REMARK ID 691858 DOMAINID 682972 MODEL 1 pep5_AB
MODEL     1
REMARK    Rerank model01.pdb score: 28.266
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 32 cluster_threshold: 1.516413
REMARK    SCORE     rama_prepro:           9.043
REMARK    SCORE    fa_intra_rep:           0.439
REMARK    SCORE     hbond_bb_sc:          -3.739
REMARK    SCORE           score:         -90.755
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE        hbond_sc:          -3.806
REMARK    SCORE             ref:           9.796
REMARK    SCORE     hbond_lr_bb:          -4.488
REMARK    SCORE         p_aa_pp:          -2.786
REMARK    SCORE     cart_bonded:          19.952
REMARK    SCORE          fa_rep:          23.306
REMARK    SCORE         fa_elec:         -80.276
REMARK    SCORE     hbond_sr_bb:         -30.534
REMARK    SCORE     total_score:         -90.755
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE     lk_ball_wtd:          -6.832
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         142.297
REMARK    SCORE           omega:          -0.121
REMARK    SCORE          fa_atr:        -223.051
REMARK    SCORE          fa_dun:          51.072
REMARK    SCORE fa_intra_sol_xover4:           8.975
ATOM      1  N   ASP A   1       0.333  -0.754   0.143  1.00  1.690          N  
ATOM      2  CA  ASP A   1       1.746  -0.591  -0.177  1.00  1.060          C  
ATOM      3  C   ASP A   1       2.262   0.850  -0.055  1.00  0.910          C  
ATOM      4  O   ASP A   1       3.287   1.102   0.598  1.00  0.870          O  
ATOM      5  CB  ASP A   1       2.016  -1.054  -1.611  1.00  1.740          C  
ATOM      6  CG  ASP A   1       1.736  -2.520  -1.823  1.00  1.740          C  
ATOM      7  OD1 ASP A   1       1.506  -3.218  -0.865  1.00  1.740          O  
ATOM      8  OD2 ASP A   1       1.730  -2.927  -2.946  1.00  1.740          O  
ATOM      9 1H   ASP A   1       0.066  -1.687  -0.146  1.00  2.030          H  
ATOM     10 2H   ASP A   1       0.189  -0.683   1.147  1.00  2.030          H  
ATOM     11 3H   ASP A   1      -0.231  -0.082  -0.351  1.00  2.030          H  
ATOM     12  HA  ASP A   1       2.317  -1.214   0.512  1.00  1.270          H  
ATOM     13 1HB  ASP A   1       1.405  -0.481  -2.303  1.00  2.080          H  
ATOM     14 2HB  ASP A   1       3.061  -0.860  -1.863  1.00  2.080          H  
ATOM     15  N   TRP A   2       1.569   1.800  -0.701  1.00  0.870          N  
ATOM     16  CA  TRP A   2       2.032   3.189  -0.739  1.00  0.830          C  
ATOM     17  C   TRP A   2       2.156   3.826   0.632  1.00  0.740          C  
ATOM     18  O   TRP A   2       3.159   4.492   0.899  1.00  0.730          O  
ATOM     19  CB  TRP A   2       1.133   4.067  -1.603  1.00  1.180          C  
ATOM     20  CG  TRP A   2       1.715   5.442  -1.807  1.00  1.180          C  
ATOM     21  CD1 TRP A   2       2.575   5.774  -2.808  1.00  1.180          C  
ATOM     22  CD2 TRP A   2       1.519   6.661  -1.037  1.00  1.180          C  
ATOM     23  NE1 TRP A   2       2.925   7.090  -2.718  1.00  1.180          N  
ATOM     24  CE2 TRP A   2       2.290   7.649  -1.643  1.00  1.180          C  
ATOM     25  CE3 TRP A   2       0.774   6.984   0.085  1.00  1.180          C  
ATOM     26  CZ2 TRP A   2       2.332   8.942  -1.160  1.00  1.180          C  
ATOM     27  CZ3 TRP A   2       0.821   8.278   0.562  1.00  1.180          C  
ATOM     28  CH2 TRP A   2       1.574   9.226  -0.041  1.00  1.180          C  
ATOM     29  H   TRP A   2       0.727   1.563  -1.207  1.00  1.040          H  
ATOM     30  HA  TRP A   2       3.023   3.196  -1.192  1.00  1.000          H  
ATOM     31 1HB  TRP A   2       0.985   3.602  -2.575  1.00  1.410          H  
ATOM     32 2HB  TRP A   2       0.158   4.173  -1.131  1.00  1.410          H  
ATOM     33  HD1 TRP A   2       2.937   5.086  -3.572  1.00  1.410          H  
ATOM     34  HE1 TRP A   2       3.552   7.573  -3.344  1.00  1.410          H  
ATOM     35  HE3 TRP A   2       0.175   6.237   0.572  1.00  1.410          H  
ATOM     36  HZ2 TRP A   2       2.934   9.718  -1.630  1.00  1.410          H  
ATOM     37  HZ3 TRP A   2       0.248   8.527   1.433  1.00  1.410          H  
ATOM     38  HH2 TRP A   2       1.580  10.234   0.370  1.00  1.410          H  
ATOM     39  N   PHE A   3       1.157   3.645   1.515  1.00  0.760          N  
ATOM     40  CA  PHE A   3       1.261   4.292   2.815  1.00  0.790          C  
ATOM     41  C   PHE A   3       2.365   3.720   3.659  1.00  0.690          C  
ATOM     42  O   PHE A   3       2.892   4.427   4.510  1.00  0.630          O  
ATOM     43  CB  PHE A   3      -0.048   4.349   3.581  1.00  1.090          C  
ATOM     44  CG  PHE A   3      -0.859   5.500   3.182  1.00  1.090          C  
ATOM     45  CD1 PHE A   3      -1.828   5.415   2.228  1.00  1.090          C  
ATOM     46  CD2 PHE A   3      -0.628   6.707   3.787  1.00  1.090          C  
ATOM     47  CE1 PHE A   3      -2.558   6.522   1.870  1.00  1.090          C  
ATOM     48  CE2 PHE A   3      -1.334   7.815   3.453  1.00  1.090          C  
ATOM     49  CZ  PHE A   3      -2.308   7.726   2.480  1.00  1.090          C  
ATOM     50  H   PHE A   3       0.337   3.072   1.295  1.00  0.910          H  
ATOM     51  HA  PHE A   3       1.497   5.329   2.625  1.00  0.950          H  
ATOM     52 1HB  PHE A   3      -0.618   3.473   3.404  1.00  1.310          H  
ATOM     53 2HB  PHE A   3       0.144   4.414   4.649  1.00  1.310          H  
ATOM     54  HD1 PHE A   3      -2.004   4.475   1.749  1.00  1.310          H  
ATOM     55  HD2 PHE A   3       0.137   6.760   4.535  1.00  1.310          H  
ATOM     56  HE1 PHE A   3      -3.332   6.450   1.104  1.00  1.310          H  
ATOM     57  HE2 PHE A   3      -1.131   8.768   3.946  1.00  1.310          H  
ATOM     58  HZ  PHE A   3      -2.887   8.605   2.197  1.00  1.310          H  
ATOM     59  N   LYS A   4       2.749   2.461   3.452  1.00  0.740          N  
ATOM     60  CA  LYS A   4       3.852   1.956   4.240  1.00  0.720          C  
ATOM     61  C   LYS A   4       5.100   2.689   3.818  1.00  0.620          C  
ATOM     62  O   LYS A   4       5.836   3.193   4.668  1.00  0.580          O  
ATOM     63  CB  LYS A   4       4.049   0.449   4.054  1.00  1.020          C  
ATOM     64  CG  LYS A   4       5.258  -0.155   4.835  1.00  1.020          C  
ATOM     65  CD  LYS A   4       5.091  -0.032   6.344  1.00  1.020          C  
ATOM     66  CE  LYS A   4       6.096  -0.898   7.132  1.00  1.020          C  
ATOM     67  NZ  LYS A   4       7.500  -0.323   7.144  1.00  1.020          N  
ATOM     68  H   LYS A   4       2.299   1.870   2.761  1.00  0.890          H  
ATOM     69  HA  LYS A   4       3.666   2.173   5.289  1.00  0.860          H  
ATOM     70 1HB  LYS A   4       3.148  -0.079   4.368  1.00  1.220          H  
ATOM     71 2HB  LYS A   4       4.196   0.233   2.995  1.00  1.220          H  
ATOM     72 1HG  LYS A   4       5.363  -1.207   4.571  1.00  1.220          H  
ATOM     73 2HG  LYS A   4       6.178   0.363   4.546  1.00  1.220          H  
ATOM     74 1HD  LYS A   4       5.313   0.999   6.603  1.00  1.220          H  
ATOM     75 2HD  LYS A   4       4.074  -0.266   6.648  1.00  1.220          H  
ATOM     76 1HE  LYS A   4       5.748  -0.992   8.161  1.00  1.220          H  
ATOM     77 2HE  LYS A   4       6.129  -1.885   6.679  1.00  1.220          H  
ATOM     78 1HZ  LYS A   4       8.109  -0.920   7.666  1.00  1.220          H  
ATOM     79 2HZ  LYS A   4       7.910  -0.178   6.220  1.00  1.220          H  
ATOM     80 3HZ  LYS A   4       7.517   0.610   7.573  1.00  1.220          H  
ATOM     81  N   ALA A   5       5.341   2.771   2.503  1.00  0.630          N  
ATOM     82  CA  ALA A   5       6.552   3.431   2.031  1.00  0.640          C  
ATOM     83  C   ALA A   5       6.576   4.885   2.472  1.00  0.570          C  
ATOM     84  O   ALA A   5       7.602   5.395   2.939  1.00  0.590          O  
ATOM     85  CB  ALA A   5       6.631   3.351   0.521  1.00  0.890          C  
ATOM     86  H   ALA A   5       4.678   2.349   1.841  1.00  0.760          H  
ATOM     87  HA  ALA A   5       7.411   2.924   2.473  1.00  0.770          H  
ATOM     88 1HB  ALA A   5       7.545   3.829   0.177  1.00  1.070          H  
ATOM     89 2HB  ALA A   5       6.626   2.305   0.216  1.00  1.070          H  
ATOM     90 3HB  ALA A   5       5.765   3.859   0.085  1.00  1.070          H  
ATOM     91  N   PHE A   6       5.421   5.536   2.361  1.00  0.560          N  
ATOM     92  CA  PHE A   6       5.247   6.910   2.766  1.00  0.570          C  
ATOM     93  C   PHE A   6       5.536   7.104   4.237  1.00  0.500          C  
ATOM     94  O   PHE A   6       6.326   7.983   4.591  1.00  0.520          O  
ATOM     95  CB  PHE A   6       3.846   7.343   2.407  1.00  0.790          C  
ATOM     96  CG  PHE A   6       3.415   8.635   2.911  1.00  0.790          C  
ATOM     97  CD1 PHE A   6       3.870   9.820   2.393  1.00  0.790          C  
ATOM     98  CD2 PHE A   6       2.482   8.656   3.907  1.00  0.790          C  
ATOM     99  CE1 PHE A   6       3.393  11.011   2.886  1.00  0.790          C  
ATOM    100  CE2 PHE A   6       2.001   9.818   4.398  1.00  0.790          C  
ATOM    101  CZ  PHE A   6       2.455  11.007   3.892  1.00  0.790          C  
ATOM    102  H   PHE A   6       4.618   5.054   1.946  1.00  0.670          H  
ATOM    103  HA  PHE A   6       5.947   7.521   2.199  1.00  0.680          H  
ATOM    104 1HB  PHE A   6       3.729   7.333   1.325  1.00  0.950          H  
ATOM    105 2HB  PHE A   6       3.183   6.618   2.794  1.00  0.950          H  
ATOM    106  HD1 PHE A   6       4.606   9.810   1.589  1.00  0.950          H  
ATOM    107  HD2 PHE A   6       2.127   7.708   4.293  1.00  0.950          H  
ATOM    108  HE1 PHE A   6       3.753  11.954   2.478  1.00  0.950          H  
ATOM    109  HE2 PHE A   6       1.258   9.807   5.189  1.00  0.950          H  
ATOM    110  HZ  PHE A   6       2.071  11.945   4.280  1.00  0.950          H  
ATOM    111  N   TYR A   7       4.919   6.296   5.098  1.00  0.470          N  
ATOM    112  CA  TYR A   7       5.119   6.442   6.523  1.00  0.470          C  
ATOM    113  C   TYR A   7       6.565   6.206   6.900  1.00  0.380          C  
ATOM    114  O   TYR A   7       7.078   6.904   7.771  1.00  0.370          O  
ATOM    115  CB  TYR A   7       4.225   5.496   7.316  1.00  0.660          C  
ATOM    116  CG  TYR A   7       2.721   5.811   7.329  1.00  0.660          C  
ATOM    117  CD1 TYR A   7       2.215   7.067   7.012  1.00  0.660          C  
ATOM    118  CD2 TYR A   7       1.836   4.814   7.685  1.00  0.660          C  
ATOM    119  CE1 TYR A   7       0.877   7.272   7.051  1.00  0.660          C  
ATOM    120  CE2 TYR A   7       0.511   5.054   7.719  1.00  0.660          C  
ATOM    121  CZ  TYR A   7       0.038   6.262   7.409  1.00  0.660          C  
ATOM    122  OH  TYR A   7      -1.279   6.476   7.456  1.00  0.660          O  
ATOM    123  H   TYR A   7       4.278   5.575   4.767  1.00  0.560          H  
ATOM    124  HA  TYR A   7       4.897   7.466   6.789  1.00  0.560          H  
ATOM    125 1HB  TYR A   7       4.344   4.508   6.883  1.00  0.790          H  
ATOM    126 2HB  TYR A   7       4.570   5.446   8.347  1.00  0.790          H  
ATOM    127  HD1 TYR A   7       2.851   7.890   6.728  1.00  0.790          H  
ATOM    128  HD2 TYR A   7       2.185   3.835   7.940  1.00  0.790          H  
ATOM    129  HE1 TYR A   7       0.478   8.241   6.800  1.00  0.790          H  
ATOM    130  HE2 TYR A   7      -0.177   4.270   7.998  1.00  0.790          H  
ATOM    131  HH  TYR A   7      -1.462   7.375   7.180  1.00  0.790          H  
ATOM    132  N   ASP A   8       7.230   5.214   6.280  1.00  0.380          N  
ATOM    133  CA  ASP A   8       8.632   4.982   6.605  1.00  0.420          C  
ATOM    134  C   ASP A   8       9.473   6.209   6.262  1.00  0.390          C  
ATOM    135  O   ASP A   8      10.337   6.604   7.053  1.00  0.400          O  
ATOM    136  CB  ASP A   8       9.186   3.764   5.850  1.00  0.570          C  
ATOM    137  CG  ASP A   8       8.690   2.391   6.377  1.00  0.570          C  
ATOM    138  OD1 ASP A   8       8.159   2.308   7.463  1.00  0.570          O  
ATOM    139  OD2 ASP A   8       8.845   1.398   5.680  1.00  0.570          O  
ATOM    140  H   ASP A   8       6.753   4.610   5.602  1.00  0.460          H  
ATOM    141  HA  ASP A   8       8.711   4.793   7.674  1.00  0.500          H  
ATOM    142 1HB  ASP A   8       8.898   3.848   4.796  1.00  0.690          H  
ATOM    143 2HB  ASP A   8      10.274   3.781   5.889  1.00  0.690          H  
ATOM    144  N   LYS A   9       9.203   6.845   5.114  1.00  0.420          N  
ATOM    145  CA  LYS A   9       9.931   8.051   4.722  1.00  0.470          C  
ATOM    146  C   LYS A   9       9.662   9.209   5.688  1.00  0.420          C  
ATOM    147  O   LYS A   9      10.588   9.937   6.065  1.00  0.460          O  
ATOM    148  CB  LYS A   9       9.575   8.445   3.292  1.00  0.640          C  
ATOM    149  CG  LYS A   9      10.131   7.497   2.226  1.00  0.640          C  
ATOM    150  CD  LYS A   9       9.690   7.903   0.826  1.00  0.640          C  
ATOM    151  CE  LYS A   9      10.223   6.939  -0.228  1.00  0.640          C  
ATOM    152  NZ  LYS A   9       9.774   7.311  -1.599  1.00  0.640          N  
ATOM    153  H   LYS A   9       8.510   6.438   4.469  1.00  0.500          H  
ATOM    154  HA  LYS A   9      11.000   7.827   4.764  1.00  0.560          H  
ATOM    155 1HB  LYS A   9       8.488   8.465   3.186  1.00  0.770          H  
ATOM    156 2HB  LYS A   9       9.944   9.447   3.086  1.00  0.770          H  
ATOM    157 1HG  LYS A   9      11.221   7.510   2.274  1.00  0.770          H  
ATOM    158 2HG  LYS A   9       9.796   6.483   2.430  1.00  0.770          H  
ATOM    159 1HD  LYS A   9       8.598   7.901   0.783  1.00  0.770          H  
ATOM    160 2HD  LYS A   9      10.046   8.908   0.606  1.00  0.770          H  
ATOM    161 1HE  LYS A   9      11.311   6.944  -0.198  1.00  0.770          H  
ATOM    162 2HE  LYS A   9       9.867   5.932  -0.001  1.00  0.770          H  
ATOM    163 1HZ  LYS A   9      10.146   6.650  -2.267  1.00  0.770          H  
ATOM    164 2HZ  LYS A   9       8.765   7.296  -1.638  1.00  0.770          H  
ATOM    165 3HZ  LYS A   9      10.106   8.238  -1.824  1.00  0.770          H  
ATOM    166  N   VAL A  10       8.399   9.356   6.115  1.00  0.380          N  
ATOM    167  CA  VAL A  10       8.030  10.399   7.063  1.00  0.400          C  
ATOM    168  C   VAL A  10       8.757  10.150   8.375  1.00  0.350          C  
ATOM    169  O   VAL A  10       9.268  11.089   8.993  1.00  0.420          O  
ATOM    170  CB  VAL A  10       6.500  10.422   7.318  1.00  0.550          C  
ATOM    171  CG1 VAL A  10       6.147  11.377   8.472  1.00  0.550          C  
ATOM    172  CG2 VAL A  10       5.752  10.875   6.066  1.00  0.550          C  
ATOM    173  H   VAL A  10       7.680   8.739   5.726  1.00  0.460          H  
ATOM    174  HA  VAL A  10       8.338  11.362   6.661  1.00  0.480          H  
ATOM    175  HB  VAL A  10       6.194   9.431   7.583  1.00  0.660          H  
ATOM    176 1HG1 VAL A  10       5.078  11.361   8.638  1.00  0.660          H  
ATOM    177 2HG1 VAL A  10       6.649  11.079   9.391  1.00  0.660          H  
ATOM    178 3HG1 VAL A  10       6.449  12.379   8.208  1.00  0.660          H  
ATOM    179 1HG2 VAL A  10       4.677  10.861   6.255  1.00  0.660          H  
ATOM    180 2HG2 VAL A  10       6.063  11.884   5.803  1.00  0.660          H  
ATOM    181 3HG2 VAL A  10       5.970  10.221   5.242  1.00  0.660          H  
ATOM    182  N   ALA A  11       8.765   8.891   8.820  1.00  0.300          N  
ATOM    183  CA  ALA A  11       9.404   8.519  10.065  1.00  0.310          C  
ATOM    184  C   ALA A  11      10.883   8.868  10.041  1.00  0.360          C  
ATOM    185  O   ALA A  11      11.401   9.454  11.000  1.00  0.420          O  
ATOM    186  CB  ALA A  11       9.203   7.023  10.304  1.00  0.430          C  
ATOM    187  H   ALA A  11       8.288   8.169   8.283  1.00  0.360          H  
ATOM    188  HA  ALA A  11       8.940   9.077  10.869  1.00  0.370          H  
ATOM    189 1HB  ALA A  11       9.650   6.727  11.226  1.00  0.520          H  
ATOM    190 2HB  ALA A  11       8.143   6.790  10.334  1.00  0.520          H  
ATOM    191 3HB  ALA A  11       9.665   6.469   9.494  1.00  0.520          H  
ATOM    192  N   GLU A  12      11.579   8.610   8.929  1.00  0.400          N  
ATOM    193  CA  GLU A  12      12.978   8.996   8.933  1.00  0.530          C  
ATOM    194  C   GLU A  12      13.134  10.516   8.950  1.00  0.590          C  
ATOM    195  O   GLU A  12      13.907  11.053   9.748  1.00  0.770          O  
ATOM    196  CB  GLU A  12      13.723   8.420   7.723  1.00  0.690          C  
ATOM    197  CG  GLU A  12      13.932   6.906   7.753  1.00  0.690          C  
ATOM    198  CD  GLU A  12      14.697   6.393   6.544  1.00  0.690          C  
ATOM    199  OE1 GLU A  12      14.924   7.164   5.639  1.00  0.690          O  
ATOM    200  OE2 GLU A  12      15.060   5.239   6.537  1.00  0.690          O  
ATOM    201  H   GLU A  12      11.157   8.090   8.151  1.00  0.480          H  
ATOM    202  HA  GLU A  12      13.436   8.597   9.835  1.00  0.640          H  
ATOM    203 1HB  GLU A  12      13.162   8.656   6.816  1.00  0.830          H  
ATOM    204 2HB  GLU A  12      14.700   8.894   7.638  1.00  0.830          H  
ATOM    205 1HG  GLU A  12      14.479   6.644   8.658  1.00  0.830          H  
ATOM    206 2HG  GLU A  12      12.957   6.419   7.798  1.00  0.830          H  
ATOM    207  N   LYS A  13      12.334  11.222   8.143  1.00  0.550          N  
ATOM    208  CA  LYS A  13      12.435  12.675   8.024  1.00  0.640          C  
ATOM    209  C   LYS A  13      12.286  13.411   9.343  1.00  0.650          C  
ATOM    210  O   LYS A  13      13.029  14.355   9.621  1.00  0.770          O  
ATOM    211  CB  LYS A  13      11.395  13.199   7.029  1.00  0.860          C  
ATOM    212  CG  LYS A  13      11.429  14.716   6.799  1.00  0.860          C  
ATOM    213  CD  LYS A  13      10.443  15.135   5.712  1.00  0.860          C  
ATOM    214  CE  LYS A  13      10.436  16.646   5.523  1.00  0.860          C  
ATOM    215  NZ  LYS A  13       9.497  17.073   4.441  1.00  0.860          N  
ATOM    216  H   LYS A  13      11.680  10.724   7.530  1.00  0.660          H  
ATOM    217  HA  LYS A  13      13.423  12.906   7.632  1.00  0.770          H  
ATOM    218 1HB  LYS A  13      11.526  12.696   6.071  1.00  1.030          H  
ATOM    219 2HB  LYS A  13      10.399  12.941   7.391  1.00  1.030          H  
ATOM    220 1HG  LYS A  13      11.159  15.230   7.727  1.00  1.030          H  
ATOM    221 2HG  LYS A  13      12.435  15.023   6.517  1.00  1.030          H  
ATOM    222 1HD  LYS A  13      10.723  14.662   4.770  1.00  1.030          H  
ATOM    223 2HD  LYS A  13       9.445  14.800   5.980  1.00  1.030          H  
ATOM    224 1HE  LYS A  13      10.138  17.118   6.458  1.00  1.030          H  
ATOM    225 2HE  LYS A  13      11.442  16.976   5.268  1.00  1.030          H  
ATOM    226 1HZ  LYS A  13       9.523  18.080   4.349  1.00  1.030          H  
ATOM    227 2HZ  LYS A  13       9.773  16.649   3.565  1.00  1.030          H  
ATOM    228 3HZ  LYS A  13       8.558  16.783   4.672  1.00  1.030          H  
ATOM    229  N   PHE A  14      11.335  12.981  10.161  1.00  0.570          N  
ATOM    230  CA  PHE A  14      11.076  13.649  11.424  1.00  0.650          C  
ATOM    231  C   PHE A  14      11.612  12.933  12.663  1.00  0.570          C  
ATOM    232  O   PHE A  14      11.223  13.282  13.776  1.00  0.640          O  
ATOM    233  CB  PHE A  14       9.575  13.869  11.568  1.00  0.880          C  
ATOM    234  CG  PHE A  14       9.025  14.789  10.517  1.00  0.880          C  
ATOM    235  CD1 PHE A  14       8.376  14.277   9.417  1.00  0.880          C  
ATOM    236  CD2 PHE A  14       9.160  16.162  10.625  1.00  0.880          C  
ATOM    237  CE1 PHE A  14       7.865  15.097   8.446  1.00  0.880          C  
ATOM    238  CE2 PHE A  14       8.651  16.994   9.652  1.00  0.880          C  
ATOM    239  CZ  PHE A  14       8.001  16.459   8.561  1.00  0.880          C  
ATOM    240  H   PHE A  14      10.729  12.213   9.851  1.00  0.680          H  
ATOM    241  HA  PHE A  14      11.555  14.627  11.382  1.00  0.780          H  
ATOM    242 1HB  PHE A  14       9.059  12.906  11.488  1.00  1.050          H  
ATOM    243 2HB  PHE A  14       9.345  14.282  12.549  1.00  1.050          H  
ATOM    244  HD1 PHE A  14       8.273  13.204   9.328  1.00  1.050          H  
ATOM    245  HD2 PHE A  14       9.674  16.584  11.490  1.00  1.050          H  
ATOM    246  HE1 PHE A  14       7.352  14.670   7.587  1.00  1.050          H  
ATOM    247  HE2 PHE A  14       8.759  18.075   9.745  1.00  1.050          H  
ATOM    248  HZ  PHE A  14       7.595  17.115   7.796  1.00  1.050          H  
ATOM    249  N   LYS A  15      12.492  11.941  12.492  1.00  0.530          N  
ATOM    250  CA  LYS A  15      13.041  11.181  13.622  1.00  0.540          C  
ATOM    251  C   LYS A  15      11.953  10.540  14.505  1.00  0.490          C  
ATOM    252  O   LYS A  15      12.022  10.596  15.736  1.00  0.580          O  
ATOM    253  CB  LYS A  15      13.938  12.079  14.488  1.00  0.750          C  
ATOM    254  CG  LYS A  15      15.120  12.679  13.742  1.00  0.750          C  
ATOM    255  CD  LYS A  15      16.000  13.509  14.665  1.00  0.750          C  
ATOM    256  CE  LYS A  15      17.162  14.141  13.903  1.00  0.750          C  
ATOM    257  NZ  LYS A  15      18.017  14.991  14.788  1.00  0.750          N  
ATOM    258  H   LYS A  15      12.813  11.702  11.543  1.00  0.640          H  
ATOM    259  HA  LYS A  15      13.647  10.372  13.213  1.00  0.650          H  
ATOM    260 1HB  LYS A  15      13.359  12.891  14.921  1.00  0.900          H  
ATOM    261 2HB  LYS A  15      14.335  11.493  15.316  1.00  0.900          H  
ATOM    262 1HG  LYS A  15      15.711  11.879  13.298  1.00  0.900          H  
ATOM    263 2HG  LYS A  15      14.746  13.316  12.940  1.00  0.900          H  
ATOM    264 1HD  LYS A  15      15.399  14.297  15.122  1.00  0.900          H  
ATOM    265 2HD  LYS A  15      16.396  12.874  15.456  1.00  0.900          H  
ATOM    266 1HE  LYS A  15      17.776  13.351  13.473  1.00  0.900          H  
ATOM    267 2HE  LYS A  15      16.765  14.759  13.096  1.00  0.900          H  
ATOM    268 1HZ  LYS A  15      18.773  15.388  14.246  1.00  0.900          H  
ATOM    269 2HZ  LYS A  15      17.462  15.736  15.184  1.00  0.900          H  
ATOM    270 3HZ  LYS A  15      18.401  14.426  15.532  1.00  0.900          H  
ATOM    271  N   GLU A  16      10.955   9.932  13.861  1.00  0.410          N  
ATOM    272  CA  GLU A  16       9.832   9.255  14.514  1.00  0.430          C  
ATOM    273  C   GLU A  16       9.875   7.766  14.191  1.00  0.400          C  
ATOM    274  O   GLU A  16      10.575   7.348  13.272  1.00  0.400          O  
ATOM    275  CB  GLU A  16       8.485   9.870  14.084  1.00  0.590          C  
ATOM    276  CG  GLU A  16       8.235  11.323  14.556  1.00  0.590          C  
ATOM    277  CD  GLU A  16       6.869  11.889  14.127  1.00  0.590          C  
ATOM    278  OE1 GLU A  16       6.310  11.374  13.196  1.00  0.590          O  
ATOM    279  OE2 GLU A  16       6.394  12.809  14.753  1.00  0.590          O  
ATOM    280  H   GLU A  16      11.005   9.912  12.840  1.00  0.490          H  
ATOM    281  HA  GLU A  16       9.931   9.368  15.594  1.00  0.520          H  
ATOM    282 1HB  GLU A  16       8.423   9.871  13.003  1.00  0.710          H  
ATOM    283 2HB  GLU A  16       7.677   9.256  14.450  1.00  0.710          H  
ATOM    284 1HG  GLU A  16       8.311  11.355  15.643  1.00  0.710          H  
ATOM    285 2HG  GLU A  16       9.024  11.950  14.153  1.00  0.710          H  
ATOM    286  N   ALA A  17       9.217   6.932  14.991  1.00  0.480          N  
ATOM    287  CA  ALA A  17       9.156   5.510  14.670  1.00  0.540          C  
ATOM    288  C   ALA A  17       8.010   5.243  13.687  1.00  0.490          C  
ATOM    289  O   ALA A  17       7.040   6.000  13.634  1.00  0.430          O  
ATOM    290  CB  ALA A  17       8.995   4.690  15.935  1.00  0.730          C  
ATOM    291  H   ALA A  17       8.686   7.280  15.808  1.00  0.580          H  
ATOM    292  HA  ALA A  17      10.092   5.227  14.185  1.00  0.650          H  
ATOM    293 1HB  ALA A  17       8.989   3.638  15.692  1.00  0.880          H  
ATOM    294 2HB  ALA A  17       9.830   4.897  16.603  1.00  0.880          H  
ATOM    295 3HB  ALA A  17       8.066   4.959  16.434  1.00  0.880          H  
ATOM    296  N   PHE A  18       8.046   4.129  12.951  1.00  0.570          N  
ATOM    297  CA  PHE A  18       6.914   3.861  12.059  1.00  0.580          C  
ATOM    298  C   PHE A  18       5.538   3.945  12.740  1.00  0.550          C  
ATOM    299  O   PHE A  18       4.656   4.587  12.164  1.00  0.550          O  
ATOM    300  CB  PHE A  18       7.040   2.525  11.302  1.00  0.810          C  
ATOM    301  CG  PHE A  18       5.738   2.127  10.624  1.00  0.810          C  
ATOM    302  CD1 PHE A  18       5.392   2.593   9.376  1.00  0.810          C  
ATOM    303  CD2 PHE A  18       4.835   1.284  11.283  1.00  0.810          C  
ATOM    304  CE1 PHE A  18       4.188   2.224   8.812  1.00  0.810          C  
ATOM    305  CE2 PHE A  18       3.642   0.937  10.714  1.00  0.810          C  
ATOM    306  CZ  PHE A  18       3.318   1.407   9.480  1.00  0.810          C  
ATOM    307  H   PHE A  18       8.846   3.509  12.986  1.00  0.680          H  
ATOM    308  HA  PHE A  18       6.925   4.633  11.287  1.00  0.700          H  
ATOM    309 1HB  PHE A  18       7.781   2.660  10.507  1.00  0.970          H  
ATOM    310 2HB  PHE A  18       7.393   1.715  11.901  1.00  0.970          H  
ATOM    311  HD1 PHE A  18       6.085   3.250   8.834  1.00  0.970          H  
ATOM    312  HD2 PHE A  18       5.082   0.902  12.271  1.00  0.970          H  
ATOM    313  HE1 PHE A  18       3.928   2.580   7.831  1.00  0.970          H  
ATOM    314  HE2 PHE A  18       2.950   0.285  11.248  1.00  0.970          H  
ATOM    315  HZ  PHE A  18       2.371   1.127   9.033  1.00  0.970          H  
ATOM    316  N   PRO A  19       5.280   3.289  13.906  1.00  0.560          N  
ATOM    317  CA  PRO A  19       4.025   3.321  14.635  1.00  0.590          C  
ATOM    318  C   PRO A  19       3.631   4.714  15.099  1.00  0.540          C  
ATOM    319  O   PRO A  19       2.465   4.958  15.398  1.00  0.600          O  
ATOM    320  CB  PRO A  19       4.297   2.423  15.845  1.00  0.890          C  
ATOM    321  CG  PRO A  19       5.423   1.539  15.422  1.00  0.890          C  
ATOM    322  CD  PRO A  19       6.282   2.424  14.574  1.00  0.890          C  
ATOM    323  HA  PRO A  19       3.240   2.888  13.998  1.00  0.710          H  
ATOM    324 1HB  PRO A  19       4.558   3.049  16.718  1.00  1.060          H  
ATOM    325 2HB  PRO A  19       3.387   1.863  16.116  1.00  1.060          H  
ATOM    326 1HG  PRO A  19       5.952   1.148  16.305  1.00  1.060          H  
ATOM    327 2HG  PRO A  19       5.036   0.670  14.872  1.00  1.060          H  
ATOM    328 1HD  PRO A  19       6.894   3.015  15.229  1.00  1.060          H  
ATOM    329 2HD  PRO A  19       6.853   1.813  13.923  1.00  1.060          H  
ATOM    330  N   ASP A  20       4.583   5.638  15.182  1.00  0.470          N  
ATOM    331  CA  ASP A  20       4.276   6.973  15.640  1.00  0.470          C  
ATOM    332  C   ASP A  20       3.625   7.664  14.475  1.00  0.430          C  
ATOM    333  O   ASP A  20       2.567   8.280  14.610  1.00  0.470          O  
ATOM    334  CB  ASP A  20       5.552   7.711  16.016  1.00  0.660          C  
ATOM    335  CG  ASP A  20       6.279   7.133  17.217  1.00  0.660          C  
ATOM    336  OD1 ASP A  20       5.684   6.433  18.021  1.00  0.660          O  
ATOM    337  OD2 ASP A  20       7.489   7.333  17.278  1.00  0.660          O  
ATOM    338  H   ASP A  20       5.536   5.452  14.892  1.00  0.560          H  
ATOM    339  HA  ASP A  20       3.582   6.938  16.480  1.00  0.560          H  
ATOM    340 1HB  ASP A  20       6.220   7.701  15.174  1.00  0.790          H  
ATOM    341 2HB  ASP A  20       5.314   8.759  16.219  1.00  0.790          H  
ATOM    342  N   VAL A  21       4.261   7.531  13.313  1.00  0.400          N  
ATOM    343  CA  VAL A  21       3.753   8.167  12.117  1.00  0.410          C  
ATOM    344  C   VAL A  21       2.420   7.564  11.746  1.00  0.480          C  
ATOM    345  O   VAL A  21       1.452   8.286  11.497  1.00  0.500          O  
ATOM    346  CB  VAL A  21       4.720   7.989  10.941  1.00  0.570          C  
ATOM    347  CG1 VAL A  21       4.092   8.497   9.671  1.00  0.570          C  
ATOM    348  CG2 VAL A  21       5.982   8.727  11.213  1.00  0.570          C  
ATOM    349  H   VAL A  21       5.134   6.994  13.300  1.00  0.480          H  
ATOM    350  HA  VAL A  21       3.627   9.232  12.317  1.00  0.490          H  
ATOM    351  HB  VAL A  21       4.939   6.927  10.806  1.00  0.680          H  
ATOM    352 1HG1 VAL A  21       4.780   8.353   8.876  1.00  0.680          H  
ATOM    353 2HG1 VAL A  21       3.182   7.958   9.454  1.00  0.680          H  
ATOM    354 3HG1 VAL A  21       3.869   9.552   9.786  1.00  0.680          H  
ATOM    355 1HG2 VAL A  21       6.626   8.592  10.377  1.00  0.680          H  
ATOM    356 2HG2 VAL A  21       5.766   9.786  11.343  1.00  0.680          H  
ATOM    357 3HG2 VAL A  21       6.454   8.344  12.117  1.00  0.680          H  
ATOM    358  N   CYS A  22       2.361   6.238  11.730  1.00  0.560          N  
ATOM    359  CA  CYS A  22       1.148   5.561  11.363  1.00  0.680          C  
ATOM    360  C   CYS A  22      -0.001   5.970  12.269  1.00  0.680          C  
ATOM    361  O   CYS A  22      -1.084   6.286  11.777  1.00  0.770          O  
ATOM    362  CB  CYS A  22       1.351   4.055  11.419  1.00  0.900          C  
ATOM    363  SG  CYS A  22      -0.050   3.108  10.848  1.00  0.900          S  
ATOM    364  H   CYS A  22       3.204   5.692  11.928  1.00  0.670          H  
ATOM    365  HA  CYS A  22       0.898   5.846  10.347  1.00  0.820          H  
ATOM    366 1HB  CYS A  22       2.223   3.786  10.824  1.00  1.080          H  
ATOM    367 2HB  CYS A  22       1.558   3.764  12.444  1.00  1.080          H  
ATOM    368  HG  CYS A  22      -0.985   3.790  11.524  1.00  1.080          H  
ATOM    369  N   ARG A  23       0.203   5.980  13.592  1.00  0.650          N  
ATOM    370  CA  ARG A  23      -0.879   6.367  14.484  1.00  0.730          C  
ATOM    371  C   ARG A  23      -1.263   7.843  14.323  1.00  0.700          C  
ATOM    372  O   ARG A  23      -2.453   8.183  14.377  1.00  0.820          O  
ATOM    373  CB  ARG A  23      -0.501   6.075  15.925  1.00  0.990          C  
ATOM    374  CG  ARG A  23      -0.452   4.580  16.283  1.00  0.990          C  
ATOM    375  CD  ARG A  23       0.010   4.345  17.693  1.00  0.990          C  
ATOM    376  NE  ARG A  23       1.425   4.738  17.891  1.00  0.990          N  
ATOM    377  CZ  ARG A  23       2.063   4.778  19.088  1.00  0.990          C  
ATOM    378  NH1 ARG A  23       1.414   4.424  20.187  1.00  0.990          N  
ATOM    379  NH2 ARG A  23       3.336   5.169  19.187  1.00  0.990          N  
ATOM    380  H   ARG A  23       1.100   5.708  14.003  1.00  0.780          H  
ATOM    381  HA  ARG A  23      -1.745   5.756  14.240  1.00  0.880          H  
ATOM    382 1HB  ARG A  23       0.479   6.510  16.133  1.00  1.190          H  
ATOM    383 2HB  ARG A  23      -1.215   6.549  16.589  1.00  1.190          H  
ATOM    384 1HG  ARG A  23      -1.454   4.165  16.188  1.00  1.190          H  
ATOM    385 2HG  ARG A  23       0.210   4.053  15.601  1.00  1.190          H  
ATOM    386 1HD  ARG A  23      -0.609   4.926  18.372  1.00  1.190          H  
ATOM    387 2HD  ARG A  23      -0.084   3.284  17.924  1.00  1.190          H  
ATOM    388  HE  ARG A  23       1.957   5.008  17.051  1.00  1.190          H  
ATOM    389 1HH1 ARG A  23       0.453   4.126  20.136  1.00  1.190          H  
ATOM    390 2HH1 ARG A  23       1.884   4.454  21.081  1.00  1.190          H  
ATOM    391 1HH2 ARG A  23       3.895   5.480  18.374  1.00  1.190          H  
ATOM    392 2HH2 ARG A  23       3.788   5.195  20.083  1.00  1.190          H  
ATOM    393  N   ASN A  24      -0.275   8.729  14.086  1.00  0.600          N  
ATOM    394  CA  ASN A  24      -0.575  10.149  13.930  1.00  0.670          C  
ATOM    395  C   ASN A  24      -1.502  10.375  12.742  1.00  0.710          C  
ATOM    396  O   ASN A  24      -2.411  11.213  12.811  1.00  0.860          O  
ATOM    397  CB  ASN A  24       0.709  10.950  13.739  1.00  0.910          C  
ATOM    398  CG  ASN A  24       1.596  11.108  15.002  1.00  0.910          C  
ATOM    399  OD1 ASN A  24       1.188  11.008  16.179  1.00  0.910          O  
ATOM    400  ND2 ASN A  24       2.854  11.370  14.742  1.00  0.910          N  
ATOM    401  H   ASN A  24       0.704   8.428  14.094  1.00  0.720          H  
ATOM    402  HA  ASN A  24      -1.093  10.496  14.807  1.00  0.800          H  
ATOM    403 1HB  ASN A  24       1.308  10.466  12.969  1.00  1.090          H  
ATOM    404 2HB  ASN A  24       0.455  11.942  13.369  1.00  1.090          H  
ATOM    405 1HD2 ASN A  24       3.512  11.492  15.486  1.00  1.090          H  
ATOM    406 2HD2 ASN A  24       3.170  11.449  13.795  1.00  1.090          H  
ATOM    407  N   PHE A  25      -1.298   9.609  11.668  1.00  0.670          N  
ATOM    408  CA  PHE A  25      -2.163   9.682  10.498  1.00  0.780          C  
ATOM    409  C   PHE A  25      -3.496   8.978  10.719  1.00  0.740          C  
ATOM    410  O   PHE A  25      -4.549   9.544  10.422  1.00  0.800          O  
ATOM    411  CB  PHE A  25      -1.471   9.114   9.264  1.00  1.050          C  
ATOM    412  CG  PHE A  25      -0.550  10.071   8.551  1.00  1.050          C  
ATOM    413  CD1 PHE A  25       0.797  10.167   8.853  1.00  1.050          C  
ATOM    414  CD2 PHE A  25      -1.046  10.859   7.534  1.00  1.050          C  
ATOM    415  CE1 PHE A  25       1.617  11.037   8.169  1.00  1.050          C  
ATOM    416  CE2 PHE A  25      -0.236  11.728   6.851  1.00  1.050          C  
ATOM    417  CZ  PHE A  25       1.103  11.818   7.176  1.00  1.050          C  
ATOM    418  H   PHE A  25      -0.479   8.989  11.667  1.00  0.800          H  
ATOM    419  HA  PHE A  25      -2.374  10.729  10.301  1.00  0.940          H  
