  0.86           C  
ATOM    198  CD  GLU A  12      -4.051  14.480  -6.332  1.00  0.86           C  
ATOM    199  OE1 GLU A  12      -4.731  15.467  -6.228  1.00  0.86           O  
ATOM    200  OE2 GLU A  12      -4.009  13.810  -7.343  1.00  0.86           O  
ATOM    201  H   GLU A  12      -0.256  13.663  -5.662  1.00  0.66           H  
ATOM    202  HA  GLU A  12      -1.800  15.822  -6.771  1.00  0.77           H  
ATOM    203 1HB  GLU A  12      -1.586  14.797  -3.924  1.00  1.03           H  
ATOM    204 2HB  GLU A  12      -2.737  16.035  -4.421  1.00  1.03           H  
ATOM    205 1HG  GLU A  12      -2.586  13.195  -5.485  1.00  1.03           H  
ATOM    206 2HG  GLU A  12      -3.761  13.804  -4.327  1.00  1.03           H  
ATOM    207  N   LYS A  13       0.651  16.715  -4.758  1.00  0.67           N  
ATOM    208  CA  LYS A  13       1.455  17.858  -4.384  1.00  0.81           C  
ATOM    209  C   LYS A  13       1.927  18.566  -5.627  1.00  0.79           C  
ATOM    210  O   LYS A  13       1.823  19.784  -5.722  1.00  0.95           O  
ATOM    211  CB  LYS A  13       2.674  17.459  -3.549  1.00  1.08           C  
ATOM    212  CG  LYS A  13       3.564  18.646  -3.131  1.00  1.08           C  
ATOM    213  CD  LYS A  13       4.739  18.191  -2.271  1.00  1.08           C  
ATOM    214  CE  LYS A  13       5.654  19.363  -1.920  1.00  1.08           C  
ATOM    215  NZ  LYS A  13       6.812  18.938  -1.078  1.00  1.08           N  
ATOM    216  H   LYS A  13       0.905  15.781  -4.420  1.00  0.80           H  
ATOM    217  HA  LYS A  13       0.839  18.552  -3.812  1.00  0.97           H  
ATOM    218 1HB  LYS A  13       2.344  16.931  -2.655  1.00  1.30           H  
ATOM    219 2HB  LYS A  13       3.291  16.770  -4.122  1.00  1.30           H  
ATOM    220 1HG  LYS A  13       3.961  19.137  -4.022  1.00  1.30           H  
ATOM    221 2HG  LYS A  13       2.967  19.371  -2.577  1.00  1.30           H  
ATOM    222 1HD  LYS A  13       4.364  17.743  -1.349  1.00  1.30           H  
ATOM    223 2HD  LYS A  13       5.312  17.438  -2.815  1.00  1.30           H  
ATOM    224 1HE  LYS A  13       6.030  19.806  -2.843  1.00  1.30           H  
ATOM    225 2HE  LYS A  13       5.079  20.114  -1.378  1.00  1.30           H  
ATOM    226 1HZ  LYS A  13       7.391  19.742  -0.871  1.00  1.30           H  
ATOM    227 2HZ  LYS A  13       6.475  18.538  -0.214  1.00  1.30           H  
ATOM    228 3HZ  LYS A  13       7.361  18.251  -1.573  1.00  1.30           H  
ATOM    229  N   PHE A  14       2.450  17.809  -6.594  1.00  0.66           N  
ATOM    230  CA  PHE A  14       2.957  18.418  -7.804  1.00  0.73           C  
ATOM    231  C   PHE A  14       1.878  19.163  -8.573  1.00  0.64           C  
ATOM    232  O   PHE A  14       2.101  20.290  -9.022  1.00  0.73           O  
ATOM    233  CB  PHE A  14       3.563  17.366  -8.731  1.00  1.00           C  
ATOM    234  CG  PHE A  14       4.880  16.751  -8.341  1.00  1.00           C  
ATOM    235  CD1 PHE A  14       5.714  17.276  -7.348  1.00  1.00           C  
ATOM    236  CD2 PHE A  14       5.303  15.620  -9.015  1.00  1.00           C  
ATOM    237  CE1 PHE A  14       6.914  16.680  -7.064  1.00  1.00           C  
ATOM    238  CE2 PHE A  14       6.504  15.034  -8.719  1.00  1.00           C  
ATOM    239  CZ  PHE A  14       7.307  15.560  -7.747  1.00  1.00           C  
ATOM    240  H   PHE A  14       2.535  16.797  -6.456  1.00  0.79           H  
ATOM    241  HA  PHE A  14       3.698  19.143  -7.522  1.00  0.88           H  
ATOM    242 1HB  PHE A  14       2.859  16.554  -8.775  1.00  1.20           H  
ATOM    243 2HB  PHE A  14       3.658  17.778  -9.735  1.00  1.20           H  
ATOM    244  HD1 PHE A  14       5.429  18.152  -6.789  1.00  1.20           H  
ATOM    245  HD2 PHE A  14       4.674  15.199  -9.797  1.00  1.20           H  
ATOM    246  HE1 PHE A  14       7.555  17.096  -6.289  1.00  1.20           H  
ATOM    247  HE2 PHE A  14       6.833  14.155  -9.251  1.00  1.20           H  
ATOM    248  HZ  PHE A  14       8.261  15.088  -7.520  1.00  1.20           H  
ATOM    249  N   LYS A  15       0.674  18.597  -8.669  1.00  0.62           N  
ATOM    250  CA  LYS A  15      -0.394  19.260  -9.417  1.00  0.72           C  
ATOM    251  C   LYS A  15      -0.634  20.696  -8.945  1.00  0.82           C  
ATOM    252  O   LYS A  15      -0.908  21.575  -9.764  1.00  0.96           O  
ATOM    253  CB  LYS A  15      -1.707  18.481  -9.304  1.00  0.97           C  
ATOM    254  CG  LYS A  15      -1.756  17.164 -10.061  1.00  0.97           C  
ATOM    255  CD  LYS A  15      -3.073  16.442  -9.816  1.00  0.97           C  
ATOM    256  CE  LYS A  15      -3.125  15.089 -10.509  1.00  0.97           C  
ATOM    257  NZ  LYS A  15      -4.370  14.344 -10.144  1.00  0.97           N  
ATOM    258  H   LYS A  15       0.528  17.655  -8.284  1.00  0.74           H  
ATOM    259  HA  LYS A  15      -0.099  19.299 -10.465  1.00  0.86           H  
ATOM    260 1HB  LYS A  15      -1.895  18.255  -8.251  1.00  1.16           H  
ATOM    261 2HB  LYS A  15      -2.528  19.105  -9.650  1.00  1.16           H  
ATOM    262 1HG  LYS A  15      -1.631  17.347 -11.130  1.00  1.16           H  
ATOM    263 2HG  LYS A  15      -0.956  16.539  -9.726  1.00  1.16           H  
ATOM    264 1HD  LYS A  15      -3.206  16.283  -8.742  1.00  1.16           H  
ATOM    265 2HD  LYS A  15      -3.896  17.053 -10.175  1.00  1.16           H  
ATOM    266 1HE  LYS A  15      -3.103  15.240 -11.587  1.00  1.16           H  
ATOM    267 2HE  LYS A  15      -2.257  14.497 -10.214  1.00  1.16           H  
ATOM    268 1HZ  LYS A  15      -4.387  13.452 -10.606  1.00  1.16           H  
ATOM    269 2HZ  LYS A  15      -4.366  14.197  -9.112  1.00  1.16           H  
ATOM    270 3HZ  LYS A  15      -5.185  14.874 -10.405  1.00  1.16           H  
ATOM    271  N   GLU A  16      -0.562  20.936  -7.630  1.00  0.88           N  
ATOM    272  CA  GLU A  16      -0.777  22.298  -7.132  1.00  1.09           C  
ATOM    273  C   GLU A  16       0.518  23.107  -6.928  1.00  1.10           C  
ATOM    274  O   GLU A  16       0.525  24.322  -7.137  1.00  1.33           O  
ATOM    275  CB  GLU A  16      -1.560  22.268  -5.819  1.00  1.44           C  
ATOM    276  CG  GLU A  16      -2.993  21.750  -5.943  1.00  1.44           C  
ATOM    277  CD  GLU A  16      -3.734  21.754  -4.629  1.00  1.44           C  
ATOM    278  OE1 GLU A  16      -3.132  22.087  -3.633  1.00  1.44           O  
ATOM    279  OE2 GLU A  16      -4.898  21.429  -4.621  1.00  1.44           O  
ATOM    280  H   GLU A  16      -0.385  20.148  -6.992  1.00  1.06           H  
ATOM    281  HA  GLU A  16      -1.378  22.829  -7.866  1.00  1.31           H  
ATOM    282 1HB  GLU A  16      -1.036  21.629  -5.107  1.00  1.73           H  
ATOM    283 2HB  GLU A  16      -1.597  23.271  -5.395  1.00  1.73           H  
ATOM    284 1HG  GLU A  16      -3.531  22.370  -6.658  1.00  1.73           H  
ATOM    285 2HG  GLU A  16      -2.961  20.733  -6.337  1.00  1.73           H  
ATOM    286  N   ALA A  17       1.592  22.451  -6.469  1.00  0.99           N  
ATOM    287  CA  ALA A  17       2.886  23.078  -6.193  1.00  1.13           C  
ATOM    288  C   ALA A  17       3.595  23.550  -7.455  1.00  1.10           C  
ATOM    289  O   ALA A  17       4.275  24.580  -7.456  1.00  1.33           O  
ATOM    290  CB  ALA A  17       3.791  22.102  -5.457  1.00  1.53           C  
ATOM    291  H   ALA A  17       1.520  21.452  -6.294  1.00  1.19           H  
ATOM    292  HA  ALA A  17       2.706  23.946  -5.562  1.00  1.36           H  
ATOM    293 1HB  ALA A  17       4.738  22.585  -5.229  1.00  1.84           H  
ATOM    294 2HB  ALA A  17       3.307  21.784  -4.537  1.00  1.84           H  
ATOM    295 3HB  ALA A  17       3.964  21.238  -6.086  1.00  1.84           H  
ATOM    296  N   PHE A  18       3.450  22.777  -8.528  1.00  0.86           N  
ATOM    297  CA  PHE A  18       4.114  23.010  -9.788  1.00  0.89           C  
ATOM    298  C   PHE A  18       3.126  23.004 -10.963  1.00  0.73           C  
ATOM    299  O   PHE A  18       3.266  22.177 -11.878  1.00  0.74           O  
ATOM    300  CB  PHE A  18       5.165  21.939  -9.975  1.00  1.24           C  
ATOM    301  CG  PHE A  18       6.181  21.910  -8.879  1.00  1.24           C  
ATOM    302  CD1 PHE A  18       6.150  20.912  -7.948  1.00  1.24           C  
ATOM    303  CD2 PHE A  18       7.146  22.884  -8.767  1.00  1.24           C  
ATOM    304  CE1 PHE A  18       7.048  20.854  -6.920  1.00  1.24           C  
ATOM    305  CE2 PHE A  18       8.058  22.845  -7.739  1.00  1.24           C  
ATOM    306  CZ  PHE A  18       8.007  21.823  -6.810  1.00  1.24           C  
ATOM    307  H   PHE A  18       2.862  21.944  -8.475  1.00  1.03           H  
ATOM    308  HA  PHE A  18       4.628  23.966  -9.743  1.00  1.07           H  
ATOM    309 1HB  PHE A  18       4.676  20.961 -10.017  1.00  1.49           H  
ATOM    310 2HB  PHE A  18       5.656  22.084 -10.877  1.00  1.49           H  
ATOM    311  HD1 PHE A  18       5.407  20.166  -8.049  1.00  1.49           H  
ATOM    312  HD2 PHE A  18       7.181  23.692  -9.496  1.00  1.49           H  
ATOM    313  HE1 PHE A  18       7.002  20.044  -6.195  1.00  1.49           H  
ATOM    314  HE2 PHE A  18       8.819  23.622  -7.650  1.00  1.49           H  
ATOM    315  HZ  PHE A  18       8.729  21.794  -5.996  1.00  1.49           H  
ATOM    316  N   PRO A  19       2.148  23.937 -10.991  1.00  0.87           N  
ATOM    317  CA  PRO A  19       1.017  23.979 -11.906  1.00  0.96           C  
ATOM    318  C   PRO A  19       1.427  24.085 -13.370  1.00  0.96           C  
ATOM    319  O   PRO A  19       0.629  23.768 -14.266  1.00  1.12           O  
ATOM    320  CB  PRO A  19       0.254  25.230 -11.447  1.00  1.44           C  
ATOM    321  CG  PRO A  19       1.282  26.081 -10.740  1.00  1.44           C  
ATOM    322  CD  PRO A  19       2.201  25.101 -10.077  1.00  1.44           C  
ATOM    323  HA  PRO A  19       0.403  23.078 -11.743  1.00  1.15           H  
ATOM    324 1HB  PRO A  19      -0.196  25.734 -12.318  1.00  1.73           H  
ATOM    325 2HB  PRO A  19      -0.574  24.930 -10.784  1.00  1.73           H  
ATOM    326 1HG  PRO A  19       1.797  26.734 -11.449  1.00  1.73           H  
ATOM    327 2HG  PRO A  19       0.783  26.738 -10.012  1.00  1.73           H  
ATOM    328 1HD  PRO A  19       3.195  25.545  -9.998  1.00  1.73           H  
ATOM    329 2HD  PRO A  19       1.788  24.847  -9.108  1.00  1.73           H  
ATOM    330  N   HIS A  20       2.660  24.548 -13.625  1.00  0.97           N  
ATOM    331  CA  HIS A  20       3.115  24.655 -14.989  1.00  1.10           C  
ATOM    332  C   HIS A  20       4.513  24.062 -15.173  1.00  1.05           C  
ATOM    333  O   HIS A  20       5.336  24.637 -15.889  1.00  1.31           O  
ATOM    334  CB  HIS A  20       3.146  26.132 -15.399  1.00  1.49           C  