ATOM    420 1HB  PHE A  25      -0.886   8.235   9.565  1.00  1.260          H  
ATOM    421 2HB  PHE A  25      -2.214   8.785   8.564  1.00  1.260          H  
ATOM    422  HD1 PHE A  25       1.208   9.553   9.629  1.00  1.260          H  
ATOM    423  HD2 PHE A  25      -2.095  10.787   7.271  1.00  1.260          H  
ATOM    424  HE1 PHE A  25       2.672  11.103   8.416  1.00  1.260          H  
ATOM    425  HE2 PHE A  25      -0.647  12.348   6.052  1.00  1.260          H  
ATOM    426  HZ  PHE A  25       1.754  12.505   6.639  1.00  1.260          H  
ATOM    427  N   MET A  26      -3.503   7.783  11.310  1.00  0.730          N  
ATOM    428  CA  MET A  26      -4.773   7.081  11.491  1.00  0.810          C  
ATOM    429  C   MET A  26      -5.766   7.920  12.291  1.00  0.720          C  
ATOM    430  O   MET A  26      -6.921   8.065  11.895  1.00  0.820          O  
ATOM    431  CB  MET A  26      -4.556   5.748  12.193  1.00  1.100          C  
ATOM    432  CG  MET A  26      -3.844   4.698  11.362  1.00  1.100          C  
ATOM    433  SD  MET A  26      -3.378   3.234  12.325  1.00  1.100          S  
ATOM    434  CE  MET A  26      -4.932   2.407  12.659  1.00  1.100          C  
ATOM    435  H   MET A  26      -2.624   7.332  11.584  1.00  0.880          H  
ATOM    436  HA  MET A  26      -5.204   6.892  10.509  1.00  0.970          H  
ATOM    437 1HB  MET A  26      -3.966   5.914  13.096  1.00  1.320          H  
ATOM    438 2HB  MET A  26      -5.521   5.352  12.498  1.00  1.320          H  
ATOM    439 1HG  MET A  26      -4.498   4.392  10.570  1.00  1.320          H  
ATOM    440 2HG  MET A  26      -2.962   5.114  10.903  1.00  1.320          H  
ATOM    441 1HE  MET A  26      -4.743   1.508  13.245  1.00  1.320          H  
ATOM    442 2HE  MET A  26      -5.596   3.067  13.217  1.00  1.320          H  
ATOM    443 3HE  MET A  26      -5.400   2.123  11.728  1.00  1.320          H  
ATOM    444  N   ARG A  27      -5.299   8.589  13.345  1.00  0.650          N  
ATOM    445  CA  ARG A  27      -6.176   9.418  14.175  1.00  0.730          C  
ATOM    446  C   ARG A  27      -6.855  10.575  13.425  1.00  0.730          C  
ATOM    447  O   ARG A  27      -7.840  11.128  13.916  1.00  0.910          O  
ATOM    448  CB  ARG A  27      -5.434  10.020  15.359  1.00  0.990          C  
ATOM    449  CG  ARG A  27      -5.041   9.043  16.460  1.00  0.990          C  
ATOM    450  CD  ARG A  27      -4.632   9.755  17.711  1.00  0.990          C  
ATOM    451  NE  ARG A  27      -3.534  10.688  17.482  1.00  0.990          N  
ATOM    452  CZ  ARG A  27      -2.220  10.392  17.480  1.00  0.990          C  
ATOM    453  NH1 ARG A  27      -1.797   9.167  17.687  1.00  0.990          N  
ATOM    454  NH2 ARG A  27      -1.356  11.360  17.248  1.00  0.990          N  
ATOM    455  H   ARG A  27      -4.318   8.465  13.621  1.00  0.780          H  
ATOM    456  HA  ARG A  27      -6.956   8.773  14.572  1.00  0.880          H  
ATOM    457 1HB  ARG A  27      -4.512  10.476  14.989  1.00  1.190          H  
ATOM    458 2HB  ARG A  27      -6.036  10.809  15.803  1.00  1.190          H  
ATOM    459 1HG  ARG A  27      -5.893   8.407  16.695  1.00  1.190          H  
ATOM    460 2HG  ARG A  27      -4.216   8.424  16.125  1.00  1.190          H  
ATOM    461 1HD  ARG A  27      -5.483  10.325  18.087  1.00  1.190          H  
ATOM    462 2HD  ARG A  27      -4.329   9.034  18.466  1.00  1.190          H  
ATOM    463  HE  ARG A  27      -3.785  11.653  17.312  1.00  1.190          H  
ATOM    464 1HH1 ARG A  27      -2.457   8.426  17.856  1.00  1.190          H  
ATOM    465 2HH1 ARG A  27      -0.804   8.965  17.679  1.00  1.190          H  
ATOM    466 1HH2 ARG A  27      -1.681  12.299  17.082  1.00  1.190          H  
ATOM    467 2HH2 ARG A  27      -0.360  11.156  17.181  1.00  1.190          H  
ATOM    468  N   ARG A  28      -6.281  11.011  12.308  1.00  0.660          N  
ATOM    469  CA  ARG A  28      -6.805  12.134  11.542  1.00  0.800          C  
ATOM    470  C   ARG A  28      -7.563  11.699  10.291  1.00  0.780          C  
ATOM    471  O   ARG A  28      -8.550  12.331   9.885  1.00  0.970          O  
ATOM    472  CB  ARG A  28      -5.657  13.025  11.104  1.00  1.060          C  
ATOM    473  CG  ARG A  28      -4.959  13.789  12.199  1.00  1.060          C  
ATOM    474  CD  ARG A  28      -3.780  14.534  11.670  1.00  1.060          C  
ATOM    475  NE  ARG A  28      -2.644  13.643  11.367  1.00  1.060          N  
ATOM    476  CZ  ARG A  28      -1.592  13.945  10.561  1.00  1.060          C  
ATOM    477  NH1 ARG A  28      -1.534  15.090   9.903  1.00  1.060          N  
ATOM    478  NH2 ARG A  28      -0.609  13.085  10.445  1.00  1.060          N  
ATOM    479  H   ARG A  28      -5.493  10.490  11.924  1.00  0.790          H  
ATOM    480  HA  ARG A  28      -7.479  12.701  12.181  1.00  0.960          H  
ATOM    481 1HB  ARG A  28      -4.900  12.401  10.639  1.00  1.280          H  
ATOM    482 2HB  ARG A  28      -6.003  13.734  10.354  1.00  1.280          H  
ATOM    483 1HG  ARG A  28      -5.648  14.496  12.656  1.00  1.280          H  
ATOM    484 2HG  ARG A  28      -4.603  13.083  12.955  1.00  1.280          H  
ATOM    485 1HD  ARG A  28      -4.071  15.051  10.760  1.00  1.280          H  
ATOM    486 2HD  ARG A  28      -3.453  15.257  12.417  1.00  1.280          H  
ATOM    487  HE  ARG A  28      -2.614  12.733  11.862  1.00  1.280          H  
ATOM    488 1HH1 ARG A  28      -2.286  15.758   9.964  1.00  1.280          H  
ATOM    489 2HH1 ARG A  28      -0.737  15.294   9.315  1.00  1.280          H  
ATOM    490 1HH2 ARG A  28      -0.646  12.217  10.967  1.00  1.280          H  
ATOM    491 2HH2 ARG A  28       0.191  13.295   9.863  1.00  1.280          H  
ATOM    492  N   TYR A  29      -7.103  10.617   9.683  1.00  0.650          N  
ATOM    493  CA  TYR A  29      -7.642  10.161   8.424  1.00  0.750          C  
ATOM    494  C   TYR A  29      -8.432   8.849   8.429  1.00  0.770          C  
ATOM    495  O   TYR A  29      -9.256   8.630   7.526  1.00  1.010          O  
ATOM    496  CB  TYR A  29      -6.479  10.057   7.469  1.00  1.010          C  
ATOM    497  CG  TYR A  29      -5.809  11.357   7.171  1.00  1.010          C  
ATOM    498  CD1 TYR A  29      -4.667  11.717   7.856  1.00  1.010          C  
ATOM    499  CD2 TYR A  29      -6.323  12.187   6.209  1.00  1.010          C  
ATOM    500  CE1 TYR A  29      -4.049  12.909   7.599  1.00  1.010          C  
ATOM    501  CE2 TYR A  29      -5.710  13.388   5.942  1.00  1.010          C  
ATOM    502  CZ  TYR A  29      -4.575  13.755   6.641  1.00  1.010          C  
ATOM    503  OH  TYR A  29      -3.960  14.962   6.387  1.00  1.010          O  
ATOM    504  H   TYR A  29      -6.277  10.151  10.061  1.00  0.780          H  
ATOM    505  HA  TYR A  29      -8.310  10.927   8.062  1.00  0.900          H  
ATOM    506 1HB  TYR A  29      -5.739   9.411   7.912  1.00  1.210          H  
ATOM    507 2HB  TYR A  29      -6.800   9.626   6.575  1.00  1.210          H  
ATOM    508  HD1 TYR A  29      -4.258  11.061   8.604  1.00  1.210          H  
ATOM    509  HD2 TYR A  29      -7.210  11.899   5.662  1.00  1.210          H  
ATOM    510  HE1 TYR A  29      -3.154  13.188   8.149  1.00  1.210          H  
ATOM    511  HE2 TYR A  29      -6.123  14.051   5.179  1.00  1.210          H  
ATOM    512  HH  TYR A  29      -4.448  15.433   5.705  1.00  1.210          H  
ATOM    513  N   GLN A  30      -8.178   7.971   9.401  1.00  0.660          N  
ATOM    514  CA  GLN A  30      -8.753   6.633   9.447  1.00  0.800          C  
ATOM    515  C   GLN A  30      -8.691   5.917   8.099  1.00  0.640          C  
ATOM    516  O   GLN A  30      -7.600   5.737   7.542  1.00  0.710          O  
ATOM    517  CB  GLN A  30     -10.166   6.647  10.036  1.00  1.060          C  
ATOM    518  CG  GLN A  30     -10.211   6.997  11.525  1.00  1.060          C  
ATOM    519  CD  GLN A  30      -9.510   5.916  12.386  1.00  1.060          C  
ATOM    520  OE1 GLN A  30      -9.639   4.719  12.111  1.00  1.060          O  
ATOM    521  NE2 GLN A  30      -8.794   6.332  13.415  1.00  1.060          N  
ATOM    522  H   GLN A  30      -7.565   8.219  10.174  1.00  0.790          H  
ATOM    523  HA  GLN A  30      -8.142   6.053  10.138  1.00  0.960          H  
ATOM    524 1HB  GLN A  30     -10.783   7.368   9.500  1.00  1.280          H  
ATOM    525 2HB  GLN A  30     -10.620   5.664   9.930  1.00  1.280          H  
ATOM    526 1HG  GLN A  30      -9.692   7.947  11.680  1.00  1.280          H  
ATOM    527 2HG  GLN A  30     -11.247   7.076  11.846  1.00  1.280          H  
ATOM    528 1HE2 GLN A  30      -8.330   5.670  14.002  1.00  1.280          H  
ATOM    529 2HE2 GLN A  30      -8.723   7.316  13.607  1.00  1.280          H  
ATOM    530  N   SER A  31      -9.841   5.538   7.531  1.00  0.700          N  
ATOM    531  CA  SER A  31      -9.857   4.749   6.301  1.00  0.760          C  
ATOM    532  C   SER A  31      -9.174   5.411   5.110  1.00  0.720          C  
ATOM    533  O   SER A  31      -8.671   4.705   4.226  1.00  0.820          O  
ATOM    534  CB  SER A  31     -11.290   4.415   5.918  1.00  1.040          C  
ATOM    535  OG  SER A  31     -11.989   5.563   5.540  1.00  1.040          O  
ATOM    536  H   SER A  31     -10.722   5.759   7.969  1.00  0.840          H  
ATOM    537  HA  SER A  31      -9.352   3.815   6.501  1.00  0.910          H  
ATOM    538 1HB  SER A  31     -11.288   3.702   5.093  1.00  1.250          H  
ATOM    539 2HB  SER A  31     -11.790   3.940   6.759  1.00  1.250          H  
ATOM    540  HG  SER A  31     -12.904   5.287   5.408  1.00  1.250          H  
ATOM    541  N   ARG A  32      -9.045   6.748   5.125  1.00  0.730          N  
ATOM    542  CA  ARG A  32      -8.410   7.477   4.032  1.00  0.860          C  
ATOM    543  C   ARG A  32      -6.918   7.139   3.898  1.00  0.860          C  
ATOM    544  O   ARG A  32      -6.310   7.411   2.860  1.00  1.110          O  
ATOM    545  CB  ARG A  32      -8.602   8.983   4.201  1.00  1.150          C  
ATOM    546  CG  ARG A  32     -10.045   9.473   4.047  1.00  1.150          C  
ATOM    547  CD  ARG A  32     -10.191  10.966   4.234  1.00  1.150          C  
ATOM    548  NE  ARG A  32      -9.965  11.430   5.630  1.00  1.150          N  
ATOM    549  CZ  ARG A  32      -9.912  12.750   5.997  1.00  1.150          C  
ATOM    550  NH1 ARG A  32     -10.075  13.684   5.076  1.00  1.150          N  
ATOM    551  NH2 ARG A  32      -9.699  13.133   7.264  1.00  1.150          N  
ATOM    552  H   ARG A  32      -9.429   7.287   5.905  1.00  0.880          H  
ATOM    553  HA  ARG A  32      -8.907   7.188   3.107  1.00  1.030          H  
ATOM    554 1HB  ARG A  32      -8.314   9.259   5.174  1.00  1.380          H  
ATOM    555 2HB  ARG A  32      -7.971   9.522   3.498  1.00  1.380          H  
ATOM    556 1HG  ARG A  32     -10.405   9.214   3.054  1.00  1.380          H  
ATOM    557 2HG  ARG A  32     -10.666   8.979   4.796  1.00  1.380          H  
ATOM    558 1HD  ARG A  32      -9.467  11.461   3.590  1.00  1.380          H  
ATOM    559 2HD  ARG A  32     -11.199  11.256   3.939  1.00  1.380          H  
ATOM    560  HE  ARG A  32      -9.861  10.722   6.356  1.00  1.380          H  
ATOM    561 1HH1 ARG A  32     -10.238  13.428   4.114  1.00  1.380          H  
ATOM    562 2HH1 ARG A  32     -10.036  14.660   5.334  1.00  1.380          H  
ATOM    563 1HH2 ARG A  32      -9.537  12.465   8.036  1.00  1.380          H  
ATOM    564 2HH2 ARG A  32      -9.664  14.115   7.489  1.00  1.380          H  
ATOM    565  N   VAL A  33      -6.324   6.585   4.961  1.00  0.710          N  
ATOM    566  CA  VAL A  33      -4.922   6.179   4.955  1.00  0.830          C  
ATOM    567  C   VAL A  33      -4.802   4.670   5.229  1.00  0.890          C  
ATOM    568  O   VAL A  33      -3.957   3.981   4.661  1.00  0.990          O  
ATOM    569  CB  VAL A  33      -4.071   7.005   5.954  1.00  1.110          C  
ATOM    570  CG1 VAL A  33      -4.105   8.468   5.553  1.00  1.110          C  
ATOM    571  CG2 VAL A  33      -4.570   6.841   7.423  1.00  1.110          C  
ATOM    572  H   VAL A  33      -6.901   6.385   5.776  1.00  0.850          H  
ATOM    573  HA  VAL A  33      -4.518   6.365   3.962  1.00  1.000          H  
ATOM    574  HB  VAL A  33      -3.055   6.678   5.877  1.00  1.340          H  
ATOM    575 1HG1 VAL A  33      -3.491   9.056   6.224  1.00  1.340          H  
ATOM    576 2HG1 VAL A  33      -3.752   8.584   4.560  1.00  1.340          H  
ATOM    577 3HG1 VAL A  33      -5.095   8.805   5.583  1.00  1.340          H  
ATOM    578 1HG2 VAL A  33      -3.956   7.427   8.084  1.00  1.340          H  
ATOM    579 2HG2 VAL A  33      -5.594   7.177   7.499  1.00  1.340          H  
ATOM    580 3HG2 VAL A  33      -4.509   5.810   7.736  1.00  1.340          H  
ATOM    581  N   ILE A  34      -5.679   4.135   6.082  1.00  0.960          N  
ATOM    582  CA  ILE A  34      -5.601   2.736   6.487  1.00  1.240          C  
ATOM    583  C   ILE A  34      -5.751   1.811   5.299  1.00  1.250          C  
ATOM    584  O   ILE A  34      -5.036   0.816   5.189  1.00  1.430          O  
ATOM    585  CB  ILE A  34      -6.658   2.378   7.558  1.00  1.620          C  
ATOM    586  CG1 ILE A  34      -6.307   3.103   8.869  1.00  1.620          C  
ATOM    587  CG2 ILE A  34      -6.718   0.846   7.760  1.00  1.620          C  
ATOM    588  CD1 ILE A  34      -7.406   3.095   9.930  1.00  1.620          C  
ATOM    589  H   ILE A  34      -6.392   4.723   6.505  1.00  1.150          H  
ATOM    590  HA  ILE A  34      -4.618   2.565   6.922  1.00  1.490          H  
ATOM    591  HB  ILE A  34      -7.613   2.729   7.245  1.00  1.950          H  
ATOM    592 1HG1 ILE A  34      -5.416   2.641   9.287  1.00  1.950          H  
ATOM    593 2HG1 ILE A  34      -6.077   4.132   8.637  1.00  1.950          H  
ATOM    594 1HG2 ILE A  34      -7.460   0.598   8.508  1.00  1.950          H  
ATOM    595 2HG2 ILE A  34      -6.990   0.343   6.835  1.00  1.950          H  
ATOM    596 3HG2 ILE A  34      -5.741   0.485   8.088  1.00  1.950          H  
ATOM    597 1HD1 ILE A  34      -7.067   3.646  10.805  1.00  1.950          H  
ATOM    598 2HD1 ILE A  34      -8.301   3.564   9.549  1.00  1.950          H  
ATOM    599 3HD1 ILE A  34      -7.643   2.082  10.224  1.00  1.950          H  
ATOM    600  N   GLN A  35      -6.666   2.118   4.390  1.00  1.130          N  
ATOM    601  CA  GLN A  35      -6.922   1.200   3.299  1.00  1.310          C  
ATOM    602  C   GLN A  35      -5.860   1.244   2.202  1.00  1.180          C  
ATOM    603  O   GLN A  35      -5.952   0.500   1.226  1.00  1.330          O  
ATOM    604  CB  GLN A  35      -8.301   1.483   2.709  1.00  1.760          C  
ATOM    605  CG  GLN A  35      -9.450   1.283   3.700  1.00  1.760          C  
ATOM    606  CD  GLN A  35      -9.513  -0.128   4.225  1.00  1.760          C  
ATOM    607  OE1 GLN A  35      -9.437  -1.083   3.452  1.00  1.760          O  
ATOM    608  NE2 GLN A  35      -9.657  -0.280   5.537  1.00  1.760          N  
ATOM    609  H   GLN A  35      -7.220   2.975   4.468  1.00  1.360          H  
ATOM    610  HA  GLN A  35      -6.924   0.189   3.706  1.00  1.570          H  
ATOM    611 1HB  GLN A  35      -8.337   2.519   2.363  1.00  2.110          H  
ATOM    612 2HB  GLN A  35      -8.472   0.840   1.848  1.00  2.110          H  
ATOM    613 1HG  GLN A  35      -9.304   1.954   4.544  1.00  2.110          H  
ATOM    614 2HG  GLN A  35     -10.392   1.509   3.201  1.00  2.110          H  
ATOM    615 1HE2 GLN A  35      -9.707  -1.201   5.930  1.00  2.110          H  
ATOM    616 2HE2 GLN A  35      -9.730   0.516   6.135  1.00  2.110          H  
ATOM    617  N   GLY A  36      -4.857   2.117   2.341  1.00  0.980          N  
ATOM    618  CA  GLY A  36      -3.770   2.194   1.384  1.00  0.990          C  
ATOM    619  C   GLY A  36      -2.453   1.749   2.036  1.00  0.960          C  
ATOM    620  O   GLY A  36      -1.368   1.944   1.457  1.00  1.040          O  
ATOM    621  H   GLY A  36      -4.805   2.725   3.163  1.00  1.180          H  
ATOM    622 1HA  GLY A  36      -3.992   1.561   0.528  1.00  1.190          H  
ATOM    623 2HA  GLY A  36      -3.687   3.213   1.017  1.00  1.190          H  
ATOM    624  N   LEU A  37      -2.542   1.185   3.253  1.00  0.970          N  
ATOM    625  CA  LEU A  37      -1.369   0.767   4.016  1.00  1.060          C  
ATOM    626  C   LEU A  37      -1.111  -0.732   3.905  1.00  1.570          C  
ATOM    627  O   LEU A  37      -0.397  -1.166   3.001  1.00  2.000          O  
ATOM    628  OXT LEU A  37      -1.512  -1.495   4.783  1.00  1.590          O  
ATOM    629  CB  LEU A  37      -1.547   1.189   5.489  1.00  1.380          C  
ATOM    630  CG  LEU A  37      -0.429   0.797   6.513  1.00  1.380          C  
ATOM    631  CD1 LEU A  37       0.858   1.527   6.173  1.00  1.380          C  
ATOM    632  CD2 LEU A  37      -0.906   1.162   7.918  1.00  1.380          C  
ATOM    633  H   LEU A  37      -3.462   1.048   3.689  1.00  1.160          H  
ATOM    634  HA  LEU A  37      -0.502   1.275   3.608  1.00  1.270          H  
ATOM    635 1HB  LEU A  37      -1.664   2.274   5.518  1.00  1.650          H  
ATOM    636 2HB  LEU A  37      -2.484   0.752   5.846  1.00  1.650          H  
ATOM    637  HG  LEU A  37      -0.235  -0.274   6.464  1.00  1.650          H  
ATOM    638 1HD1 LEU A  37       1.632   1.260   6.876  1.00  1.650          H  
ATOM    639 2HD1 LEU A  37       1.160   1.234   5.188  1.00  1.650          H  
ATOM    640 3HD1 LEU A  37       0.692   2.591   6.203  1.00  1.650          H  
ATOM    641 1HD2 LEU A  37      -0.141   0.894   8.645  1.00  1.650          H  
ATOM    642 2HD2 LEU A  37      -1.102   2.225   7.971  1.00  1.650          H  
ATOM    643 3HD2 LEU A  37      -1.824   0.617   8.141  1.00  1.650          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 -223.069 23.3104 167.913 -15.8129 3.02675 10.1233 91.1313 -92.4671 -0.23779 -1.67165 -88.7193 -5.78767 -34.6013 -5.08728 -3.98008 -3.82741 0 -0.15914 3.10544 20.9946 36.1513 -2.8239 0.62438 -1.53515 10.0337 20.0147 -93.3507
ASP:NtermProteinFull_1 -2.15105 0.05754 3.67747 -0.12487 0.01047 0.40142 2.08361 -1.66877 -0.00787 -0.08594 -2.66404 -1.13185 0 0 0 0 0 0.16204 0.12383 0 2.32357 0 0 -2.3716 0 0.1684 -1.19765
TRP_2 -5.46577 0.60417 2.05347 -1.35959 0.11582 0.61832 1.73566 -1.71096 -0 -0 -1.57572 -0.19405 0 0 0 0 0 -0.03172 0.23597 0 1.70665 -0.20613 0 1.6906 -0.06111 0.45495 -1.38945
PHE_3 -10.6994 1.47708 3.47228 -0.68358 0.04592 0.2816 2.74364 -3.04555 -0 -0 -2.03385 -0.11414 0 0 0 0 0 0.11344 0.47898 0 2.41961 0.03065 0 1.0402 -0.17468 0.8454 -3.8024
LYS_4 -6.57206 0.85394 7.96058 -0.80593 0.13668 0.82185 3.85625 -3.56885 -0.04577 -0.28141 -5.17526 -0.01817 0 0 0 -0.76167 0 -0.02094 0.29013 2.84839 0 0.03586 0 -1.5107 -0.10246 0.94833 -1.11123
ALA_5 -4.00273 0.17612 4.4904 -0.02096 0 0 2.19578 -2.29313 -0 -0 -1.65994 -0.36288 0 0 0 0 0 0.06398 0 0 0 -0.20515 0 1.8394 -0.15163 0.46664 0.53589
PHE_6 -8.88783 0.98412 3.26988 -0.88537 0.05781 0.24995 2.74331 -2.70553 -3e-05 -0.00043 -2.54357 -0.09577 0 0 0 0 0 -0.00347 0.14222 0 1.83097 -0.42903 0 1.0402 -0.12274 0.39231 -4.96298
TYR_7 -13.1009 1.59218 4.31633 -0.56915 0.31291 0.26491 3.70382 -3.69346 -0.01389 -0.11342 -2.62081 -0.33547 0 0 0 0 0 0.03071 0.00896 0 3.05883 0.12347 0.0023 1.2797 -0.09171 0.72279 -5.12189
ASP_8 -5.62019 0.48971 8.47135 -0.10285 0.00744 0.30951 4.29654 -3.70503 -0 -0 -6.64931 -0.30097 0 0 0 -0.76167 0 0.06478 0.01893 0 1.71068 0.24775 0 -2.3716 -0.23591 0.60446 -3.52639
LYS_9 -4.55201 0.22618 5.36678 -0.3034 0.02898 0.13569 2.51388 -2.51895 -0.00165 -0.03123 -2.45839 -0.00398 0 0 0 0 0 0.06868 0.01858 1.75975 0 -0.00635 0 -1.5107 -0.3041 0.28346 -1.28876
VAL_10 -7.04814 0.64208 3.56376 -0.30584 0.18995 0.07052 2.85858 -2.67348 -9e-05 -0.0014 -2.24441 -0.15864 0 0 0 0 0 -0.06425 0.00509 0.07395 0 -0.29301 0 1.9342 -0.2615 0.24315 -3.46948
ALA_11 -6.24866 0.6586 4.68505 -0.02021 0 0 3.04651 -3.20993 -0 -0 -2.79915 -0.34684 0 0 0 0 0 0.06285 0 0 0 -0.21722 0 1.8394 -0.21704 0.45121 -2.31543
GLU_12 -3.26884 0.18957 4.42541 -0.20447 0.02089 0.26671 1.71278 -2.05653 -0.00165 -0.03123 -1.18864 -0.55773 0 0 0 0 0 -0.03302 0.04497 0 3.09777 -0.17804 0 -2.7348 -0.29129 0.46472 -0.32343
LYS_13 -4.10431 0.16695 3.4224 -0.43354 0.06849 0.24796 1.48317 -1.64786 -0 -0 -0.83754 -0.13024 0 0 0 0 0 -0.04119 0.02534 2.01313 0 -0.00903 0 -1.5107 -0.30428 0.29343 -1.29782
PHE_14 -5.28042 0.49621 3.61298 -0.66032 0.0676 0.3803 1.23762 -1.83466 -0 -0 -1.2755 0.06521 0 0 0 0 0 -0.05725 0.00142 0 1.95607 -0.22066 0 1.0402 -0.44044 0.31372 -0.59792
LYS_15 -2.08035 0.13977 2.74593 -0.33388 0.06074 0.21487 1.03909 -1.23214 -0 -0 -1.19748 -0.36791 0 0 0 0 0 -0.10192 0.01487 1.55502 0 -0.15906 0 -1.5107 -0.44003 0.33197 -1.3212
GLU_16 -4.78866 0.42773 4.60383 -0.17618 0.01787 0.23755 1.59258 -2.16321 -0.00036 -0.00237 -1.81374 -0.46198 0 0 0 0 0 0.01331 0.05547 0 3.11104 0.19016 0 -2.7348 -0.10129 0.39306 -1.59998
ALA_17 -3.95309 0.48956 3.58789 -0.02142 0 0 2.29616 -1.91245 -0.00374 -0.0375 -3.12915 -0.20214 0 0 -0.87657 0 0 -0.00753 0 0 0 0.01133 0 1.8394 -0.02617 0.48445 -1.46096
PHE_18 -7.34687 1.25346 3.34255 -1.06512 0.13746 0.45218 2.24957 -2.04075 -0 -0 -1.89375 0.01824 0 0 0 0 0 0.03036 0.39716 0 1.81378 -0.51379 0 1.0402 5.64193 1.52467 5.04129
PRO_19 -5.24638 1.01084 3.49073 -0.08178 7e-05 0.04849 1.41328 -1.679 -0 -0 -1.58496 0.63919 0 0 0 0 0 -0.16145 0.01518 0.47031 0 -0.46307 0 -2.4119 5.50374 1.56915 2.53242
ASP_20 -6.44675 0.50506 8.06397 -0.10345 0.0029 0.30972 4.1175 -3.6839 -0 -0 -5.22053 -0.16136 0 0 -0.87657 -0.49293 0 -0.01753 0.06514 0 2.08244 0.04585 0 -2.3716 -0.11236 0.62442 -3.66998
VAL_21 -8.71675 0.98483 4.10049 -0.31176 0.26622 0.06971 2.95327 -3.1339 -0 -0 -2.06679 -0.04005 0 0 0 0 0 -0.07054 0.00054 0.03424 0 -0.35913 0 1.9342 0.13541 0.5114 -3.7086
CYS_22 -7.5216 0.56777 4.57116 -0.09719 0.0002 0.06069 2.47974 -2.45178 -0.01764 -0.15091 -2.91446 -0.48857 0 0 0 0 0 0.00091 0.03162 0.73278 0 0.25632 0 3.6196 0.37409 0.33094 -0.61633
ARG_23 -6.86873 0.47075 7.98695 -0.61702 0.07178 0.40272 3.46441 -3.58735 -0 -0 -3.94051 0.56893 0 0 0 -0.49293 0 -0.0233 0.07562 2.41255 0 -0.13121 0 -1.2888 0.14264 0.44927 -0.90422
ASN_24 -6.18717 0.34806 7.42336 -0.1577 0.00376 0.22352 3.0394 -3.51511 -0.00028 -0.00097 -3.10798 -0.3587 0 0 -0.55565 -0.65911 0 0.17651 0.00619 0 1.43034 0.36199 0 -0.93687 -0.18993 0.50573 -2.1506
PHE_25 -10.0933 1.10193 4.68458 -0.55312 0.01496 0.21271 3.72343 -3.33595 -0.01079 -0.03652 -4.03725 -0.00484 0 0 0 0 0 -0.0333 0.37349 0 2.63017 -0.11219 0 1.0402 0.09555 0.47967 -3.86057
MET_26 -7.36119 0.62276 5.79255 -0.30656 0.06581 0.02901 2.99912 -2.83615 -0 -0 -2.80056 0.02391 0 0 0 0 0 -0.02684 0.0687 1.09036 0 0.00432 0 0.60916 0.08215 0.47079 -1.47266
ARG_27 -4.52125 0.36364 5.38248 -0.86872 0.11542 0.61274 1.63129 -2.45247 -0 -0 -1.88898 0.31515 0 0 0 -0.65911 0 -0.09095 0.21915 1.89546 0 -0.12581 0 -1.2888 -0.2469 0.54652 -1.06114
ARG_28 -6.12475 0.31356 5.47385 -0.64832 0.09016 0.4477 2.8248 -2.71289 -0.00708 -0.04876 -2.49702 0.27502 0 0 -1.11348 0 0 -0.01947 0.22743 2.05027 0 -0.11173 0 -1.2888 -0.11928 0.60406 -2.3847
TYR_29 -8.65279 1.14312 4.46296 -0.66756 0.05329 0.3746 2.74195 -2.74092 -0.01369 -0.11595 -2.17002 -0.13539 0 0 0 0 0 0.00082 0.01228 0 2.07789 -0.2589 0.00024 1.2797 0.21397 0.76357 -1.63083
GLN_30 -5.65407 0.56437 5.71575 -0.5636 0.10014 0.51579 3.27378 -2.96315 -0.01552 -0.07274 -3.86443 -0.43075 0 0 0 0 0 0.03631 0.08405 0 2.35099 0.24989 0 -0.18838 1.08323 0.79147 1.01313
SER_31 -3.49232 0.38011 3.6594 -0.02823 2e-05 0.0444 1.78647 -1.72859 -0.00662 -0.06719 -0.08597 -0.98828 0 0 0 0 0 -0.11318 0.00346 0.17334 0 -0.16604 0.62185 -0.77834 0.71287 0.50252 0.42969
ARG_32 -4.86495 0.56469 4.23629 -0.57344 0.06734 0.37246 2.25813 -2.11073 -0 -0 -1.8235 0.45039 0 0 -0.55782 0 0 -0.00262 0.02563 1.78998 0 -0.11279 0 -1.2888 -0.54244 0.52122 -1.59097
VAL_33 -8.31569 1.51487 3.09772 -0.24671 0.10119 0.04066 2.57869 -2.69278 -0 -0 -1.22342 -0.04507 0 0 0 0 0 -0.04231 0.00168 0.72121 0 -0.28393 0 1.9342 0.05539 0.6172 -2.18709
ILE_34 -6.52574 0.81207 3.74752 -0.50631 0.41444 0.10422 1.82122 -2.26219 -0.01639 -0.09527 -0.487 -0.01875 0 0 0 0 0 0.11871 0.01101 0.75034 0 -0.28481 0 0.73287 0.2475 0.49723 -0.93933
GLN_35 -2.81205 0.12895 2.53543 -0.6798 0.10577 0.74199 1.14064 -1.26319 -0.00473 -0.03622 -0.39861 -0.45716 0 0 0 0 0 0.03009 0.02109 0 2.55054 -0.12646 0 -0.18838 -0.20394 0.30927 1.39322
GLY_36 -2.81622 0.41191 3.45167 -8e-05 0 0 1.64668 -1.73357 -0.03019 -0.16352 -2.94343 -0.35268 0 0 0 0 0 -0.16986 0 0 0 0.59208 0 0.83697 0.16872 0.18682 -0.91471
LEU:CtermProteinFull_37 -5.67636 0.5762 2.96818 -0.72488 0.27424 0.5588 1.849 -1.90227 -0.03981 -0.29868 -1.90361 0.12066 0 0 0 0 0 0 0.00121 0.62347 0 0 0 0.18072 0.31776 0.34633 -2.72905
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691858 DOMAINID 682972 MODEL 2 pep5_AB
MODEL     2
REMARK    Rerank model03.pdb to model02.pdb score: 25.880
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 19 cluster_threshold: 1.516413
REMARK    SCORE         p_aa_pp:          -3.921
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE             ref:           9.796
REMARK    SCORE        hbond_sc:          -3.724
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE           score:         -89.921
REMARK    SCORE     hbond_bb_sc:          -4.019
REMARK    SCORE    fa_intra_rep:           0.449
REMARK    SCORE     rama_prepro:          -3.781
REMARK    SCORE     lk_ball_wtd:          -5.840
REMARK    SCORE            time:           0.000
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     hbond_sr_bb:         -26.301
REMARK    SCORE         fa_elec:         -69.077
REMARK    SCORE     total_score:         -89.921
REMARK    SCORE          fa_rep:          21.215
REMARK    SCORE     cart_bonded:          15.897
REMARK    SCORE           omega:          -0.701
REMARK    SCORE          fa_sol:         132.881
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE fa_intra_sol_xover4:           9.123
REMARK    SCORE          fa_dun:          56.726
REMARK    SCORE          fa_atr:        -218.644
ATOM      1  N   ASP A   1       1.641   0.004   1.553  1.00 20.000          N  
ATOM      2  CA  ASP A   1       3.052   0.105   1.194  1.00 20.000          C  
ATOM      3  C   ASP A   1       3.410   1.556   0.892  1.00 20.000          C  
ATOM      4  O   ASP A   1       3.286   2.008  -0.258  1.00 20.000          O  
ATOM      5  CB  ASP A   1       3.349  -0.799  -0.016  1.00 20.000          C  
ATOM      6  CG  ASP A   1       4.830  -0.896  -0.388  1.00 20.000          C  
ATOM      7  OD1 ASP A   1       5.613  -0.074   0.059  1.00 20.000          O  
ATOM      8  OD2 ASP A   1       5.169  -1.793  -1.113  1.00 20.000          O  
ATOM      9 1H   ASP A   1       1.527  -0.692   2.276  1.00 20.000          H  
ATOM     10 2H   ASP A   1       1.312   0.897   1.890  1.00 20.000          H  
ATOM     11 3H   ASP A   1       1.106  -0.266   0.740  1.00 20.000          H  
ATOM     12  HA  ASP A   1       3.654  -0.231   2.038  1.00 20.000          H  
ATOM     13 1HB  ASP A   1       2.979  -1.807   0.187  1.00 20.000          H  
ATOM     14 2HB  ASP A   1       2.805  -0.427  -0.885  1.00 20.000          H  
ATOM     15  N   TRP A   2       3.782   2.310   1.943  1.00 20.000          N  
ATOM     16  CA  TRP A   2       4.126   3.709   1.739  1.00 20.000          C  
ATOM     17  C   TRP A   2       5.425   3.833   0.970  1.00 20.000          C  
ATOM     18  O   TRP A   2       5.629   4.792   0.236  1.00 20.000          O  
ATOM     19  CB  TRP A   2       4.279   4.484   3.053  1.00 20.000          C  
ATOM     20  CG  TRP A   2       5.530   4.211   3.848  1.00 20.000          C  
ATOM     21  CD1 TRP A   2       5.716   3.312   4.852  1.00 20.000          C  
ATOM     22  CD2 TRP A   2       6.799   4.915   3.701  1.00 20.000          C  
ATOM     23  NE1 TRP A   2       6.996   3.410   5.333  1.00 20.000          N  
ATOM     24  CE2 TRP A   2       7.664   4.391   4.634  1.00 20.000          C  
ATOM     25  CE3 TRP A   2       7.246   5.941   2.861  1.00 20.000          C  
ATOM     26  CZ2 TRP A   2       8.952   4.855   4.764  1.00 20.000          C  
ATOM     27  CZ3 TRP A   2       8.529   6.398   2.978  1.00 20.000          C  
ATOM     28  CH2 TRP A   2       9.360   5.869   3.909  1.00 20.000          C  
ATOM     29  H   TRP A   2       3.848   1.908   2.869  1.00 20.000          H  
ATOM     30  HA  TRP A   2       3.334   4.178   1.157  1.00 20.000          H  
ATOM     31 1HB  TRP A   2       4.259   5.541   2.849  1.00 20.000          H  
ATOM     32 2HB  TRP A   2       3.428   4.269   3.693  1.00 20.000          H  
ATOM     33  HD1 TRP A   2       4.963   2.626   5.227  1.00 20.000          H  
ATOM     34  HE1 TRP A   2       7.392   2.859   6.081  1.00 20.000          H  
ATOM     35  HE3 TRP A   2       6.591   6.359   2.133  1.00 20.000          H  
ATOM     36  HZ2 TRP A   2       9.638   4.448   5.505  1.00 20.000          H  
ATOM     37  HZ3 TRP A   2       8.856   7.199   2.317  1.00 20.000          H  
ATOM     38  HH2 TRP A   2      10.353   6.249   3.996  1.00 20.000          H  
ATOM     39  N   PHE A   3       6.319   2.852   1.080  1.00 20.000          N  
ATOM     40  CA  PHE A   3       7.578   2.999   0.383  1.00 20.000          C  
ATOM     41  C   PHE A   3       7.296   3.092  -1.100  1.00 20.000          C  
ATOM     42  O   PHE A   3       7.820   3.974  -1.783  1.00 20.000          O  
ATOM     43  CB  PHE A   3       8.482   1.799   0.646  1.00 20.000          C  
ATOM     44  CG  PHE A   3       9.074   1.739   2.022  1.00 20.000          C  
ATOM     45  CD1 PHE A   3       8.455   1.000   3.013  1.00 20.000          C  
ATOM     46  CD2 PHE A   3      10.257   2.385   2.324  1.00 20.000          C  
ATOM     47  CE1 PHE A   3       9.002   0.919   4.272  1.00 20.000          C  
ATOM     48  CE2 PHE A   3      10.809   2.306   3.579  1.00 20.000          C  
ATOM     49  CZ  PHE A   3      10.179   1.571   4.556  1.00 20.000          C  
ATOM     50  H   PHE A   3       6.161   2.052   1.677  1.00 20.000          H  
ATOM     51  HA  PHE A   3       8.069   3.915   0.715  1.00 20.000          H  
ATOM     52 1HB  PHE A   3       7.908   0.880   0.486  1.00 20.000          H  
ATOM     53 2HB  PHE A   3       9.296   1.796  -0.073  1.00 20.000          H  
ATOM     54  HD1 PHE A   3       7.524   0.475   2.788  1.00 20.000          H  
ATOM     55  HD2 PHE A   3      10.752   2.947   1.561  1.00 20.000          H  
ATOM     56  HE1 PHE A   3       8.503   0.335   5.043  1.00 20.000          H  
ATOM     57  HE2 PHE A   3      11.742   2.818   3.806  1.00 20.000          H  
ATOM     58  HZ  PHE A   3      10.609   1.506   5.553  1.00 20.000          H  
ATOM     59  N   LYS A   4       6.409   2.225  -1.596  1.00 20.000          N  
ATOM     60  CA  LYS A   4       6.081   2.260  -3.009  1.00 20.000          C  
ATOM     61  C   LYS A   4       5.318   3.522  -3.381  1.00 20.000          C  
ATOM     62  O   LYS A   4       5.652   4.167  -4.374  1.00 20.000          O  
ATOM     63  CB  LYS A   4       5.246   1.050  -3.421  1.00 20.000          C  
ATOM     64  CG  LYS A   4       4.897   0.967  -4.947  1.00 20.000          C  
ATOM     65  CD  LYS A   4       6.158   0.742  -5.808  1.00 20.000          C  
ATOM     66  CE  LYS A   4       5.825   0.277  -7.250  1.00 20.000          C  
ATOM     67  NZ  LYS A   4       5.319   1.386  -8.144  1.00 20.000          N  
ATOM     68  H   LYS A   4       6.021   1.493  -0.979  1.00 20.000          H  
ATOM     69  HA  LYS A   4       7.013   2.254  -3.571  1.00 20.000          H  
ATOM     70 1HB  LYS A   4       5.772   0.136  -3.140  1.00 20.000          H  
ATOM     71 2HB  LYS A   4       4.308   1.061  -2.862  1.00 20.000          H  
ATOM     72 1HG  LYS A   4       4.206   0.142  -5.107  1.00 20.000          H  
ATOM     73 2HG  LYS A   4       4.410   1.892  -5.270  1.00 20.000          H  
ATOM     74 1HD  LYS A   4       6.705   1.691  -5.889  1.00 20.000          H  
ATOM     75 2HD  LYS A   4       6.803   0.008  -5.333  1.00 20.000          H  
ATOM     76 1HE  LYS A   4       6.720  -0.149  -7.697  1.00 20.000          H  
ATOM     77 2HE  LYS A   4       5.059  -0.494  -7.192  1.00 20.000          H  
ATOM     78 1HZ  LYS A   4       5.122   1.028  -9.054  1.00 20.000          H  
ATOM     79 2HZ  LYS A   4       4.479   1.857  -7.796  1.00 20.000          H  
ATOM     80 3HZ  LYS A   4       6.010   2.137  -8.237  1.00 20.000          H  
ATOM     81  N   ALA A   5       4.286   3.886  -2.602  1.00 20.000          N  
ATOM     82  CA  ALA A   5       3.478   5.049  -2.963  1.00 20.000          C  
ATOM     83  C   ALA A   5       4.308   6.328  -3.031  1.00 20.000          C  
ATOM     84  O   ALA A   5       4.131   7.152  -3.942  1.00 20.000          O  
ATOM     85  CB  ALA A   5       2.357   5.225  -1.957  1.00 20.000          C  
ATOM     86  H   ALA A   5       4.043   3.325  -1.775  1.00 20.000          H  
ATOM     87  HA  ALA A   5       3.053   4.866  -3.951  1.00 20.000          H  
ATOM     88 1HB  ALA A   5       1.738   6.066  -2.246  1.00 20.000          H  
ATOM     89 2HB  ALA A   5       1.753   4.319  -1.930  1.00 20.000          H  
ATOM     90 3HB  ALA A   5       2.779   5.405  -0.975  1.00 20.000          H  
ATOM     91  N   PHE A   6       5.232   6.472  -2.086  1.00 20.000          N  
ATOM     92  CA  PHE A   6       6.083   7.631  -2.019  1.00 20.000          C  
ATOM     93  C   PHE A   6       7.115   7.572  -3.118  1.00 20.000          C  
ATOM     94  O   PHE A   6       7.292   8.554  -3.840  1.00 20.000          O  
ATOM     95  CB  PHE A   6       6.691   7.736  -0.627  1.00 20.000          C  
ATOM     96  CG  PHE A   6       5.731   8.276   0.425  1.00 20.000          C  
ATOM     97  CD1 PHE A   6       4.570   7.601   0.802  1.00 20.000          C  
ATOM     98  CD2 PHE A   6       6.016   9.452   1.066  1.00 20.000          C  
ATOM     99  CE1 PHE A   6       3.745   8.101   1.766  1.00 20.000          C  
ATOM    100  CE2 PHE A   6       5.175   9.943   2.023  1.00 20.000          C  
ATOM    101  CZ  PHE A   6       4.050   9.267   2.371  1.00 20.000          C  
ATOM    102  H   PHE A   6       5.331   5.760  -1.358  1.00 20.000          H  
ATOM    103  HA  PHE A   6       5.483   8.517  -2.187  1.00 20.000          H  
ATOM    104 1HB  PHE A   6       7.057   6.760  -0.308  1.00 20.000          H  
ATOM    105 2HB  PHE A   6       7.514   8.387  -0.655  1.00 20.000          H  
ATOM    106  HD1 PHE A   6       4.305   6.676   0.337  1.00 20.000          H  
ATOM    107  HD2 PHE A   6       6.925   9.993   0.805  1.00 20.000          H  