ATOM    335  CG  HIS A  20       1.814  26.817 -15.294  1.00  1.49           C  
ATOM    336  ND1 HIS A  20       0.802  26.642 -16.213  1.00  1.49           N  
ATOM    337  CD2 HIS A  20       1.332  27.672 -14.363  1.00  1.49           C  
ATOM    338  CE1 HIS A  20      -0.246  27.359 -15.846  1.00  1.49           C  
ATOM    339  NE2 HIS A  20       0.052  27.994 -14.728  1.00  1.49           N  
ATOM    340  H   HIS A  20       3.282  24.810 -12.877  1.00  1.16           H  
ATOM    341  HA  HIS A  20       2.439  24.123 -15.650  1.00  1.32           H  
ATOM    342 1HB  HIS A  20       3.855  26.666 -14.767  1.00  1.79           H  
ATOM    343 2HB  HIS A  20       3.492  26.219 -16.428  1.00  1.79           H  
ATOM    344  HD1 HIS A  20       0.924  26.298 -17.144  1.00  1.79           H  
ATOM    345  HD2 HIS A  20       1.763  28.097 -13.459  1.00  1.79           H  
ATOM    346  HE1 HIS A  20      -1.157  27.356 -16.444  1.00  1.79           H  
ATOM    347  N   VAL A  21       4.757  22.863 -14.628  1.00  1.04           N  
ATOM    348  CA  VAL A  21       6.047  22.214 -14.863  1.00  1.21           C  
ATOM    349  C   VAL A  21       5.921  20.915 -15.652  1.00  1.01           C  
ATOM    350  O   VAL A  21       5.490  19.884 -15.124  1.00  1.05           O  
ATOM    351  CB  VAL A  21       6.760  21.949 -13.530  1.00  1.63           C  
ATOM    352  CG1 VAL A  21       8.072  21.250 -13.763  1.00  1.63           C  
ATOM    353  CG2 VAL A  21       7.009  23.281 -12.828  1.00  1.63           C  
ATOM    354  H   VAL A  21       4.075  22.444 -13.987  1.00  1.25           H  
ATOM    355  HA  VAL A  21       6.671  22.896 -15.439  1.00  1.45           H  
ATOM    356  HB  VAL A  21       6.143  21.302 -12.917  1.00  1.96           H  
ATOM    357 1HG1 VAL A  21       8.555  21.076 -12.804  1.00  1.96           H  
ATOM    358 2HG1 VAL A  21       7.902  20.307 -14.250  1.00  1.96           H  
ATOM    359 3HG1 VAL A  21       8.710  21.873 -14.382  1.00  1.96           H  
ATOM    360 1HG2 VAL A  21       7.520  23.105 -11.887  1.00  1.96           H  
ATOM    361 2HG2 VAL A  21       7.628  23.911 -13.465  1.00  1.96           H  
ATOM    362 3HG2 VAL A  21       6.063  23.782 -12.640  1.00  1.96           H  
ATOM    363  N   PHE A  22       6.427  20.946 -16.883  1.00  0.93           N  
ATOM    364  CA  PHE A  22       6.314  19.831 -17.822  1.00  0.87           C  
ATOM    365  C   PHE A  22       6.842  18.508 -17.299  1.00  0.84           C  
ATOM    366  O   PHE A  22       6.133  17.501 -17.327  1.00  0.90           O  
ATOM    367  CB  PHE A  22       7.049  20.168 -19.116  1.00  1.24           C  
ATOM    368  CG  PHE A  22       7.094  19.041 -20.106  1.00  1.24           C  
ATOM    369  CD1 PHE A  22       6.000  18.754 -20.904  1.00  1.24           C  
ATOM    370  CD2 PHE A  22       8.242  18.269 -20.250  1.00  1.24           C  
ATOM    371  CE1 PHE A  22       6.049  17.727 -21.817  1.00  1.24           C  
ATOM    372  CE2 PHE A  22       8.289  17.244 -21.161  1.00  1.24           C  
ATOM    373  CZ  PHE A  22       7.193  16.973 -21.947  1.00  1.24           C  
ATOM    374  H   PHE A  22       6.823  21.823 -17.201  1.00  1.12           H  
ATOM    375  HA  PHE A  22       5.255  19.698 -18.051  1.00  1.04           H  
ATOM    376 1HB  PHE A  22       6.566  21.018 -19.594  1.00  1.49           H  
ATOM    377 2HB  PHE A  22       8.071  20.461 -18.892  1.00  1.49           H  
ATOM    378  HD1 PHE A  22       5.094  19.350 -20.803  1.00  1.49           H  
ATOM    379  HD2 PHE A  22       9.114  18.481 -19.633  1.00  1.49           H  
ATOM    380  HE1 PHE A  22       5.181  17.511 -22.438  1.00  1.49           H  
ATOM    381  HE2 PHE A  22       9.194  16.645 -21.263  1.00  1.49           H  
ATOM    382  HZ  PHE A  22       7.229  16.160 -22.669  1.00  1.49           H  
ATOM    383  N   ARG A  23       8.074  18.498 -16.795  1.00  0.87           N  
ATOM    384  CA  ARG A  23       8.651  17.234 -16.358  1.00  0.97           C  
ATOM    385  C   ARG A  23       7.867  16.575 -15.223  1.00  0.91           C  
ATOM    386  O   ARG A  23       7.956  15.359 -15.042  1.00  1.04           O  
ATOM    387  CB  ARG A  23      10.093  17.398 -15.878  1.00  1.32           C  
ATOM    388  CG  ARG A  23      10.245  18.143 -14.564  1.00  1.32           C  
ATOM    389  CD  ARG A  23      11.636  18.371 -14.157  1.00  1.32           C  
ATOM    390  NE  ARG A  23      11.684  19.010 -12.833  1.00  1.32           N  
ATOM    391  CZ  ARG A  23      11.601  20.338 -12.581  1.00  1.32           C  
ATOM    392  NH1 ARG A  23      11.489  21.210 -13.564  1.00  1.32           N  
ATOM    393  NH2 ARG A  23      11.636  20.766 -11.328  1.00  1.32           N  
ATOM    394  H   ARG A  23       8.615  19.348 -16.774  1.00  1.04           H  
ATOM    395  HA  ARG A  23       8.649  16.556 -17.211  1.00  1.16           H  
ATOM    396 1HB  ARG A  23      10.548  16.415 -15.756  1.00  1.58           H  
ATOM    397 2HB  ARG A  23      10.667  17.934 -16.634  1.00  1.58           H  
ATOM    398 1HG  ARG A  23       9.760  19.094 -14.637  1.00  1.58           H  
ATOM    399 2HG  ARG A  23       9.795  17.564 -13.773  1.00  1.58           H  
ATOM    400 1HD  ARG A  23      12.148  17.410 -14.088  1.00  1.58           H  
ATOM    401 2HD  ARG A  23      12.149  19.004 -14.877  1.00  1.58           H  
ATOM    402  HE  ARG A  23      11.771  18.394 -12.034  1.00  1.58           H  
ATOM    403 1HH1 ARG A  23      11.465  20.898 -14.520  1.00  1.58           H  
ATOM    404 2HH1 ARG A  23      11.430  22.199 -13.358  1.00  1.58           H  
ATOM    405 1HH2 ARG A  23      11.725  20.104 -10.569  1.00  1.58           H  
ATOM    406 2HH2 ARG A  23      11.576  21.754 -11.127  1.00  1.58           H  
ATOM    407  N   LEU A  24       7.112  17.353 -14.442  1.00  0.83           N  
ATOM    408  CA  LEU A  24       6.429  16.751 -13.324  1.00  0.91           C  
ATOM    409  C   LEU A  24       5.098  16.253 -13.817  1.00  0.79           C  
ATOM    410  O   LEU A  24       4.644  15.186 -13.407  1.00  0.74           O  
ATOM    411  CB  LEU A  24       6.327  17.740 -12.171  1.00  1.24           C  
ATOM    412  CG  LEU A  24       7.721  18.230 -11.611  1.00  1.24           C  
ATOM    413  CD1 LEU A  24       7.482  19.212 -10.550  1.00  1.24           C  
ATOM    414  CD2 LEU A  24       8.564  17.087 -11.086  1.00  1.24           C  
ATOM    415  H   LEU A  24       6.970  18.342 -14.642  1.00  1.00           H  
ATOM    416  HA  LEU A  24       6.986  15.887 -12.988  1.00  1.09           H  
ATOM    417 1HB  LEU A  24       5.776  18.619 -12.517  1.00  1.49           H  
ATOM    418 2HB  LEU A  24       5.773  17.283 -11.361  1.00  1.49           H  
ATOM    419  HG  LEU A  24       8.259  18.720 -12.398  1.00  1.49           H  
ATOM    420 1HD1 LEU A  24       8.429  19.590 -10.173  1.00  1.49           H  
ATOM    421 2HD1 LEU A  24       6.912  20.020 -10.956  1.00  1.49           H  
ATOM    422 3HD1 LEU A  24       6.932  18.741  -9.741  1.00  1.49           H  
ATOM    423 1HD2 LEU A  24       9.504  17.485 -10.711  1.00  1.49           H  
ATOM    424 2HD2 LEU A  24       8.045  16.603 -10.292  1.00  1.49           H  
ATOM    425 3HD2 LEU A  24       8.781  16.367 -11.863  1.00  1.49           H  
ATOM    426  N   LYS A  25       4.490  16.961 -14.761  1.00  0.80           N  
ATOM    427  CA  LYS A  25       3.247  16.443 -15.302  1.00  0.81           C  
ATOM    428  C   LYS A  25       3.520  15.091 -15.973  1.00  0.67           C  
ATOM    429  O   LYS A  25       2.705  14.167 -15.866  1.00  0.69           O  
ATOM    430  CB  LYS A  25       2.602  17.446 -16.244  1.00  1.13           C  
ATOM    431  CG  LYS A  25       2.067  18.642 -15.485  1.00  1.13           C  
ATOM    432  CD  LYS A  25       1.409  19.671 -16.362  1.00  1.13           C  
ATOM    433  CE  LYS A  25       1.011  20.858 -15.510  1.00  1.13           C  
ATOM    434  NZ  LYS A  25       0.346  21.931 -16.281  1.00  1.13           N  
ATOM    435  H   LYS A  25       4.865  17.871 -15.052  1.00  0.96           H  
ATOM    436  HA  LYS A  25       2.555  16.270 -14.480  1.00  0.97           H  
ATOM    437 1HB  LYS A  25       3.345  17.797 -16.968  1.00  1.36           H  
ATOM    438 2HB  LYS A  25       1.789  16.977 -16.793  1.00  1.36           H  
ATOM    439 1HG  LYS A  25       1.342  18.291 -14.750  1.00  1.36           H  
ATOM    440 2HG  LYS A  25       2.890  19.116 -14.948  1.00  1.36           H  
ATOM    441 1HD  LYS A  25       2.106  19.998 -17.135  1.00  1.36           H  
ATOM    442 2HD  LYS A  25       0.523  19.251 -16.835  1.00  1.36           H  
ATOM    443 1HE  LYS A  25       0.345  20.531 -14.715  1.00  1.36           H  
ATOM    444 2HE  LYS A  25       1.919  21.271 -15.060  1.00  1.36           H  
ATOM    445 1HZ  LYS A  25       0.156  22.691 -15.608  1.00  1.36           H  
ATOM    446 2HZ  LYS A  25       0.956  22.270 -17.005  1.00  1.36           H  
ATOM    447 3HZ  LYS A  25      -0.512  21.598 -16.689  1.00  1.36           H  
ATOM    448  N   LYS A  26       4.688  14.959 -16.633  1.00  0.62           N  
ATOM    449  CA  LYS A  26       5.044  13.694 -17.268  1.00  0.67           C  
ATOM    450  C   LYS A  26       5.283  12.623 -16.204  1.00  0.63           C  
ATOM    451  O   LYS A  26       4.874  11.472 -16.393  1.00  0.69           O  
ATOM    452  CB  LYS A  26       6.270  13.837 -18.174  1.00  0.92           C  
ATOM    453  CG  LYS A  26       6.083  14.742 -19.433  1.00  0.92           C  
ATOM    454  CD  LYS A  26       4.921  14.307 -20.357  1.00  0.92           C  
ATOM    455  CE  LYS A  26       5.187  12.990 -21.083  1.00  0.92           C  
ATOM    456  NZ  LYS A  26       4.029  12.601 -21.938  1.00  0.92           N  
ATOM    457  H   LYS A  26       5.304  15.777 -16.710  1.00  0.74           H  
ATOM    458  HA  LYS A  26       4.199  13.352 -17.858  1.00  0.80           H  
ATOM    459 1HB  LYS A  26       7.080  14.281 -17.591  1.00  1.10           H  
ATOM    460 2HB  LYS A  26       6.609  12.855 -18.491  1.00  1.10           H  
ATOM    461 1HG  LYS A  26       5.899  15.765 -19.113  1.00  1.10           H  
ATOM    462 2HG  LYS A  26       7.006  14.731 -20.004  1.00  1.10           H  
ATOM    463 1HD  LYS A  26       3.983  14.247 -19.818  1.00  1.10           H  
ATOM    464 2HD  LYS A  26       4.799  15.073 -21.117  1.00  1.10           H  
ATOM    465 1HE  LYS A  26       6.071  13.097 -21.707  1.00  1.10           H  
ATOM    466 2HE  LYS A  26       5.355  12.198 -20.356  1.00  1.10           H  
ATOM    467 1HZ  LYS A  26       4.221  11.727 -22.402  1.00  1.10           H  
ATOM    468 2HZ  LYS A  26       3.201  12.489 -21.317  1.00  1.10           H  
ATOM    469 3HZ  LYS A  26       3.845  13.314 -22.625  1.00  1.10           H  
ATOM    470  N   TRP A  27       5.910  12.997 -15.075  1.00  0.63           N  
ATOM    471  CA  TRP A  27       6.131  12.075 -13.966  1.00  0.68           C  