ATOM    108  HE1 PHE A   6       2.843   7.560   2.044  1.00 20.000          H  
ATOM    109  HE2 PHE A   6       5.400  10.871   2.519  1.00 20.000          H  
ATOM    110  HZ  PHE A   6       3.398   9.659   3.139  1.00 20.000          H  
ATOM    111  N   TYR A   7       7.723   6.403  -3.347  1.00 20.000          N  
ATOM    112  CA  TYR A   7       8.722   6.267  -4.393  1.00 20.000          C  
ATOM    113  C   TYR A   7       8.138   6.719  -5.705  1.00 20.000          C  
ATOM    114  O   TYR A   7       8.765   7.491  -6.420  1.00 20.000          O  
ATOM    115  CB  TYR A   7       9.194   4.817  -4.552  1.00 20.000          C  
ATOM    116  CG  TYR A   7      10.272   4.643  -5.607  1.00 20.000          C  
ATOM    117  CD1 TYR A   7      11.612   4.786  -5.254  1.00 20.000          C  
ATOM    118  CD2 TYR A   7       9.932   4.369  -6.925  1.00 20.000          C  
ATOM    119  CE1 TYR A   7      12.603   4.642  -6.215  1.00 20.000          C  
ATOM    120  CE2 TYR A   7      10.918   4.236  -7.876  1.00 20.000          C  
ATOM    121  CZ  TYR A   7      12.248   4.370  -7.527  1.00 20.000          C  
ATOM    122  OH  TYR A   7      13.224   4.233  -8.488  1.00 20.000          O  
ATOM    123  H   TYR A   7       7.559   5.593  -2.746  1.00 20.000          H  
ATOM    124  HA  TYR A   7       9.573   6.907  -4.164  1.00 20.000          H  
ATOM    125 1HB  TYR A   7       9.579   4.443  -3.611  1.00 20.000          H  
ATOM    126 2HB  TYR A   7       8.346   4.191  -4.825  1.00 20.000          H  
ATOM    127  HD1 TYR A   7      11.879   5.016  -4.224  1.00 20.000          H  
ATOM    128  HD2 TYR A   7       8.881   4.263  -7.212  1.00 20.000          H  
ATOM    129  HE1 TYR A   7      13.653   4.755  -5.947  1.00 20.000          H  
ATOM    130  HE2 TYR A   7      10.645   4.024  -8.909  1.00 20.000          H  
ATOM    131  HH  TYR A   7      12.811   4.090  -9.344  1.00 20.000          H  
ATOM    132  N   ASP A   8       6.942   6.233  -6.052  1.00 20.000          N  
ATOM    133  CA  ASP A   8       6.366   6.612  -7.327  1.00 20.000          C  
ATOM    134  C   ASP A   8       6.175   8.123  -7.460  1.00 20.000          C  
ATOM    135  O   ASP A   8       6.552   8.689  -8.488  1.00 20.000          O  
ATOM    136  CB  ASP A   8       5.022   5.911  -7.534  1.00 20.000          C  
ATOM    137  CG  ASP A   8       5.135   4.411  -7.844  1.00 20.000          C  
ATOM    138  OD1 ASP A   8       6.198   3.934  -8.192  1.00 20.000          O  
ATOM    139  OD2 ASP A   8       4.147   3.707  -7.729  1.00 20.000          O  
ATOM    140  H   ASP A   8       6.455   5.571  -5.434  1.00 20.000          H  
ATOM    141  HA  ASP A   8       7.047   6.287  -8.112  1.00 20.000          H  
ATOM    142 1HB  ASP A   8       4.428   6.020  -6.617  1.00 20.000          H  
ATOM    143 2HB  ASP A   8       4.474   6.402  -8.337  1.00 20.000          H  
ATOM    144  N   LYS A   9       5.681   8.805  -6.417  1.00 20.000          N  
ATOM    145  CA  LYS A   9       5.486  10.249  -6.556  1.00 20.000          C  
ATOM    146  C   LYS A   9       6.814  10.996  -6.623  1.00 20.000          C  
ATOM    147  O   LYS A   9       6.975  11.963  -7.387  1.00 20.000          O  
ATOM    148  CB  LYS A   9       4.605  10.779  -5.422  1.00 20.000          C  
ATOM    149  CG  LYS A   9       4.267  12.297  -5.463  1.00 20.000          C  
ATOM    150  CD  LYS A   9       3.568  12.728  -6.792  1.00 20.000          C  
ATOM    151  CE  LYS A   9       2.198  12.060  -7.021  1.00 20.000          C  
ATOM    152  NZ  LYS A   9       1.557  12.550  -8.284  1.00 20.000          N  
ATOM    153  H   LYS A   9       5.363   8.305  -5.575  1.00 20.000          H  
ATOM    154  HA  LYS A   9       4.969  10.417  -7.499  1.00 20.000          H  
ATOM    155 1HB  LYS A   9       3.682  10.237  -5.428  1.00 20.000          H  
ATOM    156 2HB  LYS A   9       5.090  10.564  -4.467  1.00 20.000          H  
ATOM    157 1HG  LYS A   9       3.610  12.536  -4.621  1.00 20.000          H  
ATOM    158 2HG  LYS A   9       5.187  12.873  -5.352  1.00 20.000          H  
ATOM    159 1HD  LYS A   9       3.403  13.804  -6.750  1.00 20.000          H  
ATOM    160 2HD  LYS A   9       4.212  12.534  -7.654  1.00 20.000          H  
ATOM    161 1HE  LYS A   9       2.325  10.986  -7.107  1.00 20.000          H  
ATOM    162 2HE  LYS A   9       1.546  12.277  -6.181  1.00 20.000          H  
ATOM    163 1HZ  LYS A   9       0.670  12.091  -8.419  1.00 20.000          H  
ATOM    164 2HZ  LYS A   9       1.418  13.544  -8.245  1.00 20.000          H  
ATOM    165 3HZ  LYS A   9       2.195  12.317  -9.076  1.00 20.000          H  
ATOM    166  N   VAL A  10       7.775  10.568  -5.823  1.00 20.000          N  
ATOM    167  CA  VAL A  10       9.060  11.214  -5.835  1.00 20.000          C  
ATOM    168  C   VAL A  10       9.707  10.999  -7.183  1.00 20.000          C  
ATOM    169  O   VAL A  10      10.280  11.929  -7.726  1.00 20.000          O  
ATOM    170  CB  VAL A  10       9.951  10.730  -4.697  1.00 20.000          C  
ATOM    171  CG1 VAL A  10      11.360  11.278  -4.815  1.00 20.000          C  
ATOM    172  CG2 VAL A  10       9.375  11.205  -3.455  1.00 20.000          C  
ATOM    173  H   VAL A  10       7.597   9.776  -5.196  1.00 20.000          H  
ATOM    174  HA  VAL A  10       8.903  12.285  -5.700  1.00 20.000          H  
ATOM    175  HB  VAL A  10       9.992   9.640  -4.706  1.00 20.000          H  
ATOM    176 1HG1 VAL A  10      11.943  10.911  -3.980  1.00 20.000          H  
ATOM    177 2HG1 VAL A  10      11.832  10.971  -5.736  1.00 20.000          H  
ATOM    178 3HG1 VAL A  10      11.315  12.355  -4.784  1.00 20.000          H  
ATOM    179 1HG2 VAL A  10       9.968  10.890  -2.651  1.00 20.000          H  
ATOM    180 2HG2 VAL A  10       9.344  12.286  -3.486  1.00 20.000          H  
ATOM    181 3HG2 VAL A  10       8.377  10.815  -3.349  1.00 20.000          H  
ATOM    182  N   ALA A  11       9.640   9.777  -7.713  1.00 20.000          N  
ATOM    183  CA  ALA A  11      10.212   9.441  -9.005  1.00 20.000          C  
ATOM    184  C   ALA A  11       9.613  10.301 -10.110  1.00 20.000          C  
ATOM    185  O   ALA A  11      10.324  10.689 -11.024  1.00 20.000          O  
ATOM    186  CB  ALA A  11       9.987   7.972  -9.310  1.00 20.000          C  
ATOM    187  H   ALA A  11       9.182   9.037  -7.189  1.00 20.000          H  
ATOM    188  HA  ALA A  11      11.284   9.634  -8.965  1.00 20.000          H  
ATOM    189 1HB  ALA A  11      10.442   7.729 -10.269  1.00 20.000          H  
ATOM    190 2HB  ALA A  11      10.433   7.359  -8.529  1.00 20.000          H  
ATOM    191 3HB  ALA A  11       8.916   7.774  -9.351  1.00 20.000          H  
ATOM    192  N   GLU A  12       8.317  10.633 -10.043  1.00 20.000          N  
ATOM    193  CA  GLU A  12       7.754  11.504 -11.076  1.00 20.000          C  
ATOM    194  C   GLU A  12       8.461  12.864 -11.070  1.00 20.000          C  
ATOM    195  O   GLU A  12       8.745  13.424 -12.134  1.00 20.000          O  
ATOM    196  CB  GLU A  12       6.247  11.731 -10.864  1.00 20.000          C  
ATOM    197  CG  GLU A  12       5.332  10.532 -11.143  1.00 20.000          C  
ATOM    198  CD  GLU A  12       3.867  10.814 -10.771  1.00 20.000          C  
ATOM    199  OE1 GLU A  12       3.596  11.890 -10.262  1.00 20.000          O  
ATOM    200  OE2 GLU A  12       3.039   9.964 -10.979  1.00 20.000          O  
ATOM    201  H   GLU A  12       7.720  10.223  -9.315  1.00 20.000          H  
ATOM    202  HA  GLU A  12       7.909  11.037 -12.046  1.00 20.000          H  
ATOM    203 1HB  GLU A  12       6.078  12.030  -9.830  1.00 20.000          H  
ATOM    204 2HB  GLU A  12       5.918  12.556 -11.495  1.00 20.000          H  
ATOM    205 1HG  GLU A  12       5.387  10.287 -12.202  1.00 20.000          H  
ATOM    206 2HG  GLU A  12       5.688   9.677 -10.585  1.00 20.000          H  
ATOM    207  N   LYS A  13       8.756  13.381  -9.867  1.00 20.000          N  
ATOM    208  CA  LYS A  13       9.459  14.660  -9.693  1.00 20.000          C  
ATOM    209  C   LYS A  13      10.968  14.548 -10.001  1.00 20.000          C  
ATOM    210  O   LYS A  13      11.583  15.466 -10.553  1.00 20.000          O  
ATOM    211  CB  LYS A  13       9.247  15.183  -8.268  1.00 20.000          C  
ATOM    212  CG  LYS A  13       7.814  15.645  -7.973  1.00 20.000          C  
ATOM    213  CD  LYS A  13       7.661  16.159  -6.535  1.00 20.000          C  
ATOM    214  CE  LYS A  13       6.225  16.623  -6.261  1.00 20.000          C  
ATOM    215  NZ  LYS A  13       6.042  17.125  -4.857  1.00 20.000          N  
ATOM    216  H   LYS A  13       8.418  12.865  -9.042  1.00 20.000          H  
ATOM    217  HA  LYS A  13       9.032  15.377 -10.391  1.00 20.000          H  
ATOM    218 1HB  LYS A  13       9.480  14.391  -7.559  1.00 20.000          H  
ATOM    219 2HB  LYS A  13       9.929  16.010  -8.075  1.00 20.000          H  
ATOM    220 1HG  LYS A  13       7.539  16.433  -8.674  1.00 20.000          H  
ATOM    221 2HG  LYS A  13       7.135  14.799  -8.121  1.00 20.000          H  
ATOM    222 1HD  LYS A  13       7.914  15.355  -5.838  1.00 20.000          H  
ATOM    223 2HD  LYS A  13       8.345  16.992  -6.368  1.00 20.000          H  
ATOM    224 1HE  LYS A  13       5.975  17.423  -6.957  1.00 20.000          H  
ATOM    225 2HE  LYS A  13       5.546  15.785  -6.428  1.00 20.000          H  
ATOM    226 1HZ  LYS A  13       5.082  17.419  -4.727  1.00 20.000          H  
ATOM    227 2HZ  LYS A  13       6.254  16.390  -4.196  1.00 20.000          H  
ATOM    228 3HZ  LYS A  13       6.654  17.910  -4.692  1.00 20.000          H  
ATOM    229  N   PHE A  14      11.541  13.405  -9.641  1.00 20.000          N  
ATOM    230  CA  PHE A  14      12.951  13.043  -9.762  1.00 20.000          C  
ATOM    231  C   PHE A  14      13.201  11.985 -10.834  1.00 20.000          C  
ATOM    232  O   PHE A  14      14.084  11.143 -10.688  1.00 20.000          O  
ATOM    233  CB  PHE A  14      13.467  12.527  -8.410  1.00 20.000          C  
ATOM    234  CG  PHE A  14      13.633  13.569  -7.348  1.00 20.000          C  
ATOM    235  CD1 PHE A  14      12.575  14.003  -6.575  1.00 20.000          C  
ATOM    236  CD2 PHE A  14      14.889  14.087  -7.091  1.00 20.000          C  
ATOM    237  CE1 PHE A  14      12.754  14.936  -5.594  1.00 20.000          C  
ATOM    238  CE2 PHE A  14      15.075  15.019  -6.101  1.00 20.000          C  
ATOM    239  CZ  PHE A  14      14.004  15.445  -5.356  1.00 20.000          C  
ATOM    240  H   PHE A  14      10.938  12.728  -9.180  1.00 20.000          H  
ATOM    241  HA  PHE A  14      13.508  13.941 -10.029  1.00 20.000          H  
ATOM    242 1HB  PHE A  14      12.775  11.778  -8.036  1.00 20.000          H  
ATOM    243 2HB  PHE A  14      14.408  12.042  -8.541  1.00 20.000          H  
ATOM    244  HD1 PHE A  14      11.588  13.607  -6.752  1.00 20.000          H  
ATOM    245  HD2 PHE A  14      15.739  13.745  -7.684  1.00 20.000          H  
ATOM    246  HE1 PHE A  14      11.905  15.269  -4.997  1.00 20.000          H  
ATOM    247  HE2 PHE A  14      16.070  15.421  -5.908  1.00 20.000          H  
ATOM    248  HZ  PHE A  14      14.149  16.187  -4.574  1.00 20.000          H  
ATOM    249  N   LYS A  15      12.464  12.042 -11.936  1.00 20.000          N  
ATOM    250  CA  LYS A  15      12.579  11.070 -13.029  1.00 20.000          C  
ATOM    251  C   LYS A  15      13.964  11.017 -13.684  1.00 20.000          C  
ATOM    252  O   LYS A  15      14.318  10.032 -14.332  1.00 20.000          O  
ATOM    253  CB  LYS A  15      11.511  11.363 -14.088  1.00 20.000          C  
ATOM    254  CG  LYS A  15      11.707  12.661 -14.869  1.00 20.000          C  
ATOM    255  CD  LYS A  15      10.545  12.915 -15.820  1.00 20.000          C  
ATOM    256  CE  LYS A  15      10.750  14.195 -16.625  1.00 20.000          C  
ATOM    257  NZ  LYS A  15       9.590  14.478 -17.517  1.00 20.000          N  
ATOM    258  H   LYS A  15      11.746  12.755 -11.989  1.00 20.000          H  
ATOM    259  HA  LYS A  15      12.375  10.083 -12.612  1.00 20.000          H  
ATOM    260 1HB  LYS A  15      11.473  10.541 -14.801  1.00 20.000          H  
ATOM    261 2HB  LYS A  15      10.533  11.417 -13.598  1.00 20.000          H  
ATOM    262 1HG  LYS A  15      11.801  13.499 -14.177  1.00 20.000          H  
ATOM    263 2HG  LYS A  15      12.616  12.590 -15.460  1.00 20.000          H  
ATOM    264 1HD  LYS A  15      10.445  12.072 -16.503  1.00 20.000          H  
ATOM    265 2HD  LYS A  15       9.621  13.004 -15.239  1.00 20.000          H  
ATOM    266 1HE  LYS A  15      10.881  15.029 -15.939  1.00 20.000          H  
ATOM    267 2HE  LYS A  15      11.650  14.094 -17.235  1.00 20.000          H  
ATOM    268 1HZ  LYS A  15       9.759  15.332 -18.032  1.00 20.000          H  
ATOM    269 2HZ  LYS A  15       9.465  13.713 -18.167  1.00 20.000          H  
ATOM    270 3HZ  LYS A  15       8.756  14.583 -16.955  1.00 20.000          H  
ATOM    271  N   GLU A  16      14.734  12.095 -13.548  1.00 20.000          N  
ATOM    272  CA  GLU A  16      16.073  12.188 -14.119  1.00 20.000          C  
ATOM    273  C   GLU A  16      17.161  11.735 -13.137  1.00 20.000          C  
ATOM    274  O   GLU A  16      18.349  11.763 -13.462  1.00 20.000          O  
ATOM    275  CB  GLU A  16      16.359  13.626 -14.568  1.00 20.000          C  
ATOM    276  CG  GLU A  16      15.467  14.129 -15.705  1.00 20.000          C  
ATOM    277  CD  GLU A  16      15.762  15.551 -16.117  1.00 20.000          C  
ATOM    278  OE1 GLU A  16      16.589  16.173 -15.493  1.00 20.000          O  
ATOM    279  OE2 GLU A  16      15.159  16.011 -17.058  1.00 20.000          O  
ATOM    280  H   GLU A  16      14.369  12.867 -13.012  1.00 20.000          H  
ATOM    281  HA  GLU A  16      16.116  11.537 -14.993  1.00 20.000          H  
ATOM    282 1HB  GLU A  16      16.234  14.299 -13.720  1.00 20.000          H  
ATOM    283 2HB  GLU A  16      17.395  13.705 -14.897  1.00 20.000          H  
ATOM    284 1HG  GLU A  16      15.590  13.474 -16.567  1.00 20.000          H  
ATOM    285 2HG  GLU A  16      14.435  14.070 -15.385  1.00 20.000          H  
ATOM    286  N   ALA A  17      16.763  11.382 -11.918  1.00 20.000          N  
ATOM    287  CA  ALA A  17      17.698  11.000 -10.873  1.00 20.000          C  
ATOM    288  C   ALA A  17      17.789   9.492 -10.710  1.00 20.000          C  
ATOM    289  O   ALA A  17      16.894   8.739 -11.095  1.00 20.000          O  
ATOM    290  CB  ALA A  17      17.300  11.627  -9.555  1.00 20.000          C  
ATOM    291  H   ALA A  17      15.765  11.339 -11.702  1.00 20.000          H  
ATOM    292  HA  ALA A  17      18.682  11.369 -11.156  1.00 20.000          H  
ATOM    293 1HB  ALA A  17      18.029  11.362  -8.815  1.00 20.000          H  
ATOM    294 2HB  ALA A  17      17.261  12.707  -9.660  1.00 20.000          H  
ATOM    295 3HB  ALA A  17      16.332  11.246  -9.271  1.00 20.000          H  
ATOM    296  N   PHE A  18      18.864   9.054 -10.083  1.00 20.000          N  
ATOM    297  CA  PHE A  18      19.050   7.648  -9.783  1.00 20.000          C  
ATOM    298  C   PHE A  18      18.034   7.191  -8.711  1.00 20.000          C  
ATOM    299  O   PHE A  18      17.675   7.992  -7.843  1.00 20.000          O  
ATOM    300  CB  PHE A  18      20.475   7.423  -9.284  1.00 20.000          C  
ATOM    301  CG  PHE A  18      21.493   7.589 -10.350  1.00 20.000          C  
ATOM    302  CD1 PHE A  18      22.237   8.758 -10.427  1.00 20.000          C  
ATOM    303  CD2 PHE A  18      21.716   6.592 -11.291  1.00 20.000          C  
ATOM    304  CE1 PHE A  18      23.180   8.925 -11.416  1.00 20.000          C  
ATOM    305  CE2 PHE A  18      22.660   6.760 -12.281  1.00 20.000          C  
ATOM    306  CZ  PHE A  18      23.391   7.929 -12.343  1.00 20.000          C  
ATOM    307  H   PHE A  18      19.590   9.717  -9.851  1.00 20.000          H  
ATOM    308  HA  PHE A  18      18.916   7.111 -10.713  1.00 20.000          H  
ATOM    309 1HB  PHE A  18      20.700   8.131  -8.494  1.00 20.000          H  
ATOM    310 2HB  PHE A  18      20.581   6.427  -8.865  1.00 20.000          H  
ATOM    311  HD1 PHE A  18      22.077   9.550  -9.696  1.00 20.000          H  
ATOM    312  HD2 PHE A  18      21.140   5.669 -11.246  1.00 20.000          H  
ATOM    313  HE1 PHE A  18      23.761   9.846 -11.467  1.00 20.000          H  
ATOM    314  HE2 PHE A  18      22.830   5.972 -13.015  1.00 20.000          H  
ATOM    315  HZ  PHE A  18      24.138   8.061 -13.126  1.00 20.000          H  
ATOM    316  N   PRO A  19      17.611   5.901  -8.704  1.00 20.000          N  
ATOM    317  CA  PRO A  19      16.707   5.262  -7.738  1.00 20.000          C  
ATOM    318  C   PRO A  19      17.057   5.506  -6.267  1.00 20.000          C  
ATOM    319  O   PRO A  19      16.161   5.547  -5.425  1.00 20.000          O  
ATOM    320  CB  PRO A  19      16.853   3.781  -8.087  1.00 20.000          C  
ATOM    321  CG  PRO A  19      17.162   3.768  -9.562  1.00 20.000          C  
ATOM    322  CD  PRO A  19      18.038   4.978  -9.797  1.00 20.000          C  
ATOM    323  HA  PRO A  19      15.678   5.598  -7.941  1.00 20.000          H  
ATOM    324 1HB  PRO A  19      17.648   3.328  -7.473  1.00 20.000          H  
ATOM    325 2HB  PRO A  19      15.917   3.252  -7.845  1.00 20.000          H  
ATOM    326 1HG  PRO A  19      17.657   2.822  -9.837  1.00 20.000          H  
ATOM    327 2HG  PRO A  19      16.224   3.813 -10.140  1.00 20.000          H  
ATOM    328 1HD  PRO A  19      19.103   4.716  -9.723  1.00 20.000          H  
ATOM    329 2HD  PRO A  19      17.758   5.367 -10.785  1.00 20.000          H  
ATOM    330  N   ASP A  20      18.341   5.700  -5.950  1.00 20.000          N  
ATOM    331  CA  ASP A  20      18.729   5.922  -4.568  1.00 20.000          C  
ATOM    332  C   ASP A  20      18.460   7.362  -4.171  1.00 20.000          C  
ATOM    333  O   ASP A  20      18.226   7.644  -2.996  1.00 20.000          O  
ATOM    334  CB  ASP A  20      20.201   5.590  -4.374  1.00 20.000          C  
ATOM    335  CG  ASP A  20      20.484   4.100  -4.528  1.00 20.000          C  
ATOM    336  OD1 ASP A  20      20.072   3.321  -3.680  1.00 20.000          O  
ATOM    337  OD2 ASP A  20      21.074   3.744  -5.514  1.00 20.000          O  
ATOM    338  H   ASP A  20      19.084   5.623  -6.634  1.00 20.000          H  
ATOM    339  HA  ASP A  20      18.140   5.268  -3.930  1.00 20.000          H  
ATOM    340 1HB  ASP A  20      20.800   6.143  -5.097  1.00 20.000          H  
ATOM    341 2HB  ASP A  20      20.516   5.905  -3.377  1.00 20.000          H  
ATOM    342  N   VAL A  21      18.500   8.287  -5.134  1.00 20.000          N  
ATOM    343  CA  VAL A  21      18.219   9.676  -4.830  1.00 20.000          C  
ATOM    344  C   VAL A  21      16.757   9.727  -4.486  1.00 20.000          C  
ATOM    345  O   VAL A  21      16.359  10.354  -3.499  1.00 20.000          O  
ATOM    346  CB  VAL A  21      18.484  10.595  -6.033  1.00 20.000          C  
ATOM    347  CG1 VAL A  21      18.006  12.037  -5.729  1.00 20.000          C  
ATOM    348  CG2 VAL A  21      19.957  10.563  -6.368  1.00 20.000          C  
ATOM    349  H   VAL A  21      18.656   8.027  -6.104  1.00 20.000          H  
ATOM    350  HA  VAL A  21      18.813   9.994  -3.975  1.00 20.000          H  
ATOM    351  HB  VAL A  21      17.913  10.238  -6.876  1.00 20.000          H  
ATOM    352 1HG1 VAL A  21      18.189  12.670  -6.595  1.00 20.000          H  
ATOM    353 2HG1 VAL A  21      16.937  12.047  -5.506  1.00 20.000          H  
ATOM    354 3HG1 VAL A  21      18.555  12.428  -4.874  1.00 20.000          H  
ATOM    355 1HG2 VAL A  21      20.153  11.197  -7.231  1.00 20.000          H  
ATOM    356 2HG2 VAL A  21      20.526  10.924  -5.515  1.00 20.000          H  
ATOM    357 3HG2 VAL A  21      20.254   9.544  -6.593  1.00 20.000          H  
ATOM    358  N   CYS A  22      15.957   9.063  -5.324  1.00 20.000          N  
ATOM    359  CA  CYS A  22      14.524   9.013  -5.128  1.00 20.000          C  
ATOM    360  C   CYS A  22      14.189   8.413  -3.762  1.00 20.000          C  
ATOM    361  O   CYS A  22      13.415   9.005  -3.004  1.00 20.000          O  
ATOM    362  CB  CYS A  22      13.874   8.196  -6.235  1.00 20.000          C  
ATOM    363  SG  CYS A  22      12.107   8.089  -6.115  1.00 20.000          S  
ATOM    364  H   CYS A  22      16.392   8.594  -6.128  1.00 20.000          H  
ATOM    365  HA  CYS A  22      14.137  10.029  -5.173  1.00 20.000          H  
ATOM    366 1HB  CYS A  22      14.127   8.626  -7.206  1.00 20.000          H  
ATOM    367 2HB  CYS A  22      14.271   7.186  -6.213  1.00 20.000          H  
ATOM    368  HG  CYS A  22      11.854   9.351  -6.470  1.00 20.000          H  
ATOM    369  N   ARG A  23      14.785   7.262  -3.422  1.00 20.000          N  
ATOM    370  CA  ARG A  23      14.540   6.660  -2.119  1.00 20.000          C  
ATOM    371  C   ARG A  23      15.002   7.528  -0.942  1.00 20.000          C  
ATOM    372  O   ARG A  23      14.287   7.650   0.053  1.00 20.000          O  
ATOM    373  CB  ARG A  23      15.183   5.288  -2.034  1.00 20.000          C  
ATOM    374  CG  ARG A  23      14.452   4.188  -2.808  1.00 20.000          C  
ATOM    375  CD  ARG A  23      14.980   2.838  -2.485  1.00 20.000          C  
ATOM    376  NE  ARG A  23      16.321   2.624  -3.061  1.00 20.000          N  
ATOM    377  CZ  ARG A  23      16.568   2.099  -4.290  1.00 20.000          C  
ATOM    378  NH1 ARG A  23      15.571   1.696  -5.065  1.00 20.000          N  
ATOM    379  NH2 ARG A  23      17.815   1.976  -4.716  1.00 20.000          N  
ATOM    380  H   ARG A  23      15.399   6.783  -4.089  1.00 20.000          H  
ATOM    381  HA  ARG A  23      13.466   6.513  -2.031  1.00 20.000          H  
ATOM    382 1HB  ARG A  23      16.198   5.347  -2.422  1.00 20.000          H  
ATOM    383 2HB  ARG A  23      15.248   4.983  -0.990  1.00 20.000          H  
ATOM    384 1HG  ARG A  23      13.393   4.210  -2.553  1.00 20.000          H  
ATOM    385 2HG  ARG A  23      14.574   4.355  -3.867  1.00 20.000          H  
ATOM    386 1HD  ARG A  23      15.062   2.742  -1.406  1.00 20.000          H  
ATOM    387 2HD  ARG A  23      14.305   2.072  -2.856  1.00 20.000          H  
ATOM    388  HE  ARG A  23      17.124   2.909  -2.509  1.00 20.000          H  
ATOM    389 1HH1 ARG A  23      14.616   1.774  -4.753  1.00 20.000          H  
ATOM    390 2HH1 ARG A  23      15.764   1.291  -5.970  1.00 20.000          H  
ATOM    391 1HH2 ARG A  23      18.611   2.293  -4.130  1.00 20.000          H  
ATOM    392 2HH2 ARG A  23      18.014   1.583  -5.619  1.00 20.000          H  
ATOM    393  N   ASN A  24      16.173   8.160  -1.028  1.00 20.000          N  
ATOM    394  CA  ASN A  24      16.598   8.968   0.101  1.00 20.000          C  
ATOM    395  C   ASN A  24      15.670  10.160   0.286  1.00 20.000          C  
ATOM    396  O   ASN A  24      15.341  10.535   1.421  1.00 20.000          O  
ATOM    397  CB  ASN A  24      18.028   9.426  -0.088  1.00 20.000          C  
ATOM    398  CG  ASN A  24      19.025   8.318   0.109  1.00 20.000          C  
ATOM    399  OD1 ASN A  24      18.750   7.300   0.760  1.00 20.000          O  
ATOM    400  ND2 ASN A  24      20.198   8.496  -0.440  1.00 20.000          N  
ATOM    401  H   ASN A  24      16.787   8.043  -1.840  1.00 20.000          H  
ATOM    402  HA  ASN A  24      16.537   8.361   1.004  1.00 20.000          H  
ATOM    403 1HB  ASN A  24      18.142   9.819  -1.102  1.00 20.000          H  
ATOM    404 2HB  ASN A  24      18.251  10.232   0.606  1.00 20.000          H  
ATOM    405 1HD2 ASN A  24      20.903   7.796  -0.346  1.00 20.000          H  
ATOM    406 2HD2 ASN A  24      20.386   9.326  -0.963  1.00 20.000          H  
ATOM    407  N   PHE A  25      15.242  10.766  -0.824  1.00 20.000          N  
ATOM    408  CA  PHE A  25      14.344  11.900  -0.768  1.00 20.000          C  
ATOM    409  C   PHE A  25      12.999  11.488  -0.183  1.00 20.000          C  
ATOM    410  O   PHE A  25      12.471  12.147   0.710  1.00 20.000          O  
ATOM    411  CB  PHE A  25      14.126  12.518  -2.142  1.00 20.000          C  
ATOM    412  CG  PHE A  25      13.271  13.758  -2.097  1.00 20.000          C  
ATOM    413  CD1 PHE A  25      13.851  14.994  -1.878  1.00 20.000          C  
ATOM    414  CD2 PHE A  25      11.904  13.691  -2.224  1.00 20.000          C  
ATOM    415  CE1 PHE A  25      13.076  16.129  -1.807  1.00 20.000          C  
ATOM    416  CE2 PHE A  25      11.130  14.815  -2.152  1.00 20.000          C  
ATOM    417  CZ  PHE A  25      11.714  16.036  -1.944  1.00 20.000          C  
ATOM    418  H   PHE A  25      15.571  10.445  -1.743  1.00 20.000          H  
ATOM    419  HA  PHE A  25      14.784  12.652  -0.120  1.00 20.000          H  
ATOM    420 1HB  PHE A  25      15.086  12.775  -2.587  1.00 20.000          H  
ATOM    421 2HB  PHE A  25      13.664  11.794  -2.798  1.00 20.000          H  
ATOM    422  HD1 PHE A  25      14.931  15.068  -1.760  1.00 20.000          H  
ATOM    423  HD2 PHE A  25      11.441  12.736  -2.372  1.00 20.000          H  
ATOM    424  HE1 PHE A  25      13.543  17.098  -1.632  1.00 20.000          H  
ATOM    425  HE2 PHE A  25      10.053  14.739  -2.252  1.00 20.000          H  
ATOM    426  HZ  PHE A  25      11.100  16.932  -1.881  1.00 20.000          H  
ATOM    427  N   MET A  26      12.413  10.390  -0.675  1.00 20.000          N  
ATOM    428  CA  MET A  26      11.076  10.046  -0.214  1.00 20.000          C  
ATOM    429  C   MET A  26      11.064   9.694   1.264  1.00 20.000          C  
ATOM    430  O   MET A  26      10.064   9.914   1.944  1.00 20.000          O  
ATOM    431  CB  MET A  26      10.531   8.851  -0.995  1.00 20.000          C  
ATOM    432  CG  MET A  26      10.948   7.513  -0.448  1.00 20.000          C  
ATOM    433  SD  MET A  26      10.425   6.168  -1.369  1.00 20.000          S  
ATOM    434  CE  MET A  26      11.026   4.885  -0.337  1.00 20.000          C  
ATOM    435  H   MET A  26      12.865   9.836  -1.410  1.00 20.000          H  
ATOM    436  HA  MET A  26      10.432  10.908  -0.351  1.00 20.000          H  
ATOM    437 1HB  MET A  26       9.486   8.916  -1.074  1.00 20.000          H  
ATOM    438 2HB  MET A  26      10.932   8.884  -2.011  1.00 20.000          H  
ATOM    439 1HG  MET A  26      11.999   7.474  -0.402  1.00 20.000          H  
ATOM    440 2HG  MET A  26      10.547   7.374   0.552  1.00 20.000          H  
ATOM    441 1HE  MET A  26      10.763   3.921  -0.775  1.00 20.000          H  
ATOM    442 2HE  MET A  26      12.109   4.968  -0.243  1.00 20.000          H  
ATOM    443 3HE  MET A  26      10.562   4.984   0.644  1.00 20.000          H  
ATOM    444  N   ARG A  27      12.176   9.150   1.771  1.00 20.000          N  
ATOM    445  CA  ARG A  27      12.270   8.780   3.170  1.00 20.000          C  
ATOM    446  C   ARG A  27      12.445   9.998   4.083  1.00 20.000          C  
ATOM    447  O   ARG A  27      11.854  10.052   5.171  1.00 20.000          O  
ATOM    448  CB  ARG A  27      13.413   7.790   3.339  1.00 20.000          C  
ATOM    449  CG  ARG A  27      13.119   6.410   2.742  1.00 20.000          C  
ATOM    450  CD  ARG A  27      14.280   5.522   2.715  1.00 20.000          C  
ATOM    451  NE  ARG A  27      13.908   4.217   2.179  1.00 20.000          N  
ATOM    452  CZ  ARG A  27      14.765   3.255   1.794  1.00 20.000          C  
ATOM    453  NH1 ARG A  27      16.065   3.457   1.860  1.00 20.000          N  
ATOM    454  NH2 ARG A  27      14.292   2.099   1.350  1.00 20.000          N  
ATOM    455  H   ARG A  27      12.954   8.922   1.143  1.00 20.000          H  
ATOM    456  HA  ARG A  27      11.346   8.283   3.444  1.00 20.000          H  
ATOM    457 1HB  ARG A  27      14.306   8.182   2.844  1.00 20.000          H  
ATOM    458 2HB  ARG A  27      13.643   7.668   4.395  1.00 20.000          H  
ATOM    459 1HG  ARG A  27      12.376   5.913   3.338  1.00 20.000          H  
ATOM    460 2HG  ARG A  27      12.752   6.515   1.732  1.00 20.000          H  
ATOM    461 1HD  ARG A  27      15.045   5.960   2.070  1.00 20.000          H  
ATOM    462 2HD  ARG A  27      14.671   5.388   3.723  1.00 20.000          H  
ATOM    463  HE  ARG A  27      12.921   4.016   2.111  1.00 20.000          H  
ATOM    464 1HH1 ARG A  27      16.423   4.342   2.192  1.00 20.000          H  
ATOM    465 2HH1 ARG A  27      16.708   2.733   1.573  1.00 20.000          H  
ATOM    466 1HH2 ARG A  27      13.293   1.942   1.305  1.00 20.000          H  
ATOM    467 2HH2 ARG A  27      14.927   1.367   1.064  1.00 20.000          H  
ATOM    468  N   ARG A  28      13.238  10.988   3.644  1.00 20.000          N  
ATOM    469  CA  ARG A  28      13.493  12.185   4.448  1.00 20.000          C  
ATOM    470  C   ARG A  28      12.423  13.279   4.331  1.00 20.000          C  
ATOM    471  O   ARG A  28      12.219  14.057   5.266  1.00 20.000          O  
ATOM    472  CB  ARG A  28      14.802  12.811   4.019  1.00 20.000          C  
ATOM    473  CG  ARG A  28      16.047  12.010   4.297  1.00 20.000          C  
ATOM    474  CD  ARG A  28      17.222  12.675   3.697  1.00 20.000          C  
ATOM    475  NE  ARG A  28      17.139  12.681   2.228  1.00 20.000          N  
ATOM    476  CZ  ARG A  28      17.917  13.438   1.414  1.00 20.000          C  
ATOM    477  NH1 ARG A  28      18.832  14.237   1.929  1.00 20.000          N  
ATOM    478  NH2 ARG A  28      17.764  13.392   0.099  1.00 20.000          N  
ATOM    479  H   ARG A  28      13.745  10.869   2.759  1.00 20.000          H  
ATOM    480  HA  ARG A  28      13.566  11.879   5.490  1.00 20.000          H  
ATOM    481 1HB  ARG A  28      14.758  12.969   2.945  1.00 20.000          H  
ATOM    482 2HB  ARG A  28      14.911  13.789   4.484  1.00 20.000          H  
ATOM    483 1HG  ARG A  28      16.199  11.933   5.372  1.00 20.000          H  
ATOM    484 2HG  ARG A  28      15.951  11.012   3.868  1.00 20.000          H  
ATOM    485 1HD  ARG A  28      17.265  13.705   4.048  1.00 20.000          H  
ATOM    486 2HD  ARG A  28      18.128  12.144   3.989  1.00 20.000          H  
ATOM    487  HE  ARG A  28      16.438  12.056   1.795  1.00 20.000          H  
ATOM    488 1HH1 ARG A  28      18.959  14.288   2.928  1.00 20.000          H  
ATOM    489 2HH1 ARG A  28      19.408  14.804   1.324  1.00 20.000          H  
ATOM    490 1HH2 ARG A  28      17.058  12.802  -0.319  1.00 20.000          H  
ATOM    491 2HH2 ARG A  28      18.347  13.962  -0.496  1.00 20.000          H  
ATOM    492  N   TYR A  29      11.725  13.329   3.201  1.00 20.000          N  
ATOM    493  CA  TYR A  29      10.740  14.362   2.909  1.00 20.000          C  
ATOM    494  C   TYR A  29       9.312  13.838   2.829  1.00 20.000          C  
ATOM    495  O   TYR A  29       8.487  14.365   2.075  1.00 20.000          O  
ATOM    496  CB  TYR A  29      11.132  15.081   1.622  1.00 20.000          C  
ATOM    497  CG  TYR A  29      12.437  15.829   1.755  1.00 20.000          C  
ATOM    498  CD1 TYR A  29      13.624  15.211   1.432  1.00 20.000          C  
ATOM    499  CD2 TYR A  29      12.441  17.136   2.188  1.00 20.000          C  
ATOM    500  CE1 TYR A  29      14.810  15.874   1.540  1.00 20.000          C  
ATOM    501  CE2 TYR A  29      13.636  17.813   2.298  1.00 20.000          C  
ATOM    502  CZ  TYR A  29      14.820  17.181   1.975  1.00 20.000          C  
ATOM    503  OH  TYR A  29      16.017  17.850   2.084  1.00 20.000          O  
ATOM    504  H   TYR A  29      11.942  12.665   2.453  1.00 20.000          H  
ATOM    505  HA  TYR A  29      10.768  15.092   3.719  1.00 20.000          H  
ATOM    506 1HB  TYR A  29      11.229  14.358   0.815  1.00 20.000          H  
ATOM    507 2HB  TYR A  29      10.363  15.788   1.340  1.00 20.000          H  
ATOM    508  HD1 TYR A  29      13.618  14.197   1.094  1.00 20.000          H  
ATOM    509  HD2 TYR A  29      11.504  17.632   2.442  1.00 20.000          H  
ATOM    510  HE1 TYR A  29      15.736  15.373   1.282  1.00 20.000          H  
ATOM    511  HE2 TYR A  29      13.647  18.848   2.642  1.00 20.000          H  
ATOM    512  HH  TYR A  29      15.857  18.743   2.402  1.00 20.000          H  
ATOM    513  N   GLN A  30       8.972  12.852   3.653  1.00 20.000          N  
ATOM    514  CA  GLN A  30       7.634  12.270   3.601  1.00 20.000          C  
ATOM    515  C   GLN A  30       6.543  13.321   3.797  1.00 20.000          C  
ATOM    516  O   GLN A  30       5.480  13.242   3.181  1.00 20.000          O  
ATOM    517  CB  GLN A  30       7.470  11.184   4.671  1.00 20.000          C  
ATOM    518  CG  GLN A  30       8.269   9.935   4.409  1.00 20.000          C  
ATOM    519  CD  GLN A  30       8.154   8.907   5.510  1.00 20.000          C  
ATOM    520  OE1 GLN A  30       7.056   8.449   5.853  1.00 20.000          O  
ATOM    521  NE2 GLN A  30       9.300   8.548   6.091  1.00 20.000          N  
ATOM    522  H   GLN A  30       9.670  12.469   4.282  1.00 20.000          H  
ATOM    523  HA  GLN A  30       7.512  11.814   2.621  1.00 20.000          H  
ATOM    524 1HB  GLN A  30       7.778  11.576   5.637  1.00 20.000          H  
ATOM    525 2HB  GLN A  30       6.420  10.903   4.751  1.00 20.000          H  
ATOM    526 1HG  GLN A  30       7.932   9.480   3.480  1.00 20.000          H  
ATOM    527 2HG  GLN A  30       9.315  10.210   4.326  1.00 20.000          H  
ATOM    528 1HE2 GLN A  30       9.297   7.877   6.833  1.00 20.000          H  
ATOM    529 2HE2 GLN A  30      10.185   8.979   5.786  1.00 20.000          H  
ATOM    530  N   SER A  31       6.810  14.335   4.625  1.00 20.000          N  
ATOM    531  CA  SER A  31       5.858  15.410   4.909  1.00 20.000          C  
ATOM    532  C   SER A  31       5.548  16.292   3.692  1.00 20.000          C  
ATOM    533  O   SER A  31       4.559  17.040   3.687  1.00 20.000          O  
ATOM    534  CB  SER A  31       6.395  16.269   6.033  1.00 20.000          C  
ATOM    535  OG  SER A  31       7.555  16.951   5.635  1.00 20.000          O  
ATOM    536  H   SER A  31       7.698  14.365   5.109  1.00 20.000          H  
ATOM    537  HA  SER A  31       4.926  14.952   5.240  1.00 20.000          H  
ATOM    538 1HB  SER A  31       5.633  16.988   6.335  1.00 20.000          H  
ATOM    539 2HB  SER A  31       6.616  15.644   6.897  1.00 20.000          H  
ATOM    540  HG  SER A  31       7.809  17.501   6.387  1.00 20.000          H  
ATOM    541  N   ARG A  32       6.391  16.216   2.657  1.00 20.000          N  
ATOM    542  CA  ARG A  32       6.213  16.986   1.435  1.00 20.000          C  
ATOM    543  C   ARG A  32       5.647  16.102   0.322  1.00 20.000          C  
ATOM    544  O   ARG A  32       4.909  16.578  -0.546  1.00 20.000          O  
ATOM    545  CB  ARG A  32       7.542  17.570   0.974  1.00 20.000          C  
ATOM    546  CG  ARG A  32       8.232  18.523   1.962  1.00 20.000          C  
ATOM    547  CD  ARG A  32       7.439  19.757   2.227  1.00 20.000          C  
ATOM    548  NE  ARG A  32       8.171  20.699   3.069  1.00 20.000          N  
ATOM    549  CZ  ARG A  32       7.664  21.841   3.583  1.00 20.000          C  
ATOM    550  NH1 ARG A  32       6.413  22.186   3.342  1.00 20.000          N  
ATOM    551  NH2 ARG A  32       8.431  22.618   4.334  1.00 20.000          N  
ATOM    552  H   ARG A  32       7.179  15.575   2.716  1.00 20.000          H  
ATOM    553  HA  ARG A  32       5.503  17.787   1.622  1.00 20.000          H  
ATOM    554 1HB  ARG A  32       8.232  16.754   0.774  1.00 20.000          H  
ATOM    555 2HB  ARG A  32       7.395  18.107   0.039  1.00 20.000          H  
ATOM    556 1HG  ARG A  32       8.378  18.007   2.912  1.00 20.000          H  
ATOM    557 2HG  ARG A  32       9.200  18.819   1.559  1.00 20.000          H  
ATOM    558 1HD  ARG A  32       7.196  20.247   1.284  1.00 20.000          H  
ATOM    559 2HD  ARG A  32       6.523  19.487   2.751  1.00 20.000          H  
ATOM    560  HE  ARG A  32       9.135  20.475   3.284  1.00 20.000          H  
ATOM    561 1HH1 ARG A  32       5.824  21.597   2.773  1.00 20.000          H  
ATOM    562 2HH1 ARG A  32       6.040  23.041   3.729  1.00 20.000          H  
ATOM    563 1HH2 ARG A  32       9.390  22.356   4.519  1.00 20.000          H  
ATOM    564 2HH2 ARG A  32       8.062  23.474   4.722  1.00 20.000          H  
ATOM    565  N   VAL A  33       6.054  14.830   0.323  1.00 20.000          N  
ATOM    566  CA  VAL A  33       5.657  13.853  -0.690  1.00 20.000          C  
ATOM    567  C   VAL A  33       4.208  13.423  -0.510  1.00 20.000          C  
ATOM    568  O   VAL A  33       3.444  13.394  -1.479  1.00 20.000          O  
ATOM    569  CB  VAL A  33       6.575  12.630  -0.649  1.00 20.000          C  
ATOM    570  CG1 VAL A  33       6.063  11.526  -1.633  1.00 20.000          C  
ATOM    571  CG2 VAL A  33       7.977  13.065  -0.997  1.00 20.000          C  
ATOM    572  H   VAL A  33       6.708  14.553   1.055  1.00 20.000          H  
ATOM    573  HA  VAL A  33       5.756  14.319  -1.667  1.00 20.000          H  
ATOM    574  HB  VAL A  33       6.571  12.222   0.350  1.00 20.000          H  
ATOM    575 1HG1 VAL A  33       6.725  10.669  -1.590  1.00 20.000          H  
ATOM    576 2HG1 VAL A  33       5.055  11.206  -1.364  1.00 20.000          H  
ATOM    577 3HG1 VAL A  33       6.053  11.919  -2.649  1.00 20.000          H  
ATOM    578 1HG2 VAL A  33       8.635  12.216  -0.944  1.00 20.000          H  
ATOM    579 2HG2 VAL A  33       7.977  13.481  -2.001  1.00 20.000          H  
ATOM    580 3HG2 VAL A  33       8.320  13.820  -0.300  1.00 20.000          H  
ATOM    581  N   ILE A  34       3.832  13.127   0.738  1.00 20.000          N  
ATOM    582  CA  ILE A  34       2.508  12.655   1.141  1.00 20.000          C  
ATOM    583  C   ILE A  34       1.370  13.538   0.661  1.00 20.000          C  
ATOM    584  O   ILE A  34       0.231  13.094   0.564  1.00 20.000          O  
ATOM    585  CB  ILE A  34       2.423  12.547   2.682  1.00 20.000          C  
ATOM    586  CG1 ILE A  34       1.185  11.689   3.089  1.00 20.000          C  
ATOM    587  CG2 ILE A  34       2.382  13.971   3.327  1.00 20.000          C  
ATOM    588  CD1 ILE A  34       1.168  11.244   4.547  1.00 20.000          C  
ATOM    589  H   ILE A  34       4.539  13.183   1.474  1.00 20.000          H  
ATOM    590  HA  ILE A  34       2.368  11.665   0.721  1.00 20.000          H  
ATOM    591  HB  ILE A  34       3.304  12.043   3.044  1.00 20.000          H  
ATOM    592 1HG1 ILE A  34       0.277  12.264   2.911  1.00 20.000          H  
ATOM    593 2HG1 ILE A  34       1.160  10.800   2.458  1.00 20.000          H  
ATOM    594 1HG2 ILE A  34       2.369  13.890   4.405  1.00 20.000          H  
ATOM    595 2HG2 ILE A  34       3.267  14.527   3.029  1.00 20.000          H  
ATOM    596 3HG2 ILE A  34       1.498  14.515   3.013  1.00 20.000          H  
ATOM    597 1HD1 ILE A  34       0.273  10.649   4.730  1.00 20.000          H  
ATOM    598 2HD1 ILE A  34       2.048  10.642   4.762  1.00 20.000          H  
ATOM    599 3HD1 ILE A  34       1.159  12.107   5.202  1.00 20.000          H  
ATOM    600  N   GLN A  35       1.672  14.792   0.382  1.00 20.000          N  
ATOM    601  CA  GLN A  35       0.697  15.771  -0.041  1.00 20.000          C  
ATOM    602  C   GLN A  35       0.075  15.384  -1.382  1.00 20.000          C  
ATOM    603  O   GLN A  35      -1.020  15.837  -1.719  1.00 20.000          O  
ATOM    604  CB  GLN A  35       1.360  17.140  -0.152  1.00 20.000          C  
ATOM    605  CG  GLN A  35       1.982  17.660   1.160  1.00 20.000          C  
ATOM    606  CD  GLN A  35       1.040  17.737   2.317  1.00 20.000          C  
ATOM    607  OE1 GLN A  35      -0.150  18.031   2.166  1.00 20.000          O  
ATOM    608  NE2 GLN A  35       1.579  17.482   3.510  1.00 20.000          N  
ATOM    609  H   GLN A  35       2.643  15.063   0.465  1.00 20.000          H  
ATOM    610  HA  GLN A  35      -0.099  15.811   0.701  1.00 20.000          H  
ATOM    611 1HB  GLN A  35       2.162  17.088  -0.891  1.00 20.000          H  
ATOM    612 2HB  GLN A  35       0.634  17.871  -0.503  1.00 20.000          H  
ATOM    613 1HG  GLN A  35       2.798  16.995   1.445  1.00 20.000          H  
ATOM    614 2HG  GLN A  35       2.376  18.659   0.981  1.00 20.000          H  
ATOM    615 1HE2 GLN A  35       1.014  17.521   4.334  1.00 20.000          H  
ATOM    616 2HE2 GLN A  35       2.586  17.264   3.591  1.00 20.000          H  
ATOM    617  N   GLY A  36       0.804  14.596  -2.174  1.00 20.000          N  
ATOM    618  CA  GLY A  36       0.355  14.151  -3.483  1.00 20.000          C  
ATOM    619  C   GLY A  36      -0.242  12.739  -3.478  1.00 20.000          C  
ATOM    620  O   GLY A  36      -0.462  12.168  -4.551  1.00 20.000          O  
ATOM    621  H   GLY A  36       1.711  14.253  -1.839  1.00 20.000          H  
ATOM    622 1HA  GLY A  36      -0.385  14.855  -3.864  1.00 20.000          H  
ATOM    623 2HA  GLY A  36       1.200  14.178  -4.169  1.00 20.000          H  
ATOM    624  N   LEU A  37      -0.466  12.158  -2.294  1.00 20.000          N  
ATOM    625  CA  LEU A  37      -0.942  10.782  -2.211  1.00 20.000          C  
ATOM    626  C   LEU A  37      -2.274  10.654  -1.474  1.00 20.000          C  
ATOM    627  O   LEU A  37      -2.768   9.540  -1.283  1.00 20.000          O  
ATOM    628  OXT LEU A  37      -2.961  11.656  -1.285  1.00 20.000          O  
ATOM    629  CB  LEU A  37       0.132   9.944  -1.500  1.00 20.000          C  
ATOM    630  CG  LEU A  37       1.539   9.917  -2.182  1.00 20.000          C  
ATOM    631  CD1 LEU A  37       2.516   9.230  -1.298  1.00 20.000          C  
ATOM    632  CD2 LEU A  37       1.474   9.187  -3.506  1.00 20.000          C  
ATOM    633  H   LEU A  37      -0.292  12.667  -1.422  1.00 20.000          H  
ATOM    634  HA  LEU A  37      -1.097  10.405  -3.218  1.00 20.000          H  
ATOM    635 1HB  LEU A  37       0.260  10.351  -0.493  1.00 20.000          H  
ATOM    636 2HB  LEU A  37      -0.225   8.919  -1.414  1.00 20.000          H  
ATOM    637  HG  LEU A  37       1.889  10.941  -2.337  1.00 20.000          H  
ATOM    638 1HD1 LEU A  37       3.471   9.238  -1.780  1.00 20.000          H  
ATOM    639 2HD1 LEU A  37       2.588   9.742  -0.358  1.00 20.000          H  
ATOM    640 3HD1 LEU A  37       2.203   8.209  -1.127  1.00 20.000          H  
ATOM    641 1HD2 LEU A  37       2.457   9.169  -3.941  1.00 20.000          H  
ATOM    642 2HD2 LEU A  37       1.139   8.168  -3.345  1.00 20.000          H  
ATOM    643 3HD2 LEU A  37       0.791   9.692  -4.186  1.00 20.000          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 -218.724 21.2074 160.592 -15.9449 3.65878 10.4603 84.4732 -88.1137 -0.09634 -0.76775 -76.2827 -4.95206 -29.7978 0 -4.37436 -3.82414 0 -0.82822 3.19276 22.4491 39.7603 -3.99084 0.60788 -1.53515 -4.20669 15.8463 -91.1903
ASP:NtermProteinFull_1 -2.91549 0.14978 4.33922 -0.2515 0.05875 0.83409 2.06749 -1.86144 -0 -0 -3.64097 -0.028 0 0 -0.57395 0 0 0.0008 0.01723 0 1.89129 0 0 -2.3716 0 0.11679 -2.16753
TRP_2 -9.13925 1.12769 2.73983 -1.41022 0.23858 0.55008 1.93378 -2.58549 -0.00683 -0.03204 -0.91042 -0.76931 0 0 0 0 0 -0.05417 0.34961 0 1.90293 -0.02095 0 1.6906 -0.2052 0.46982 -4.13094
PHE_3 -7.41086 0.64924 4.13439 -0.57104 0.02125 0.25367 2.22977 -2.68836 -0 -0 -1.30655 0.00611 0 0 0 0 0 0.00831 0.00621 0 3.05421 -0.17126 0 1.0402 -0.28586 0.52413 -0.50645
LYS_4 -5.26476 0.57239 8.22158 -0.77135 0.14642 0.77087 3.69587 -3.40388 -0 -0 -6.41649 -0.05973 0 0 -0.57395 -0.76797 0 -0.01707 0.34983 2.88113 0 0.01628 0 -1.5107 -0.10596 0.54567 -1.69185
ALA_5 -4.62895 0.15377 3.21277 -0.02174 0 0 1.82866 -2.21941 -0 -0 -1.41709 -0.35576 0 0 0 0 0 -0.03542 0 0 0 -0.29439 0 1.8394 -0.26378 0.4494 -1.75254
PHE_6 -11.7753 1.73905 3.86932 -0.55806 0.2169 0.24546 3.20267 -3.26058 -0.00501 -0.02982 -3.10201 0.01043 0 0 0 0 0 0.02612 0.06707 0 3.80186 -0.0935 0 1.0402 -0.20923 0.46549 -4.34887
TYR_7 -9.07599 0.80539 5.99008 -0.90553 0.10255 0.37287 3.40813 -3.24597 -0.00683 -0.03204 -2.88513 -0.30159 0 0 0 0 0 -0.01637 0.0831 0 1.90388 -0.42982 0.00426 1.2797 0.06747 0.55472 -2.3271
ASP_8 -5.34196 0.56355 8.11524 -0.10674 0.01143 0.32555 3.95016 -3.56458 -0 -0 -6.09974 -0.28474 0 0 0 -0.76797 0 -0.02931 0.01107 0 1.72779 0.26261 0 -2.3716 -0.00214 0.47914 -3.12224
LYS_9 -6.60855 0.3208 7.17691 -0.99425 0.32009 0.7901 3.35673 -3.14054 -0.02028 -0.14227 -3.88356 0.11606 0 0 0 -0.79424 0 0.02185 0.11443 2.59261 0 -0.0647 0 -1.5107 -0.19874 0.57019 -1.97803
VAL_10 -9.50664 1.50478 3.9236 -0.32271 0.21593 0.07319 3.3345 -3.0798 -0 -0 -2.90772 -0.24978 0 0 0 0 0 -0.05561 0.00234 0.10975 0 -0.30066 0 1.9342 -0.22725 0.61449 -4.93738
ALA_11 -5.53588 0.51631 4.47584 -0.023 0 0 2.57967 -2.80612 -0.00501 -0.02982 -1.78181 -0.36513 0 0 0 0 0 0.09247 0 0 0 -0.38351 0 1.8394 -0.38177 0.58483 -1.22352
GLU_12 -4.37535 0.2321 6.12535 -0.20388 0.01979 0.27432 2.5984 -2.58055 -0.02028 -0.14227 -2.84811 -0.59407 0 0 0 -0.79424 0 0.04244 0.02262 0 3.02899 -0.24035 0 -2.7348 -0.60236 0.40231 -2.38995
LYS_13 -3.68572 0.15232 3.64091 -0.29377 0.02763 0.13098 1.59957 -1.67943 -0 -0 -0.72628 -0.05296 0 0 0 0 0 -0.04752 0.00546 1.92131 0 -0.13089 0 -1.5107 -0.4151 0.43649 -0.6277
PHE_14 -7.09065 0.78761 2.71015 -0.59142 0.10574 0.30505 2.67345 -2.29115 -0 -0 -2.2444 -0.15649 0 0 0 0 0 0.0067 0.26677 0 2.43302 -0.30568 0 1.0402 0.01298 0.4384 -1.89971
LYS_15 -3.07688 0.25975 3.66518 -0.41813 0.06325 0.22293 1.57447 -1.58923 -0 -0 -0.30649 0.11411 0 0 0 0 0 -0.09964 0.03121 1.46993 0 -0.02602 0 -1.5107 -0.16736 0.27967 0.48605
GLU_16 -1.66917 0.25617 1.74004 -0.23059 0.03955 0.36876 0.21633 -0.75078 -0 -0 -0.09225 -0.56545 0 0 0 0 0 -0.03558 0.00101 0 2.92184 -0.05678 0 -2.7348 -0.56517 0.16188 -0.99501
ALA_17 -3.04538 0.3021 1.28758 -0.02152 0 0 1.40297 -1.16995 -0 -0 -0.26564 -0.21932 0 0 0 0 0 -0.01277 0 0 0 0.17789 0 1.8394 -0.10991 0.19681 0.36225
PHE_18 -3.28726 0.55299 2.98847 -0.61276 0.03559 0.29129 2.03345 -1.52255 -0 -0 -1.52281 0.25461 0 0 0 0 0 -0.01412 0.01152 0 2.23983 0.11233 0 1.0402 0.04244 0.8004 3.44363
PRO_19 -4.54966 0.43361 3.77317 -0.06893 0 0.04284 1.62223 -1.72932 -0 -0 -1.26707 0.58686 0 0 0 0 0 -0.22675 0.04638 0.21917 0 -0.76488 0 -2.4119 0.07572 0.98149 -3.23705
ASP_20 -4.44535 0.28274 5.61397 -0.11549 0.00093 0.34896 1.89923 -2.59118 -0.00146 -0.00871 -2.82452 -0.74181 0 0 0 -0.34986 0 0.11118 0.00058 0 2.74651 -0.3092 0 -2.3716 0.00944 0.44645 -2.2992
VAL_21 -5.17503 0.34899 3.81341 -0.30001 0.18272 0.06804 2.48694 -2.29737 -0 -0 -1.78264 -0.1609 0 0 0 0 0 -0.05354 0 0.09508 0 -0.37106 0 1.9342 -0.18855 0.3968 -1.00291
CYS_22 -8.09563 0.70042 4.40367 -0.06804 3e-05 0.05921 2.56094 -2.52899 -0 -0 -1.81143 -0.41275 0 0 0 0 0 0.07716 0.00109 0.65649 0 0.25774 0 3.6196 0.41356 0.39011 0.22318
ARG_23 -8.90365 0.58283 8.70862 -0.73235 0.13151 0.47035 2.96772 -3.9327 -0.00146 -0.00871 -3.60739 0.3812 0 0 0 -0.34986 0 -0.02541 0.35751 1.43721 0 -0.07384 0 -1.2888 0.23755 0.42362 -3.22606
ASN_24 -5.40025 0.16582 6.30923 -0.1756 0.02925 0.25884 2.81148 -2.95701 -0.0105 -0.13402 -3.02621 -0.31907 0 0 0 0 0 0.02292 0.00014 0 1.42664 0.4329 0 -0.93687 -0.1226 0.35542 -1.26951
PHE_25 -9.50097 0.99234 3.798 -0.92066 0.10752 0.359 3.16349 -2.9654 -0 -0 -2.69601 0.02733 0 0 0 0 0 0.06299 0.10176 0 2.07893 -0.25728 0 1.0402 0.06568 0.25698 -4.28612
MET_26 -11.379 1.48654 5.76608 -0.40407 0.17086 0.11035 2.63689 -3.128 -0 -0 -1.3525 0.00085 0 0 0 0 0 -0.02568 0.58984 2.68895 0 -0.17762 0 0.60916 -0.15171 0.56032 -1.99877
ARG_27 -7.10931 0.54307 5.60703 -0.45112 0.06122 0.22898 2.13563 -2.58581 -0.0105 -0.13402 -1.08916 0.28208 0 0 -1.02165 0 0 -0.0251 0.20277 2.02987 0 -0.11176 0 -1.2888 -0.21851 0.6036 -2.3515
ARG_28 -5.41257 0.17498 4.74626 -0.72762 0.14806 0.49626 2.00977 -2.30347 -0 -0 -1.4689 0.66693 0 0 0 0 0 -0.03984 0.06346 1.84002 0 -0.1207 0 -1.2888 -0.17993 0.52598 -0.87012
TYR_29 -7.53717 0.79421 4.20824 -0.66344 0.08418 0.37423 2.9351 -2.60718 -0.00409 -0.037 -3.59899 -0.24372 0 0 0 0 0 0.01815 0.01184 0 2.10579 -0.14969 7e-05 1.2797 0.09373 0.4696 -2.46646
GLN_30 -6.58792 0.70224 5.28023 -0.28139 0.02231 0.22624 3.17131 -2.80928 -0 -0 -2.39083 -0.30338 0 0 -1.02165 0 0 -0.06678 0.00021 0 3.48278 -0.19868 0 -0.18838 0.06483 0.28723 -0.61091
SER_31 -2.75644 0.19871 2.92868 -0.02972 0.00035 0.04836 0.89635 -1.42598 -0 -0 -0.90109 -1.01638 0 0 -0.59157 0 0 -0.06438 0.00436 0.15772 0 -0.32021 0.60354 -0.77834 -0.44683 0.17465 -3.31819
ARG_32 -4.04238 0.2273 3.97614 -0.65505 0.18139 0.36656 1.6826 -1.86098 -0 -0 -0.94619 0.25852 0 0 0 0 0 -0.034 0.06054 2.11505 0 -0.11021 0 -1.2888 -0.16713 0.1995 -0.03712
VAL_33 -7.48094 0.90673 2.69414 -0.30719 0.21062 0.06941 2.42319 -2.3758 -0 -0 -1.25625 -0.12142 0 0 0 0 0 -0.03942 0.00794 0.17914 0 -0.38815 0 1.9342 0.13376 0.29567 -3.11437
ILE_34 -6.01616 0.69625 3.68285 -0.60839 0.39016 0.19122 1.89052 -2.3162 -0.00409 -0.03701 -1.11591 -0.00999 0 0 0 0 0 -0.18751 0.01335 1.18208 0 0.41916 0 0.73287 0.08638 0.38357 -0.62685
GLN_35 -3.48761 0.45775 3.27971 -0.62037 0.095 0.70553 1.49286 -1.67283 -0 -0 -0.90792 -0.29809 0 0 -0.59157 0 0 -0.07025 0.35332 0 3.01407 -0.18415 0 -0.18838 -0.15727 0.34321 1.56298
GLY_36 -2.13888 0.28861 2.29713 -7e-05 0 0 1.03625 -1.123 -0 -0 -1.46551 -0.3687 0 0 0 0 0 -0.04306 0 0 0 0.38618 0 0.83697 -0.19428 0.23921 -0.24915
LEU:CtermProteinFull_37 -5.27069 0.57849 1.34878 -0.50714 0.21918 0.2267 0.96466 -1.46339 -0 -1e-05 -0.41669 0.3414 0 0 0 0 0 0 0.03817 0.87358 0 0 0 0.18072 0.05642 0.42232 -2.40747
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691858 DOMAINID 682972 MODEL 3 pep5_AB
MODEL     3
REMARK    Rerank model04.pdb to model03.pdb score: 25.018
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 17 cluster_threshold: 1.516413
REMARK    SCORE         p_aa_pp:          -2.987
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE             ref:           9.796
REMARK    SCORE        hbond_sc:          -3.203
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE           score:         -63.632
REMARK    SCORE    fa_intra_rep:           0.447
REMARK    SCORE     hbond_bb_sc:           0.000
REMARK    SCORE     rama_prepro:          -4.081
REMARK    SCORE     lk_ball_wtd:          -6.672
REMARK    SCORE            time:           0.000
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     hbond_sr_bb:         -30.196
REMARK    SCORE         fa_elec:         -62.312
REMARK    SCORE     total_score:         -63.632
REMARK    SCORE          fa_rep:          22.096
REMARK    SCORE     cart_bonded:          20.586
REMARK    SCORE           omega:           0.171
REMARK    SCORE          fa_sol:         128.815
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE fa_intra_sol_xover4:           9.697
REMARK    SCORE          fa_dun:          59.807
REMARK    SCORE          fa_atr:        -205.596
ATOM      1  N   ASP A   1      -0.224  -0.147  -0.270  1.00  1.590          N  
ATOM      2  CA  ASP A   1       1.233  -0.152  -0.249  1.00  1.380          C  
ATOM      3  C   ASP A   1       1.825   1.254  -0.195  1.00  1.210          C  
ATOM      4  O   ASP A   1       2.585   1.581   0.724  1.00  1.010          O  
ATOM      5  CB  ASP A   1       1.772  -0.872  -1.482  1.00  2.020          C  
ATOM      6  CG  ASP A   1       1.396  -2.313  -1.469  1.00  2.020          C  
ATOM      7  OD1 ASP A   1       0.922  -2.750  -0.450  1.00  2.020          O  
ATOM      8  OD2 ASP A   1       1.550  -2.960  -2.461  1.00  2.020          O  
ATOM      9 1H   ASP A   1      -0.543  -0.869  -0.902  1.00  1.910          H  
ATOM     10 2H   ASP A   1      -0.562  -0.357   0.659  1.00  1.910          H  
ATOM     11 3H   ASP A   1      -0.578   0.749  -0.562  1.00  1.910          H  
ATOM     12  HA  ASP A   1       1.561  -0.690   0.642  1.00  1.660          H  
ATOM     13 1HB  ASP A   1       1.380  -0.414  -2.387  1.00  2.420          H  
ATOM     14 2HB  ASP A   1       2.860  -0.788  -1.512  1.00  2.420          H  
ATOM     15  N   TRP A   2       1.461   2.096  -1.171  1.00  1.360          N  
ATOM     16  CA  TRP A   2       1.991   3.460  -1.225  1.00  1.320          C  
ATOM     17  C   TRP A   2       1.805   4.313   0.002  1.00  1.210          C  
ATOM     18  O   TRP A   2       2.764   4.903   0.490  1.00  1.030          O  
ATOM     19  CB  TRP A   2       1.401   4.230  -2.399  1.00  1.860          C  
ATOM     20  CG  TRP A   2       1.710   5.703  -2.332  1.00  1.860          C  
ATOM     21  CD1 TRP A   2       0.803   6.707  -2.145  1.00  1.860          C  
ATOM     22  CD2 TRP A   2       3.004   6.345  -2.385  1.00  1.860          C  
ATOM     23  NE1 TRP A   2       1.440   7.915  -2.114  1.00  1.860          N  
ATOM     24  CE2 TRP A   2       2.780   7.716  -2.256  1.00  1.860          C  
ATOM     25  CE3 TRP A   2       4.315   5.876  -2.524  1.00  1.860          C  
ATOM     26  CZ2 TRP A   2       3.812   8.627  -2.273  1.00  1.860          C  
ATOM     27  CZ3 TRP A   2       5.349   6.790  -2.530  1.00  1.860          C  
ATOM     28  CH2 TRP A   2       5.105   8.132  -2.412  1.00  1.860          C  
ATOM     29  H   TRP A   2       0.845   1.790  -1.911  1.00  1.630          H  
ATOM     30  HA  TRP A   2       3.062   3.374  -1.397  1.00  1.580          H  
ATOM     31 1HB  TRP A   2       1.795   3.837  -3.335  1.00  2.240          H  
ATOM     32 2HB  TRP A   2       0.320   4.110  -2.415  1.00  2.240          H  
ATOM     33  HD1 TRP A   2      -0.273   6.567  -2.043  1.00  2.240          H  
ATOM     34  HE1 TRP A   2       0.999   8.815  -1.997  1.00  2.240          H  
ATOM     35  HE3 TRP A   2       4.519   4.816  -2.622  1.00  2.240          H  
ATOM     36  HZ2 TRP A   2       3.636   9.699  -2.174  1.00  2.240          H  
ATOM     37  HZ3 TRP A   2       6.365   6.416  -2.637  1.00  2.240          H  
ATOM     38  HH2 TRP A   2       5.945   8.826  -2.425  1.00  2.240          H  
ATOM     39  N   PHE A   3       0.596   4.406   0.535  1.00  1.380          N  
ATOM     40  CA  PHE A   3       0.451   5.329   1.643  1.00  1.410          C  
ATOM     41  C   PHE A   3       1.306   4.957   2.829  1.00  1.190          C  
ATOM     42  O   PHE A   3       1.925   5.841   3.415  1.00  1.150          O  
ATOM     43  CB  PHE A   3      -1.005   5.518   2.023  1.00  1.960          C  
ATOM     44  CG  PHE A   3      -1.671   6.425   1.049  1.00  1.960          C  
ATOM     45  CD1 PHE A   3      -2.629   5.961   0.164  1.00  1.960          C  
ATOM     46  CD2 PHE A   3      -1.299   7.764   0.989  1.00  1.960          C  
ATOM     47  CE1 PHE A   3      -3.205   6.817  -0.753  1.00  1.960          C  
ATOM     48  CE2 PHE A   3      -1.869   8.611   0.075  1.00  1.960          C  
ATOM     49  CZ  PHE A   3      -2.823   8.140  -0.797  1.00  1.960          C  
ATOM     50  H   PHE A   3      -0.185   3.905   0.148  1.00  1.660          H  
ATOM     51  HA  PHE A   3       0.806   6.297   1.295  1.00  1.690          H  
ATOM     52 1HB  PHE A   3      -1.521   4.564   2.030  1.00  2.350          H  
ATOM     53 2HB  PHE A   3      -1.080   5.949   3.008  1.00  2.350          H  
ATOM     54  HD1 PHE A   3      -2.931   4.913   0.189  1.00  2.350          H  
ATOM     55  HD2 PHE A   3      -0.539   8.142   1.678  1.00  2.350          H  
ATOM     56  HE1 PHE A   3      -3.960   6.446  -1.446  1.00  2.350          H  
ATOM     57  HE2 PHE A   3      -1.566   9.657   0.036  1.00  2.350          H  
ATOM     58  HZ  PHE A   3      -3.275   8.812  -1.523  1.00  2.350          H  
ATOM     59  N   LYS A   4       1.405   3.674   3.169  1.00  1.100          N  
ATOM     60  CA  LYS A   4       2.255   3.327   4.292  1.00  1.010          C  
ATOM     61  C   LYS A   4       3.702   3.669   3.961  1.00  0.720          C  
ATOM     62  O   LYS A   4       4.398   4.270   4.781  1.00  0.750          O  
ATOM     63  CB  LYS A   4       2.148   1.847   4.656  1.00  1.450          C  
ATOM     64  CG  LYS A   4       2.997   1.413   5.899  1.00  1.450          C  
ATOM     65  CD  LYS A   4       2.488   2.075   7.204  1.00  1.450          C  
ATOM     66  CE  LYS A   4       3.020   1.369   8.483  1.00  1.450          C  
ATOM     67  NZ  LYS A   4       4.475   1.657   8.779  1.00  1.450          N  
ATOM     68  H   LYS A   4       0.885   2.972   2.667  1.00  1.320          H  
ATOM     69  HA  LYS A   4       1.955   3.923   5.148  1.00  1.210          H  
ATOM     70 1HB  LYS A   4       1.107   1.599   4.856  1.00  1.740          H  
ATOM     71 2HB  LYS A   4       2.470   1.246   3.803  1.00  1.740          H  
ATOM     72 1HG  LYS A   4       2.949   0.331   6.008  1.00  1.740          H  
ATOM     73 2HG  LYS A   4       4.044   1.697   5.750  1.00  1.740          H  
ATOM     74 1HD  LYS A   4       2.846   3.112   7.232  1.00  1.740          H  
ATOM     75 2HD  LYS A   4       1.401   2.083   7.221  1.00  1.740          H  
ATOM     76 1HE  LYS A   4       2.423   1.687   9.334  1.00  1.740          H  
ATOM     77 2HE  LYS A   4       2.902   0.295   8.353  1.00  1.740          H  
ATOM     78 1HZ  LYS A   4       4.757   1.176   9.607  1.00  1.740          H  
ATOM     79 2HZ  LYS A   4       5.116   1.397   8.024  1.00  1.740          H  
ATOM     80 3HZ  LYS A   4       4.644   2.659   8.918  1.00  1.740          H  
ATOM     81  N   ALA A   5       4.163   3.337   2.742  1.00  0.550          N  
ATOM     82  CA  ALA A   5       5.553   3.623   2.405  1.00  0.420          C  
ATOM     83  C   ALA A   5       5.837   5.109   2.530  1.00  0.400          C  
ATOM     84  O   ALA A   5       6.885   5.509   3.054  1.00  0.350          O  
ATOM     85  CB  ALA A   5       5.848   3.173   0.985  1.00  0.640          C  
ATOM     86  H   ALA A   5       3.564   2.853   2.065  1.00  0.660          H  
ATOM     87  HA  ALA A   5       6.193   3.088   3.104  1.00  0.500          H  
ATOM     88 1HB  ALA A   5       6.887   3.377   0.746  1.00  0.770          H  
ATOM     89 2HB  ALA A   5       5.652   2.105   0.898  1.00  0.770          H  
ATOM     90 3HB  ALA A   5       5.199   3.716   0.295  1.00  0.770          H  
ATOM     91  N   PHE A   6       4.888   5.923   2.072  1.00  0.620          N  
ATOM     92  CA  PHE A   6       4.976   7.359   2.150  1.00  0.750          C  
ATOM     93  C   PHE A   6       5.069   7.789   3.593  1.00  0.720          C  
ATOM     94  O   PHE A   6       6.001   8.489   3.969  1.00  0.670          O  
ATOM     95  CB  PHE A   6       3.758   7.995   1.491  1.00  1.000          C  
ATOM     96  CG  PHE A   6       3.669   9.484   1.570  1.00  1.000          C  
ATOM     97  CD1 PHE A   6       4.400  10.290   0.722  1.00  1.000          C  
ATOM     98  CD2 PHE A   6       2.830  10.083   2.490  1.00  1.000          C  
ATOM     99  CE1 PHE A   6       4.289  11.660   0.781  1.00  1.000          C  
ATOM    100  CE2 PHE A   6       2.725  11.444   2.559  1.00  1.000          C  
ATOM    101  CZ  PHE A   6       3.449  12.237   1.698  1.00  1.000          C  
ATOM    102  H   PHE A   6       4.068   5.510   1.619  1.00  0.740          H  
ATOM    103  HA  PHE A   6       5.877   7.682   1.628  1.00  0.900          H  
ATOM    104 1HB  PHE A   6       3.733   7.701   0.454  1.00  1.200          H  
ATOM    105 2HB  PHE A   6       2.865   7.589   1.939  1.00  1.200          H  
ATOM    106  HD1 PHE A   6       5.065   9.832  -0.002  1.00  1.200          H  
ATOM    107  HD2 PHE A   6       2.254   9.458   3.158  1.00  1.200          H  
ATOM    108  HE1 PHE A   6       4.869  12.286   0.102  1.00  1.200          H  
ATOM    109  HE2 PHE A   6       2.073  11.901   3.287  1.00  1.200          H  
ATOM    110  HZ  PHE A   6       3.365  13.322   1.748  1.00  1.200          H  
ATOM    111  N   TYR A   7       4.127   7.323   4.427  1.00  0.900          N  
ATOM    112  CA  TYR A   7       4.041   7.731   5.823  1.00  1.120          C  
ATOM    113  C   TYR A   7       5.346   7.458   6.556  1.00  0.990          C  
ATOM    114  O   TYR A   7       5.846   8.321   7.283  1.00  1.080          O  
ATOM    115  CB  TYR A   7       2.940   6.946   6.563  1.00  1.480          C  
ATOM    116  CG  TYR A   7       1.477   7.157   6.134  1.00  1.480          C  
ATOM    117  CD1 TYR A   7       1.035   8.305   5.489  1.00  1.480          C  
ATOM    118  CD2 TYR A   7       0.563   6.143   6.417  1.00  1.480          C  
ATOM    119  CE1 TYR A   7      -0.305   8.415   5.128  1.00  1.480          C  
ATOM    120  CE2 TYR A   7      -0.754   6.264   6.059  1.00  1.480          C  
ATOM    121  CZ  TYR A   7      -1.193   7.392   5.414  1.00  1.480          C  
ATOM    122  OH  TYR A   7      -2.531   7.500   5.064  1.00  1.480          O  
ATOM    123  H   TYR A   7       3.408   6.707   4.049  1.00  1.080          H  
ATOM    124  HA  TYR A   7       3.840   8.797   5.871  1.00  1.340          H  
ATOM    125 1HB  TYR A   7       3.156   5.880   6.468  1.00  1.780          H  
ATOM    126 2HB  TYR A   7       2.999   7.174   7.613  1.00  1.780          H  
ATOM    127  HD1 TYR A   7       1.715   9.118   5.268  1.00  1.780          H  
ATOM    128  HD2 TYR A   7       0.901   5.243   6.927  1.00  1.780          H  
ATOM    129  HE1 TYR A   7      -0.651   9.300   4.636  1.00  1.780          H  
ATOM    130  HE2 TYR A   7      -1.453   5.461   6.286  1.00  1.780          H  
ATOM    131  HH  TYR A   7      -3.013   6.744   5.424  1.00  1.780          H  
ATOM    132  N   ASP A   8       5.942   6.290   6.332  1.00  0.870          N  
ATOM    133  CA  ASP A   8       7.166   5.983   7.049  1.00  0.950          C  
ATOM    134  C   ASP A   8       8.344   6.822   6.562  1.00  0.810          C  
ATOM    135  O   ASP A   8       9.109   7.352   7.377  1.00  0.980          O  
ATOM    136  CB  ASP A   8       7.505   4.502   6.883  1.00  1.300          C  
ATOM    137  CG  ASP A   8       6.555   3.557   7.623  1.00  1.300          C  
ATOM    138  OD1 ASP A   8       5.811   3.972   8.495  1.00  1.300          O  
ATOM    139  OD2 ASP A   8       6.547   2.378   7.314  1.00  1.300          O  
ATOM    140  H   ASP A   8       5.495   5.598   5.719  1.00  1.040          H  
ATOM    141  HA  ASP A   8       7.006   6.195   8.106  1.00  1.140          H  
ATOM    142 1HB  ASP A   8       7.463   4.256   5.815  1.00  1.560          H  
ATOM    143 2HB  ASP A   8       8.524   4.322   7.219  1.00  1.560          H  
ATOM    144  N   LYS A   9       8.473   6.990   5.241  1.00  0.580          N  
ATOM    145  CA  LYS A   9       9.583   7.766   4.700  1.00  0.590          C  
ATOM    146  C   LYS A   9       9.513   9.232   5.104  1.00  0.570          C  
ATOM    147  O   LYS A   9      10.541   9.838   5.441  1.00  0.670          O  
ATOM    148  CB  LYS A   9       9.626   7.639   3.179  1.00  0.820          C  
ATOM    149  CG  LYS A   9      10.072   6.260   2.685  1.00  0.820          C  
ATOM    150  CD  LYS A   9      10.058   6.175   1.164  1.00  0.820          C  
ATOM    151  CE  LYS A   9      10.487   4.792   0.680  1.00  0.820          C  
ATOM    152  NZ  LYS A   9      10.474   4.692  -0.810  1.00  0.820          N  
ATOM    153  H   LYS A   9       7.813   6.532   4.602  1.00  0.700          H  
ATOM    154  HA  LYS A   9      10.510   7.358   5.104  1.00  0.710          H  
ATOM    155 1HB  LYS A   9       8.624   7.829   2.780  1.00  0.990          H  
ATOM    156 2HB  LYS A   9      10.295   8.391   2.768  1.00  0.990          H  
ATOM    157 1HG  LYS A   9      11.082   6.063   3.045  1.00  0.990          H  
ATOM    158 2HG  LYS A   9       9.410   5.499   3.094  1.00  0.990          H  
ATOM    159 1HD  LYS A   9       9.044   6.374   0.806  1.00  0.990          H  
ATOM    160 2HD  LYS A   9      10.729   6.923   0.748  1.00  0.990          H  
ATOM    161 1HE  LYS A   9      11.493   4.584   1.040  1.00  0.990          H  
ATOM    162 2HE  LYS A   9       9.804   4.046   1.090  1.00  0.990          H  
ATOM    163 1HZ  LYS A   9      10.762   3.763  -1.089  1.00  0.990          H  
ATOM    164 2HZ  LYS A   9       9.541   4.871  -1.151  1.00  0.990          H  
ATOM    165 3HZ  LYS A   9      11.112   5.372  -1.201  1.00  0.990          H  
ATOM    166  N   VAL A  10       8.310   9.807   5.101  1.00  0.570          N  
ATOM    167  CA  VAL A  10       8.208  11.202   5.470  1.00  0.680          C  
ATOM    168  C   VAL A  10       8.421  11.341   6.956  1.00  0.760          C  
ATOM    169  O   VAL A  10       9.081  12.272   7.392  1.00  0.730          O  
ATOM    170  CB  VAL A  10       6.875  11.834   5.020  1.00  0.910          C  
ATOM    171  CG1 VAL A  10       6.767  11.716   3.518  1.00  0.910          C  
ATOM    172  CG2 VAL A  10       5.702  11.186   5.708  1.00  0.910          C  
ATOM    173  H   VAL A  10       7.489   9.270   4.805  1.00  0.680          H  
ATOM    174  HA  VAL A  10       9.000  11.744   4.959  1.00  0.820          H  
ATOM    175  HB  VAL A  10       6.876  12.876   5.248  1.00  1.090          H  
ATOM    176 1HG1 VAL A  10       5.855  12.183   3.190  1.00  1.090          H  
ATOM    177 2HG1 VAL A  10       7.614  12.216   3.058  1.00  1.090          H  
ATOM    178 3HG1 VAL A  10       6.762  10.676   3.219  1.00  1.090          H  
ATOM    179 1HG2 VAL A  10       4.826  11.611   5.356  1.00  1.090          H  
ATOM    180 2HG2 VAL A  10       5.689  10.170   5.490  1.00  1.090          H  
ATOM    181 3HG2 VAL A  10       5.742  11.315   6.781  1.00  1.090          H  
ATOM    182  N   ALA A  11       7.955  10.399   7.769  1.00  0.940          N  
ATOM    183  CA  ALA A  11       8.181  10.570   9.182  1.00  1.130          C  
ATOM    184  C   ALA A  11       9.669  10.692   9.469  1.00  1.110          C  
ATOM    185  O   ALA A  11      10.071  11.559  10.254  1.00  1.180          O  
ATOM    186  CB  ALA A  11       7.598   9.410   9.933  1.00  1.510          C  
ATOM    187  H   ALA A  11       7.388   9.617   7.429  1.00  1.130          H  
ATOM    188  HA  ALA A  11       7.686  11.485   9.497  1.00  1.360          H  
ATOM    189 1HB  ALA A  11       7.738   9.546  11.002  1.00  1.810          H  
ATOM    190 2HB  ALA A  11       6.542   9.360   9.702  1.00  1.810          H  
ATOM    191 3HB  ALA A  11       8.079   8.485   9.614  1.00  1.810          H  
ATOM    192  N   GLU A  12      10.504   9.886   8.793  1.00  1.060          N  
ATOM    193  CA  GLU A  12      11.936  10.018   9.020  1.00  1.160          C  
ATOM    194  C   GLU A  12      12.455  11.380   8.550  1.00  1.000          C  
ATOM    195  O   GLU A  12      13.219  12.032   9.272  1.00  1.110          O  
ATOM    196  CB  GLU A  12      12.713   8.910   8.302  1.00  1.580          C  
ATOM    197  CG  GLU A  12      12.534   7.512   8.887  1.00  1.580          C  
ATOM    198  CD  GLU A  12      13.328   6.455   8.142  1.00  1.580          C  
ATOM    199  OE1 GLU A  12      13.879   6.768   7.111  1.00  1.580          O  
ATOM    200  OE2 GLU A  12      13.390   5.343   8.613  1.00  1.580          O  
ATOM    201  H   GLU A  12      10.125   9.151   8.182  1.00  1.270          H  
ATOM    202  HA  GLU A  12      12.122   9.934  10.088  1.00  1.390          H  
ATOM    203 1HB  GLU A  12      12.393   8.870   7.257  1.00  1.900          H  
ATOM    204 2HB  GLU A  12      13.777   9.148   8.310  1.00  1.900          H  
ATOM    205 1HG  GLU A  12      12.846   7.521   9.930  1.00  1.900          H  
ATOM    206 2HG  GLU A  12      11.475   7.254   8.853  1.00  1.900          H  
ATOM    207  N   LYS A  13      11.995  11.848   7.378  1.00  0.760          N  
ATOM    208  CA  LYS A  13      12.449  13.137   6.860  1.00  0.650          C  
ATOM    209  C   LYS A  13      12.065  14.286   7.773  1.00  0.650          C  
ATOM    210  O   LYS A  13      12.854  15.204   7.975  1.00  0.690          O  
ATOM    211  CB  LYS A  13      11.879  13.408   5.468  1.00  0.950          C  
ATOM    212  CG  LYS A  13      12.453  12.544   4.359  1.00  0.950          C  
ATOM    213  CD  LYS A  13      11.799  12.865   3.015  1.00  0.950          C  
ATOM    214  CE  LYS A  13      12.354  11.985   1.900  1.00  0.950          C  
ATOM    215  NZ  LYS A  13      11.708  12.276   0.587  1.00  0.950          N  
ATOM    216  H   LYS A  13      11.375  11.252   6.814  1.00  0.910          H  
ATOM    217  HA  LYS A  13      13.537  13.113   6.796  1.00  0.780          H  
ATOM    218 1HB  LYS A  13      10.803  13.258   5.490  1.00  1.140          H  
ATOM    219 2HB  LYS A  13      12.056  14.446   5.204  1.00  1.140          H  
ATOM    220 1HG  LYS A  13      13.527  12.719   4.288  1.00  1.140          H  
ATOM    221 2HG  LYS A  13      12.292  11.495   4.599  1.00  1.140          H  
ATOM    222 1HD  LYS A  13      10.722  12.698   3.091  1.00  1.140          H  
ATOM    223 2HD  LYS A  13      11.971  13.912   2.765  1.00  1.140          H  
ATOM    224 1HE  LYS A  13      13.426  12.155   1.812  1.00  1.140          H  
ATOM    225 2HE  LYS A  13      12.181  10.938   2.154  1.00  1.140          H  
ATOM    226 1HZ  LYS A  13      12.102  11.675  -0.124  1.00  1.140          H  
ATOM    227 2HZ  LYS A  13      10.714  12.110   0.654  1.00  1.140          H  
ATOM    228 3HZ  LYS A  13      11.871  13.241   0.336  1.00  1.140          H  
ATOM    229  N   PHE A  14      10.852  14.243   8.308  1.00  0.710          N  
ATOM    230  CA  PHE A  14      10.324  15.278   9.180  1.00  0.860          C  
ATOM    231  C   PHE A  14      11.097  15.362  10.479  1.00  0.980          C  