ATOM    472  C   TRP A  27       4.783  11.545 -13.502  1.00  0.61           C  
ATOM    473  O   TRP A  27       4.617  10.338 -13.326  1.00  0.71           O  
ATOM    474  CB  TRP A  27       6.829  12.798 -12.800  1.00  0.94           C  
ATOM    475  CG  TRP A  27       7.153  11.972 -11.590  1.00  0.94           C  
ATOM    476  CD1 TRP A  27       8.313  11.306 -11.359  1.00  0.94           C  
ATOM    477  CD2 TRP A  27       6.318  11.732 -10.424  1.00  0.94           C  
ATOM    478  NE1 TRP A  27       8.266  10.684 -10.137  1.00  0.94           N  
ATOM    479  CE2 TRP A  27       7.054  10.941  -9.554  1.00  0.94           C  
ATOM    480  CE3 TRP A  27       5.037  12.130 -10.055  1.00  0.94           C  
ATOM    481  CZ2 TRP A  27       6.549  10.540  -8.339  1.00  0.94           C  
ATOM    482  CZ3 TRP A  27       4.541  11.715  -8.851  1.00  0.94           C  
ATOM    483  CH2 TRP A  27       5.270  10.944  -8.019  1.00  0.94           C  
ATOM    484  H   TRP A  27       6.312  13.938 -15.014  1.00  0.76           H  
ATOM    485  HA  TRP A  27       6.747  11.244 -14.304  1.00  0.82           H  
ATOM    486 1HB  TRP A  27       7.751  13.250 -13.166  1.00  1.13           H  
ATOM    487 2HB  TRP A  27       6.204  13.602 -12.459  1.00  1.13           H  
ATOM    488  HD1 TRP A  27       9.163  11.280 -12.041  1.00  1.13           H  
ATOM    489  HE1 TRP A  27       9.010  10.129  -9.729  1.00  1.13           H  
ATOM    490  HE3 TRP A  27       4.448  12.744 -10.701  1.00  1.13           H  
ATOM    491  HZ2 TRP A  27       7.119   9.923  -7.648  1.00  1.13           H  
ATOM    492  HZ3 TRP A  27       3.559  12.016  -8.582  1.00  1.13           H  
ATOM    493  HH2 TRP A  27       4.832  10.634  -7.087  1.00  1.13           H  
ATOM    494  N   ILE A  28       3.805  12.444 -13.345  1.00  0.55           N  
ATOM    495  CA  ILE A  28       2.483  12.052 -12.881  1.00  0.62           C  
ATOM    496  C   ILE A  28       1.844  11.067 -13.844  1.00  0.57           C  
ATOM    497  O   ILE A  28       1.256  10.082 -13.394  1.00  0.52           O  
ATOM    498  CB  ILE A  28       1.541  13.262 -12.686  1.00  0.84           C  
ATOM    499  CG1 ILE A  28       2.045  14.123 -11.512  1.00  0.84           C  
ATOM    500  CG2 ILE A  28       0.087  12.765 -12.432  1.00  0.84           C  
ATOM    501  CD1 ILE A  28       1.373  15.470 -11.383  1.00  0.84           C  
ATOM    502  H   ILE A  28       4.025  13.432 -13.505  1.00  0.66           H  
ATOM    503  HA  ILE A  28       2.594  11.559 -11.918  1.00  0.74           H  
ATOM    504  HB  ILE A  28       1.561  13.885 -13.581  1.00  1.01           H  
ATOM    505 1HG1 ILE A  28       1.909  13.575 -10.609  1.00  1.01           H  
ATOM    506 2HG1 ILE A  28       3.101  14.303 -11.645  1.00  1.01           H  
ATOM    507 1HG2 ILE A  28      -0.580  13.604 -12.303  1.00  1.01           H  
ATOM    508 2HG2 ILE A  28      -0.264  12.184 -13.276  1.00  1.01           H  
ATOM    509 3HG2 ILE A  28       0.065  12.143 -11.539  1.00  1.01           H  
ATOM    510 1HD1 ILE A  28       1.780  16.001 -10.555  1.00  1.01           H  
ATOM    511 2HD1 ILE A  28       1.532  16.047 -12.292  1.00  1.01           H  
ATOM    512 3HD1 ILE A  28       0.320  15.340 -11.225  1.00  1.01           H  
ATOM    513  N   GLN A  29       1.915  11.329 -15.154  1.00  0.65           N  
ATOM    514  CA  GLN A  29       1.314  10.407 -16.113  1.00  0.70           C  
ATOM    515  C   GLN A  29       1.940   9.014 -16.017  1.00  0.64           C  
ATOM    516  O   GLN A  29       1.221   8.005 -16.054  1.00  0.65           O  
ATOM    517  CB  GLN A  29       1.502  10.918 -17.543  1.00  0.96           C  
ATOM    518  CG  GLN A  29       0.702  12.159 -17.904  1.00  0.96           C  
ATOM    519  CD  GLN A  29       1.038  12.660 -19.321  1.00  0.96           C  
ATOM    520  OE1 GLN A  29       2.018  12.188 -19.939  1.00  0.96           O  
ATOM    521  NE2 GLN A  29       0.243  13.596 -19.825  1.00  0.96           N  
ATOM    522  H   GLN A  29       2.363  12.198 -15.468  1.00  0.78           H  
ATOM    523  HA  GLN A  29       0.253  10.322 -15.895  1.00  0.84           H  
ATOM    524 1HB  GLN A  29       2.556  11.154 -17.695  1.00  1.15           H  
ATOM    525 2HB  GLN A  29       1.240  10.129 -18.247  1.00  1.15           H  
ATOM    526 1HG  GLN A  29      -0.359  11.919 -17.864  1.00  1.15           H  
ATOM    527 2HG  GLN A  29       0.932  12.948 -17.194  1.00  1.15           H  
ATOM    528 1HE2 GLN A  29       0.404  13.964 -20.742  1.00  1.15           H  
ATOM    529 2HE2 GLN A  29      -0.530  13.941 -19.288  1.00  1.15           H  
ATOM    530  N   LYS A  30       3.271   8.950 -15.856  1.00  0.65           N  
ATOM    531  CA  LYS A  30       3.951   7.665 -15.731  1.00  0.71           C  
ATOM    532  C   LYS A  30       3.461   6.914 -14.501  1.00  0.60           C  
ATOM    533  O   LYS A  30       3.211   5.709 -14.578  1.00  0.65           O  
ATOM    534  CB  LYS A  30       5.467   7.853 -15.665  1.00  0.97           C  
ATOM    535  CG  LYS A  30       6.109   8.295 -16.980  1.00  0.97           C  
ATOM    536  CD  LYS A  30       7.617   8.511 -16.827  1.00  0.97           C  
ATOM    537  CE  LYS A  30       8.249   8.987 -18.133  1.00  0.97           C  
ATOM    538  NZ  LYS A  30       9.715   9.237 -17.988  1.00  0.97           N  
ATOM    539  H   LYS A  30       3.816   9.822 -15.879  1.00  0.78           H  