ATOM    232  O   PHE A  14      11.370  16.455  10.973  1.00  0.980          O  
ATOM    233  CB  PHE A  14       8.854  15.007   9.461  1.00  1.140          C  
ATOM    234  CG  PHE A  14       7.913  15.434   8.372  1.00  1.140          C  
ATOM    235  CD1 PHE A  14       8.081  15.066   7.040  1.00  1.140          C  
ATOM    236  CD2 PHE A  14       6.835  16.211   8.684  1.00  1.140          C  
ATOM    237  CE1 PHE A  14       7.215  15.476   6.103  1.00  1.140          C  
ATOM    238  CE2 PHE A  14       5.980  16.610   7.734  1.00  1.140          C  
ATOM    239  CZ  PHE A  14       6.175  16.246   6.449  1.00  1.140          C  
ATOM    240  H   PHE A  14      10.256  13.452   8.062  1.00  0.850          H  
ATOM    241  HA  PHE A  14      10.411  16.236   8.668  1.00  1.030          H  
ATOM    242 1HB  PHE A  14       8.737  13.935   9.592  1.00  1.370          H  
ATOM    243 2HB  PHE A  14       8.559  15.483  10.393  1.00  1.370          H  
ATOM    244  HD1 PHE A  14       8.907  14.462   6.725  1.00  1.370          H  
ATOM    245  HD2 PHE A  14       6.671  16.510   9.715  1.00  1.370          H  
ATOM    246  HE1 PHE A  14       7.362  15.194   5.060  1.00  1.370          H  
ATOM    247  HE2 PHE A  14       5.135  17.220   7.990  1.00  1.370          H  
ATOM    248  HZ  PHE A  14       5.490  16.584   5.682  1.00  1.370          H  
ATOM    249  N   LYS A  15      11.433  14.203  11.044  1.00  1.160          N  
ATOM    250  CA  LYS A  15      12.201  14.138  12.277  1.00  1.370          C  
ATOM    251  C   LYS A  15      13.630  14.670  12.098  1.00  1.310          C  
ATOM    252  O   LYS A  15      14.146  15.364  12.975  1.00  1.480          O  
ATOM    253  CB  LYS A  15      12.214  12.703  12.799  1.00  1.830          C  
ATOM    254  CG  LYS A  15      10.857  12.232  13.336  1.00  1.830          C  
ATOM    255  CD  LYS A  15      10.892  10.772  13.772  1.00  1.830          C  
ATOM    256  CE  LYS A  15       9.513  10.291  14.229  1.00  1.830          C  
ATOM    257  NZ  LYS A  15       9.527   8.856  14.643  1.00  1.830          N  
ATOM    258  H   LYS A  15      11.098  13.333  10.616  1.00  1.390          H  
ATOM    259  HA  LYS A  15      11.706  14.769  13.016  1.00  1.640          H  
ATOM    260 1HB  LYS A  15      12.503  12.031  11.986  1.00  2.200          H  
ATOM    261 2HB  LYS A  15      12.956  12.606  13.589  1.00  2.200          H  
ATOM    262 1HG  LYS A  15      10.584  12.850  14.192  1.00  2.200          H  
ATOM    263 2HG  LYS A  15      10.101  12.365  12.573  1.00  2.200          H  
ATOM    264 1HD  LYS A  15      11.217  10.158  12.928  1.00  2.200          H  
ATOM    265 2HD  LYS A  15      11.603  10.649  14.588  1.00  2.200          H  
ATOM    266 1HE  LYS A  15       9.179  10.901  15.066  1.00  2.200          H  
ATOM    267 2HE  LYS A  15       8.810  10.407  13.403  1.00  2.200          H  
ATOM    268 1HZ  LYS A  15       8.590   8.583  14.924  1.00  2.200          H  
ATOM    269 2HZ  LYS A  15       9.820   8.283  13.863  1.00  2.200          H  
ATOM    270 3HZ  LYS A  15      10.165   8.726  15.416  1.00  2.200          H  
ATOM    271  N   GLU A  16      14.274  14.339  10.967  1.00  1.130          N  
ATOM    272  CA  GLU A  16      15.638  14.806  10.694  1.00  1.150          C  
ATOM    273  C   GLU A  16      15.711  16.266  10.216  1.00  0.890          C  
ATOM    274  O   GLU A  16      16.700  16.960  10.465  1.00  0.930          O  
ATOM    275  CB  GLU A  16      16.324  13.909   9.658  1.00  1.600          C  
ATOM    276  CG  GLU A  16      16.648  12.491  10.137  1.00  1.600          C  
ATOM    277  CD  GLU A  16      17.350  11.662   9.081  1.00  1.600          C  
ATOM    278  OE1 GLU A  16      17.394  12.093   7.951  1.00  1.600          O  
ATOM    279  OE2 GLU A  16      17.854  10.611   9.409  1.00  1.600          O  
ATOM    280  H   GLU A  16      13.821  13.706  10.298  1.00  1.360          H  
ATOM    281  HA  GLU A  16      16.202  14.737  11.623  1.00  1.380          H  
ATOM    282 1HB  GLU A  16      15.671  13.817   8.785  1.00  1.920          H  
ATOM    283 2HB  GLU A  16      17.249  14.376   9.328  1.00  1.920          H  
ATOM    284 1HG  GLU A  16      17.281  12.552  11.021  1.00  1.920          H  
ATOM    285 2HG  GLU A  16      15.717  11.999  10.421  1.00  1.920          H  
ATOM    286  N   ALA A  17      14.676  16.721   9.515  1.00  0.740          N  
ATOM    287  CA  ALA A  17      14.596  18.056   8.938  1.00  0.540          C  
ATOM    288  C   ALA A  17      14.662  19.174   9.963  1.00  0.360          C  
ATOM    289  O   ALA A  17      14.156  19.077  11.080  1.00  0.370          O  
ATOM    290  CB  ALA A  17      13.304  18.196   8.161  1.00  0.840          C  
ATOM    291  H   ALA A  17      13.909  16.080   9.308  1.00  0.890          H  
ATOM    292  HA  ALA A  17      15.440  18.180   8.261  1.00  0.650          H  
ATOM    293 1HB  ALA A  17      13.253  19.154   7.723  1.00  1.000          H  
ATOM    294 2HB  ALA A  17      13.277  17.455   7.393  1.00  1.000          H  
ATOM    295 3HB  ALA A  17      12.464  18.061   8.835  1.00  1.000          H  
ATOM    296  N   PHE A  18      15.251  20.283   9.534  1.00  0.400          N  
ATOM    297  CA  PHE A  18      15.314  21.483  10.344  1.00  0.470          C  
ATOM    298  C   PHE A  18      13.869  21.906  10.587  1.00  0.490          C  
ATOM    299  O   PHE A  18      13.039  21.702   9.703  1.00  0.440          O  
ATOM    300  CB  PHE A  18      16.063  22.588   9.602  1.00  0.630          C  
ATOM    301  CG  PHE A  18      17.512  22.325   9.462  1.00  0.630          C  
ATOM    302  CD1 PHE A  18      18.033  21.917   8.242  1.00  0.630          C  
ATOM    303  CD2 PHE A  18      18.370  22.472  10.541  1.00  0.630          C  
ATOM    304  CE1 PHE A  18      19.380  21.665   8.106  1.00  0.630          C  
ATOM    305  CE2 PHE A  18      19.718  22.220  10.405  1.00  0.630          C  
ATOM    306  CZ  PHE A  18      20.222  21.815   9.186  1.00  0.630          C  
ATOM    307  H   PHE A  18      15.685  20.277   8.623  1.00  0.480          H  
ATOM    308  HA  PHE A  18      15.828  21.240  11.267  1.00  0.560          H  
ATOM    309 1HB  PHE A  18      15.651  22.697   8.613  1.00  0.760          H  
ATOM    310 2HB  PHE A  18      15.939  23.540  10.112  1.00  0.760          H  
ATOM    311  HD1 PHE A  18      17.373  21.800   7.383  1.00  0.760          H  
ATOM    312  HD2 PHE A  18      17.974  22.793  11.506  1.00  0.760          H  
ATOM    313  HE1 PHE A  18      19.782  21.346   7.144  1.00  0.760          H  
ATOM    314  HE2 PHE A  18      20.386  22.339  11.259  1.00  0.760          H  
ATOM    315  HZ  PHE A  18      21.287  21.615   9.079  1.00  0.760          H  
ATOM    316  N   PRO A  19      13.521  22.534  11.723  1.00  0.650          N  
ATOM    317  CA  PRO A  19      12.171  22.985  12.057  1.00  0.770          C  
ATOM    318  C   PRO A  19      11.444  23.743  10.939  1.00  0.770          C  
ATOM    319  O   PRO A  19      10.246  23.537  10.754  1.00  0.740          O  
ATOM    320  CB  PRO A  19      12.442  23.900  13.254  1.00  1.160          C  
ATOM    321  CG  PRO A  19      13.668  23.300  13.918  1.00  1.160          C  
ATOM    322  CD  PRO A  19      14.535  22.819  12.776  1.00  1.160          C  
ATOM    323  HA  PRO A  19      11.578  22.111  12.366  1.00  0.920          H  
ATOM    324 1HB  PRO A  19      12.599  24.936  12.908  1.00  1.390          H  
ATOM    325 2HB  PRO A  19      11.566  23.912  13.915  1.00  1.390          H  
ATOM    326 1HG  PRO A  19      14.171  24.054  14.549  1.00  1.390          H  
ATOM    327 2HG  PRO A  19      13.369  22.478  14.589  1.00  1.390          H  
ATOM    328 1HD  PRO A  19      15.244  23.598  12.459  1.00  1.390          H  
ATOM    329 2HD  PRO A  19      15.032  21.902  13.119  1.00  1.390          H  
ATOM    330  N   ASP A  20      12.158  24.529  10.124  1.00  0.860          N  
ATOM    331  CA  ASP A  20      11.484  25.271   9.064  1.00  0.930          C  
ATOM    332  C   ASP A  20      11.236  24.379   7.863  1.00  0.740          C  
ATOM    333  O   ASP A  20      10.277  24.578   7.113  1.00  0.740          O  
ATOM    334  CB  ASP A  20      12.324  26.472   8.652  1.00  1.270          C  
ATOM    335  CG  ASP A  20      12.422  27.503   9.754  1.00  1.270          C  
ATOM    336  OD1 ASP A  20      11.431  28.153  10.053  1.00  1.270          O  
ATOM    337  OD2 ASP A  20      13.475  27.606  10.328  1.00  1.270          O  
ATOM    338  H   ASP A  20      13.146  24.691  10.274  1.00  1.030          H  
ATOM    339  HA  ASP A  20      10.524  25.624   9.438  1.00  1.120          H  
ATOM    340 1HB  ASP A  20      13.327  26.141   8.384  1.00  1.530          H  
ATOM    341 2HB  ASP A  20      11.885  26.939   7.770  1.00  1.530          H  
ATOM    342  N   VAL A  21      12.110  23.404   7.659  1.00  0.620          N  
ATOM    343  CA  VAL A  21      11.986  22.495   6.548  1.00  0.560          C  
ATOM    344  C   VAL A  21      10.795  21.594   6.842  1.00  0.390          C  
ATOM    345  O   VAL A  21       9.944  21.390   5.975  1.00  0.430          O  
ATOM    346  CB  VAL A  21      13.295  21.723   6.344  1.00  0.810          C  
ATOM    347  CG1 VAL A  21      13.110  20.656   5.300  1.00  0.810          C  
ATOM    348  CG2 VAL A  21      14.386  22.696   5.929  1.00  0.810          C  
ATOM    349  H   VAL A  21      12.850  23.239   8.333  1.00  0.740          H  
ATOM    350  HA  VAL A  21      11.778  23.066   5.643  1.00  0.670          H  
ATOM    351  HB  VAL A  21      13.575  21.256   7.268  1.00  0.970          H  
ATOM    352 1HG1 VAL A  21      14.037  20.104   5.165  1.00  0.970          H  
ATOM    353 2HG1 VAL A  21      12.335  19.978   5.621  1.00  0.970          H  
ATOM    354 3HG1 VAL A  21      12.819  21.111   4.354  1.00  0.970          H  
ATOM    355 1HG2 VAL A  21      15.326  22.162   5.793  1.00  0.970          H  
ATOM    356 2HG2 VAL A  21      14.102  23.174   4.992  1.00  0.970          H  
ATOM    357 3HG2 VAL A  21      14.509  23.458   6.693  1.00  0.970          H  
ATOM    358  N   CYS A  22      10.736  21.079   8.079  1.00  0.320          N  
ATOM    359  CA  CYS A  22       9.643  20.224   8.508  1.00  0.380          C  
ATOM    360  C   CYS A  22       8.319  20.974   8.397  1.00  0.370          C  
ATOM    361  O   CYS A  22       7.328  20.416   7.914  1.00  0.410          O  
ATOM    362  CB  CYS A  22       9.837  19.744   9.938  1.00  0.510          C  
ATOM    363  SG  CYS A  22       8.525  18.644  10.495  1.00  0.510          S  
ATOM    364  H   CYS A  22      11.487  21.307   8.735  1.00  0.380          H  
ATOM    365  HA  CYS A  22       9.611  19.353   7.859  1.00  0.460          H  
ATOM    366 1HB  CYS A  22      10.789  19.210  10.025  1.00  0.610          H  
ATOM    367 2HB  CYS A  22       9.881  20.601  10.612  1.00  0.610          H  
ATOM    368  HG  CYS A  22       8.644  17.767   9.495  1.00  0.610          H  
ATOM    369  N   ARG A  23       8.275  22.229   8.871  1.00  0.450          N  
ATOM    370  CA  ARG A  23       7.056  23.009   8.750  1.00  0.520          C  
ATOM    371  C   ARG A  23       6.644  23.201   7.296  1.00  0.430          C  
ATOM    372  O   ARG A  23       5.461  23.058   6.986  1.00  0.390          O  
ATOM    373  CB  ARG A  23       7.187  24.355   9.451  1.00  0.700          C  
ATOM    374  CG  ARG A  23       7.079  24.301  10.993  1.00  0.700          C  
ATOM    375  CD  ARG A  23       6.964  25.672  11.599  1.00  0.700          C  
ATOM    376  NE  ARG A  23       8.247  26.418  11.549  1.00  0.700          N  
ATOM    377  CZ  ARG A  23       9.198  26.398  12.525  1.00  0.700          C  
ATOM    378  NH1 ARG A  23       9.008  25.696  13.632  1.00  0.700          N  
ATOM    379  NH2 ARG A  23      10.317  27.091  12.382  1.00  0.700          N  
ATOM    380  H   ARG A  23       9.091  22.640   9.329  1.00  0.540          H  
ATOM    381  HA  ARG A  23       6.261  22.458   9.253  1.00  0.620          H  
ATOM    382 1HB  ARG A  23       8.154  24.790   9.205  1.00  0.840          H  
ATOM    383 2HB  ARG A  23       6.419  25.032   9.079  1.00  0.840          H  
ATOM    384 1HG  ARG A  23       6.183  23.742  11.260  1.00  0.840          H  
ATOM    385 2HG  ARG A  23       7.940  23.804  11.414  1.00  0.840          H  
ATOM    386 1HD  ARG A  23       6.225  26.241  11.034  1.00  0.840          H  
ATOM    387 2HD  ARG A  23       6.636  25.597  12.630  1.00  0.840          H  
ATOM    388  HE  ARG A  23       8.438  26.977  10.724  1.00  0.840          H  
ATOM    389 1HH1 ARG A  23       8.161  25.164  13.760  1.00  0.840          H  
ATOM    390 2HH1 ARG A  23       9.707  25.699  14.358  1.00  0.840          H  
ATOM    391 1HH2 ARG A  23      10.502  27.640  11.526  1.00  0.840          H  
ATOM    392 2HH2 ARG A  23      11.018  27.087  13.102  1.00  0.840          H  
ATOM    393  N   ASN A  24       7.585  23.489   6.389  1.00  0.520          N  
ATOM    394  CA  ASN A  24       7.184  23.644   5.001  1.00  0.700          C  
ATOM    395  C   ASN A  24       6.675  22.324   4.411  1.00  0.680          C  
ATOM    396  O   ASN A  24       5.681  22.313   3.668  1.00  0.800          O  
ATOM    397  CB  ASN A  24       8.320  24.211   4.176  1.00  0.910          C  
ATOM    398  CG  ASN A  24       8.556  25.682   4.451  1.00  0.910          C  
ATOM    399  OD1 ASN A  24       7.696  26.384   5.002  1.00  0.910          O  
ATOM    400  ND2 ASN A  24       9.707  26.169   4.063  1.00  0.910          N  
ATOM    401  H   ASN A  24       8.557  23.661   6.670  1.00  0.620          H  
ATOM    402  HA  ASN A  24       6.357  24.349   4.962  1.00  0.840          H  
ATOM    403 1HB  ASN A  24       9.236  23.661   4.412  1.00  1.090          H  
ATOM    404 2HB  ASN A  24       8.114  24.072   3.117  1.00  1.090          H  
ATOM    405 1HD2 ASN A  24       9.917  27.134   4.214  1.00  1.090          H  
ATOM    406 2HD2 ASN A  24      10.378  25.577   3.621  1.00  1.090          H  
ATOM    407  N   PHE A  25       7.308  21.197   4.786  1.00  0.620          N  
ATOM    408  CA  PHE A  25       6.878  19.906   4.276  1.00  0.770          C  
ATOM    409  C   PHE A  25       5.429  19.647   4.684  1.00  0.670          C  
ATOM    410  O   PHE A  25       4.621  19.174   3.874  1.00  0.860          O  
ATOM    411  CB  PHE A  25       7.663  18.745   4.894  1.00  1.020          C  
ATOM    412  CG  PHE A  25       9.112  18.462   4.569  1.00  1.020          C  
ATOM    413  CD1 PHE A  25       9.738  18.852   3.406  1.00  1.020          C  
ATOM    414  CD2 PHE A  25       9.842  17.706   5.494  1.00  1.020          C  
ATOM    415  CE1 PHE A  25      11.058  18.488   3.182  1.00  1.020          C  
ATOM    416  CE2 PHE A  25      11.124  17.344   5.276  1.00  1.020          C  
ATOM    417  CZ  PHE A  25      11.746  17.726   4.118  1.00  1.020          C  
ATOM    418  H   PHE A  25       8.144  21.254   5.377  1.00  0.740          H  
ATOM    419  HA  PHE A  25       6.950  19.901   3.190  1.00  0.920          H  
ATOM    420 1HB  PHE A  25       7.580  18.806   5.975  1.00  1.220          H  
ATOM    421 2HB  PHE A  25       7.137  17.874   4.587  1.00  1.220          H  
ATOM    422  HD1 PHE A  25       9.198  19.437   2.663  1.00  1.220          H  
ATOM    423  HD2 PHE A  25       9.355  17.395   6.409  1.00  1.220          H  
ATOM    424  HE1 PHE A  25      11.556  18.794   2.262  1.00  1.220          H  
ATOM    425  HE2 PHE A  25      11.653  16.747   6.016  1.00  1.220          H  
ATOM    426  HZ  PHE A  25      12.779  17.438   3.935  1.00  1.220          H  
ATOM    427  N   MET A  26       5.122  19.938   5.958  1.00  0.460          N  
ATOM    428  CA  MET A  26       3.799  19.722   6.515  1.00  0.470          C  
ATOM    429  C   MET A  26       2.761  20.678   5.940  1.00  0.380          C  
ATOM    430  O   MET A  26       1.648  20.269   5.607  1.00  0.470          O  
ATOM    431  CB  MET A  26       3.848  19.832   8.036  1.00  0.650          C  
ATOM    432  CG  MET A  26       2.567  19.364   8.719  1.00  0.650          C  
ATOM    433  SD  MET A  26       2.673  19.237  10.499  1.00  0.650          S  
ATOM    434  CE  MET A  26       3.656  17.752  10.685  1.00  0.650          C  
ATOM    435  H   MET A  26       5.867  20.282   6.576  1.00  0.550          H  
ATOM    436  HA  MET A  26       3.489  18.713   6.260  1.00  0.560          H  
ATOM    437 1HB  MET A  26       4.708  19.314   8.418  1.00  0.780          H  
ATOM    438 2HB  MET A  26       3.987  20.885   8.299  1.00  0.780          H  
ATOM    439 1HG  MET A  26       1.775  20.070   8.487  1.00  0.780          H  
ATOM    440 2HG  MET A  26       2.291  18.395   8.328  1.00  0.780          H  
ATOM    441 1HE  MET A  26       3.788  17.545  11.746  1.00  0.780          H  
ATOM    442 2HE  MET A  26       3.146  16.909  10.210  1.00  0.780          H  
ATOM    443 3HE  MET A  26       4.630  17.891  10.233  1.00  0.780          H  
ATOM    444  N   ARG A  27       3.116  21.944   5.727  1.00  0.370          N  
ATOM    445  CA  ARG A  27       2.138  22.871   5.175  1.00  0.530          C  
ATOM    446  C   ARG A  27       1.586  22.350   3.852  1.00  0.580          C  
ATOM    447  O   ARG A  27       0.397  22.513   3.570  1.00  0.710          O  
ATOM    448  CB  ARG A  27       2.742  24.251   4.986  1.00  0.680          C  
ATOM    449  CG  ARG A  27       2.970  25.030   6.276  1.00  0.680          C  
ATOM    450  CD  ARG A  27       3.715  26.277   6.037  1.00  0.680          C  
ATOM    451  NE  ARG A  27       3.930  27.024   7.266  1.00  0.680          N  
ATOM    452  CZ  ARG A  27       4.778  28.064   7.397  1.00  0.680          C  
ATOM    453  NH1 ARG A  27       5.494  28.473   6.367  1.00  0.680          N  
ATOM    454  NH2 ARG A  27       4.889  28.677   8.567  1.00  0.680          N  
ATOM    455  H   ARG A  27       4.041  22.279   6.013  1.00  0.440          H  
ATOM    456  HA  ARG A  27       1.314  22.956   5.883  1.00  0.640          H  
ATOM    457 1HB  ARG A  27       3.710  24.149   4.493  1.00  0.810          H  
ATOM    458 2HB  ARG A  27       2.102  24.845   4.338  1.00  0.810          H  
ATOM    459 1HG  ARG A  27       2.003  25.300   6.696  1.00  0.810          H  
ATOM    460 2HG  ARG A  27       3.506  24.433   6.993  1.00  0.810          H  
ATOM    461 1HD  ARG A  27       4.688  26.026   5.613  1.00  0.810          H  
ATOM    462 2HD  ARG A  27       3.161  26.906   5.341  1.00  0.810          H  
ATOM    463  HE  ARG A  27       3.397  26.746   8.081  1.00  0.810          H  
ATOM    464 1HH1 ARG A  27       5.408  28.009   5.472  1.00  0.810          H  
ATOM    465 2HH1 ARG A  27       6.129  29.251   6.465  1.00  0.810          H  
ATOM    466 1HH2 ARG A  27       4.338  28.367   9.356  1.00  0.810          H  
ATOM    467 2HH2 ARG A  27       5.521  29.458   8.672  1.00  0.810          H  
ATOM    468  N   ARG A  28       2.438  21.718   3.042  1.00  0.560          N  
ATOM    469  CA  ARG A  28       1.963  21.160   1.790  1.00  0.710          C  
ATOM    470  C   ARG A  28       1.306  19.765   1.908  1.00  0.620          C  
ATOM    471  O   ARG A  28       0.315  19.501   1.217  1.00  0.700          O  
ATOM    472  CB  ARG A  28       3.094  21.089   0.775  1.00  0.930          C  
ATOM    473  CG  ARG A  28       2.733  20.389  -0.545  1.00  0.930          C  
ATOM    474  CD  ARG A  28       1.692  21.083  -1.333  1.00  0.930          C  
ATOM    475  NE  ARG A  28       1.334  20.307  -2.506  1.00  0.930          N  
ATOM    476  CZ  ARG A  28       0.440  19.281  -2.515  1.00  0.930          C  
ATOM    477  NH1 ARG A  28      -0.185  18.910  -1.405  1.00  0.930          N  
ATOM    478  NH2 ARG A  28       0.190  18.643  -3.651  1.00  0.930          N  
ATOM    479  H   ARG A  28       3.432  21.676   3.302  1.00  0.670          H  
ATOM    480  HA  ARG A  28       1.215  21.848   1.404  1.00  0.850          H  
ATOM    481 1HB  ARG A  28       3.440  22.093   0.543  1.00  1.120          H  
ATOM    482 2HB  ARG A  28       3.934  20.547   1.219  1.00  1.120          H  
ATOM    483 1HG  ARG A  28       3.625  20.333  -1.164  1.00  1.120          H  
ATOM    484 2HG  ARG A  28       2.389  19.390  -0.348  1.00  1.120          H  
ATOM    485 1HD  ARG A  28       0.795  21.249  -0.750  1.00  1.120          H  
ATOM    486 2HD  ARG A  28       2.081  22.043  -1.669  1.00  1.120          H  
ATOM    487  HE  ARG A  28       1.782  20.547  -3.380  1.00  1.120          H  
ATOM    488 1HH1 ARG A  28      -0.002  19.387  -0.506  1.00  1.120          H  
ATOM    489 2HH1 ARG A  28      -0.844  18.149  -1.422  1.00  1.120          H  
ATOM    490 1HH2 ARG A  28       0.663  18.919  -4.501  1.00  1.120          H  
ATOM    491 2HH2 ARG A  28      -0.470  17.881  -3.668  1.00  1.120          H  
ATOM    492  N   TYR A  29       1.859  18.857   2.729  1.00  0.530          N  
ATOM    493  CA  TYR A  29       1.341  17.485   2.773  1.00  0.570          C  
ATOM    494  C   TYR A  29       0.736  16.973   4.105  1.00  0.590          C  
ATOM    495  O   TYR A  29       0.500  15.757   4.221  1.00  0.840          O  
ATOM    496  CB  TYR A  29       2.455  16.531   2.365  1.00  0.780          C  
ATOM    497  CG  TYR A  29       3.037  16.758   1.010  1.00  0.780          C  
ATOM    498  CD1 TYR A  29       4.279  17.356   0.906  1.00  0.780          C  
ATOM    499  CD2 TYR A  29       2.352  16.369  -0.128  1.00  0.780          C  
ATOM    500  CE1 TYR A  29       4.843  17.563  -0.330  1.00  0.780          C  
ATOM    501  CE2 TYR A  29       2.916  16.578  -1.373  1.00  0.780          C  
ATOM    502  CZ  TYR A  29       4.159  17.171  -1.475  1.00  0.780          C  
ATOM    503  OH  TYR A  29       4.733  17.376  -2.712  1.00  0.780          O  
ATOM    504  H   TYR A  29       2.688  19.094   3.284  1.00  0.640          H  
ATOM    505  HA  TYR A  29       0.549  17.415   2.031  1.00  0.680          H  
ATOM    506 1HB  TYR A  29       3.260  16.611   3.088  1.00  0.940          H  
ATOM    507 2HB  TYR A  29       2.075  15.518   2.385  1.00  0.940          H  
ATOM    508  HD1 TYR A  29       4.814  17.663   1.807  1.00  0.940          H  
ATOM    509  HD2 TYR A  29       1.373  15.899  -0.045  1.00  0.940          H  
ATOM    510  HE1 TYR A  29       5.822  18.032  -0.407  1.00  0.940          H  
ATOM    511  HE2 TYR A  29       2.382  16.275  -2.272  1.00  0.940          H  
ATOM    512  HH  TYR A  29       5.609  17.754  -2.602  1.00  0.940          H  
ATOM    513  N   GLN A  30       0.449  17.862   5.077  1.00  0.490          N  
ATOM    514  CA  GLN A  30      -0.044  17.515   6.423  1.00  0.670          C  
ATOM    515  C   GLN A  30      -1.083  16.420   6.525  1.00  0.640          C  
ATOM    516  O   GLN A  30      -0.961  15.551   7.388  1.00  0.810          O  
ATOM    517  CB  GLN A  30      -0.653  18.732   7.106  1.00  0.870          C  
ATOM    518  CG  GLN A  30      -1.084  18.489   8.537  1.00  0.870          C  
ATOM    519  CD  GLN A  30      -1.538  19.751   9.170  1.00  0.870          C  
ATOM    520  OE1 GLN A  30      -1.578  20.796   8.513  1.00  0.870          O  
ATOM    521  NE2 GLN A  30      -1.885  19.683  10.446  1.00  0.870          N  
ATOM    522  H   GLN A  30       0.676  18.848   4.934  1.00  0.590          H  
ATOM    523  HA  GLN A  30       0.805  17.227   7.020  1.00  0.800          H  
ATOM    524 1HB  GLN A  30       0.032  19.543   7.113  1.00  1.040          H  
ATOM    525 2HB  GLN A  30      -1.527  19.060   6.546  1.00  1.040          H  
ATOM    526 1HG  GLN A  30      -1.916  17.787   8.563  1.00  1.040          H  
ATOM    527 2HG  GLN A  30      -0.244  18.093   9.107  1.00  1.040          H  
ATOM    528 1HE2 GLN A  30      -2.198  20.506  10.924  1.00  1.040          H  
ATOM    529 2HE2 GLN A  30      -1.837  18.811  10.937  1.00  1.040          H  
ATOM    530  N   SER A  31      -2.079  16.408   5.640  1.00  0.700          N  
ATOM    531  CA  SER A  31      -3.177  15.442   5.742  1.00  0.920          C  
ATOM    532  C   SER A  31      -2.731  13.979   5.661  1.00  0.990          C  
ATOM    533  O   SER A  31      -3.457  13.074   6.092  1.00  1.220          O  
ATOM    534  CB  SER A  31      -4.195  15.716   4.654  1.00  1.200          C  
ATOM    535  OG  SER A  31      -3.656  15.468   3.381  1.00  1.200          O  
ATOM    536  H   SER A  31      -2.109  17.108   4.910  1.00  0.840          H  
ATOM    537  HA  SER A  31      -3.661  15.590   6.708  1.00  1.100          H  
ATOM    538 1HB  SER A  31      -5.069  15.085   4.810  1.00  1.440          H  
ATOM    539 2HB  SER A  31      -4.522  16.752   4.717  1.00  1.440          H  
ATOM    540  HG  SER A  31      -4.377  15.601   2.757  1.00  1.440          H  
ATOM    541  N   ARG A  32      -1.547  13.741   5.112  1.00  0.910          N  
ATOM    542  CA  ARG A  32      -1.009  12.401   4.994  1.00  1.040          C  
ATOM    543  C   ARG A  32       0.275  12.227   5.788  1.00  1.030          C  
ATOM    544  O   ARG A  32       0.463  11.223   6.465  1.00  1.280          O  
ATOM    545  CB  ARG A  32      -0.766  12.058   3.529  1.00  1.400          C  
ATOM    546  CG  ARG A  32      -2.019  11.916   2.653  1.00  1.400          C  
ATOM    547  CD  ARG A  32      -2.797  10.682   2.982  1.00  1.400          C  
ATOM    548  NE  ARG A  32      -3.923  10.493   2.090  1.00  1.400          N  
ATOM    549  CZ  ARG A  32      -4.732   9.409   2.075  1.00  1.400          C  
ATOM    550  NH1 ARG A  32      -4.526   8.393   2.897  1.00  1.400          N  
ATOM    551  NH2 ARG A  32      -5.740   9.365   1.217  1.00  1.400          N  
ATOM    552  H   ARG A  32      -0.998  14.539   4.788  1.00  1.090          H  
ATOM    553  HA  ARG A  32      -1.736  11.705   5.401  1.00  1.250          H  
ATOM    554 1HB  ARG A  32      -0.161  12.849   3.085  1.00  1.680          H  
ATOM    555 2HB  ARG A  32      -0.202  11.138   3.450  1.00  1.680          H  
ATOM    556 1HG  ARG A  32      -2.668  12.778   2.809  1.00  1.680          H  
ATOM    557 2HG  ARG A  32      -1.726  11.866   1.607  1.00  1.680          H  
ATOM    558 1HD  ARG A  32      -2.150   9.817   2.906  1.00  1.680          H  
ATOM    559 2HD  ARG A  32      -3.189  10.753   3.994  1.00  1.680          H  
ATOM    560  HE  ARG A  32      -4.128  11.240   1.440  1.00  1.680          H  
ATOM    561 1HH1 ARG A  32      -3.750   8.397   3.558  1.00  1.680          H  
ATOM    562 2HH1 ARG A  32      -5.137   7.592   2.865  1.00  1.680          H  
ATOM    563 1HH2 ARG A  32      -5.899  10.136   0.585  1.00  1.680          H  
ATOM    564 2HH2 ARG A  32      -6.348   8.560   1.191  1.00  1.680          H  
ATOM    565  N   VAL A  33       1.158  13.209   5.773  1.00  0.870          N  
ATOM    566  CA  VAL A  33       2.438  13.001   6.451  1.00  0.990          C  
ATOM    567  C   VAL A  33       2.286  12.843   7.958  1.00  1.230          C  
ATOM    568  O   VAL A  33       3.025  12.085   8.589  1.00  1.460          O  
ATOM    569  CB  VAL A  33       3.415  14.158   6.152  1.00  1.340          C  
ATOM    570  CG1 VAL A  33       3.651  14.230   4.673  1.00  1.340          C  
ATOM    571  CG2 VAL A  33       2.842  15.456   6.650  1.00  1.340          C  
ATOM    572  H   VAL A  33       0.961  14.056   5.237  1.00  1.040          H  
ATOM    573  HA  VAL A  33       2.858  12.080   6.066  1.00  1.190          H  
ATOM    574  HB  VAL A  33       4.376  13.967   6.628  1.00  1.610          H  
ATOM    575 1HG1 VAL A  33       4.338  15.031   4.442  1.00  1.610          H  
ATOM    576 2HG1 VAL A  33       4.061  13.321   4.320  1.00  1.610          H  
ATOM    577 3HG1 VAL A  33       2.718  14.400   4.189  1.00  1.610          H  
ATOM    578 1HG2 VAL A  33       3.469  16.275   6.412  1.00  1.610          H  
ATOM    579 2HG2 VAL A  33       1.929  15.582   6.168  1.00  1.610          H  
ATOM    580 3HG2 VAL A  33       2.694  15.450   7.717  1.00  1.610          H  
ATOM    581  N   ILE A  34       1.286  13.507   8.537  1.00  1.270          N  
ATOM    582  CA  ILE A  34       1.064  13.451   9.964  1.00  1.680          C  
ATOM    583  C   ILE A  34       0.749  12.034  10.442  1.00  1.990          C  
ATOM    584  O   ILE A  34       0.965  11.707  11.604  1.00  2.360          O  
ATOM    585  CB  ILE A  34      -0.090  14.412  10.346  1.00  2.190          C  
ATOM    586  CG1 ILE A  34      -0.112  14.731  11.879  1.00  2.190          C  
ATOM    587  CG2 ILE A  34      -1.463  13.817   9.911  1.00  2.190          C  
ATOM    588  CD1 ILE A  34       1.086  15.538  12.388  1.00  2.190          C  
ATOM    589  H   ILE A  34       0.672  14.113   7.980  1.00  1.520          H  
ATOM    590  HA  ILE A  34       1.979  13.772  10.445  1.00  2.020          H  
ATOM    591  HB  ILE A  34       0.059  15.353   9.815  1.00  2.630          H  
ATOM    592 1HG1 ILE A  34      -1.014  15.299  12.090  1.00  2.630          H  
ATOM    593 2HG1 ILE A  34      -0.153  13.798  12.441  1.00  2.630          H  
ATOM    594 1HG2 ILE A  34      -2.251  14.530  10.144  1.00  2.630          H  
ATOM    595 2HG2 ILE A  34      -1.464  13.624   8.839  1.00  2.630          H  
ATOM    596 3HG2 ILE A  34      -1.664  12.889  10.439  1.00  2.630          H  
ATOM    597 1HD1 ILE A  34       0.967  15.720  13.456  1.00  2.630          H  
ATOM    598 2HD1 ILE A  34       2.006  14.999  12.234  1.00  2.630          H  
ATOM    599 3HD1 ILE A  34       1.128  16.491  11.864  1.00  2.630          H  
ATOM    600  N   GLN A  35       0.247  11.182   9.551  1.00  1.940          N  
ATOM    601  CA  GLN A  35      -0.182   9.850   9.923  1.00  2.350          C  
ATOM    602  C   GLN A  35       0.947   8.965  10.436  1.00  2.510          C  
ATOM    603  O   GLN A  35       0.699   8.054  11.226  1.00  2.840          O  
ATOM    604  CB  GLN A  35      -0.849   9.172   8.733  1.00  3.130          C  
ATOM    605  CG  GLN A  35      -2.122   9.868   8.227  1.00  3.130          C  
ATOM    606  CD  GLN A  35      -3.184  10.012   9.265  1.00  3.130          C  
ATOM    607  OE1 GLN A  35      -3.383   9.126  10.099  1.00  3.130          O  
ATOM    608  NE2 GLN A  35      -3.897  11.134   9.222  1.00  3.130          N  
ATOM    609  H   GLN A  35       0.185  11.460   8.571  1.00  2.330          H  
ATOM    610  HA  GLN A  35      -0.911   9.945  10.726  1.00  2.820          H  
ATOM    611 1HB  GLN A  35      -0.145   9.150   7.921  1.00  3.750          H  
ATOM    612 2HB  GLN A  35      -1.093   8.142   8.984  1.00  3.750          H  
ATOM    613 1HG  GLN A  35      -1.857  10.868   7.884  1.00  3.750          H  
ATOM    614 2HG  GLN A  35      -2.531   9.294   7.398  1.00  3.750          H  
ATOM    615 1HE2 GLN A  35      -4.630  11.289   9.885  1.00  3.750          H  
ATOM    616 2HE2 GLN A  35      -3.716  11.825   8.507  1.00  3.750          H  
ATOM    617  N   GLY A  36       2.181   9.179   9.970  1.00  2.290          N  
ATOM    618  CA  GLY A  36       3.289   8.344  10.419  1.00  2.440          C  
ATOM    619  C   GLY A  36       4.235   9.082  11.363  1.00  2.670          C  
ATOM    620  O   GLY A  36       5.306   8.563  11.684  1.00  2.830          O  
ATOM    621  H   GLY A  36       2.381   9.951   9.323  1.00  2.750          H  
ATOM    622 1HA  GLY A  36       2.906   7.452  10.910  1.00  2.930          H  
ATOM    623 2HA  GLY A  36       3.858   8.009   9.553  1.00  2.930          H  
ATOM    624  N   LEU A  37       3.863  10.292  11.786  1.00  2.750          N  
ATOM    625  CA  LEU A  37       4.780  11.108  12.566  1.00  3.100          C  
ATOM    626  C   LEU A  37       4.413  11.158  14.048  1.00  3.670          C  
ATOM    627  O   LEU A  37       4.871  10.324  14.832  1.00  3.570          O  
ATOM    628  OXT LEU A  37       3.838  12.151  14.491  1.00  4.650          O  
ATOM    629  CB  LEU A  37       4.789  12.513  11.942  1.00  3.980          C  
ATOM    630  CG  LEU A  37       5.715  13.595  12.536  1.00  3.980          C  
ATOM    631  CD1 LEU A  37       7.198  13.213  12.297  1.00  3.980          C  
ATOM    632  CD2 LEU A  37       5.377  14.906  11.854  1.00  3.980          C  
ATOM    633  H   LEU A  37       2.932  10.658  11.568  1.00  3.300          H  
ATOM    634  HA  LEU A  37       5.772  10.677  12.475  1.00  3.720          H  
ATOM    635 1HB  LEU A  37       5.035  12.410  10.883  1.00  4.770          H  
ATOM    636 2HB  LEU A  37       3.770  12.897  12.003  1.00  4.770          H  
ATOM    637  HG  LEU A  37       5.553  13.686  13.611  1.00  4.770          H  
ATOM    638 1HD1 LEU A  37       7.848  13.989  12.705  1.00  4.770          H  
ATOM    639 2HD1 LEU A  37       7.416  12.275  12.789  1.00  4.770          H  
ATOM    640 3HD1 LEU A  37       7.376  13.111  11.240  1.00  4.770          H  
ATOM    641 1HD2 LEU A  37       6.012  15.704  12.243  1.00  4.770          H  
ATOM    642 2HD2 LEU A  37       5.531  14.798  10.787  1.00  4.770          H  
ATOM    643 3HD2 LEU A  37       4.339  15.142  12.046  1.00  4.770          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 -205.727 22.0799 155.196 -15.9925 3.84632 10.9685 80.1552 -86.732 -0.34683 -2.1547 -69.9464 -7.78497 -34.2224 0 0 -3.06842 0 0.2079 3.01387 23.7047 41.9982 -3.05101 0.63366 -1.53515 -4.52143 20.5105 -72.7677
ASP:NtermProteinFull_1 -1.47062 0.04151 2.05976 -0.12506 0.02762 0.42663 1.02815 -0.99817 -0.04631 -0.15814 -0.79887 -1.00834 0 0 0 0 0 0.01216 0.08356 0 2.24349 0 0 -2.3716 0 0.09806 -0.95617
TRP_2 -5.1351 0.37999 2.9567 -1.55605 0.16813 0.80466 1.54636 -1.92866 -0.00411 -0.02854 -1.29736 -0.14156 0 0 0 0 0 0.07331 0.3685 0 2.13257 -0.37042 0 1.6906 0.10044 0.56725 0.32671
PHE_3 -7.19685 0.51239 4.44498 -0.6714 0.14751 0.30849 1.92803 -2.68069 -0.04619 -0.15679 -0.89526 -0.02025 0 0 0 0 0 0.04459 0.02993 0 2.743 0.01683 0 1.0402 -0.01221 0.87058 0.4069
LYS_4 -4.98461 0.63309 7.11919 -0.75367 0.13413 0.72696 3.23003 -3.1197 -0.00418 -0.03351 -4.80932 -0.05437 0 0 0 -0.76343 0 -0.0312 0.28947 2.96245 0 0.0306 0 -1.5107 -0.25235 0.7946 -0.39652
ALA_5 -4.28106 0.21015 4.44812 -0.02161 0 0 2.3722 -2.39028 -0 -0 -1.96566 -0.3663 0 0 0 0 0 0.0679 0 0 0 -0.26896 0 1.8394 -0.33694 0.46617 -0.22687
PHE_6 -9.25147 1.15852 4.18303 -0.82035 0.03552 0.22821 3.10404 -3.08228 -0.00912 -0.05424 -2.88566 -0.0784 0 0 0 0 0 0.04794 0.00229 0 1.74418 -0.43188 0 1.0402 -0.12836 0.25471 -4.94311
TYR_7 -10.3572 0.83543 6.17434 -0.53563 0.13578 0.24895 3.77544 -3.781 -0.01594 -0.15663 -2.51127 -0.3406 0 0 0 -0.4536 0 -0.0379 0.16021 0 3.39003 -0.17213 0.01902 1.2797 -0.00142 0.55622 -1.78815
ASP_8 -4.87799 0.47554 7.71939 -0.10619 0.00749 0.32232 3.63644 -3.35401 -0 -0 -6.25099 -0.21029 0 0 0 -0.76343 0 -0.01657 0.00119 0 1.86929 0.12736 0 -2.3716 -0.10971 0.56184 -3.33994
LYS_9 -4.72329 0.19131 5.36579 -0.30476 0.02857 0.13689 2.46738 -2.50534 -0.01703 -0.17281 -2.33665 -0.01478 0 0 0 0 0 -0.02482 0.01425 1.75763 0 -0.01436 0 -1.5107 -0.24956 0.28746 -1.62482