ATOM    540  HA  LYS A  30       3.710   7.061 -16.609  1.00  0.85           H  
ATOM    541 1HB  LYS A  30       5.699   8.609 -14.915  1.00  1.16           H  
ATOM    542 2HB  LYS A  30       5.935   6.923 -15.346  1.00  1.16           H  
ATOM    543 1HG  LYS A  30       5.932   7.534 -17.738  1.00  1.16           H  
ATOM    544 2HG  LYS A  30       5.646   9.221 -17.311  1.00  1.16           H  
ATOM    545 1HD  LYS A  30       7.793   9.266 -16.056  1.00  1.16           H  
ATOM    546 2HD  LYS A  30       8.092   7.582 -16.517  1.00  1.16           H  
ATOM    547 1HE  LYS A  30       8.094   8.229 -18.900  1.00  1.16           H  
ATOM    548 2HE  LYS A  30       7.762   9.912 -18.446  1.00  1.16           H  
ATOM    549 1HZ  LYS A  30      10.093   9.550 -18.872  1.00  1.16           H  
ATOM    550 2HZ  LYS A  30       9.869   9.947 -17.287  1.00  1.16           H  
ATOM    551 3HZ  LYS A  30      10.180   8.384 -17.709  1.00  1.16           H  
ATOM    552  N   VAL A  31       3.283   7.648 -13.399  1.00  0.51           N  
ATOM    553  CA  VAL A  31       2.797   7.138 -12.121  1.00  0.53           C  
ATOM    554  C   VAL A  31       1.372   6.595 -12.226  1.00  0.50           C  
ATOM    555  O   VAL A  31       1.050   5.543 -11.666  1.00  0.63           O  
ATOM    556  CB  VAL A  31       2.946   8.232 -11.061  1.00  0.74           C  
ATOM    557  CG1 VAL A  31       2.273   7.873  -9.761  1.00  0.74           C  
ATOM    558  CG2 VAL A  31       4.419   8.400 -10.829  1.00  0.74           C  
ATOM    559  H   VAL A  31       3.567   8.632 -13.449  1.00  0.61           H  
ATOM    560  HA  VAL A  31       3.455   6.331 -11.822  1.00  0.64           H  
ATOM    561  HB  VAL A  31       2.513   9.153 -11.426  1.00  0.89           H  
ATOM    562 1HG1 VAL A  31       2.433   8.677  -9.041  1.00  0.89           H  
ATOM    563 2HG1 VAL A  31       1.203   7.734  -9.904  1.00  0.89           H  
ATOM    564 3HG1 VAL A  31       2.706   6.963  -9.390  1.00  0.89           H  
ATOM    565 1HG2 VAL A  31       4.575   9.168 -10.113  1.00  0.89           H  
ATOM    566 2HG2 VAL A  31       4.830   7.463 -10.469  1.00  0.89           H  
ATOM    567 3HG2 VAL A  31       4.924   8.660 -11.736  1.00  0.89           H  
ATOM    568  N   ILE A  32       0.505   7.301 -12.939  1.00  0.47           N  
ATOM    569  CA  ILE A  32      -0.846   6.801 -13.117  1.00  0.61           C  
ATOM    570  C   ILE A  32      -0.783   5.432 -13.809  1.00  0.68           C  
ATOM    571  O   ILE A  32      -1.434   4.480 -13.361  1.00  0.82           O  
ATOM    572  CB  ILE A  32      -1.699   7.799 -13.927  1.00  0.80           C  
ATOM    573  CG1 ILE A  32      -1.932   9.074 -13.076  1.00  0.80           C  
ATOM    574  CG2 ILE A  32      -3.029   7.153 -14.331  1.00  0.80           C  
ATOM    575  CD1 ILE A  32      -2.479  10.259 -13.845  1.00  0.80           C  
ATOM    576  H   ILE A  32       0.795   8.209 -13.320  1.00  0.56           H  
ATOM    577  HA  ILE A  32      -1.304   6.672 -12.139  1.00  0.73           H  
ATOM    578  HB  ILE A  32      -1.150   8.096 -14.823  1.00  0.96           H  
ATOM    579 1HG1 ILE A  32      -2.635   8.828 -12.278  1.00  0.96           H  
ATOM    580 2HG1 ILE A  32      -0.991   9.367 -12.621  1.00  0.96           H  
ATOM    581 1HG2 ILE A  32      -3.631   7.841 -14.907  1.00  0.96           H  
ATOM    582 2HG2 ILE A  32      -2.857   6.266 -14.942  1.00  0.96           H  
ATOM    583 3HG2 ILE A  32      -3.576   6.866 -13.436  1.00  0.96           H  
ATOM    584 1HD1 ILE A  32      -2.605  11.097 -13.164  1.00  0.96           H  
ATOM    585 2HD1 ILE A  32      -1.778  10.535 -14.628  1.00  0.96           H  
ATOM    586 3HD1 ILE A  32      -3.436  10.017 -14.289  1.00  0.96           H  
ATOM    587  N   ASP A  33       0.017   5.300 -14.880  1.00  0.67           N  
ATOM    588  CA  ASP A  33       0.129   3.981 -15.511  1.00  0.82           C  
ATOM    589  C   ASP A  33       0.796   2.955 -14.576  1.00  0.86           C  
ATOM    590  O   ASP A  33       0.335   1.814 -14.459  1.00  1.03           O  
ATOM    591  CB  ASP A  33       0.960   4.048 -16.800  1.00  1.09           C  
ATOM    592  CG  ASP A  33       0.280   4.713 -18.007  1.00  1.09           C  
ATOM    593  OD1 ASP A  33      -0.914   4.886 -18.010  1.00  1.09           O  
ATOM    594  OD2 ASP A  33       0.990   5.031 -18.931  1.00  1.09           O  
ATOM    595  H   ASP A  33       0.518   6.116 -15.255  1.00  0.80           H  
ATOM    596  HA  ASP A  33      -0.874   3.632 -15.752  1.00  0.98           H  
ATOM    597 1HB  ASP A  33       1.879   4.602 -16.589  1.00  1.31           H  
ATOM    598 2HB  ASP A  33       1.256   3.039 -17.085  1.00  1.31           H  
ATOM    599  N   GLN A  34       1.835   3.387 -13.852  1.00  0.82           N  
ATOM    600  CA  GLN A  34       2.638   2.551 -12.954  1.00  1.00           C  
ATOM    601  C   GLN A  34       1.817   1.824 -11.920  1.00  1.08           C  
ATOM    602  O   GLN A  34       2.048   0.643 -11.654  1.00  1.28           O  
ATOM    603  CB  GLN A  34       3.646   3.423 -12.206  1.00  1.33           C  
ATOM    604  CG  GLN A  34       4.587   2.718 -11.267  1.00  1.33           C  
ATOM    605  CD  GLN A  34       5.485   3.724 -10.582  1.00  1.33           C  
ATOM    606  OE1 GLN A  34       5.375   4.928 -10.824  1.00  1.33           O  
ATOM    607  NE2 GLN A  34       6.370   3.245  -9.725  1.00  1.33           N  