VAL_10 -8.22495 1.70989 3.74203 -0.2685 0.13839 0.04363 3.33283 -3.0904 -0.00813 -0.05208 -2.68181 0.34848 0 0 0 0 0 -0.04488 5e-05 0.89739 0 -0.12384 0 1.9342 -0.26622 0.69391 -1.92003
ALA_11 -5.85595 0.67192 4.35067 -0.02144 0 0 2.69182 -2.83491 -0.00899 -0.0529 -2.47315 -0.37818 0 0 0 0 0 0.06812 0 0 0 -0.30124 0 1.8394 -0.2635 0.79939 -1.76894
GLU_12 -4.36412 0.24604 5.47827 -0.20763 0.02223 0.27481 2.31938 -2.49067 -0.01285 -0.1393 -1.54432 -0.56193 0 0 0 0 0 -0.01445 0.0269 0 3.04338 -0.19038 0 -2.7348 -0.40648 0.34307 -0.91284
LYS_13 -5.44135 0.3909 5.02587 -0.30588 0.02524 0.1362 2.53766 -2.53504 -0 -0 -2.02638 -0.00305 0 0 0 0 0 -0.04267 0.00353 1.73677 0 -0.00064 0 -1.5107 -0.41412 0.22679 -2.19688
PHE_14 -11.0174 1.83465 2.34501 -0.5802 0.33689 0.2434 2.16197 -2.58588 -0.00106 -0.00401 -1.18531 -0.0727 0 0 0 0 0 0.05469 0.12518 0 4.17369 -0.01715 0 1.0402 -0.30225 0.36238 -3.08786
LYS_15 -3.98365 0.18187 4.00639 -0.30604 0.03268 0.14221 1.45658 -1.88028 -0.02663 -0.17549 -0.91746 -0.01227 0 0 0 0 0 0.01745 0.05132 1.77446 0 -0.01685 0 -1.5107 -0.27524 0.3943 -1.04734
GLU_16 -2.47733 0.05159 3.20175 -0.21476 0.02306 0.29896 1.15389 -1.46884 -0 -0 -0.71368 -0.56734 0 0 0 0 0 -0.05057 0.01952 0 3.04912 -0.26983 0 -2.7348 -0.34397 0.27699 -0.76626
ALA_17 -4.30174 0.55219 2.00589 -0.02514 0 0 1.66277 -1.76177 -0.00106 -0.00401 -0.47696 -0.18022 0 0 0 0 0 0.01285 0 0 0 -0.1698 0 1.8394 -0.59593 0.36974 -1.07379
PHE_18 -3.77895 0.53187 3.61836 -0.60639 0.03187 0.28821 2.32659 -1.81665 -0.00833 -0.06166 -1.80035 0.17707 0 0 0 0 0 -0.0055 0.01312 0 2.35813 0.228 0 1.0402 -0.5172 1.02396 3.04233
PRO_19 -3.86763 0.42001 3.57085 -0.0655 0 0.04143 1.36157 -1.60309 -0 -0 -1.12278 0.59659 0 0 0 0 0 -0.16727 0.03495 0.16456 0 -0.67204 0 -2.4119 0.15419 1.21088 -2.3552
ASP_20 -4.30832 0.22699 5.45697 -0.11627 0.00084 0.35052 1.74455 -2.51814 -0.00295 -0.01846 -2.63889 -0.75157 0 0 0 -0.31718 0 0.00959 0 0 2.59963 -0.30751 0 -2.3716 0.06037 0.50836 -2.39306
VAL_21 -6.16078 0.58511 3.79725 -0.29964 0.17432 0.06446 2.56294 -2.50498 -0 -0 -1.35842 -0.16891 0 0 0 0 0 -0.01056 0.00159 0.12499 0 -0.38951 0 1.9342 -0.173 0.31267 -1.50829
CYS_22 -6.92081 0.3767 4.7529 -0.0721 0.00313 0.06748 2.57888 -2.6433 -0 -0 -2.40608 -0.49161 0 0 0 0 0 0.09378 0.00559 0.8187 0 0.26137 0 3.6196 0.28784 0.32883 0.66091
ARG_23 -6.76163 0.42187 8.05609 -0.69065 0.11778 0.43462 2.90987 -3.62649 -0.01128 -0.08013 -3.90456 0.32728 0 0 0 -0.31718 0 0.03277 0.51885 1.44397 0 -0.08994 0 -1.2888 0.09924 0.42874 -1.97957
ASN_24 -4.73928 0.19618 5.65075 -0.17379 0.03607 0.2595 2.47311 -2.69878 -0 -0 -2.01656 -0.29193 0 0 0 0 0 0.00316 0.0003 0 1.43236 0.37096 0 -0.93687 -0.14756 0.44376 -0.13861
PHE_25 -8.20533 1.01219 3.79523 -0.46703 0.062 0.16931 2.65556 -2.78638 -0 -0 -2.54009 -0.19223 0 0 0 0 0 -0.03198 0.02746 0 3.30746 -0.20253 0 1.0402 -0.03441 1.04993 -1.34064
MET_26 -7.93161 0.9125 4.93711 -0.44009 0.12145 0.14378 2.5289 -2.78114 -0.0079 -0.07188 -2.0573 -0.18505 0 0 0 0 0 0.00681 0.20323 2.14318 0 0.04694 0 0.60916 -0.07225 1.16745 -0.72672
ARG_27 -3.90837 0.25681 4.52038 -0.44963 0.05838 0.22542 1.66716 -1.97791 -0 -0 -1.55026 0.34779 0 0 0 0 0 0.0625 0.14935 2.09574 0 -0.19031 0 -1.2888 -0.20372 0.37108 0.18561
ARG_28 -4.24469 0.37649 3.32993 -1.72787 0.53032 1.959 1.07251 -1.68769 -0 -0 -0.63169 -2.05037 0 0 0 0 0 0.00339 0.09616 3.28747 0 -0.11115 0 -1.2888 -0.17355 0.45809 -0.80244
TYR_29 -6.7897 0.73099 4.62853 -0.65243 0.06626 0.38758 2.82765 -2.64346 -0.0091 -0.07408 -3.27135 -0.16983 0 0 0 0 0 0.07745 0.05417 0 2.04444 -0.24199 0.00495 1.2797 -0.06421 0.93211 -0.88233
GLN_30 -5.44858 1.05223 4.90154 -0.43156 0.14553 0.29956 2.64954 -2.35871 -0.0079 -0.07188 -2.11624 -0.66305 0 0 0 0 0 -0.03708 0.07986 0 2.98616 0.04574 0 -0.18838 0.32319 1.06734 2.22731
SER_31 -2.27191 0.13625 2.52857 -0.0289 0.00022 0.04637 0.74795 -1.18176 -0 -0 -0.61214 -0.94929 0 0 0 0 0 -0.08627 0.00351 0.16441 0 -0.23274 0.6097 -0.77834 0.12579 0.54633 -1.23227
ARG_32 -7.37296 0.74226 5.38221 -0.61788 0.2026 0.34524 2.73217 -2.8216 -0.02915 -0.1313 -1.60374 0.19648 0 0 0 -0.4536 0 -0.01062 0.30198 1.9756 0 -0.12826 0 -1.2888 -0.00682 0.30298 -2.2832
VAL_33 -8.18392 2.10242 2.13739 -0.2759 0.22934 0.04517 1.9632 -2.46334 -0.01183 -0.12809 -1.08079 0.43696 0 0 0 0 0 -0.06332 0.01056 0.76344 0 0.11891 0 1.9342 0.14765 0.53863 -1.77928
ILE_34 -5.49478 0.67031 3.1716 -0.70195 0.46523 0.249 1.69043 -2.07251 -0.0091 -0.07408 -0.99998 0.22278 0 0 0 0 0 0.15773 0.04333 0.90125 0 0.31553 0 0.73287 -0.28352 0.60954 -0.40634
GLN_35 -4.43423 0.50077 3.03904 -0.64437 0.09972 0.70917 1.61855 -1.61841 -0 -0 -1.22378 -0.28235 0 0 0 0 0 -0.06459 0.18093 0 2.88123 -0.25235 0 -0.18838 -0.36897 0.47495 0.42694
GLY_36 -2.2893 0.39887 2.09916 -7e-05 0 0 0.62468 -1.20708 -0.02915 -0.1313 -0.81064 -0.35746 0 0 0 0 0 0.10196 0 0 0 0.55254 0 0.83697 -0.02232 0.28854 0.05539
LEU:CtermProteinFull_37 -4.66975 0.35215 1.19546 -0.70612 0.238 0.54036 1.01435 -1.23269 -0.0185 -0.12341 -0.43066 0.12584 0 0 0 0 0 0 0.11301 0.69274 0 0 0 0.18072 0.20566 0.52287 -1.99996
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691858 DOMAINID 682972 MODEL 4 pep5_AB
MODEL     4
REMARK    Rerank model02.pdb to model04.pdb score: 23.578
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 22 cluster_threshold: 1.516413
REMARK    SCORE           score:         -70.393
REMARK    SCORE    fa_intra_rep:           0.467
REMARK    SCORE     hbond_bb_sc:           0.000
REMARK    SCORE     rama_prepro:          -3.366
REMARK    SCORE             ref:           9.796
REMARK    SCORE        hbond_sc:          -3.376
REMARK    SCORE     description: cluster0002_0001
REMARK    SCORE         p_aa_pp:          -2.362
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE     cart_bonded:          16.472
REMARK    SCORE     hbond_sr_bb:         -30.538
REMARK    SCORE     total_score:         -70.393
REMARK    SCORE         fa_elec:         -65.342
REMARK    SCORE          fa_rep:          17.581
REMARK    SCORE     lk_ball_wtd:          -5.542
REMARK    SCORE            time:           0.000
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE          fa_sol:         131.919
REMARK    SCORE           omega:          -0.057
REMARK    SCORE          fa_atr:        -200.092
REMARK    SCORE fa_intra_sol_xover4:           8.330
REMARK    SCORE          fa_dun:          55.716
ATOM      1  N   ASP A   1      -0.294   0.911   0.290  1.00  1.810          N  
ATOM      2  CA  ASP A   1       0.744   0.947   1.310  1.00  1.260          C  
ATOM      3  C   ASP A   1       1.582   2.228   1.290  1.00  1.080          C  
ATOM      4  O   ASP A   1       2.750   2.204   1.698  1.00  0.950          O  
ATOM      5  CB  ASP A   1       1.657  -0.264   1.135  1.00  1.980          C  
ATOM      6  CG  ASP A   1       2.237  -0.226  -0.230  1.00  1.980          C  
ATOM      7  OD1 ASP A   1       1.686   0.561  -0.987  1.00  1.980          O  
ATOM      8  OD2 ASP A   1       3.154  -0.937  -0.542  1.00  1.980          O  
ATOM      9 1H   ASP A   1      -0.746   0.009   0.302  1.00  2.170          H  
ATOM     10 2H   ASP A   1      -0.975   1.634   0.446  1.00  2.170          H  
ATOM     11 3H   ASP A   1       0.156   1.043  -0.614  1.00  2.170          H  
ATOM     12  HA  ASP A   1       0.260   0.878   2.285  1.00  1.510          H  
ATOM     13 1HB  ASP A   1       2.460  -0.246   1.873  1.00  2.380          H  
ATOM     14 2HB  ASP A   1       1.092  -1.187   1.268  1.00  2.380          H  
ATOM     15  N   TRP A   2       0.995   3.358   0.867  1.00  1.160          N  
ATOM     16  CA  TRP A   2       1.781   4.586   0.820  1.00  1.150          C  
ATOM     17  C   TRP A   2       2.306   5.020   2.173  1.00  1.040          C  
ATOM     18  O   TRP A   2       3.465   5.395   2.281  1.00  1.030          O  
ATOM     19  CB  TRP A   2       0.985   5.757   0.276  1.00  1.610          C  
ATOM     20  CG  TRP A   2       0.748   5.801  -1.174  1.00  1.610          C  
ATOM     21  CD1 TRP A   2       1.054   4.874  -2.124  1.00  1.610          C  
ATOM     22  CD2 TRP A   2       0.151   6.910  -1.872  1.00  1.610          C  
ATOM     23  NE1 TRP A   2       0.660   5.327  -3.360  1.00  1.610          N  
ATOM     24  CE2 TRP A   2       0.106   6.572  -3.219  1.00  1.610          C  
ATOM     25  CE3 TRP A   2      -0.347   8.148  -1.463  1.00  1.610          C  
ATOM     26  CZ2 TRP A   2      -0.430   7.425  -4.167  1.00  1.610          C  
ATOM     27  CZ3 TRP A   2      -0.878   8.999  -2.402  1.00  1.610          C  
ATOM     28  CH2 TRP A   2      -0.925   8.650  -3.719  1.00  1.610          C  
ATOM     29  H   TRP A   2       0.038   3.365   0.549  1.00  1.390          H  
ATOM     30  HA  TRP A   2       2.635   4.415   0.165  1.00  1.380          H  
ATOM     31 1HB  TRP A   2       0.014   5.733   0.742  1.00  1.940          H  
ATOM     32 2HB  TRP A   2       1.470   6.679   0.564  1.00  1.940          H  
ATOM     33  HD1 TRP A   2       1.531   3.907  -1.938  1.00  1.940          H  
ATOM     34  HE1 TRP A   2       0.765   4.828  -4.234  1.00  1.940          H  
ATOM     35  HE3 TRP A   2      -0.328   8.440  -0.435  1.00  1.940          H  
ATOM     36  HZ2 TRP A   2      -0.473   7.166  -5.224  1.00  1.940          H  
ATOM     37  HZ3 TRP A   2      -1.270   9.957  -2.062  1.00  1.940          H  
ATOM     38  HH2 TRP A   2      -1.362   9.351  -4.433  1.00  1.940          H  
ATOM     39  N   PHE A   3       1.513   4.933   3.242  1.00  1.050          N  
ATOM     40  CA  PHE A   3       2.067   5.408   4.505  1.00  1.070          C  
ATOM     41  C   PHE A   3       3.368   4.721   4.818  1.00  0.900          C  
ATOM     42  O   PHE A   3       4.345   5.382   5.172  1.00  0.940          O  
ATOM     43  CB  PHE A   3       1.142   5.251   5.703  1.00  1.490          C  
ATOM     44  CG  PHE A   3       1.898   5.612   6.974  1.00  1.490          C  
ATOM     45  CD1 PHE A   3       2.149   6.938   7.314  1.00  1.490          C  
ATOM     46  CD2 PHE A   3       2.393   4.612   7.814  1.00  1.490          C  
ATOM     47  CE1 PHE A   3       2.877   7.245   8.455  1.00  1.490          C  
ATOM     48  CE2 PHE A   3       3.112   4.928   8.944  1.00  1.490          C  
ATOM     49  CZ  PHE A   3       3.353   6.244   9.262  1.00  1.490          C  
ATOM     50  H   PHE A   3       0.566   4.594   3.168  1.00  1.260          H  
ATOM     51  HA  PHE A   3       2.278   6.471   4.402  1.00  1.280          H  
ATOM     52 1HB  PHE A   3       0.282   5.912   5.608  1.00  1.790          H  
ATOM     53 2HB  PHE A   3       0.786   4.228   5.779  1.00  1.790          H  
ATOM     54  HD1 PHE A   3       1.785   7.735   6.669  1.00  1.790          H  
ATOM     55  HD2 PHE A   3       2.214   3.565   7.565  1.00  1.790          H  
ATOM     56  HE1 PHE A   3       3.082   8.278   8.715  1.00  1.790          H  
ATOM     57  HE2 PHE A   3       3.496   4.134   9.586  1.00  1.790          H  
ATOM     58  HZ  PHE A   3       3.927   6.493  10.154  1.00  1.790          H  
ATOM     59  N   LYS A   4       3.388   3.394   4.718  1.00  0.780          N  
ATOM     60  CA  LYS A   4       4.599   2.671   5.016  1.00  0.700          C  
ATOM     61  C   LYS A   4       5.709   3.107   4.070  1.00  0.630          C  
ATOM     62  O   LYS A   4       6.812   3.405   4.512  1.00  0.610          O  
ATOM     63  CB  LYS A   4       4.374   1.164   4.881  1.00  1.010          C  
ATOM     64  CG  LYS A   4       5.587   0.264   5.228  1.00  1.010          C  
ATOM     65  CD  LYS A   4       5.920   0.312   6.728  1.00  1.010          C  
ATOM     66  CE  LYS A   4       6.811  -0.882   7.167  1.00  1.010          C  
ATOM     67  NZ  LYS A   4       8.240  -0.774   6.694  1.00  1.010          N  
ATOM     68  H   LYS A   4       2.554   2.905   4.427  1.00  0.940          H  
ATOM     69  HA  LYS A   4       4.902   2.908   6.036  1.00  0.840          H  
ATOM     70 1HB  LYS A   4       3.541   0.866   5.515  1.00  1.210          H  
ATOM     71 2HB  LYS A   4       4.089   0.942   3.848  1.00  1.210          H  
ATOM     72 1HG  LYS A   4       5.363  -0.762   4.942  1.00  1.210          H  
ATOM     73 2HG  LYS A   4       6.465   0.595   4.665  1.00  1.210          H  
ATOM     74 1HD  LYS A   4       6.476   1.233   6.934  1.00  1.210          H  
ATOM     75 2HD  LYS A   4       5.006   0.316   7.315  1.00  1.210          H  
ATOM     76 1HE  LYS A   4       6.807  -0.945   8.254  1.00  1.210          H  
ATOM     77 2HE  LYS A   4       6.381  -1.796   6.761  1.00  1.210          H  
ATOM     78 1HZ  LYS A   4       8.765  -1.565   7.002  1.00  1.210          H  
ATOM     79 2HZ  LYS A   4       8.339  -0.693   5.676  1.00  1.210          H  
ATOM     80 3HZ  LYS A   4       8.684   0.071   7.059  1.00  1.210          H  
ATOM     81  N   ALA A   5       5.420   3.228   2.764  1.00  0.680          N  
ATOM     82  CA  ALA A   5       6.478   3.608   1.834  1.00  0.730          C  
ATOM     83  C   ALA A   5       7.103   4.960   2.187  1.00  0.720          C  
ATOM     84  O   ALA A   5       8.333   5.108   2.154  1.00  0.690          O  
ATOM     85  CB  ALA A   5       5.914   3.671   0.425  1.00  1.000          C  
ATOM     86  H   ALA A   5       4.483   2.997   2.415  1.00  0.820          H  
ATOM     87  HA  ALA A   5       7.257   2.848   1.882  1.00  0.880          H  
ATOM     88 1HB  ALA A   5       6.707   3.924  -0.273  1.00  1.200          H  
ATOM     89 2HB  ALA A   5       5.485   2.700   0.164  1.00  1.200          H  
ATOM     90 3HB  ALA A   5       5.137   4.431   0.388  1.00  1.200          H  
ATOM     91  N   PHE A   6       6.263   5.925   2.566  1.00  0.810          N  
ATOM     92  CA  PHE A   6       6.737   7.250   2.933  1.00  0.910          C  
ATOM     93  C   PHE A   6       7.477   7.207   4.258  1.00  0.840          C  
ATOM     94  O   PHE A   6       8.538   7.824   4.395  1.00  0.890          O  
ATOM     95  CB  PHE A   6       5.571   8.233   2.978  1.00  1.230          C  
ATOM     96  CG  PHE A   6       5.160   8.797   1.610  1.00  1.230          C  
ATOM     97  CD1 PHE A   6       4.253   8.143   0.780  1.00  1.230          C  
ATOM     98  CD2 PHE A   6       5.666  10.012   1.177  1.00  1.230          C  
ATOM     99  CE1 PHE A   6       3.868   8.674  -0.430  1.00  1.230          C  
ATOM    100  CE2 PHE A   6       5.284  10.551  -0.027  1.00  1.230          C  
ATOM    101  CZ  PHE A   6       4.381   9.879  -0.833  1.00  1.230          C  
ATOM    102  H   PHE A   6       5.259   5.729   2.547  1.00  0.970          H  
ATOM    103  HA  PHE A   6       7.434   7.587   2.167  1.00  1.090          H  
ATOM    104 1HB  PHE A   6       4.703   7.725   3.409  1.00  1.480          H  
ATOM    105 2HB  PHE A   6       5.822   9.051   3.629  1.00  1.480          H  
ATOM    106  HD1 PHE A   6       3.847   7.218   1.080  1.00  1.480          H  
ATOM    107  HD2 PHE A   6       6.370  10.545   1.798  1.00  1.480          H  
ATOM    108  HE1 PHE A   6       3.155   8.141  -1.063  1.00  1.480          H  
ATOM    109  HE2 PHE A   6       5.693  11.511  -0.347  1.00  1.480          H  
ATOM    110  HZ  PHE A   6       4.078  10.308  -1.788  1.00  1.480          H  
ATOM    111  N   TYR A   7       6.941   6.467   5.228  1.00  0.790          N  
ATOM    112  CA  TYR A   7       7.581   6.319   6.516  1.00  0.840          C  
ATOM    113  C   TYR A   7       8.959   5.723   6.389  1.00  0.720          C  
ATOM    114  O   TYR A   7       9.894   6.228   7.000  1.00  0.760          O  
ATOM    115  CB  TYR A   7       6.767   5.501   7.496  1.00  1.160          C  
ATOM    116  CG  TYR A   7       7.571   5.242   8.737  1.00  1.160          C  
ATOM    117  CD1 TYR A   7       7.839   6.280   9.591  1.00  1.160          C  
ATOM    118  CD2 TYR A   7       8.046   3.976   9.016  1.00  1.160          C  
ATOM    119  CE1 TYR A   7       8.580   6.082  10.728  1.00  1.160          C  
ATOM    120  CE2 TYR A   7       8.792   3.762  10.156  1.00  1.160          C  
ATOM    121  CZ  TYR A   7       9.058   4.813  11.015  1.00  1.160          C  
ATOM    122  OH  TYR A   7       9.803   4.608  12.156  1.00  1.160          O  
ATOM    123  H   TYR A   7       6.047   6.001   5.077  1.00  0.950          H  
ATOM    124  HA  TYR A   7       7.696   7.314   6.940  1.00  1.010          H  
ATOM    125 1HB  TYR A   7       5.858   6.034   7.760  1.00  1.390          H  
ATOM    126 2HB  TYR A   7       6.486   4.549   7.048  1.00  1.390          H  
ATOM    127  HD1 TYR A   7       7.479   7.257   9.349  1.00  1.390          H  
ATOM    128  HD2 TYR A   7       7.839   3.148   8.333  1.00  1.390          H  
ATOM    129  HE1 TYR A   7       8.793   6.918  11.395  1.00  1.390          H  
ATOM    130  HE2 TYR A   7       9.172   2.766  10.377  1.00  1.390          H  
ATOM    131  HH  TYR A   7      10.107   3.697  12.181  1.00  1.390          H  
ATOM    132  N   ASP A   8       9.103   4.620   5.649  1.00  0.610          N  
ATOM    133  CA  ASP A   8      10.415   4.014   5.510  1.00  0.610          C  
ATOM    134  C   ASP A   8      11.405   5.006   4.910  1.00  0.580          C  
ATOM    135  O   ASP A   8      12.541   5.109   5.378  1.00  0.600          O  
ATOM    136  CB  ASP A   8      10.352   2.752   4.644  1.00  0.850          C  
ATOM    137  CG  ASP A   8       9.725   1.528   5.348  1.00  0.850          C  
ATOM    138  OD1 ASP A   8       9.607   1.519   6.557  1.00  0.850          O  
ATOM    139  OD2 ASP A   8       9.356   0.574   4.683  1.00  0.850          O  
ATOM    140  H   ASP A   8       8.289   4.207   5.187  1.00  0.730          H  
ATOM    141  HA  ASP A   8      10.766   3.732   6.501  1.00  0.730          H  
ATOM    142 1HB  ASP A   8       9.755   2.974   3.751  1.00  1.020          H  
ATOM    143 2HB  ASP A   8      11.356   2.493   4.308  1.00  1.020          H  
ATOM    144  N   LYS A   9      10.982   5.798   3.911  1.00  0.610          N  
ATOM    145  CA  LYS A   9      11.908   6.779   3.347  1.00  0.690          C  
ATOM    146  C   LYS A   9      12.380   7.754   4.424  1.00  0.680          C  
ATOM    147  O   LYS A   9      13.575   8.059   4.500  1.00  0.680          O  
ATOM    148  CB  LYS A   9      11.255   7.546   2.194  1.00  0.930          C  
ATOM    149  CG  LYS A   9      11.054   6.724   0.927  1.00  0.930          C  
ATOM    150  CD  LYS A   9      10.346   7.528  -0.163  1.00  0.930          C  
ATOM    151  CE  LYS A   9      10.122   6.682  -1.415  1.00  0.930          C  
ATOM    152  NZ  LYS A   9       9.398   7.439  -2.481  1.00  0.930          N  
ATOM    153  H   LYS A   9      10.048   5.662   3.509  1.00  0.730          H  
ATOM    154  HA  LYS A   9      12.781   6.251   2.967  1.00  0.830          H  
ATOM    155 1HB  LYS A   9      10.279   7.908   2.510  1.00  1.120          H  
ATOM    156 2HB  LYS A   9      11.862   8.415   1.945  1.00  1.120          H  
ATOM    157 1HG  LYS A   9      12.025   6.400   0.557  1.00  1.120          H  
ATOM    158 2HG  LYS A   9      10.469   5.842   1.159  1.00  1.120          H  
ATOM    159 1HD  LYS A   9       9.377   7.866   0.213  1.00  1.120          H  
ATOM    160 2HD  LYS A   9      10.943   8.401  -0.423  1.00  1.120          H  
ATOM    161 1HE  LYS A   9      11.086   6.359  -1.803  1.00  1.120          H  
ATOM    162 2HE  LYS A   9       9.535   5.801  -1.146  1.00  1.120          H  
ATOM    163 1HZ  LYS A   9       9.270   6.845  -3.289  1.00  1.120          H  
ATOM    164 2HZ  LYS A   9       8.494   7.732  -2.133  1.00  1.120          H  
ATOM    165 3HZ  LYS A   9       9.936   8.252  -2.746  1.00  1.120          H  
ATOM    166  N   VAL A  10      11.447   8.205   5.276  1.00  0.730          N  
ATOM    167  CA  VAL A  10      11.743   9.108   6.390  1.00  0.840          C  
ATOM    168  C   VAL A  10      12.634   8.469   7.447  1.00  0.790          C  
ATOM    169  O   VAL A  10      13.599   9.076   7.921  1.00  0.850          O  
ATOM    170  CB  VAL A  10      10.427   9.572   7.057  1.00  1.130          C  
ATOM    171  CG1 VAL A  10      10.670  10.320   8.343  1.00  1.130          C  
ATOM    172  CG2 VAL A  10       9.717  10.456   6.123  1.00  1.130          C  
ATOM    173  H   VAL A  10      10.474   7.929   5.094  1.00  0.880          H  
ATOM    174  HA  VAL A  10      12.251   9.977   5.980  1.00  1.010          H  
ATOM    175  HB  VAL A  10       9.820   8.705   7.289  1.00  1.360          H  
ATOM    176 1HG1 VAL A  10       9.725  10.609   8.760  1.00  1.360          H  
ATOM    177 2HG1 VAL A  10      11.166   9.685   9.037  1.00  1.360          H  
ATOM    178 3HG1 VAL A  10      11.253  11.196   8.178  1.00  1.360          H  
ATOM    179 1HG2 VAL A  10       8.778  10.783   6.567  1.00  1.360          H  
ATOM    180 2HG2 VAL A  10      10.339  11.312   5.905  1.00  1.360          H  
ATOM    181 3HG2 VAL A  10       9.520   9.918   5.210  1.00  1.360          H  
ATOM    182  N   ALA A  11      12.311   7.240   7.825  1.00  0.770          N  
ATOM    183  CA  ALA A  11      13.040   6.524   8.847  1.00  0.870          C  
ATOM    184  C   ALA A  11      14.508   6.376   8.475  1.00  0.800          C  
ATOM    185  O   ALA A  11      15.378   6.501   9.339  1.00  0.890          O  
ATOM    186  CB  ALA A  11      12.411   5.162   9.054  1.00  1.180          C  
ATOM    187  H   ALA A  11      11.501   6.800   7.401  1.00  0.920          H  
ATOM    188  HA  ALA A  11      12.976   7.087   9.771  1.00  1.040          H  
ATOM    189 1HB  ALA A  11      12.938   4.630   9.841  1.00  1.410          H  
ATOM    190 2HB  ALA A  11      11.371   5.292   9.330  1.00  1.410          H  
ATOM    191 3HB  ALA A  11      12.471   4.596   8.126  1.00  1.410          H  
ATOM    192  N   GLU A  12      14.799   6.143   7.192  1.00  0.680          N  
ATOM    193  CA  GLU A  12      16.191   6.059   6.781  1.00  0.700          C  
ATOM    194  C   GLU A  12      16.797   7.452   6.533  1.00  0.630          C  
ATOM    195  O   GLU A  12      17.855   7.777   7.077  1.00  0.690          O  
ATOM    196  CB  GLU A  12      16.335   5.192   5.529  1.00  0.970          C  
ATOM    197  CG  GLU A  12      16.042   3.704   5.751  1.00  0.970          C  
ATOM    198  CD  GLU A  12      16.241   2.867   4.504  1.00  0.970          C  
ATOM    199  OE1 GLU A  12      16.487   3.436   3.464  1.00  0.970          O  
ATOM    200  OE2 GLU A  12      16.159   1.663   4.596  1.00  0.970          O  
ATOM    201  H   GLU A  12      14.039   5.972   6.523  1.00  0.820          H  
ATOM    202  HA  GLU A  12      16.753   5.585   7.583  1.00  0.840          H  
ATOM    203 1HB  GLU A  12      15.640   5.552   4.764  1.00  1.170          H  
ATOM    204 2HB  GLU A  12      17.343   5.287   5.131  1.00  1.170          H  
ATOM    205 1HG  GLU A  12      16.691   3.329   6.541  1.00  1.170          H  
ATOM    206 2HG  GLU A  12      15.009   3.604   6.089  1.00  1.170          H  
ATOM    207  N   LYS A  13      16.118   8.303   5.754  1.00  0.630          N  
ATOM    208  CA  LYS A  13      16.642   9.619   5.390  1.00  0.750          C  
ATOM    209  C   LYS A  13      17.003  10.490   6.578  1.00  0.840          C  
ATOM    210  O   LYS A  13      18.009  11.202   6.550  1.00  1.010          O  
ATOM    211  CB  LYS A  13      15.659  10.372   4.490  1.00  1.000          C  
ATOM    212  CG  LYS A  13      16.164  11.745   4.018  1.00  1.000          C  
ATOM    213  CD  LYS A  13      15.214  12.390   3.016  1.00  1.000          C  
ATOM    214  CE  LYS A  13      15.726  13.760   2.588  1.00  1.000          C  
ATOM    215  NZ  LYS A  13      14.828  14.409   1.589  1.00  1.000          N  
ATOM    216  H   LYS A  13      15.233   8.010   5.339  1.00  0.760          H  
ATOM    217  HA  LYS A  13      17.557   9.462   4.819  1.00  0.900          H  
ATOM    218 1HB  LYS A  13      15.435   9.767   3.612  1.00  1.200          H  
ATOM    219 2HB  LYS A  13      14.723  10.520   5.029  1.00  1.200          H  
ATOM    220 1HG  LYS A  13      16.252  12.409   4.881  1.00  1.200          H  
ATOM    221 2HG  LYS A  13      17.149  11.635   3.570  1.00  1.200          H  
ATOM    222 1HD  LYS A  13      15.126  11.751   2.137  1.00  1.200          H  
ATOM    223 2HD  LYS A  13      14.230  12.497   3.462  1.00  1.200          H  
ATOM    224 1HE  LYS A  13      15.801  14.401   3.465  1.00  1.200          H  
ATOM    225 2HE  LYS A  13      16.716  13.647   2.149  1.00  1.200          H  
ATOM    226 1HZ  LYS A  13      15.205  15.312   1.333  1.00  1.200          H  
ATOM    227 2HZ  LYS A  13      14.760  13.828   0.765  1.00  1.200          H  
ATOM    228 3HZ  LYS A  13      13.911  14.531   1.990  1.00  1.200          H  
ATOM    229  N   PHE A  14      16.193  10.445   7.626  1.00  0.840          N  
ATOM    230  CA  PHE A  14      16.421  11.269   8.786  1.00  1.020          C  
ATOM    231  C   PHE A  14      16.964  10.461   9.954  1.00  0.730          C  
ATOM    232  O   PHE A  14      16.931  10.915  11.090  1.00  0.670          O  
ATOM    233  CB  PHE A  14      15.121  11.977   9.143  1.00  1.360          C  
ATOM    234  CG  PHE A  14      14.678  12.852   8.030  1.00  1.360          C  
ATOM    235  CD1 PHE A  14      13.671  12.439   7.217  1.00  1.360          C  
ATOM    236  CD2 PHE A  14      15.289  14.058   7.766  1.00  1.360          C  
ATOM    237  CE1 PHE A  14      13.249  13.184   6.164  1.00  1.360          C  
ATOM    238  CE2 PHE A  14      14.877  14.824   6.707  1.00  1.360          C  
ATOM    239  CZ  PHE A  14      13.853  14.381   5.903  1.00  1.360          C  
ATOM    240  H   PHE A  14      15.359   9.851   7.609  1.00  1.010          H  
ATOM    241  HA  PHE A  14      17.160  12.027   8.528  1.00  1.220          H  
ATOM    242 1HB  PHE A  14      14.351  11.231   9.318  1.00  1.630          H  
ATOM    243 2HB  PHE A  14      15.226  12.571  10.035  1.00  1.630          H  
ATOM    244  HD1 PHE A  14      13.221  11.495   7.422  1.00  1.630          H  
ATOM    245  HD2 PHE A  14      16.106  14.401   8.402  1.00  1.630          H  
ATOM    246  HE1 PHE A  14      12.437  12.830   5.528  1.00  1.630          H  
ATOM    247  HE2 PHE A  14      15.358  15.779   6.500  1.00  1.630          H  
ATOM    248  HZ  PHE A  14      13.518  14.987   5.065  1.00  1.630          H  
ATOM    249  N   LYS A  15      17.529   9.282   9.688  1.00  0.710          N  
ATOM    250  CA  LYS A  15      18.061   8.424  10.748  1.00  0.830          C  
ATOM    251  C   LYS A  15      19.024   9.142  11.688  1.00  0.890          C  
ATOM    252  O   LYS A  15      19.007   8.913  12.896  1.00  1.210          O  
ATOM    253  CB  LYS A  15      18.778   7.216  10.140  1.00  1.110          C  
ATOM    254  CG  LYS A  15      19.370   6.228  11.157  1.00  1.110          C  
ATOM    255  CD  LYS A  15      20.014   5.029  10.457  1.00  1.110          C  
ATOM    256  CE  LYS A  15      20.650   4.071  11.457  1.00  1.110          C  
ATOM    257  NZ  LYS A  15      21.286   2.900  10.781  1.00  1.110          N  
ATOM    258  H   LYS A  15      17.574   8.937   8.724  1.00  0.850          H  
ATOM    259  HA  LYS A  15      17.217   8.064  11.338  1.00  1.000          H  
ATOM    260 1HB  LYS A  15      18.072   6.665   9.519  1.00  1.340          H  
ATOM    261 2HB  LYS A  15      19.580   7.560   9.487  1.00  1.340          H  
ATOM    262 1HG  LYS A  15      20.131   6.730  11.759  1.00  1.340          H  
ATOM    263 2HG  LYS A  15      18.579   5.881  11.821  1.00  1.340          H  
ATOM    264 1HD  LYS A  15      19.254   4.496   9.882  1.00  1.340          H  
ATOM    265 2HD  LYS A  15      20.781   5.386   9.769  1.00  1.340          H  
ATOM    266 1HE  LYS A  15      21.408   4.605  12.027  1.00  1.340          H  
ATOM    267 2HE  LYS A  15      19.882   3.709  12.140  1.00  1.340          H  
ATOM    268 1HZ  LYS A  15      21.696   2.290  11.476  1.00  1.340          H  
ATOM    269 2HZ  LYS A  15      20.589   2.390  10.256  1.00  1.340          H  
ATOM    270 3HZ  LYS A  15      22.009   3.223  10.152  1.00  1.340          H  
ATOM    271  N   GLU A  16      19.896   9.981  11.128  1.00  0.860          N  
ATOM    272  CA  GLU A  16      20.904  10.708  11.895  1.00  1.170          C  
ATOM    273  C   GLU A  16      20.433  12.093  12.360  1.00  1.080          C  
ATOM    274  O   GLU A  16      21.209  12.860  12.936  1.00  1.370          O  
ATOM    275  CB  GLU A  16      22.181  10.846  11.062  1.00  1.510          C  
ATOM    276  CG  GLU A  16      22.863   9.512  10.742  1.00  1.510          C  
ATOM    277  CD  GLU A  16      24.103   9.658   9.887  1.00  1.510          C  
ATOM    278  OE1 GLU A  16      24.413  10.759   9.498  1.00  1.510          O  
ATOM    279  OE2 GLU A  16      24.736   8.662   9.624  1.00  1.510          O  
ATOM    280  H   GLU A  16      19.858  10.109  10.124  1.00  1.030          H  
ATOM    281  HA  GLU A  16      21.137  10.122  12.783  1.00  1.400          H  
ATOM    282 1HB  GLU A  16      21.946  11.340  10.119  1.00  1.820          H  
ATOM    283 2HB  GLU A  16      22.898  11.473  11.592  1.00  1.820          H  
ATOM    284 1HG  GLU A  16      23.136   9.029  11.679  1.00  1.820          H  
ATOM    285 2HG  GLU A  16      22.150   8.866  10.232  1.00  1.820          H  
ATOM    286  N   ALA A  17      19.197  12.446  12.034  1.00  0.740          N  
ATOM    287  CA  ALA A  17      18.633  13.741  12.371  1.00  0.660          C  
ATOM    288  C   ALA A  17      18.093  13.707  13.784  1.00  0.580          C  
ATOM    289  O   ALA A  17      17.840  12.641  14.340  1.00  0.580          O  
ATOM    290  CB  ALA A  17      17.535  14.123  11.399  1.00  0.960          C  
ATOM    291  H   ALA A  17      18.583  11.761  11.597  1.00  0.890          H  
ATOM    292  HA  ALA A  17      19.429  14.482  12.322  1.00  0.790          H  
ATOM    293 1HB  ALA A  17      17.156  15.099  11.667  1.00  1.150          H  
ATOM    294 2HB  ALA A  17      17.929  14.149  10.387  1.00  1.150          H  
ATOM    295 3HB  ALA A  17      16.746  13.394  11.468  1.00  1.150          H  
ATOM    296  N   PHE A  18      17.871  14.865  14.376  1.00  0.570          N  
ATOM    297  CA  PHE A  18      17.265  14.843  15.689  1.00  0.590          C  
ATOM    298  C   PHE A  18      15.918  14.130  15.523  1.00  0.550          C  
ATOM    299  O   PHE A  18      15.224  14.406  14.537  1.00  0.540          O  
ATOM    300  CB  PHE A  18      17.069  16.263  16.211  1.00  0.820          C  
ATOM    301  CG  PHE A  18      18.349  16.927  16.569  1.00  0.820          C  
ATOM    302  CD1 PHE A  18      18.889  17.905  15.746  1.00  0.820          C  
ATOM    303  CD2 PHE A  18      19.030  16.577  17.726  1.00  0.820          C  
ATOM    304  CE1 PHE A  18      20.080  18.517  16.074  1.00  0.820          C  
ATOM    305  CE2 PHE A  18      20.221  17.188  18.053  1.00  0.820          C  
ATOM    306  CZ  PHE A  18      20.746  18.159  17.226  1.00  0.820          C  
ATOM    307  H   PHE A  18      18.115  15.736  13.930  1.00  0.680          H  
ATOM    308  HA  PHE A  18      17.932  14.310  16.354  1.00  0.710          H  
ATOM    309 1HB  PHE A  18      16.577  16.868  15.454  1.00  0.980          H  
ATOM    310 2HB  PHE A  18      16.430  16.255  17.091  1.00  0.980          H  
ATOM    311  HD1 PHE A  18      18.365  18.195  14.833  1.00  0.980          H  
ATOM    312  HD2 PHE A  18      18.620  15.810  18.381  1.00  0.980          H  
ATOM    313  HE1 PHE A  18      20.497  19.285  15.422  1.00  0.980          H  
ATOM    314  HE2 PHE A  18      20.749  16.907  18.965  1.00  0.980          H  
ATOM    315  HZ  PHE A  18      21.686  18.643  17.484  1.00  0.980          H  
ATOM    316  N   PRO A  19      15.475  13.288  16.488  1.00  0.630          N  
ATOM    317  CA  PRO A  19      14.217  12.547  16.463  1.00  0.650          C  
ATOM    318  C   PRO A  19      13.028  13.403  16.066  1.00  0.670          C  
ATOM    319  O   PRO A  19      12.147  12.926  15.355  1.00  0.670          O  
ATOM    320  CB  PRO A  19      14.093  12.078  17.917  1.00  0.980          C  
ATOM    321  CG  PRO A  19      15.526  11.905  18.371  1.00  0.980          C  
ATOM    322  CD  PRO A  19      16.291  13.037  17.707  1.00  0.980          C  
ATOM    323  HA  PRO A  19      14.321  11.691  15.780  1.00  0.780          H  
ATOM    324 1HB  PRO A  19      13.534  12.823  18.510  1.00  1.170          H  
ATOM    325 2HB  PRO A  19      13.517  11.142  17.959  1.00  1.170          H  
ATOM    326 1HG  PRO A  19      15.583  11.936  19.473  1.00  1.170          H  
ATOM    327 2HG  PRO A  19      15.898  10.915  18.065  1.00  1.170          H  
ATOM    328 1HD  PRO A  19      16.348  13.927  18.353  1.00  1.170          H  
ATOM    329 2HD  PRO A  19      17.281  12.631  17.446  1.00  1.170          H  
ATOM    330  N   ASP A  20      13.022  14.676  16.472  1.00  0.730          N  
ATOM    331  CA  ASP A  20      11.938  15.578  16.128  1.00  0.810          C  
ATOM    332  C   ASP A  20      11.794  15.737  14.620  1.00  0.740          C  
ATOM    333  O   ASP A  20      10.684  15.888  14.112  1.00  0.800          O  
ATOM    334  CB  ASP A  20      12.188  16.941  16.752  1.00  1.100          C  
ATOM    335  CG  ASP A  20      12.037  16.942  18.269  1.00  1.100          C  
ATOM    336  OD1 ASP A  20      11.490  16.011  18.820  1.00  1.100          O  
ATOM    337  OD2 ASP A  20      12.502  17.871  18.865  1.00  1.100          O  
ATOM    338  H   ASP A  20      13.746  15.029  17.081  1.00  0.880          H  
ATOM    339  HA  ASP A  20      11.008  15.173  16.523  1.00  0.970          H  
ATOM    340 1HB  ASP A  20      13.193  17.276  16.498  1.00  1.320          H  
ATOM    341 2HB  ASP A  20      11.488  17.664  16.328  1.00  1.320          H  
ATOM    342  N   VAL A  21      12.919  15.740  13.899  1.00  0.710          N  
ATOM    343  CA  VAL A  21      12.916  15.943  12.465  1.00  0.730          C  
ATOM    344  C   VAL A  21      12.304  14.746  11.797  1.00  0.650          C  
ATOM    345  O   VAL A  21      11.435  14.883  10.936  1.00  0.630          O  
ATOM    346  CB  VAL A  21      14.351  16.122  11.934  1.00  1.010          C  
ATOM    347  CG1 VAL A  21      14.350  16.182  10.402  1.00  1.010          C  
ATOM    348  CG2 VAL A  21      14.967  17.371  12.539  1.00  1.010          C  
ATOM    349  H   VAL A  21      13.812  15.559  14.351  1.00  0.850          H  
ATOM    350  HA  VAL A  21      12.324  16.828  12.232  1.00  0.880          H  
ATOM    351  HB  VAL A  21      14.935  15.259  12.221  1.00  1.220          H  
ATOM    352 1HG1 VAL A  21      15.370  16.290  10.044  1.00  1.220          H  
ATOM    353 2HG1 VAL A  21      13.926  15.274   9.986  1.00  1.220          H  
ATOM    354 3HG1 VAL A  21      13.763  17.035  10.077  1.00  1.220          H  
ATOM    355 1HG2 VAL A  21      15.988  17.487  12.181  1.00  1.220          H  
ATOM    356 2HG2 VAL A  21      14.378  18.239  12.250  1.00  1.220          H  
ATOM    357 3HG2 VAL A  21      14.973  17.284  13.622  1.00  1.220          H  
ATOM    358  N   CYS A  22      12.765  13.567  12.198  1.00  0.620          N  
ATOM    359  CA  CYS A  22      12.263  12.343  11.601  1.00  0.610          C  
ATOM    360  C   CYS A  22      10.751  12.246  11.848  1.00  0.550          C  
ATOM    361  O   CYS A  22       9.980  11.937  10.932  1.00  0.580          O  
ATOM    362  CB  CYS A  22      13.013  11.134  12.172  1.00  0.860          C  
ATOM    363  SG  CYS A  22      12.616   9.539  11.402  1.00  0.860          S  
ATOM    364  H   CYS A  22      13.487  13.562  12.931  1.00  0.740          H  
ATOM    365  HA  CYS A  22      12.436  12.382  10.526  1.00  0.730          H  
ATOM    366 1HB  CYS A  22      14.090  11.296  12.070  1.00  1.030          H  
ATOM    367 2HB  CYS A  22      12.800  11.057  13.241  1.00  1.030          H  
ATOM    368  HG  CYS A  22      13.069   9.830  10.172  1.00  1.030          H  
ATOM    369  N   ARG A  23      10.324  12.541  13.085  1.00  0.540          N  
ATOM    370  CA  ARG A  23       8.915  12.516  13.450  1.00  0.580          C  
ATOM    371  C   ARG A  23       8.099  13.533  12.649  1.00  0.580          C  
ATOM    372  O   ARG A  23       7.007  13.205  12.173  1.00  0.620          O  
ATOM    373  CB  ARG A  23       8.775  12.815  14.929  1.00  0.800          C  
ATOM    374  CG  ARG A  23       9.264  11.714  15.857  1.00  0.800          C  
ATOM    375  CD  ARG A  23       9.328  12.193  17.258  1.00  0.800          C  
ATOM    376  NE  ARG A  23       9.865  11.184  18.162  1.00  0.800          N  
ATOM    377  CZ  ARG A  23      10.394  11.439  19.384  1.00  0.800          C  
ATOM    378  NH1 ARG A  23      10.464  12.676  19.852  1.00  0.800          N  
ATOM    379  NH2 ARG A  23      10.849  10.434  20.117  1.00  0.800          N  
ATOM    380  H   ARG A  23      11.011  12.773  13.809  1.00  0.650          H  
ATOM    381  HA  ARG A  23       8.527  11.518  13.249  1.00  0.700          H  
ATOM    382 1HB  ARG A  23       9.338  13.716  15.163  1.00  0.960          H  
ATOM    383 2HB  ARG A  23       7.728  13.014  15.163  1.00  0.960          H  
ATOM    384 1HG  ARG A  23       8.565  10.880  15.816  1.00  0.960          H  
ATOM    385 2HG  ARG A  23      10.247  11.370  15.552  1.00  0.960          H  
ATOM    386 1HD  ARG A  23       9.977  13.066  17.292  1.00  0.960          H  
ATOM    387 2HD  ARG A  23       8.328  12.464  17.596  1.00  0.960          H  
ATOM    388  HE  ARG A  23       9.835  10.219  17.855  1.00  0.960          H  
ATOM    389 1HH1 ARG A  23      10.122  13.458  19.302  1.00  0.960          H  
ATOM    390 2HH1 ARG A  23      10.862  12.852  20.764  1.00  0.960          H  
ATOM    391 1HH2 ARG A  23      10.798   9.487  19.765  1.00  0.960          H  
ATOM    392 2HH2 ARG A  23      11.246  10.609  21.029  1.00  0.960          H  
ATOM    393  N   ASN A  24       8.629  14.754  12.462  1.00  0.610          N  
ATOM    394  CA  ASN A  24       7.910  15.763  11.704  1.00  0.690          C  
ATOM    395  C   ASN A  24       7.719  15.340  10.261  1.00  0.700          C  
ATOM    396  O   ASN A  24       6.628  15.511   9.717  1.00  0.730          O  
ATOM    397  CB  ASN A  24       8.635  17.094  11.749  1.00  0.930          C  
ATOM    398  CG  ASN A  24       8.518  17.805  13.077  1.00  0.930          C  
ATOM    399  OD1 ASN A  24       7.599  17.568  13.873  1.00  0.930          O  
ATOM    400  ND2 ASN A  24       9.442  18.698  13.330  1.00  0.930          N  
ATOM    401  H   ASN A  24       9.511  15.011  12.914  1.00  0.730          H  
ATOM    402  HA  ASN A  24       6.922  15.884  12.144  1.00  0.830          H  
ATOM    403 1HB  ASN A  24       9.694  16.925  11.542  1.00  1.120          H  
ATOM    404 2HB  ASN A  24       8.251  17.741  10.967  1.00  1.120          H  
ATOM    405 1HD2 ASN A  24       9.421  19.204  14.190  1.00  1.120          H  
ATOM    406 2HD2 ASN A  24      10.170  18.867  12.670  1.00  1.120          H  
ATOM    407  N   PHE A  25       8.739  14.740   9.641  1.00  0.720          N  
ATOM    408  CA  PHE A  25       8.577  14.309   8.261  1.00  0.790          C  
ATOM    409  C   PHE A  25       7.579  13.177   8.139  1.00  0.790          C  
ATOM    410  O   PHE A  25       6.774  13.171   7.204  1.00  0.890          O  
ATOM    411  CB  PHE A  25       9.906  13.989   7.616  1.00  1.080          C  
ATOM    412  CG  PHE A  25      10.562  15.219   7.101  1.00  1.080          C  
ATOM    413  CD1 PHE A  25      11.537  15.885   7.810  1.00  1.080          C  
ATOM    414  CD2 PHE A  25      10.183  15.716   5.867  1.00  1.080          C  
ATOM    415  CE1 PHE A  25      12.128  17.022   7.300  1.00  1.080          C  
ATOM    416  CE2 PHE A  25      10.767  16.848   5.352  1.00  1.080          C  
ATOM    417  CZ  PHE A  25      11.744  17.502   6.071  1.00  1.080          C  
ATOM    418  H   PHE A  25       9.642  14.646  10.121  1.00  0.860          H  
ATOM    419  HA  PHE A  25       8.174  15.147   7.703  1.00  0.950          H  
ATOM    420 1HB  PHE A  25      10.568  13.520   8.349  1.00  1.290          H  
ATOM    421 2HB  PHE A  25       9.761  13.313   6.796  1.00  1.290          H  
ATOM    422  HD1 PHE A  25      11.847  15.507   8.766  1.00  1.290          H  
ATOM    423  HD2 PHE A  25       9.411  15.193   5.300  1.00  1.290          H  
ATOM    424  HE1 PHE A  25      12.904  17.533   7.866  1.00  1.290          H  
ATOM    425  HE2 PHE A  25      10.461  17.227   4.376  1.00  1.290          H  
ATOM    426  HZ  PHE A  25      12.213  18.397   5.664  1.00  1.290          H  
ATOM    427  N   MET A  26       7.589  12.238   9.087  1.00  0.720          N  
ATOM    428  CA  MET A  26       6.620  11.157   9.064  1.00  0.780          C  
ATOM    429  C   MET A  26       5.204  11.708   9.080  1.00  0.760          C  
ATOM    430  O   MET A  26       4.364  11.260   8.294  1.00  0.860          O  
ATOM    431  CB  MET A  26       6.843  10.238  10.266  1.00  1.070          C  
ATOM    432  CG  MET A  26       5.845   9.068  10.428  1.00  1.070          C  
ATOM    433  SD  MET A  26       4.301   9.526  11.284  1.00  1.070          S  
ATOM    434  CE  MET A  26       4.869   9.774  12.979  1.00  1.070          C  
ATOM    435  H   MET A  26       8.306  12.259   9.822  1.00  0.860          H  
ATOM    436  HA  MET A  26       6.754  10.588   8.145  1.00  0.940          H  
ATOM    437 1HB  MET A  26       7.841   9.804  10.193  1.00  1.280          H  
ATOM    438 2HB  MET A  26       6.837  10.836  11.161  1.00  1.280          H  
ATOM    439 1HG  MET A  26       5.587   8.669   9.445  1.00  1.280          H  
ATOM    440 2HG  MET A  26       6.314   8.284  11.009  1.00  1.280          H  
ATOM    441 1HE  MET A  26       4.020  10.054  13.603  1.00  1.280          H  
ATOM    442 2HE  MET A  26       5.305   8.849  13.356  1.00  1.280          H  
ATOM    443 3HE  MET A  26       5.616  10.566  13.018  1.00  1.280          H  
ATOM    444  N   ARG A  27       4.951  12.677   9.973  1.00  0.680          N  
ATOM    445  CA  ARG A  27       3.642  13.296  10.135  1.00  0.720          C  
ATOM    446  C   ARG A  27       3.227  14.132   8.924  1.00  0.770          C  
ATOM    447  O   ARG A  27       2.064  14.086   8.500  1.00  0.850          O  
ATOM    448  CB  ARG A  27       3.670  14.147  11.389  1.00  0.990          C  
ATOM    449  CG  ARG A  27       3.742  13.319  12.653  1.00  0.990          C  
ATOM    450  CD  ARG A  27       3.975  14.120  13.854  1.00  0.990          C  
ATOM    451  NE  ARG A  27       4.061  13.272  15.042  1.00  0.990          N  
ATOM    452  CZ  ARG A  27       4.529  13.660  16.247  1.00  0.990          C  
ATOM    453  NH1 ARG A  27       4.970  14.889  16.424  1.00  0.990          N  
ATOM    454  NH2 ARG A  27       4.543  12.798  17.253  1.00  0.990          N  
ATOM    455  H   ARG A  27       5.709  12.962  10.603  1.00  0.820          H  
ATOM    456  HA  ARG A  27       2.910  12.501  10.276  1.00  0.860          H  
ATOM    457 1HB  ARG A  27       4.543  14.797  11.366  1.00  1.190          H  
ATOM    458 2HB  ARG A  27       2.783  14.775  11.434  1.00  1.190          H  
ATOM    459 1HG  ARG A  27       2.815  12.762  12.780  1.00  1.190          H  
ATOM    460 2HG  ARG A  27       4.561  12.626  12.563  1.00  1.190          H  
ATOM    461 1HD  ARG A  27       4.922  14.651  13.737  1.00  1.190          H  
ATOM    462 2HD  ARG A  27       3.162  14.831  13.991  1.00  1.190          H  
ATOM    463  HE  ARG A  27       3.732  12.319  14.955  1.00  1.190          H  
ATOM    464 1HH1 ARG A  27       4.962  15.538  15.652  1.00  1.190          H  
ATOM    465 2HH1 ARG A  27       5.319  15.182  17.325  1.00  1.190          H  
ATOM    466 1HH2 ARG A  27       4.203  11.856  17.117  1.00  1.190          H  
ATOM    467 2HH2 ARG A  27       4.889  13.080  18.159  1.00  1.190          H  
ATOM    468  N   ARG A  28       4.172  14.890   8.355  1.00  0.790          N  
ATOM    469  CA  ARG A  28       3.888  15.707   7.185  1.00  0.890          C  
ATOM    470  C   ARG A  28       3.476  14.820   6.029  1.00  0.940          C  
ATOM    471  O   ARG A  28       2.507  15.121   5.312  1.00  1.000          O  
ATOM    472  CB  ARG A  28       5.122  16.510   6.804  1.00  1.210          C  
ATOM    473  CG  ARG A  28       5.462  17.648   7.758  1.00  1.210          C  
ATOM    474  CD  ARG A  28       6.803  18.222   7.483  1.00  1.210          C  
ATOM    475  NE  ARG A  28       7.151  19.250   8.453  1.00  1.210          N  
ATOM    476  CZ  ARG A  28       8.388  19.754   8.643  1.00  1.210          C  
ATOM    477  NH1 ARG A  28       9.401  19.329   7.924  1.00  1.210          N  
ATOM    478  NH2 ARG A  28       8.577  20.690   9.561  1.00  1.210          N  
ATOM    479  H   ARG A  28       5.107  14.925   8.769  1.00  0.950          H  
ATOM    480  HA  ARG A  28       3.073  16.389   7.421  1.00  1.070          H  
ATOM    481 1HB  ARG A  28       5.981  15.842   6.770  1.00  1.450          H  
ATOM    482 2HB  ARG A  28       4.994  16.928   5.808  1.00  1.450          H  
ATOM    483 1HG  ARG A  28       4.737  18.444   7.608  1.00  1.450          H  
ATOM    484 2HG  ARG A  28       5.407  17.323   8.785  1.00  1.450          H  
ATOM    485 1HD  ARG A  28       7.545  17.429   7.543  1.00  1.450          H  
ATOM    486 2HD  ARG A  28       6.817  18.664   6.488  1.00  1.450          H  
ATOM    487  HE  ARG A  28       6.402  19.615   9.029  1.00  1.450          H  
ATOM    488 1HH1 ARG A  28       9.261  18.616   7.219  1.00  1.450          H  
ATOM    489 2HH1 ARG A  28      10.323  19.713   8.070  1.00  1.450          H  
ATOM    490 1HH2 ARG A  28       7.797  21.020  10.114  1.00  1.450          H  
ATOM    491 2HH2 ARG A  28       9.497  21.079   9.709  1.00  1.450          H  
ATOM    492  N   TYR A  29       4.177  13.697   5.873  1.00  0.960          N  
ATOM    493  CA  TYR A  29       3.852  12.788   4.813  1.00  1.090          C  
ATOM    494  C   TYR A  29       2.563  12.070   5.140  1.00  1.110          C  
ATOM    495  O   TYR A  29       1.714  11.943   4.277  1.00  1.210          O  
ATOM    496  CB  TYR A  29       4.987  11.811   4.558  1.00  1.470          C  
ATOM    497  CG  TYR A  29       6.279  12.453   4.022  1.00  1.470          C  
ATOM    498  CD1 TYR A  29       6.318  13.767   3.516  1.00  1.470          C  
ATOM    499  CD2 TYR A  29       7.429  11.706   4.011  1.00  1.470          C  
ATOM    500  CE1 TYR A  29       7.493  14.282   3.035  1.00  1.470          C  
ATOM    501  CE2 TYR A  29       8.600  12.237   3.514  1.00  1.470          C  
ATOM    502  CZ  TYR A  29       8.632  13.510   3.034  1.00  1.470          C  
ATOM    503  OH  TYR A  29       9.805  14.021   2.537  1.00  1.470          O  
ATOM    504  H   TYR A  29       4.988  13.502   6.472  1.00  1.150          H  
ATOM    505  HA  TYR A  29       3.661  13.350   3.905  1.00  1.310          H  
ATOM    506 1HB  TYR A  29       5.230  11.289   5.490  1.00  1.770          H  
ATOM    507 2HB  TYR A  29       4.651  11.072   3.844  1.00  1.770          H  
ATOM    508  HD1 TYR A  29       5.442  14.400   3.497  1.00  1.770          H  
ATOM    509  HD2 TYR A  29       7.411  10.686   4.389  1.00  1.770          H  
ATOM    510  HE1 TYR A  29       7.521  15.299   2.648  1.00  1.770          H  
ATOM    511  HE2 TYR A  29       9.506  11.638   3.500  1.00  1.770          H  
ATOM    512  HH  TYR A  29       9.673  14.941   2.292  1.00  1.770          H  
ATOM    513  N   GLN A  30       2.331  11.657   6.385  1.00  1.050          N  
ATOM    514  CA  GLN A  30       1.095  10.937   6.665  1.00  1.110          C  
ATOM    515  C   GLN A  30      -0.112  11.764   6.235  1.00  1.050          C  
ATOM    516  O   GLN A  30      -1.060  11.222   5.653  1.00  1.140          O  
ATOM    517  CB  GLN A  30       0.993  10.574   8.139  1.00  1.530          C  
ATOM    518  CG  GLN A  30      -0.191   9.682   8.483  1.00  1.530          C  
ATOM    519  CD  GLN A  30      -0.149   9.231   9.915  1.00  1.530          C  
ATOM    520  OE1 GLN A  30       0.165  10.009  10.816  1.00  1.530          O  
ATOM    521  NE2 GLN A  30      -0.456   7.961  10.140  1.00  1.530          N  
ATOM    522  H   GLN A  30       3.038  11.755   7.119  1.00  1.260          H  
ATOM    523  HA  GLN A  30       1.099  10.017   6.083  1.00  1.330          H  
ATOM    524 1HB  GLN A  30       1.908  10.110   8.467  1.00  1.840          H  
ATOM    525 2HB  GLN A  30       0.889  11.492   8.718  1.00  1.840          H  
ATOM    526 1HG  GLN A  30      -1.114  10.243   8.332  1.00  1.840          H  
ATOM    527 2HG  GLN A  30      -0.181   8.805   7.843  1.00  1.840          H  
ATOM    528 1HE2 GLN A  30      -0.440   7.600  11.074  1.00  1.840          H  
ATOM    529 2HE2 GLN A  30      -0.705   7.358   9.382  1.00  1.840          H  
ATOM    530  N   SER A  31      -0.071  13.075   6.501  1.00  0.990          N  
ATOM    531  CA  SER A  31      -1.147  13.965   6.096  1.00  1.030          C  
ATOM    532  C   SER A  31      -1.311  13.972   4.573  1.00  1.060          C  
ATOM    533  O   SER A  31      -2.424  13.781   4.067  1.00  1.200          O  
ATOM    534  CB  SER A  31      -0.876  15.369   6.594  1.00  1.430          C  
ATOM    535  OG  SER A  31      -1.898  16.250   6.211  1.00  1.430          O  
ATOM    536  H   SER A  31       0.721  13.453   7.035  1.00  1.190          H  
ATOM    537  HA  SER A  31      -2.076  13.606   6.540  1.00  1.240          H  
ATOM    538 1HB  SER A  31      -0.784  15.357   7.680  1.00  1.710          H  
ATOM    539 2HB  SER A  31       0.078  15.715   6.194  1.00  1.710          H  
ATOM    540  HG  SER A  31      -1.652  17.106   6.569  1.00  1.710          H  
ATOM    541  N   ARG A  32      -0.190  14.147   3.842  1.00  1.050          N  
ATOM    542  CA  ARG A  32      -0.209  14.162   2.373  1.00  1.210          C  
ATOM    543  C   ARG A  32      -0.638  12.823   1.772  1.00  1.100          C  
ATOM    544  O   ARG A  32      -1.264  12.789   0.704  1.00  1.190          O  
ATOM    545  CB  ARG A  32       1.147  14.561   1.811  1.00  1.630          C  
ATOM    546  CG  ARG A  32       1.581  16.015   2.079  1.00  1.630          C  
ATOM    547  CD  ARG A  32       0.699  17.013   1.390  1.00  1.630          C  
ATOM    548  NE  ARG A  32       1.213  18.367   1.514  1.00  1.630          N  
ATOM    549  CZ  ARG A  32       0.569  19.488   1.116  1.00  1.630          C  
ATOM    550  NH1 ARG A  32      -0.633  19.426   0.568  1.00  1.630          N  
ATOM    551  NH2 ARG A  32       1.159  20.666   1.279  1.00  1.630          N  
ATOM    552  H   ARG A  32       0.697  14.311   4.335  1.00  1.260          H  
ATOM    553  HA  ARG A  32      -0.938  14.904   2.061  1.00  1.450          H  
ATOM    554 1HB  ARG A  32       1.907  13.911   2.239  1.00  1.960          H  
ATOM    555 2HB  ARG A  32       1.152  14.403   0.734  1.00  1.960          H  
ATOM    556 1HG  ARG A  32       1.529  16.210   3.150  1.00  1.960          H  
ATOM    557 2HG  ARG A  32       2.604  16.160   1.735  1.00  1.960          H  
ATOM    558 1HD  ARG A  32       0.613  16.765   0.332  1.00  1.960          H  
ATOM    559 2HD  ARG A  32      -0.282  16.998   1.851  1.00  1.960          H  
ATOM    560  HE  ARG A  32       2.129  18.476   1.929  1.00  1.960          H  
ATOM    561 1HH1 ARG A  32      -1.113  18.523   0.440  1.00  1.960          H  
ATOM    562 2HH1 ARG A  32      -1.096  20.271   0.273  1.00  1.960          H  
ATOM    563 1HH2 ARG A  32       2.079  20.717   1.698  1.00  1.960          H  
ATOM    564 2HH2 ARG A  32       0.695  21.513   0.987  1.00  1.960          H  
ATOM    565  N   VAL A  33      -0.251  11.726   2.426  1.00  1.100          N  
ATOM    566  CA  VAL A  33      -0.601  10.387   1.997  1.00  1.320          C  
ATOM    567  C   VAL A  33      -2.081  10.184   2.015  1.00  1.200          C  
ATOM    568  O   VAL A  33      -2.638   9.711   1.040  1.00  1.390          O  
ATOM    569  CB  VAL A  33       0.087   9.314   2.877  1.00  1.760          C  
ATOM    570  CG1 VAL A  33      -0.508   7.945   2.622  1.00  1.760          C  
ATOM    571  CG2 VAL A  33       1.572   9.244   2.498  1.00  1.760          C  
ATOM    572  H   VAL A  33       0.322  11.849   3.252  1.00  1.320          H  
ATOM    573  HA  VAL A  33      -0.249  10.264   0.975  1.00  1.580          H  
ATOM    574  HB  VAL A  33      -0.031   9.566   3.926  1.00  2.110          H  
ATOM    575 1HG1 VAL A  33       0.006   7.221   3.227  1.00  2.110          H  
ATOM    576 2HG1 VAL A  33      -1.566   7.926   2.877  1.00  2.110          H  
ATOM    577 3HG1 VAL A  33      -0.400   7.714   1.603  1.00  2.110          H  
ATOM    578 1HG2 VAL A  33       2.076   8.493   3.096  1.00  2.110          H  
ATOM    579 2HG2 VAL A  33       1.641   8.985   1.451  1.00  2.110          H  
ATOM    580 3HG2 VAL A  33       2.050  10.200   2.653  1.00  2.110          H  
ATOM    581  N   ILE A  34      -2.738  10.562   3.094  1.00  1.140          N  
ATOM    582  CA  ILE A  34      -4.174  10.390   3.110  1.00  1.450          C  
ATOM    583  C   ILE A  34      -4.825  11.373   2.139  1.00  1.450          C  
ATOM    584  O   ILE A  34      -5.704  10.998   1.366  1.00  1.770          O  
ATOM    585  CB  ILE A  34      -4.747  10.541   4.531  1.00  1.910          C  
ATOM    586  CG1 ILE A  34      -4.131   9.434   5.487  1.00  1.910          C  
ATOM    587  CG2 ILE A  34      -6.292  10.467   4.501  1.00  1.910          C  
ATOM    588  CD1 ILE A  34      -4.353   7.964   5.083  1.00  1.910          C  
ATOM    589  H   ILE A  34      -2.212  10.919   3.899  1.00  1.370          H  
ATOM    590  HA  ILE A  34      -4.410   9.396   2.745  1.00  1.740          H  
ATOM    591  HB  ILE A  34      -4.440  11.511   4.936  1.00  2.290          H  
ATOM    592 1HG1 ILE A  34      -3.057   9.602   5.550  1.00  2.290          H  
ATOM    593 2HG1 ILE A  34      -4.558   9.574   6.480  1.00  2.290          H  
ATOM    594 1HG2 ILE A  34      -6.679  10.589   5.510  1.00  2.290          H  
ATOM    595 2HG2 ILE A  34      -6.693  11.260   3.871  1.00  2.290          H  
ATOM    596 3HG2 ILE A  34      -6.614   9.507   4.103  1.00  2.290          H  
ATOM    597 1HD1 ILE A  34      -3.881   7.323   5.828  1.00  2.290          H  
ATOM    598 2HD1 ILE A  34      -5.415   7.740   5.044  1.00  2.290          H  
ATOM    599 3HD1 ILE A  34      -3.905   7.760   4.117  1.00  2.290          H  
ATOM    600  N   GLN A  35      -4.392  12.634   2.162  1.00  1.300          N  
ATOM    601  CA  GLN A  35      -4.973  13.663   1.312  1.00  1.670          C  
ATOM    602  C   GLN A  35      -5.004  13.290  -0.170  1.00  1.790          C  
ATOM    603  O   GLN A  35      -6.015  13.498  -0.844  1.00  2.180          O  
ATOM    604  CB  GLN A  35      -4.158  14.943   1.466  1.00  2.190          C  
ATOM    605  CG  GLN A  35      -4.658  16.143   0.709  1.00  2.190          C  
ATOM    606  CD  GLN A  35      -3.701  17.299   0.865  1.00  2.190          C  
ATOM    607  OE1 GLN A  35      -2.537  17.200   0.432  1.00  2.190          O  
ATOM    608  NE2 GLN A  35      -4.167  18.384   1.477  1.00  2.190          N  
ATOM    609  H   GLN A  35      -3.659  12.910   2.823  1.00  1.560          H  
ATOM    610  HA  GLN A  35      -5.994  13.839   1.642  1.00  2.000          H  
ATOM    611 1HB  GLN A  35      -4.100  15.207   2.521  1.00  2.630          H  
ATOM    612 2HB  GLN A  35      -3.145  14.753   1.131  1.00  2.630          H  
ATOM    613 1HG  GLN A  35      -4.736  15.904  -0.352  1.00  2.630          H  
ATOM    614 2HG  GLN A  35      -5.630  16.436   1.102  1.00  2.630          H  
ATOM    615 1HE2 GLN A  35      -3.581  19.183   1.615  1.00  2.630          H  
ATOM    616 2HE2 GLN A  35      -5.112  18.408   1.806  1.00  2.630          H  
ATOM    617  N   GLY A  36      -3.903  12.748  -0.685  1.00  1.720          N  
ATOM    618  CA  GLY A  36      -3.785  12.389  -2.091  1.00  2.040          C  
ATOM    619  C   GLY A  36      -4.130  10.939  -2.451  1.00  2.750          C  
ATOM    620  O   GLY A  36      -3.818  10.509  -3.567  1.00  3.210          O  
ATOM    621  H   GLY A  36      -3.077  12.624  -0.089  1.00  2.060          H  
ATOM    622 1HA  GLY A  36      -4.420  13.057  -2.672  1.00  2.450          H  
ATOM    623 2HA  GLY A  36      -2.764  12.593  -2.407  1.00  2.450          H  
ATOM    624  N   LEU A  37      -4.714  10.173  -1.526  1.00  3.170          N  
ATOM    625  CA  LEU A  37      -4.972   8.758  -1.783  1.00  4.310          C  
ATOM    626  C   LEU A  37      -6.455   8.403  -1.678  1.00  5.030          C  
ATOM    627  O   LEU A  37      -7.156   8.380  -2.690  1.00  5.770          O  
ATOM    628  OXT LEU A  37      -6.878   7.881  -0.644  1.00  6.460          O  
ATOM    629  CB  LEU A  37      -4.134   7.944  -0.794  1.00  5.130          C  
ATOM    630  CG  LEU A  37      -4.182   6.422  -0.808  1.00  5.130          C  
ATOM    631  CD1 LEU A  37      -3.624   5.875  -2.131  1.00  5.130          C  
ATOM    632  CD2 LEU A  37      -3.321   5.950   0.365  1.00  5.130          C  
ATOM    633  H   LEU A  37      -4.979  10.570  -0.617  1.00  3.800          H  
ATOM    634  HA  LEU A  37      -4.640   8.533  -2.793  1.00  5.170          H  
ATOM    635 1HB  LEU A  37      -3.113   8.233  -0.910  1.00  6.160          H  
ATOM    636 2HB  LEU A  37      -4.446   8.249   0.205  1.00  6.160          H  
ATOM    637  HG  LEU A  37      -5.207   6.072  -0.690  1.00  6.160          H  
ATOM    638 1HD1 LEU A  37      -3.643   4.789  -2.112  1.00  6.160          H  
ATOM    639 2HD1 LEU A  37      -4.231   6.227  -2.962  1.00  6.160          H  
ATOM    640 3HD1 LEU A  37      -2.612   6.214  -2.259  1.00  6.160          H  
ATOM    641 1HD2 LEU A  37      -3.319   4.864   0.406  1.00  6.160          H  
ATOM    642 2HD2 LEU A  37      -2.306   6.315   0.228  1.00  6.160          H  
ATOM    643 3HD2 LEU A  37      -3.730   6.352   1.295  1.00  6.160          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 -200.052 17.5881 159.925 -15.149 3.81862 9.67749 81.8259 -86.2534 -0.13676 -1.10768 -74.693 -8.81049 -34.5972 0 0 -3.40004 0 -0.05964 3.12714 23.4362 40.586 -2.40864 0.61454 -1.53515 -3.73935 16.4892 -74.8543
ASP:NtermProteinFull_1 -1.96645 0.0682 2.50905 -0.31164 0.22281 1.06976 1.24722 -1.22138 -0 -0 -0.80989 -4.26142 0 0 0 0 0 0.03942 0.14032 0 2.47145 0 0 -2.3716 0 0.36053 -2.81363
TRP_2 -7.60844 1.14964 2.31083 -0.69054 0.08775 0.30942 2.11412 -2.30915 -0.01525 -0.08976 -1.02985 -0.37048 0 0 0 0 0 -0.04554 0.02725 0 3.55364 -0.05575 0 1.6906 -0.12282 0.89413 -0.20021
PHE_3 -6.46421 0.53794 3.72579 -1.10109 0.14351 0.49184 1.46543 -2.23286 -0 -0 -1.19195 0.03645 0 0 0 0 0 -0.00953 0.09461 0 1.82472 -0.47485 0 1.0402 -0.08979 0.86271 -1.34107
LYS_4 -5.25078 0.58074 7.43979 -0.72064 0.11021 0.64379 3.45232 -3.23589 -0.00453 -0.03267 -5.14992 0.04591 0 0 0 -0.78787 0 -0.03209 0.29347 2.9831 0 0.04198 0 -1.5107 -0.10955 0.72034 -0.52298
ALA_5 -4.19022 0.22567 4.32391 -0.0214 0 0 2.35635 -2.34616 -0 -0 -1.82963 -0.34902 0 0 0 0 0 -0.00984 0 0 0 -0.25461 0 1.8394 -0.32785 0.48618 -0.09722
PHE_6 -7.44044 0.85641 3.86609 -0.53702 0.01355 0.21697 2.63373 -2.57601 -0 -0 -2.78476 -0.00947 0 0 0 0 0 0.11683 0.23525 0 2.82579 -0.05294 0 1.0402 -0.20338 0.22959 -1.56959
TYR_7 -7.24351 0.56839 5.19759 -1.12284 0.14717 0.52096 3.23509 -2.98838 -0.01525 -0.08976 -2.99784 -0.2752 0 0 0 0 0 0.00083 0.0977 0 2.02733 -0.35201 0.00717 1.2797 -0.00511 0.42968 -1.57828
ASP_8 -5.53927 0.52189 8.30123 -0.10474 0.01179 0.31778 4.12674 -3.66122 -0.00985 -0.0677 -6.52325 -0.29208 0 0 0 -0.78787 0 0.04137 0.04787 0 1.70238 0.19424 0 -2.3716 -0.08566 0.54625 -3.63169
LYS_9 -4.43571 0.31014 5.28488 -0.30007 0.02636 0.13078 2.51557 -2.45003 -0.00453 -0.03267 -2.56963 -0.00228 0 0 0 0 0 0.08034 0.01793 1.72602 0 0.01051 0 -1.5107 -0.28773 0.36527 -1.12555
VAL_10 -9.01226 1.26829 4.18769 -0.31595 0.24356 0.07096 3.02394 -3.15399 -0 -0 -2.32832 -0.03027 0 0 0 0 0 -0.0627 0.03942 0.06672 0 -0.34068 0 1.9342 -0.22182 0.29517 -4.33602
ALA_11 -4.40255 0.20036 3.13847 -0.02231 0 0 1.92666 -2.0966 -0 -0 -1.63697 -0.36738 0 0 0 0 0 0.13559 0 0 0 -0.35971 0 1.8394 -0.30976 0.31839 -1.63642
GLU_12 -3.46851 0.24376 4.35283 -0.2 0.02494 0.26774 1.79797 -2.02939 -0.00455 -0.04441 -1.50238 -0.53916 0 0 0 0 0 -0.03194 0.03891 0 3.09703 -0.05471 0 -2.7348 -0.10979 0.27083 -0.62565
LYS_13 -4.13666 0.21809 3.36238 -0.44988 0.08804 0.27359 1.42495 -1.6429 -0.00985 -0.0677 -1.00779 -0.18441 0 0 0 0 0 -0.06086 0.0328 2.09173 0 -0.05339 0 -1.5107 -0.03884 0.24088 -1.43053
PHE_14 -9.59909 1.02574 2.55994 -0.71146 0.08098 0.42689 2.00277 -2.4254 -0.00033 -0.0012 -2.0635 0.14529 0 0 0 0 0 -0.05012 0.02835 0 1.94206 -0.24234 0 1.0402 -0.40055 0.38293 -5.85883
LYS_15 -2.95007 0.16752 3.54458 -0.43777 0.08882 0.26156 1.71378 -1.58525 -0 -0 -0.61616 -0.16673 0 0 0 0 0 -0.05258 0.00627 1.87794 0 -0.05125 0 -1.5107 -0.28826 0.36447 0.36618
GLU_16 -1.47986 0.12628 1.65621 -0.23452 0.04933 0.38122 0.01917 -0.76472 -0.00455 -0.04441 -0.15684 -0.56715 0 0 0 0 0 -0.06343 0.00113 0 2.91622 -0.03937 0 -2.7348 -0.35659 0.22206 -1.07463
ALA_17 -3.47411 0.37921 1.64319 -0.02141 0 0 1.47116 -1.38329 -0.00033 -0.0012 -0.56609 -0.17271 0 0 0 0 0 0.00484 0 0 0 0.03846 0 1.8394 -0.31313 0.295 -0.261
PHE_18 -3.21774 0.6645 3.15427 -0.60797 0.03605 0.28767 1.91171 -1.58453 -0 -0 -1.69258 0.13343 0 0 0 0 0 -0.04534 0.00383 0 2.54384 0.16357 0 1.0402 -0.17933 0.98555 3.59715
PRO_19 -4.02038 0.50516 3.66283 -0.06733 0 0.04274 1.73857 -1.6026 -0 -0 -1.26963 0.61048 0 0 0 0 0 -0.11401 0.05569 0.15842 0 -0.61879 0 -2.4119 0.09662 1.04036 -2.19378
ASP_20 -4.12393 0.30952 4.81449 -0.11562 0.01241 0.35479 1.86544 -2.25456 -0 -0 -1.67319 -0.41233 0 0 0 0 0 -0.0635 0.0182 0 1.69416 0.09339 0 -2.3716 0.03495 0.30797 -1.50943
VAL_21 -6.36715 0.68038 3.84903 -0.30305 0.2267 0.06828 2.70135 -2.53606 -0 -0 -2.01725 -0.0618 0 0 0 0 0 -0.05757 0.00573 0.06222 0 -0.39877 0 1.9342 -0.16246 0.20753 -2.16868
CYS_22 -6.54234 0.43427 4.45367 -0.06711 0 0.05417 2.09616 -2.44767 -0 -0 -1.86668 -0.44577 0 0 0 0 0 0.04245 0.03268 0.89094 0 0.25902 0 3.6196 0.27455 0.2558 1.04374
ARG_23 -6.70319 0.33669 7.13995 -0.45554 0.0821 0.23314 2.89009 -3.22661 -0 -0 -3.04379 0.38312 0 0 0 0 0 0.00033 0.36912 2.09104 0 -0.07372 0 -1.2888 0.05901 0.30961 -0.89746
ASN_24 -6.08523 0.35234 6.76226 -0.17304 0.02164 0.25398 2.93204 -3.20396 -0.0154 -0.14416 -2.86156 -0.30813 0 0 0 0 0 0.01931 0.00379 0 1.43312 0.50343 0 -0.93687 -0.10056 0.31398 -1.23301
PHE_25 -9.20147 0.77928 4.24401 -0.63946 0.04154 0.26167 3.04461 -3.02163 -0 -0 -2.53714 -0.04164 0 0 0 0 0 0.16196 0.31073 0 2.49776 0.07319 0 1.0402 0.00292 0.43785 -2.54562
MET_26 -7.72053 0.53791 5.60208 -0.77326 0.26705 0.36328 2.59948 -2.73599 -0 -0 -2.31229 -0.2163 0 0 0 0 0 -0.02269 0.09859 2.7683 0 0.05546 0 0.60916 0.04412 0.43692 -0.39871
ARG_27 -6.33996 0.31932 6.25782 -0.46538 0.08469 0.2423 2.43941 -2.83978 -0.0154 -0.14416 -2.15776 0.34937 0 0 0 0 0 0.04307 0.17905 2.06549 0 -0.06354 0 -1.2888 -0.0213 0.31193 -1.04364
ARG_28 -6.28924 0.33614 6.24489 -0.44686 0.06245 0.22433 2.77786 -2.9193 -0 -0 -2.66013 0.35194 0 0 0 0 0 0.00827 0.31635 2.0872 0 -0.08298 0 -1.2888 -0.34931 0.29568 -1.33152
TYR_29 -8.06694 0.96835 4.92469 -0.58325 0.37997 0.28761 2.94923 -3.00212 -0.00773 -0.05307 -2.48996 -0.36003 0 0 0 0 0 -0.03458 0.08435 0 3.2341 0.03533 0.00729 1.2797 -0.20713 0.59509 -0.0591
GLN_30 -5.90452 0.35955 5.46549 -0.37403 0.03836 0.2069 2.58153 -2.66251 -0 -0 -2.20934 -0.5804 0 0 0 0 0 0.06854 0.13314 0 3.39542 -0.05764 0 -0.18838 -0.0609 0.55623 0.76746
SER_31 -3.81998 0.25371 5.00577 -0.02612 0 0.06112 2.27536 -2.2861 -0 -0 -2.38291 -0.62615 0 0 0 0 0 0.02476 0.00068 0.57682 0 0.35828 0.60009 -0.77834 0.15048 0.15962 -0.45292
ARG_32 -5.09403 0.16122 5.6589 -0.65954 0.2398 0.35718 2.74348 -2.66312 -0.01073 -0.12087 -2.773 0.40146 0 0 0 -0.91215 0 0.03637 0.04791 2.55079 0 -0.16046 0 -1.2888 -0.04918 0.24851 -1.28626
VAL_33 -8.11552 1.1363 3.37855 -0.31795 0.21775 0.07188 2.2729 -2.77995 -0 -0 -1.41445 -0.07626 0 0 0 0 0 -0.02364 0.22859 0.03094 0 -0.3076 0 1.9342 -0.24724 0.47768 -3.5338
ILE_34 -3.99263 0.20141 3.9932 -0.65811 0.46227 0.14899 1.67589 -2.01442 -0.00773 -0.05307 -0.95196 0.23729 0 0 0 0 0 -0.05233 0.03098 0.61686 0 -0.46652 0 0.73287 0.0066 0.58524 0.49481
GLN_35 -3.62477 0.16467 4.0268 -0.39256 0.07943 0.21906 1.90081 -1.88764 -0.01073 -0.12087 -1.58449 -0.49426 0 0 0 -0.91215 0 -0.03088 0.06504 0 3.42697 0.03651 0 -0.18838 0.07835 0.46826 1.21916
GLY_36 -2.04731 0.12779 2.19832 -6e-05 0 0 0.74462 -1.16594 -0 -0 -1.36398 -0.37113 0 0 0 0 0 -0.02078 0 0 0 0.28962 0 0.83697 0.11953 0.41086 -0.24148
LEU:CtermProteinFull_37 -4.11301 0.51134 1.68321 -0.7195 0.22758 0.55516 1.1584 -1.31627 -0 -0 -0.66608 0.07671 0 0 0 0 0 0 0.04142 0.79172 0 0 0 0.18072 0.04152 0.80018 -0.74692
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691858 DOMAINID 682972 MODEL 5 pep5_AB
MODEL     5
REMARK    Rerank model05.pdb score: 20.189
REMARK    S_0000_0008
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE           omega:          -0.122
REMARK    SCORE          fa_sol:         132.666
REMARK    SCORE          fa_atr:        -217.200
REMARK    SCORE fa_intra_sol_xover4:           9.008
REMARK    SCORE          fa_dun:          55.153
REMARK    SCORE             ref:           9.796
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE        hbond_sc:          -8.965
REMARK    SCORE     hbond_bb_sc:          -3.203
REMARK    SCORE    fa_intra_rep:           0.462
REMARK    SCORE           score:         -85.089
REMARK    SCORE     rama_prepro:           1.277
REMARK    SCORE     hbond_lr_bb:           0.000
REMARK    SCORE         p_aa_pp:          -2.558
REMARK    SCORE     hbond_sr_bb:         -27.223
REMARK    SCORE     total_score:         -85.089
REMARK    SCORE         fa_elec:         -72.892
REMARK    SCORE          fa_rep:          21.830
REMARK    SCORE     cart_bonded:          21.508
REMARK    SCORE     lk_ball_wtd:          -4.627
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE       dslf_fa13:           0.000
ATOM      1  N   ASP A   1       0.417   0.069  -0.163  1.00  6.27           N  
ATOM      2  CA  ASP A   1       1.873   0.115  -0.145  1.00  5.92           C  
ATOM      3  C   ASP A   1       2.412   1.551  -0.120  1.00  5.80           C  
ATOM      4  O   ASP A   1       1.643   2.524  -0.059  1.00  5.70           O  
ATOM      5  CB  ASP A   1       2.424  -0.710  -1.333  1.00  6.43           C  
ATOM      6  CG  ASP A   1       2.030  -0.150  -2.718  1.00  6.43           C  
ATOM      7  OD1 ASP A   1       1.556   0.971  -2.754  1.00  6.43           O  
ATOM      8  OD2 ASP A   1       2.183  -0.845  -3.706  1.00  6.43           O  
ATOM      9 1H   ASP A   1       0.093  -0.785   0.268  1.00  7.52           H  
ATOM     10 2H   ASP A   1       0.048   0.865   0.337  1.00  7.52           H  
ATOM     11 3H   ASP A   1       0.107   0.105  -1.126  1.00  7.52           H  
ATOM     12  HA  ASP A   1       2.211  -0.375   0.768  1.00  7.10           H  
ATOM     13 1HB  ASP A   1       3.508  -0.765  -1.276  1.00  7.72           H  
ATOM     14 2HB  ASP A   1       2.050  -1.734  -1.260  1.00  7.72           H  
ATOM     15  N   TRP A   2       3.747   1.677  -0.118  1.00  5.84           N  
ATOM     16  CA  TRP A   2       4.396   2.984  -0.085  1.00  5.82           C  
ATOM     17  C   TRP A   2       4.036   3.823  -1.277  1.00  5.74           C  
ATOM     18  O   TRP A   2       3.797   5.023  -1.144  1.00  5.69           O  
ATOM     19  CB  TRP A   2       5.918   2.886  -0.026  1.00  6.16           C  
ATOM     20  CG  TRP A   2       6.559   4.255  -0.028  1.00  6.16           C  
ATOM     21  CD1 TRP A   2       6.767   5.033   1.065  1.00  6.16           C  
ATOM     22  CD2 TRP A   2       7.077   5.017  -1.163  1.00  6.16           C  
ATOM     23  NE1 TRP A   2       7.356   6.216   0.700  1.00  6.16           N  
ATOM     24  CE2 TRP A   2       7.551   6.222  -0.656  1.00  6.16           C  
ATOM     25  CE3 TRP A   2       7.167   4.776  -2.535  1.00  6.16           C  
ATOM     26  CZ2 TRP A   2       8.108   7.192  -1.472  1.00  6.16           C  
ATOM     27  CZ3 TRP A   2       7.721   5.749  -3.348  1.00  6.16           C  
ATOM     28  CH2 TRP A   2       8.179   6.921  -2.832  1.00  6.16           C  
ATOM     29  H   TRP A   2       4.327   0.849  -0.141  1.00  7.01           H  
ATOM     30  HA  TRP A   2       4.057   3.508   0.809  1.00  6.98           H  
ATOM     31 1HB  TRP A   2       6.223   2.359   0.876  1.00  7.39           H  
ATOM     32 2HB  TRP A   2       6.288   2.329  -0.884  1.00  7.39           H  
ATOM     33  HD1 TRP A   2       6.496   4.761   2.083  1.00  7.39           H  
ATOM     34  HE1 TRP A   2       7.606   6.963   1.330  1.00  7.39           H  
ATOM     35  HE3 TRP A   2       6.810   3.846  -2.956  1.00  7.39           H  
ATOM     36  HZ2 TRP A   2       8.478   8.138  -1.081  1.00  7.39           H  
ATOM     37  HZ3 TRP A   2       7.785   5.560  -4.410  1.00  7.39           H  
ATOM     38  HH2 TRP A   2       8.607   7.665  -3.504  1.00  7.39           H  
ATOM     39  N   PHE A   3       4.056   3.205  -2.451  1.00  5.79           N  
ATOM     40  CA  PHE A   3       3.807   3.922  -3.677  1.00  5.81           C  
ATOM     41  C   PHE A   3       2.447   4.548  -3.670  1.00  5.69           C  
ATOM     42  O   PHE A   3       2.331   5.714  -4.027  1.00  5.68           O  
ATOM     43  CB  PHE A   3       3.955   2.990  -4.860  1.00  6.13           C  
ATOM     44  CG  PHE A   3       5.366   2.720  -5.179  1.00  6.13           C  
ATOM     45  CD1 PHE A   3       5.976   1.547  -4.768  1.00  6.13           C  