ATOM    608  H   GLN A  34       2.152   4.345 -13.998  1.00  0.98           H  
ATOM    609  HA  GLN A  34       3.165   1.813 -13.555  1.00  1.20           H  
ATOM    610 1HB  GLN A  34       4.227   4.004 -12.915  1.00  1.60           H  
ATOM    611 2HB  GLN A  34       3.098   4.110 -11.593  1.00  1.60           H  
ATOM    612 1HG  GLN A  34       4.017   2.193 -10.497  1.00  1.60           H  
ATOM    613 2HG  GLN A  34       5.201   2.017 -11.828  1.00  1.60           H  
ATOM    614 1HE2 GLN A  34       6.989   3.869  -9.241  1.00  1.60           H  
ATOM    615 2HE2 GLN A  34       6.423   2.260  -9.556  1.00  1.60           H  
ATOM    616  N   PHE A  35       0.848   2.515 -11.344  1.00  1.00           N  
ATOM    617  CA  PHE A  35       0.032   1.916 -10.310  1.00  1.20           C  
ATOM    618  C   PHE A  35      -1.336   1.424 -10.784  1.00  1.26           C  
ATOM    619  O   PHE A  35      -2.211   1.149  -9.958  1.00  1.56           O  
ATOM    620  CB  PHE A  35      -0.075   2.874  -9.132  1.00  1.61           C  
ATOM    621  CG  PHE A  35       1.265   3.061  -8.468  1.00  1.61           C  
ATOM    622  CD1 PHE A  35       2.043   4.158  -8.740  1.00  1.61           C  
ATOM    623  CD2 PHE A  35       1.756   2.112  -7.587  1.00  1.61           C  
ATOM    624  CE1 PHE A  35       3.270   4.310  -8.158  1.00  1.61           C  
ATOM    625  CE2 PHE A  35       2.990   2.268  -7.002  1.00  1.61           C  
ATOM    626  CZ  PHE A  35       3.748   3.374  -7.288  1.00  1.61           C  
ATOM    627  H   PHE A  35       0.740   3.508 -11.583  1.00  1.20           H  
ATOM    628  HA  PHE A  35       0.569   1.042  -9.943  1.00  1.44           H  
ATOM    629 1HB  PHE A  35      -0.436   3.847  -9.477  1.00  1.93           H  
ATOM    630 2HB  PHE A  35      -0.774   2.487  -8.404  1.00  1.93           H  
ATOM    631  HD1 PHE A  35       1.675   4.903  -9.437  1.00  1.93           H  
ATOM    632  HD2 PHE A  35       1.152   1.229  -7.364  1.00  1.93           H  
ATOM    633  HE1 PHE A  35       3.875   5.176  -8.400  1.00  1.93           H  
ATOM    634  HE2 PHE A  35       3.361   1.513  -6.314  1.00  1.93           H  
ATOM    635  HZ  PHE A  35       4.726   3.505  -6.832  1.00  1.93           H  
ATOM    636  N   GLY A  36      -1.517   1.286 -12.103  1.00  1.19           N  
ATOM    637  CA  GLY A  36      -2.746   0.729 -12.662  1.00  1.43           C  
ATOM    638  C   GLY A  36      -4.005   1.602 -12.728  1.00  1.52           C  
ATOM    639  O   GLY A  36      -5.108   1.045 -12.732  1.00  2.12           O  
ATOM    640  H   GLY A  36      -0.765   1.536 -12.755  1.00  1.43           H  
ATOM    641 1HA  GLY A  36      -2.518   0.393 -13.675  1.00  1.72           H  
ATOM    642 2HA  GLY A  36      -2.986  -0.174 -12.105  1.00  1.72           H  
ATOM    643  N   GLU A  37      -3.884   2.932 -12.748  1.00  1.52           N  
ATOM    644  CA  GLU A  37      -5.087   3.763 -12.804  1.00  1.90           C  
ATOM    645  C   GLU A  37      -5.208   4.488 -14.140  1.00  2.36           C  
ATOM    646  O   GLU A  37      -5.129   3.857 -15.193  1.00  2.83           O  
ATOM    647  OXT GLU A  37      -5.699   5.617 -14.155  1.00  2.85           O  
ATOM    648  CB  GLU A  37      -5.143   4.767 -11.646  1.00  2.33           C  
ATOM    649  CG  GLU A  37      -5.310   4.133 -10.263  1.00  2.33           C  
ATOM    650  CD  GLU A  37      -5.521   5.160  -9.163  1.00  2.33           C  
ATOM    651  OE1 GLU A  37      -5.355   6.323  -9.425  1.00  2.33           O  
ATOM    652  OE2 GLU A  37      -5.878   4.777  -8.060  1.00  2.33           O  
ATOM    653  H   GLU A  37      -2.964   3.383 -12.762  1.00  1.82           H  
ATOM    654  HA  GLU A  37      -5.957   3.115 -12.707  1.00  2.28           H  
ATOM    655 1HB  GLU A  37      -4.218   5.345 -11.631  1.00  2.80           H  
ATOM    656 2HB  GLU A  37      -5.966   5.463 -11.801  1.00  2.80           H  
ATOM    657 1HG  GLU A  37      -6.161   3.455 -10.289  1.00  2.80           H  
ATOM    658 2HG  GLU A  37      -4.418   3.541 -10.043  1.00  2.80           H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -211.657 20.8259 160.543 -16.0915 3.64557 9.56859 84.652 -88.6277 -0.17884 -1.27595 -83.0506 -5.32999 -34.1836 -1.16916 -2.47316 -5.69274 0 0.88232 1.73901 17.8247 45.0866 -7.48961 0 -5.71984 -7.41833 18.5655 -107.025
ASP:NtermProteinFull_1 -2.48971 0.15833 3.93171 -0.14876 0.00269 0.43928 2.21369 -1.721 -0 -0 -3.70115 -0.58218 0 0 -0.91688 0 0 0.00718 0.02158 0 3.87553 0 0 -2.3716 0 0.17894 -1.10236
TRP_2 -6.13832 0.64876 2.70673 -1.38139 0.12738 0.65285 1.47149 -2.01867 -0.02159 -0.10858 -2.18702 -0.20861 0 0 0 0 0 0.05398 0.00152 0 1.7725 -0.13846 0 1.6906 -0.0953 0.38688 -2.78525
PHE_3 -6.29719 0.8951 3.84288 -0.62344 0.02844 0.25437 2.4503 -2.38172 -0 -0 -2.75602 0.03353 0 0 -0.91688 0 0 -0.01768 0.2055 0 3.2309 -0.23107 0 1.0402 -0.16229 0.56737 -0.83771
LYS_4 -6.42794 0.3494 8.07894 -0.44209 0.05533 0.2797 3.46083 -3.4347 -0.01002 -0.06855 -5.41036 0.02962 0 0 0 -1.3076 0 -0.01664 0.17692 2.49344 0 -0.0112 0 -1.5107 -0.06532 0.77853 -3.0024
ALA_5 -4.05134 0.20477 4.4462 -0.02193 0 0 2.06896 -2.30321 -0 -0 -1.67903 -0.34972 0 0 0 0 0 0.01418 0 0 0 -0.23879 0 1.8394 -0.16916 0.49751 0.25782
PHE_6 -7.59135 0.71442 4.00366 -0.93345 0.05996 0.28916 2.55587 -2.69375 -0 -0 -2.9557 -0.0375 0 0 0 0 0 0.00383 0.05406 0 1.74854 -0.42858 0 1.0402 -0.08895 0.17074 -4.08885
TYR_7 -9.58895 1.3851 3.69937 -0.5816 0.02532 0.24515 3.15992 -2.98094 -0.02159 -0.10861 -2.45119 -0.2552 0 0 0 0 0 0.02066 0.36519 0 3.08027 0.07785 0 1.2797 -0.04218 0.5057 -2.18603
ASP_8 -5.01202 0.18486 7.48185 -0.10465 0.00533 0.3156 3.42693 -3.29359 -0.01268 -0.11268 -4.79533 -0.32154 0 0 0 -0.85352 0 0.02024 0.02786 0 1.76234 0.26698 0 -2.3716 -0.21168 0.61283 -2.98447
LYS_9 -4.47098 0.19841 5.24116 -0.30161 0.02675 0.13323 2.42497 -2.4608 -0.01002 -0.06855 -2.4835 -0.0185 0 0 0 0 0 0.05356 0.02205 1.75561 0 0.00116 0 -1.5107 -0.28594 0.25784 -1.49588
VAL_10 -7.01808 0.71353 3.72054 -0.31647 0.23365 0.07259 2.85235 -2.6887 -0 -0 -2.17628 -0.20916 0 0 0 0 0 -0.04321 0.00528 0.10513 0 -0.28549 0 1.9342 -0.27379 0.24611 -3.12779
ALA_11 -6.29623 0.59479 4.14247 -0.02158 0 0 2.83229 -2.82985 -0 -0 -2.37314 -0.35127 0 0 0 0 0 -0.02499 0 0 0 -0.24402 0 1.8394 -0.25342 0.38227 -2.60328
GLU_12 -4.90736 0.26406 6.85339 -0.45638 0.06792 0.90765 2.9699 -2.94164 -0.01272 -0.11312 -3.57875 -0.48816 0 0 0 -0.7607 0 0.1229 0.02426 0 3.36486 -0.28984 0 -2.7348 -0.42317 0.32348 -1.80822
LYS_13 -4.67111 0.30938 4.87761 -0.42299 0.07402 0.23319 2.85747 -2.46092 -0.0072 -0.03264 -2.65641 -0.13892 0 0 0 0 0 -0.02049 0.01991 1.9524 0 0.05962 0 -1.5107 -0.31878 0.25219 -1.60438
PHE_14 -9.93828 1.17492 3.19864 -0.53305 0.26366 0.2286 2.75332 -2.89669 -0 -0 -1.96645 -0.17181 0 0 0 0 0 -0.0411 0.01005 0 3.17493 -0.01394 0 1.0402 -0.18266 0.50809 -3.39159
LYS_15 -5.13853 0.34917 5.69068 -0.30801 0.02511 0.13908 2.33658 -2.46986 -0 -0 -3.3404 0.02987 0 0 0 -0.7607 0 -0.02406 0.07889 1.65283 0 -0.06504 0 -1.5107 -0.27104 0.55636 -3.02977
GLU_16 -2.75678 0.29039 3.26208 -0.21212 0.0306 0.30847 1.01888 -1.51641 -0 -0 -0.33234 -0.55797 0 0 0 0 0 -0.00666 0.00693 0 2.98915 -0.12635 0 -2.7348 -0.07698 0.33892 -0.07497
ALA_17 -3.76906 0.33801 1.57246 -0.02337 0 0 1.24285 -1.39914 -4e-05 -0.00044 -1.14187 -0.33477 0 0 0 0 0 -0.02392 0 0 0 -0.1017 0 1.8394 -0.08141 0.27108 -1.61191
PHE_18 -6.68128 1.31808 2.40344 -0.66935 0.06814 0.41893 1.83124 -2.06644 -0.02722 -0.17905 -1.39229 0.1252 0 0 0 0 0 0.27161 0.00402 0 1.98435 -0.34284 0 1.0402 -0.48203 0.83497 -1.54032
PRO_19 -4.01697 0.6363 3.32616 -0.08841 0.00021 0.05487 1.13615 -1.41936 -0 -0 -1.70182 0.69699 0 0 -0.3197 0 0 -0.13062 0.00121 0.59318 0 -0.46706 0 -2.4119 -0.54532 0.89429 -3.76179
HIS_D_20 -2.91788 0.31926 2.44716 -0.41115 0.03041 0.5588 0.3068 -1.24281 -0.00422 -0.01295 0.3261 -0.34125 0 0 0 0 0 0.16296 0.04019 0 1.57252 -0.65248 0 -0.45461 0.06586 0.38217 0.17488
VAL_21 -6.02574 0.66128 3.38903 -0.2917 0.26481 0.07265 1.9967 -2.11353 -0.02024 -0.14944 -1.59963 -0.46604 0 0 0 0 0 -0.02425 0.0101 0.20144 0 -0.53898 0 1.9342 0.25135 0.48025 -1.96774
PHE_22 -4.07487 0.39698 3.41532 -0.93478 0.05934 0.30794 1.71616 -1.66859 -0.00422 -0.01295 -0.81729 -0.02205 0 0 0 0 0 0.02442 0.01704 0 1.74629 -0.53455 0 1.0402 0.04304 0.39501 1.09244
ARG_23 -5.2071 0.39393 3.46592 -0.75841 0.16185 0.50568 0.97483 -1.93932 -0 -0 -0.36274 0.29707 0 0 0 0 0 -0.0531 0.1007 1.91049 0 -0.14356 0 -1.2888 -0.18688 0.46807 -1.66139
LEU_24 -8.94632 1.29249 3.90535 -0.49732 0.29788 0.11647 2.90817 -2.66335 -0 -0 -1.51491 0.15855 0 0 0 0 0 0.3767 0.07714 0.30047 0 -0.28125 0 0.18072 -0.28085 0.82062 -3.74945
LYS_25 -6.03894 0.27063 7.43002 -0.32569 0.05239 0.16065 3.31551 -3.31942 -0 -0 -3.40722 -0.03673 0 0 -0.3197 0 0 0.05564 0.0486 1.72304 0 -0.04637 0 -1.5107 -0.2795 0.83386 -1.39394
LYS_26 -6.47007 0.45091 6.61941 -0.78096 0.34133 0.49192 3.14458 -2.95281 -0.01365 -0.1557 -3.3712 0.27227 0 0 0 -0.77807 0 0.19311 0.16771 2.16086 0 -0.04706 0 -1.5107 -0.47566 0.70767 -2.00612
TRP_27 -10.2006 1.51477 3.70318 -1.21408 0.08433 0.39679 3.12128 -3.0686 -0 -3e-05 -2.08233 -0.34457 0 0 0 0 0 -0.0248 0.00705 0 1.73155 -0.24909 0 1.6906 -0.23981 0.60042 -4.57391
ILE_28 -8.84379 0.9216 4.74548 -0.51056 0.45287 0.10366 3.0518 -3.11092 -0 -0 -2.40766 -0.00824 0 0 0 0 0 -0.04457 0.00538 0.56349 0 -0.39721 0 0.73287 -0.03066 0.46723 -4.30924
GLN_29 -5.53053 0.25254 6.49496 -0.25708 0.0342 0.18439 3.10543 -2.98953 -0.01343 -0.15268 -2.81805 -0.44917 0 0 0 -0.77807 0 0.0216 0.00335 0 2.75207 -0.07544 0 -0.18838 -0.10459 0.373 -0.13542
LYS_30 -4.70362 0.23763 5.50909 -0.29855 0.02556 0.13025 2.67691 -2.54811 -0 -0 -2.86609 -0.00637 0 0 0 0 0 0.03557 0.00866 1.73056 0 0.00272 0 -1.5107 -0.32313 0.30758 -1.59205
VAL_31 -8.34656 1.27496 3.98927 -0.31622 0.18859 0.06966 3.23452 -2.974 -0 -0 -2.39781 -0.10509 0 0 0 0 0 0.02897 0.01364 0.14245 0 -0.23346 0 1.9342 -0.31223 0.52119 -3.28792
ILE_32 -5.83859 0.38029 5.66414 -0.49343 0.33004 0.09679 2.59002 -2.93792 -0 -0 -2.37679 0.07721 0 0 0 0 0 0.05522 0.0211 0.5393 0 -0.38858 0 0.73287 -0.05769 0.6026 -1.00341
ASP_33 -3.36721 0.18809 4.59111 -0.10234 0.0058 0.30829 1.65991 -2.17947 -0 -0 -1.42764 -0.28557 0 0 0 0 0 -0.04219 0.01971 0 1.75287 0.21715 0 -2.3716 -0.07165 0.52022 -0.58453
GLN_34 -5.6966 0.49943 4.02047 -0.39359 0.1 0.26511 2.28042 -2.26653 -0 -0 -1.43869 -0.60758 0 0 0 0 0 -0.04629 0.02096 0 3.2579 -0.02983 0 -0.18838 -0.13005 0.52931 0.17605
PHE_35 -8.04479 0.76652 2.59541 -0.67448 0.06943 0.37892 1.23518 -2.04995 -0 -0 -1.50639 0.05055 0 0 0 0 0 0.12108 0.00651 0 1.96078 -0.21613 0 1.0402 -0.25411 0.53048 -3.9908
GLY_36 -1.46183 0.09011 2.10731 -4e-05 0 0 0.90818 -0.98068 -0 -0 -1.3166 -0.35224 0 0 0 0 0 -0.17652 0 0 0 -1.29671 0 0.83697 -0.62014 0.78981 -1.47237
GLU:CtermProteinFull_37 -2.68004 0.18668 3.96999 -0.2404 0.05224 0.44789 1.36159 -1.64476 -0 -0 -2.58663 -0.0506 0 0 0 -0.45408 0 0 0.14593 0 3.32924 0 0 -2.7348 -0.38221 0.67186 -0.60809
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