ATOM     46  CD2 PHE A   3       6.107   3.646  -5.889  1.00  6.13           C  
ATOM     47  CE1 PHE A   3       7.300   1.313  -5.062  1.00  6.13           C  
ATOM     48  CE2 PHE A   3       7.425   3.413  -6.188  1.00  6.13           C  
ATOM     49  CZ  PHE A   3       8.024   2.246  -5.772  1.00  6.13           C  
ATOM     50  H   PHE A   3       4.234   2.214  -2.482  1.00  6.95           H  
ATOM     51  HA  PHE A   3       4.544   4.716  -3.769  1.00  6.97           H  
ATOM     52 1HB  PHE A   3       3.458   2.041  -4.638  1.00  7.36           H  
ATOM     53 2HB  PHE A   3       3.476   3.409  -5.725  1.00  7.36           H  
ATOM     54  HD1 PHE A   3       5.402   0.805  -4.208  1.00  7.36           H  
ATOM     55  HD2 PHE A   3       5.636   4.570  -6.211  1.00  7.36           H  
ATOM     56  HE1 PHE A   3       7.776   0.388  -4.736  1.00  7.36           H  
ATOM     57  HE2 PHE A   3       8.000   4.151  -6.750  1.00  7.36           H  
ATOM     58  HZ  PHE A   3       9.071   2.058  -6.005  1.00  7.36           H  
ATOM     59  N   LYS A   4       1.414   3.825  -3.233  1.00  5.65           N  
ATOM     60  CA  LYS A   4       0.109   4.457  -3.197  1.00  5.60           C  
ATOM     61  C   LYS A   4       0.138   5.644  -2.256  1.00  5.49           C  
ATOM     62  O   LYS A   4      -0.291   6.739  -2.619  1.00  5.48           O  
ATOM     63  CB  LYS A   4      -0.988   3.510  -2.734  1.00  5.87           C  
ATOM     64  CG  LYS A   4      -2.397   4.155  -2.753  1.00  5.87           C  
ATOM     65  CD  LYS A   4      -3.479   3.171  -2.324  1.00  5.87           C  
ATOM     66  CE  LYS A   4      -4.903   3.738  -2.535  1.00  5.87           C  
ATOM     67  NZ  LYS A   4      -5.259   4.860  -1.588  1.00  5.87           N  
ATOM     68  H   LYS A   4       1.534   2.833  -2.972  1.00  6.78           H  
ATOM     69  HA  LYS A   4      -0.135   4.816  -4.195  1.00  6.72           H  
ATOM     70 1HB  LYS A   4      -0.988   2.625  -3.353  1.00  7.04           H  
ATOM     71 2HB  LYS A   4      -0.774   3.189  -1.714  1.00  7.04           H  
ATOM     72 1HG  LYS A   4      -2.418   5.011  -2.074  1.00  7.04           H  
ATOM     73 2HG  LYS A   4      -2.618   4.521  -3.756  1.00  7.04           H  
ATOM     74 1HD  LYS A   4      -3.377   2.245  -2.886  1.00  7.04           H  
ATOM     75 2HD  LYS A   4      -3.350   2.946  -1.268  1.00  7.04           H  
ATOM     76 1HE  LYS A   4      -4.989   4.107  -3.555  1.00  7.04           H  
ATOM     77 2HE  LYS A   4      -5.613   2.926  -2.393  1.00  7.04           H  
ATOM     78 1HZ  LYS A   4      -6.196   5.165  -1.778  1.00  7.04           H  
ATOM     79 2HZ  LYS A   4      -5.202   4.538  -0.639  1.00  7.04           H  
ATOM     80 3HZ  LYS A   4      -4.636   5.684  -1.693  1.00  7.04           H  
ATOM     81  N   ALA A   5       0.673   5.461  -1.038  1.00  5.46           N  
ATOM     82  CA  ALA A   5       0.653   6.564  -0.085  1.00  5.44           C  
ATOM     83  C   ALA A   5       1.362   7.782  -0.651  1.00  5.42           C  
ATOM     84  O   ALA A   5       0.860   8.904  -0.547  1.00  5.40           O  
ATOM     85  CB  ALA A   5       1.319   6.141   1.210  1.00  5.63           C  
ATOM     86  H   ALA A   5       1.058   4.547  -0.774  1.00  6.55           H  
ATOM     87  HA  ALA A   5      -0.387   6.829   0.105  1.00  6.53           H  
ATOM     88 1HB  ALA A   5       1.285   6.959   1.923  1.00  6.76           H  
ATOM     89 2HB  ALA A   5       0.798   5.276   1.617  1.00  6.76           H  
ATOM     90 3HB  ALA A   5       2.360   5.874   1.006  1.00  6.76           H  
ATOM     91  N   PHE A   6       2.493   7.546  -1.308  1.00  5.49           N  
ATOM     92  CA  PHE A   6       3.262   8.579  -1.959  1.00  5.55           C  
ATOM     93  C   PHE A   6       2.445   9.275  -3.027  1.00  5.51           C  
ATOM     94  O   PHE A   6       2.347  10.506  -3.038  1.00  5.52           O  
ATOM     95  CB  PHE A   6       4.547   7.958  -2.502  1.00  5.75           C  
ATOM     96  CG  PHE A   6       5.338   8.768  -3.457  1.00  5.75           C  
ATOM     97  CD1 PHE A   6       5.987   9.926  -3.101  1.00  5.75           C  
ATOM     98  CD2 PHE A   6       5.477   8.298  -4.742  1.00  5.75           C  
ATOM     99  CE1 PHE A   6       6.734  10.615  -4.038  1.00  5.75           C  
ATOM    100  CE2 PHE A   6       6.217   8.967  -5.676  1.00  5.75           C  
ATOM    101  CZ  PHE A   6       6.844  10.135  -5.328  1.00  5.75           C  
ATOM    102  H   PHE A   6       2.858   6.591  -1.337  1.00  6.59           H  
ATOM    103  HA  PHE A   6       3.537   9.319  -1.209  1.00  6.66           H  
ATOM    104 1HB  PHE A   6       5.186   7.705  -1.664  1.00  6.90           H  
ATOM    105 2HB  PHE A   6       4.302   7.022  -2.982  1.00  6.90           H  
ATOM    106  HD1 PHE A   6       5.901  10.300  -2.082  1.00  6.90           H  
ATOM    107  HD2 PHE A   6       4.986   7.366  -4.998  1.00  6.90           H  
ATOM    108  HE1 PHE A   6       7.239  11.539  -3.757  1.00  6.90           H  
ATOM    109  HE2 PHE A   6       6.305   8.573  -6.695  1.00  6.90           H  
ATOM    110  HZ  PHE A   6       7.434  10.675  -6.066  1.00  6.90           H  
ATOM    111  N   TYR A   7       1.830   8.499  -3.911  1.00  5.54           N  
ATOM    112  CA  TYR A   7       1.076   9.058  -5.008  1.00  5.60           C  
ATOM    113  C   TYR A   7      -0.089   9.915  -4.533  1.00  5.52           C  
ATOM    114  O   TYR A   7      -0.319  11.018  -5.055  1.00  5.55           O  
ATOM    115  CB  TYR A   7       0.485   7.933  -5.859  1.00  5.82           C  
ATOM    116  CG  TYR A   7       1.453   6.977  -6.545  1.00  5.82           C  
ATOM    117  CD1 TYR A   7       2.773   7.268  -6.656  1.00  5.82           C  
ATOM    118  CD2 TYR A   7       0.975   5.790  -7.077  1.00  5.82           C  
ATOM    119  CE1 TYR A   7       3.628   6.412  -7.276  1.00  5.82           C  
ATOM    120  CE2 TYR A   7       1.836   4.918  -7.710  1.00  5.82           C  
ATOM    121  CZ  TYR A   7       3.174   5.245  -7.805  1.00  5.82           C  
ATOM    122  OH  TYR A   7       4.080   4.411  -8.417  1.00  5.82           O  
ATOM    123  H   TYR A   7       1.936   7.484  -3.852  1.00  6.65           H  
ATOM    124  HA  TYR A   7       1.733   9.701  -5.581  1.00  6.72           H  
ATOM    125 1HB  TYR A   7      -0.207   7.344  -5.254  1.00  6.98           H  
ATOM    126 2HB  TYR A   7      -0.071   8.393  -6.608  1.00  6.98           H  
ATOM    127  HD1 TYR A   7       3.157   8.173  -6.252  1.00  6.98           H  
ATOM    128  HD2 TYR A   7      -0.070   5.553  -6.993  1.00  6.98           H  
ATOM    129  HE1 TYR A   7       4.684   6.664  -7.350  1.00  6.98           H  
ATOM    130  HE2 TYR A   7       1.464   3.983  -8.128  1.00  6.98           H  
ATOM    131  HH  TYR A   7       4.949   4.843  -8.421  1.00  6.98           H  
ATOM    132  N   ASP A   8      -0.808   9.428  -3.513  1.00  5.46           N  
ATOM    133  CA  ASP A   8      -1.953  10.153  -3.001  1.00  5.49           C  
ATOM    134  C   ASP A   8      -1.518  11.463  -2.376  1.00  5.44           C  
ATOM    135  O   ASP A   8      -2.134  12.500  -2.633  1.00  5.49           O  
ATOM    136  CB  ASP A   8      -2.690   9.343  -1.923  1.00  5.68           C  
ATOM    137  CG  ASP A   8      -3.488   8.101  -2.415  1.00  5.68           C  
ATOM    138  OD1 ASP A   8      -3.696   7.934  -3.590  1.00  5.68           O  
ATOM    139  OD2 ASP A   8      -3.919   7.339  -1.561  1.00  5.68           O  
ATOM    140  H   ASP A   8      -0.573   8.506  -3.130  1.00  6.55           H  
ATOM    141  HA  ASP A   8      -2.632  10.364  -3.826  1.00  6.59           H  
ATOM    142 1HB  ASP A   8      -1.948   8.990  -1.197  1.00  6.82           H  
ATOM    143 2HB  ASP A   8      -3.371  10.005  -1.383  1.00  6.82           H  
ATOM    144  N   LYS A   9      -0.423  11.431  -1.599  1.00  5.40           N  
ATOM    145  CA  LYS A   9       0.078  12.629  -0.943  1.00  5.43           C  
ATOM    146  C   LYS A   9       0.536  13.677  -1.941  1.00  5.41           C  
ATOM    147  O   LYS A   9       0.263  14.863  -1.746  1.00  5.45           O  
ATOM    148  CB  LYS A   9       1.199  12.276   0.031  1.00  5.59           C  
ATOM    149  CG  LYS A   9       0.711  11.544   1.290  1.00  5.59           C  
ATOM    150  CD  LYS A   9       1.865  11.151   2.208  1.00  5.59           C  
ATOM    151  CE  LYS A   9       1.363  10.398   3.441  1.00  5.59           C  
ATOM    152  NZ  LYS A   9       2.481   9.996   4.352  1.00  5.59           N  
ATOM    153  H   LYS A   9       0.034  10.531  -1.417  1.00  6.48           H  
ATOM    154  HA  LYS A   9      -0.743  13.062  -0.366  1.00  6.52           H  
ATOM    155 1HB  LYS A   9       1.921  11.628  -0.477  1.00  6.71           H  
ATOM    156 2HB  LYS A   9       1.719  13.181   0.333  1.00  6.71           H  
ATOM    157 1HG  LYS A   9       0.036  12.205   1.837  1.00  6.71           H  
ATOM    158 2HG  LYS A   9       0.150  10.661   1.008  1.00  6.71           H  
ATOM    159 1HD  LYS A   9       2.552  10.504   1.657  1.00  6.71           H  
ATOM    160 2HD  LYS A   9       2.404  12.041   2.527  1.00  6.71           H  
ATOM    161 1HE  LYS A   9       0.671  11.033   3.989  1.00  6.71           H  
ATOM    162 2HE  LYS A   9       0.837   9.500   3.113  1.00  6.71           H  
ATOM    163 1HZ  LYS A   9       2.104   9.499   5.148  1.00  6.71           H  
ATOM    164 2HZ  LYS A   9       3.123   9.395   3.857  1.00  6.71           H  
ATOM    165 3HZ  LYS A   9       2.971  10.819   4.674  1.00  6.71           H  
ATOM    166  N   VAL A  10       1.207  13.256  -3.021  1.00  5.42           N  
ATOM    167  CA  VAL A  10       1.644  14.215  -4.022  1.00  5.48           C  
ATOM    168  C   VAL A  10       0.444  14.899  -4.645  1.00  5.47           C  
ATOM    169  O   VAL A  10       0.462  16.116  -4.832  1.00  5.50           O  
ATOM    170  CB  VAL A  10       2.514  13.553  -5.116  1.00  5.64           C  
ATOM    171  CG1 VAL A  10       2.761  14.536  -6.298  1.00  5.64           C  
ATOM    172  CG2 VAL A  10       3.876  13.160  -4.506  1.00  5.64           C  
ATOM    173  H   VAL A  10       1.443  12.260  -3.111  1.00  6.50           H  
ATOM    174  HA  VAL A  10       2.250  14.968  -3.524  1.00  6.58           H  
ATOM    175  HB  VAL A  10       1.997  12.668  -5.497  1.00  6.77           H  
ATOM    176 1HG1 VAL A  10       3.370  14.053  -7.044  1.00  6.77           H  
ATOM    177 2HG1 VAL A  10       1.819  14.831  -6.754  1.00  6.77           H  
ATOM    178 3HG1 VAL A  10       3.275  15.418  -5.944  1.00  6.77           H  
ATOM    179 1HG2 VAL A  10       4.504  12.686  -5.252  1.00  6.77           H  
ATOM    180 2HG2 VAL A  10       4.374  14.054  -4.135  1.00  6.77           H  
ATOM    181 3HG2 VAL A  10       3.721  12.468  -3.683  1.00  6.77           H  
ATOM    182  N   ALA A  11      -0.584  14.134  -5.010  1.00  5.50           N  
ATOM    183  CA  ALA A  11      -1.756  14.756  -5.593  1.00  5.57           C  
ATOM    184  C   ALA A  11      -2.412  15.741  -4.629  1.00  5.56           C  
ATOM    185  O   ALA A  11      -2.676  16.896  -4.969  1.00  5.62           O  
ATOM    186  CB  ALA A  11      -2.755  13.682  -5.957  1.00  5.78           C  
ATOM    187  H   ALA A  11      -0.542  13.114  -4.890  1.00  6.60           H  
ATOM    188  HA  ALA A  11      -1.443  15.300  -6.483  1.00  6.68           H  
ATOM    189 1HB  ALA A  11      -3.637  14.112  -6.407  1.00  6.94           H  
ATOM    190 2HB  ALA A  11      -2.274  13.014  -6.641  1.00  6.94           H  
ATOM    191 3HB  ALA A  11      -3.043  13.139  -5.057  1.00  6.94           H  
ATOM    192  N   GLU A  12      -2.565  15.347  -3.366  1.00  5.53           N  
ATOM    193  CA  GLU A  12      -3.218  16.226  -2.407  1.00  5.59           C  
ATOM    194  C   GLU A  12      -2.467  17.538  -2.181  1.00  5.55           C  
ATOM    195  O   GLU A  12      -3.082  18.615  -2.098  1.00  5.64           O  
ATOM    196  CB  GLU A  12      -3.345  15.501  -1.066  1.00  5.81           C  
ATOM    197  CG  GLU A  12      -4.345  14.349  -1.041  1.00  5.81           C  
ATOM    198  CD  GLU A  12      -4.245  13.543   0.233  1.00  5.81           C  
ATOM    199  OE1 GLU A  12      -3.354  13.815   1.006  1.00  5.81           O  
ATOM    200  OE2 GLU A  12      -5.052  12.658   0.430  1.00  5.81           O  
ATOM    201  H   GLU A  12      -2.299  14.398  -3.084  1.00  6.64           H  
ATOM    202  HA  GLU A  12      -4.213  16.457  -2.785  1.00  6.71           H  
ATOM    203 1HB  GLU A  12      -2.369  15.096  -0.792  1.00  6.97           H  
ATOM    204 2HB  GLU A  12      -3.629  16.214  -0.293  1.00  6.97           H  
ATOM    205 1HG  GLU A  12      -5.351  14.760  -1.121  1.00  6.97           H  
ATOM    206 2HG  GLU A  12      -4.184  13.706  -1.899  1.00  6.97           H  
ATOM    207  N   LYS A  13      -1.134  17.452  -2.104  1.00  5.48           N  
ATOM    208  CA  LYS A  13      -0.283  18.605  -1.853  1.00  5.51           C  
ATOM    209  C   LYS A  13      -0.055  19.527  -3.043  1.00  5.53           C  
ATOM    210  O   LYS A  13      -0.040  20.750  -2.876  1.00  5.61           O  
ATOM    211  CB  LYS A  13       1.075  18.143  -1.336  1.00  5.70           C  
ATOM    212  CG  LYS A  13       1.064  17.575   0.068  1.00  5.70           C  
ATOM    213  CD  LYS A  13       2.459  17.130   0.483  1.00  5.70           C  
ATOM    214  CE  LYS A  13       2.466  16.568   1.901  1.00  5.70           C  
ATOM    215  NZ  LYS A  13       3.830  16.125   2.322  1.00  5.70           N  
ATOM    216  H   LYS A  13      -0.699  16.525  -2.160  1.00  6.58           H  
ATOM    217  HA  LYS A  13      -0.758  19.197  -1.073  1.00  6.61           H  
ATOM    218 1HB  LYS A  13       1.447  17.357  -1.995  1.00  6.84           H  
ATOM    219 2HB  LYS A  13       1.785  18.969  -1.378  1.00  6.84           H  
ATOM    220 1HG  LYS A  13       0.701  18.332   0.762  1.00  6.84           H  
ATOM    221 2HG  LYS A  13       0.386  16.719   0.103  1.00  6.84           H  
ATOM    222 1HD  LYS A  13       2.803  16.355  -0.207  1.00  6.84           H  
ATOM    223 2HD  LYS A  13       3.145  17.974   0.425  1.00  6.84           H  
ATOM    224 1HE  LYS A  13       2.117  17.336   2.590  1.00  6.84           H  
ATOM    225 2HE  LYS A  13       1.788  15.714   1.949  1.00  6.84           H  
ATOM    226 1HZ  LYS A  13       3.790  15.761   3.264  1.00  6.84           H  
ATOM    227 2HZ  LYS A  13       4.158  15.402   1.696  1.00  6.84           H  
ATOM    228 3HZ  LYS A  13       4.466  16.909   2.294  1.00  6.84           H  
ATOM    229  N   PHE A  14       0.133  18.968  -4.239  1.00  5.53           N  
ATOM    230  CA  PHE A  14       0.495  19.807  -5.370  1.00  5.63           C  
ATOM    231  C   PHE A  14      -0.573  19.969  -6.459  1.00  5.57           C  
ATOM    232  O   PHE A  14      -0.431  20.841  -7.316  1.00  5.57           O  
ATOM    233  CB  PHE A  14       1.774  19.231  -5.969  1.00  5.84           C  
ATOM    234  CG  PHE A  14       2.876  19.161  -4.952  1.00  5.84           C  
ATOM    235  CD1 PHE A  14       3.166  17.958  -4.342  1.00  5.84           C  
ATOM    236  CD2 PHE A  14       3.606  20.273  -4.590  1.00  5.84           C  
ATOM    237  CE1 PHE A  14       4.149  17.846  -3.400  1.00  5.84           C  
ATOM    238  CE2 PHE A  14       4.600  20.172  -3.638  1.00  5.84           C  
ATOM    239  CZ  PHE A  14       4.870  18.954  -3.043  1.00  5.84           C  
ATOM    240  H   PHE A  14       0.119  17.951  -4.355  1.00  6.64           H  
ATOM    241  HA  PHE A  14       0.720  20.800  -4.988  1.00  6.76           H  
ATOM    242 1HB  PHE A  14       1.588  18.221  -6.354  1.00  7.01           H  
ATOM    243 2HB  PHE A  14       2.111  19.851  -6.795  1.00  7.01           H  
ATOM    244  HD1 PHE A  14       2.598  17.093  -4.620  1.00  7.01           H  
ATOM    245  HD2 PHE A  14       3.388  21.235  -5.059  1.00  7.01           H  
ATOM    246  HE1 PHE A  14       4.353  16.881  -2.937  1.00  7.01           H  
ATOM    247  HE2 PHE A  14       5.174  21.055  -3.354  1.00  7.01           H  
ATOM    248  HZ  PHE A  14       5.655  18.876  -2.293  1.00  7.01           H  
ATOM    249  N   LYS A  15      -1.625  19.137  -6.446  1.00  5.60           N  
ATOM    250  CA  LYS A  15      -2.692  19.116  -7.452  1.00  5.68           C  
ATOM    251  C   LYS A  15      -2.171  18.786  -8.852  1.00  5.67           C  
ATOM    252  O   LYS A  15      -2.759  19.161  -9.867  1.00  5.81           O  
ATOM    253  CB  LYS A  15      -3.460  20.442  -7.473  1.00  5.92           C  
ATOM    254  CG  LYS A  15      -3.970  20.921  -6.091  1.00  5.92           C  
ATOM    255  CD  LYS A  15      -4.945  19.907  -5.452  1.00  5.92           C  
ATOM    256  CE  LYS A  15      -5.652  20.469  -4.208  1.00  5.92           C  
ATOM    257  NZ  LYS A  15      -4.708  20.713  -3.055  1.00  5.92           N  
ATOM    258  H   LYS A  15      -1.738  18.437  -5.709  1.00  6.72           H  
ATOM    259  HA  LYS A  15      -3.389  18.322  -7.175  1.00  6.82           H  
ATOM    260 1HB  LYS A  15      -2.841  21.226  -7.905  1.00  7.10           H  
ATOM    261 2HB  LYS A  15      -4.336  20.329  -8.117  1.00  7.10           H  
ATOM    262 1HG  LYS A  15      -3.119  21.069  -5.427  1.00  7.10           H  
ATOM    263 2HG  LYS A  15      -4.481  21.873  -6.216  1.00  7.10           H  
ATOM    264 1HD  LYS A  15      -5.695  19.594  -6.189  1.00  7.10           H  
ATOM    265 2HD  LYS A  15      -4.391  19.016  -5.137  1.00  7.10           H  
ATOM    266 1HE  LYS A  15      -6.138  21.405  -4.471  1.00  7.10           H  
ATOM    267 2HE  LYS A  15      -6.412  19.754  -3.891  1.00  7.10           H  
ATOM    268 1HZ  LYS A  15      -5.219  21.072  -2.266  1.00  7.10           H  
ATOM    269 2HZ  LYS A  15      -4.235  19.828  -2.776  1.00  7.10           H  
ATOM    270 3HZ  LYS A  15      -4.002  21.377  -3.321  1.00  7.10           H  
ATOM    271  N   GLU A  16      -1.083  18.034  -8.881  1.00  5.60           N  
ATOM    272  CA  GLU A  16      -0.458  17.532 -10.093  1.00  5.68           C  
ATOM    273  C   GLU A  16       0.231  16.231  -9.753  1.00  5.59           C  
ATOM    274  O   GLU A  16       0.673  16.029  -8.625  1.00  5.67           O  
ATOM    275  CB  GLU A  16       0.552  18.519 -10.694  1.00  5.92           C  
ATOM    276  CG  GLU A  16       1.780  18.826  -9.833  1.00  5.92           C  
ATOM    277  CD  GLU A  16       2.751  19.771 -10.529  1.00  5.92           C  
ATOM    278  OE1 GLU A  16       2.489  20.123 -11.655  1.00  5.92           O  
ATOM    279  OE2 GLU A  16       3.745  20.139  -9.941  1.00  5.92           O  
ATOM    280  H   GLU A  16      -0.685  17.804  -7.983  1.00  6.72           H  
ATOM    281  HA  GLU A  16      -1.227  17.335 -10.841  1.00  6.82           H  
ATOM    282 1HB  GLU A  16       0.910  18.128 -11.646  1.00  7.10           H  
ATOM    283 2HB  GLU A  16       0.049  19.465 -10.897  1.00  7.10           H  
ATOM    284 1HG  GLU A  16       1.434  19.289  -8.922  1.00  7.10           H  
ATOM    285 2HG  GLU A  16       2.294  17.903  -9.574  1.00  7.10           H  
ATOM    286  N   ALA A  17       0.348  15.349 -10.725  1.00  5.49           N  
ATOM    287  CA  ALA A  17       1.074  14.122 -10.494  1.00  5.43           C  
ATOM    288  C   ALA A  17       2.472  14.247 -11.075  1.00  5.35           C  
ATOM    289  O   ALA A  17       2.641  14.393 -12.285  1.00  5.34           O  
ATOM    290  CB  ALA A  17       0.324  12.946 -11.093  1.00  5.63           C  
ATOM    291  H   ALA A  17      -0.043  15.548 -11.635  1.00  6.59           H  
ATOM    292  HA  ALA A  17       1.171  13.964  -9.420  1.00  6.52           H  
ATOM    293 1HB  ALA A  17       0.874  12.044 -10.897  1.00  6.76           H  
ATOM    294 2HB  ALA A  17      -0.655  12.883 -10.638  1.00  6.76           H  
ATOM    295 3HB  ALA A  17       0.216  13.088 -12.164  1.00  6.76           H  
ATOM    296  N   PHE A  18       3.467  14.176 -10.211  1.00  5.38           N  
ATOM    297  CA  PHE A  18       4.859  14.274 -10.614  1.00  5.41           C  
ATOM    298  C   PHE A  18       5.088  13.043 -11.475  1.00  5.39           C  
ATOM    299  O   PHE A  18       4.463  12.039 -11.194  1.00  5.38           O  
ATOM    300  CB  PHE A  18       5.763  14.220  -9.377  1.00  5.56           C  
ATOM    301  CG  PHE A  18       5.669  15.398  -8.434  1.00  5.56           C  
ATOM    302  CD1 PHE A  18       5.084  16.619  -8.794  1.00  5.56           C  
ATOM    303  CD2 PHE A  18       6.197  15.282  -7.152  1.00  5.56           C  
ATOM    304  CE1 PHE A  18       5.044  17.657  -7.900  1.00  5.56           C  
ATOM    305  CE2 PHE A  18       6.149  16.335  -6.272  1.00  5.56           C  
ATOM    306  CZ  PHE A  18       5.578  17.516  -6.654  1.00  5.56           C  
ATOM    307  H   PHE A  18       3.237  14.099  -9.228  1.00  6.46           H  
ATOM    308  HA  PHE A  18       5.014  15.182 -11.188  1.00  6.49           H  
ATOM    309 1HB  PHE A  18       5.523  13.327  -8.804  1.00  6.67           H  
ATOM    310 2HB  PHE A  18       6.800  14.126  -9.686  1.00  6.67           H  
ATOM    311  HD1 PHE A  18       4.651  16.772  -9.779  1.00  6.67           H  
ATOM    312  HD2 PHE A  18       6.658  14.343  -6.843  1.00  6.67           H  
ATOM    313  HE1 PHE A  18       4.586  18.608  -8.192  1.00  6.67           H  
ATOM    314  HE2 PHE A  18       6.568  16.237  -5.272  1.00  6.67           H  
ATOM    315  HZ  PHE A  18       5.547  18.349  -5.962  1.00  6.67           H  
ATOM    316  N   PRO A  19       5.959  13.015 -12.491  1.00  5.46           N  
ATOM    317  CA  PRO A  19       6.200  11.835 -13.332  1.00  5.50           C  
ATOM    318  C   PRO A  19       6.387  10.516 -12.550  1.00  5.49           C  
ATOM    319  O   PRO A  19       5.830   9.478 -12.923  1.00  5.50           O  
ATOM    320  CB  PRO A  19       7.493  12.243 -14.048  1.00  5.75           C  
ATOM    321  CG  PRO A  19       7.399  13.761 -14.153  1.00  5.75           C  
ATOM    322  CD  PRO A  19       6.761  14.206 -12.846  1.00  5.75           C  
ATOM    323  HA  PRO A  19       5.376  11.742 -14.055  1.00  6.60           H  
ATOM    324 1HB  PRO A  19       8.369  11.901 -13.470  1.00  6.90           H  
ATOM    325 2HB  PRO A  19       7.548  11.755 -15.031  1.00  6.90           H  
ATOM    326 1HG  PRO A  19       8.401  14.196 -14.310  1.00  6.90           H  
ATOM    327 2HG  PRO A  19       6.794  14.041 -15.031  1.00  6.90           H  
ATOM    328 1HD  PRO A  19       7.519  14.426 -12.081  1.00  6.90           H  
ATOM    329 2HD  PRO A  19       6.116  15.072 -13.060  1.00  6.90           H  
ATOM    330  N   ASP A  20       7.042  10.582 -11.378  1.00  5.51           N  
ATOM    331  CA  ASP A  20       7.278   9.404 -10.526  1.00  5.55           C  
ATOM    332  C   ASP A  20       6.000   8.876  -9.866  1.00  5.47           C  
ATOM    333  O   ASP A  20       5.999   7.833  -9.206  1.00  5.50           O  
ATOM    334  CB  ASP A  20       8.308   9.748  -9.460  1.00  5.75           C  
ATOM    335  CG  ASP A  20       9.733   9.945 -10.033  1.00  5.75           C  
ATOM    336  OD1 ASP A  20      10.064   9.427 -11.098  1.00  5.75           O  
ATOM    337  OD2 ASP A  20      10.467  10.656  -9.402  1.00  5.75           O  
ATOM    338  H   ASP A  20       7.476  11.449 -11.096  1.00  6.61           H  
ATOM    339  HA  ASP A  20       7.675   8.612 -11.146  1.00  6.66           H  
ATOM    340 1HB  ASP A  20       8.004  10.661  -8.948  1.00  6.90           H  
ATOM    341 2HB  ASP A  20       8.337   8.953  -8.715  1.00  6.90           H  
ATOM    342  N   VAL A  21       4.930   9.624 -10.048  1.00  5.43           N  
ATOM    343  CA  VAL A  21       3.598   9.361  -9.584  1.00  5.42           C  
ATOM    344  C   VAL A  21       2.716   9.061 -10.775  1.00  5.38           C  
ATOM    345  O   VAL A  21       2.159   7.965 -10.904  1.00  5.39           O  
ATOM    346  CB  VAL A  21       3.061  10.598  -8.817  1.00  5.59           C  
ATOM    347  CG1 VAL A  21       1.652  10.401  -8.394  1.00  5.59           C  
ATOM    348  CG2 VAL A  21       3.949  10.855  -7.649  1.00  5.59           C  
ATOM    349  H   VAL A  21       5.045  10.461 -10.604  1.00  6.52           H  
ATOM    350  HA  VAL A  21       3.620   8.504  -8.937  1.00  6.50           H  
ATOM    351  HB  VAL A  21       3.062  11.453  -9.449  1.00  6.71           H  
ATOM    352 1HG1 VAL A  21       1.290  11.278  -7.851  1.00  6.71           H  
ATOM    353 2HG1 VAL A  21       1.042  10.249  -9.259  1.00  6.71           H  
ATOM    354 3HG1 VAL A  21       1.595   9.559  -7.785  1.00  6.71           H  
ATOM    355 1HG2 VAL A  21       3.594  11.712  -7.125  1.00  6.71           H  
ATOM    356 2HG2 VAL A  21       3.944  10.016  -6.996  1.00  6.71           H  
ATOM    357 3HG2 VAL A  21       4.965  11.034  -7.990  1.00  6.71           H  
ATOM    358  N   CYS A  22       2.654  10.020 -11.696  1.00  5.37           N  
ATOM    359  CA  CYS A  22       1.763  10.006 -12.842  1.00  5.41           C  
ATOM    360  C   CYS A  22       1.836   8.752 -13.669  1.00  5.40           C  
ATOM    361  O   CYS A  22       0.796   8.231 -14.072  1.00  5.44           O  
ATOM    362  CB  CYS A  22       2.054  11.149 -13.795  1.00  5.56           C  
ATOM    363  SG  CYS A  22       0.887  11.200 -15.151  1.00  5.56           S  
ATOM    364  H   CYS A  22       3.218  10.846 -11.535  1.00  6.44           H  
ATOM    365  HA  CYS A  22       0.744  10.114 -12.474  1.00  6.49           H  
ATOM    366 1HB  CYS A  22       2.050  12.100 -13.281  1.00  6.67           H  
ATOM    367 2HB  CYS A  22       3.049  11.015 -14.210  1.00  6.67           H  
ATOM    368  HG  CYS A  22       0.723   9.859 -15.239  1.00  6.67           H  
ATOM    369  N   ARG A  23       3.042   8.230 -13.904  1.00  5.41           N  
ATOM    370  CA  ARG A  23       3.181   7.054 -14.755  1.00  5.45           C  
ATOM    371  C   ARG A  23       2.310   5.883 -14.291  1.00  5.42           C  
ATOM    372  O   ARG A  23       1.837   5.102 -15.125  1.00  5.45           O  
ATOM    373  CB  ARG A  23       4.637   6.605 -14.815  1.00  5.62           C  
ATOM    374  CG  ARG A  23       5.561   7.503 -15.649  1.00  5.62           C  
ATOM    375  CD  ARG A  23       6.896   6.868 -15.902  1.00  5.62           C  
ATOM    376  NE  ARG A  23       7.645   6.643 -14.656  1.00  5.62           N  
ATOM    377  CZ  ARG A  23       8.447   7.550 -14.033  1.00  5.62           C  
ATOM    378  NH1 ARG A  23       8.622   8.756 -14.525  1.00  5.62           N  
ATOM    379  NH2 ARG A  23       9.059   7.220 -12.909  1.00  5.62           N  
ATOM    380  H   ARG A  23       3.881   8.685 -13.528  1.00  6.49           H  
ATOM    381  HA  ARG A  23       2.873   7.332 -15.761  1.00  6.54           H  
ATOM    382 1HB  ARG A  23       5.040   6.580 -13.802  1.00  6.74           H  
ATOM    383 2HB  ARG A  23       4.690   5.593 -15.215  1.00  6.74           H  
ATOM    384 1HG  ARG A  23       5.093   7.692 -16.613  1.00  6.74           H  
ATOM    385 2HG  ARG A  23       5.715   8.445 -15.143  1.00  6.74           H  
ATOM    386 1HD  ARG A  23       6.744   5.902 -16.382  1.00  6.74           H  
ATOM    387 2HD  ARG A  23       7.489   7.500 -16.559  1.00  6.74           H  
ATOM    388  HE  ARG A  23       7.554   5.732 -14.225  1.00  6.74           H  
ATOM    389 1HH1 ARG A  23       8.163   9.031 -15.374  1.00  6.74           H  
ATOM    390 2HH1 ARG A  23       9.229   9.412 -14.040  1.00  6.74           H  
ATOM    391 1HH2 ARG A  23       8.934   6.302 -12.512  1.00  6.74           H  
ATOM    392 2HH2 ARG A  23       9.636   7.922 -12.411  1.00  6.74           H  
ATOM    393  N   ASN A  24       2.137   5.711 -12.975  1.00  5.43           N  
ATOM    394  CA  ASN A  24       1.325   4.610 -12.480  1.00  5.51           C  
ATOM    395  C   ASN A  24      -0.018   5.107 -11.962  1.00  5.52           C  
ATOM    396  O   ASN A  24      -1.072   4.577 -12.316  1.00  5.59           O  
ATOM    397  CB  ASN A  24       2.055   3.877 -11.382  1.00  5.68           C  
ATOM    398  CG  ASN A  24       3.278   3.160 -11.857  1.00  5.68           C  
ATOM    399  OD1 ASN A  24       3.352   2.641 -12.977  1.00  5.68           O  
ATOM    400  ND2 ASN A  24       4.261   3.114 -11.004  1.00  5.68           N  
ATOM    401  H   ASN A  24       2.524   6.382 -12.310  1.00  6.52           H  
ATOM    402  HA  ASN A  24       1.124   3.920 -13.299  1.00  6.61           H  
ATOM    403 1HB  ASN A  24       2.355   4.598 -10.627  1.00  6.82           H  
ATOM    404 2HB  ASN A  24       1.383   3.164 -10.906  1.00  6.82           H  
ATOM    405 1HD2 ASN A  24       5.114   2.648 -11.244  1.00  6.82           H  
ATOM    406 2HD2 ASN A  24       4.160   3.548 -10.100  1.00  6.82           H  
ATOM    407  N   PHE A  25       0.011   6.178 -11.179  1.00  5.50           N  
ATOM    408  CA  PHE A  25      -1.144   6.736 -10.487  1.00  5.58           C  
ATOM    409  C   PHE A  25      -2.302   7.017 -11.422  1.00  5.55           C  
ATOM    410  O   PHE A  25      -3.431   6.577 -11.181  1.00  5.63           O  
ATOM    411  CB  PHE A  25      -0.671   7.984  -9.749  1.00  5.78           C  
ATOM    412  CG  PHE A  25      -1.644   8.823  -8.975  1.00  5.78           C  
ATOM    413  CD1 PHE A  25      -2.309   8.327  -7.860  1.00  5.78           C  
ATOM    414  CD2 PHE A  25      -1.799  10.172  -9.293  1.00  5.78           C  
ATOM    415  CE1 PHE A  25      -3.117   9.134  -7.098  1.00  5.78           C  
ATOM    416  CE2 PHE A  25      -2.603  10.982  -8.529  1.00  5.78           C  
ATOM    417  CZ  PHE A  25      -3.265  10.456  -7.428  1.00  5.78           C  
ATOM    418  H   PHE A  25       0.906   6.633 -11.010  1.00  6.60           H  
ATOM    419  HA  PHE A  25      -1.473   6.008  -9.747  1.00  6.70           H  
ATOM    420 1HB  PHE A  25       0.133   7.706  -9.084  1.00  6.94           H  
ATOM    421 2HB  PHE A  25      -0.229   8.635 -10.488  1.00  6.94           H  
ATOM    422  HD1 PHE A  25      -2.175   7.291  -7.577  1.00  6.94           H  
ATOM    423  HD2 PHE A  25      -1.269  10.582 -10.147  1.00  6.94           H  
ATOM    424  HE1 PHE A  25      -3.630   8.722  -6.215  1.00  6.94           H  
ATOM    425  HE2 PHE A  25      -2.718  12.032  -8.781  1.00  6.94           H  
ATOM    426  HZ  PHE A  25      -3.900  11.091  -6.817  1.00  6.94           H  
ATOM    427  N   MET A  26      -2.006   7.659 -12.552  1.00  5.47           N  
ATOM    428  CA  MET A  26      -2.985   8.111 -13.527  1.00  5.51           C  
ATOM    429  C   MET A  26      -3.852   6.969 -14.082  1.00  5.46           C  
ATOM    430  O   MET A  26      -4.935   7.205 -14.625  1.00  5.53           O  
ATOM    431  CB  MET A  26      -2.222   8.824 -14.637  1.00  5.70           C  
ATOM    432  CG  MET A  26      -3.028   9.682 -15.587  1.00  5.70           C  
ATOM    433  SD  MET A  26      -3.844  11.078 -14.756  1.00  5.70           S  
ATOM    434  CE  MET A  26      -2.494  12.157 -14.239  1.00  5.70           C  
ATOM    435  H   MET A  26      -1.034   7.885 -12.768  1.00  6.56           H  
ATOM    436  HA  MET A  26      -3.640   8.828 -13.046  1.00  6.61           H  
ATOM    437 1HB  MET A  26      -1.456   9.439 -14.191  1.00  6.84           H  
ATOM    438 2HB  MET A  26      -1.703   8.075 -15.240  1.00  6.84           H  
ATOM    439 1HG  MET A  26      -2.369  10.078 -16.357  1.00  6.84           H  
ATOM    440 2HG  MET A  26      -3.791   9.074 -16.072  1.00  6.84           H  
ATOM    441 1HE  MET A  26      -2.905  13.033 -13.743  1.00  6.84           H  
ATOM    442 2HE  MET A  26      -1.837  11.635 -13.547  1.00  6.84           H  
ATOM    443 3HE  MET A  26      -1.929  12.474 -15.115  1.00  6.84           H  
ATOM    444  N   ARG A  27      -3.350   5.732 -14.018  1.00  5.42           N  
ATOM    445  CA  ARG A  27      -4.072   4.582 -14.543  1.00  5.49           C  
ATOM    446  C   ARG A  27      -4.432   3.545 -13.464  1.00  5.52           C  
ATOM    447  O   ARG A  27      -5.447   2.855 -13.578  1.00  5.61           O  
ATOM    448  CB  ARG A  27      -3.249   3.942 -15.649  1.00  5.66           C  
ATOM    449  CG  ARG A  27      -3.110   4.830 -16.894  1.00  5.66           C  
ATOM    450  CD  ARG A  27      -2.205   4.262 -17.929  1.00  5.66           C  
ATOM    451  NE  ARG A  27      -0.798   4.298 -17.511  1.00  5.66           N  
ATOM    452  CZ  ARG A  27       0.227   3.704 -18.161  1.00  5.66           C  
ATOM    453  NH1 ARG A  27       0.016   3.014 -19.271  1.00  5.66           N  
ATOM    454  NH2 ARG A  27       1.454   3.824 -17.675  1.00  5.66           N  
ATOM    455  H   ARG A  27      -2.462   5.581 -13.539  1.00  6.50           H  
ATOM    456  HA  ARG A  27      -5.003   4.939 -14.984  1.00  6.59           H  
ATOM    457 1HB  ARG A  27      -2.249   3.723 -15.274  1.00  6.79           H  
ATOM    458 2HB  ARG A  27      -3.705   3.001 -15.950  1.00  6.79           H  
ATOM    459 1HG  ARG A  27      -4.092   4.982 -17.340  1.00  6.79           H  
ATOM    460 2HG  ARG A  27      -2.700   5.795 -16.596  1.00  6.79           H  
ATOM    461 1HD  ARG A  27      -2.485   3.226 -18.112  1.00  6.79           H  
ATOM    462 2HD  ARG A  27      -2.306   4.838 -18.848  1.00  6.79           H  
ATOM    463  HE  ARG A  27      -0.567   4.820 -16.668  1.00  6.79           H  
ATOM    464 1HH1 ARG A  27      -0.917   2.923 -19.645  1.00  6.79           H  
ATOM    465 2HH1 ARG A  27       0.791   2.576 -19.748  1.00  6.79           H  
ATOM    466 1HH2 ARG A  27       1.614   4.362 -16.796  1.00  6.79           H  
ATOM    467 2HH2 ARG A  27       2.233   3.390 -18.143  1.00  6.79           H  
ATOM    468  N   ARG A  28      -3.613   3.454 -12.412  1.00  5.50           N  
ATOM    469  CA  ARG A  28      -3.760   2.471 -11.341  1.00  5.60           C  
ATOM    470  C   ARG A  28      -4.780   2.894 -10.286  1.00  5.58           C  
ATOM    471  O   ARG A  28      -5.513   2.056  -9.758  1.00  5.66           O  
ATOM    472  CB  ARG A  28      -2.403   2.248 -10.675  1.00  5.80           C  
ATOM    473  CG  ARG A  28      -2.340   1.215  -9.572  1.00  5.80           C  
ATOM    474  CD  ARG A  28      -0.928   1.035  -9.104  1.00  5.80           C  
ATOM    475  NE  ARG A  28      -0.846   0.219  -7.891  1.00  5.80           N  
ATOM    476  CZ  ARG A  28       0.281   0.005  -7.158  1.00  5.80           C  
ATOM    477  NH1 ARG A  28       1.432   0.516  -7.530  1.00  5.80           N  
ATOM    478  NH2 ARG A  28       0.213  -0.714  -6.046  1.00  5.80           N  
ATOM    479  H   ARG A  28      -2.791   4.045 -12.380  1.00  6.60           H  
ATOM    480  HA  ARG A  28      -4.089   1.533 -11.784  1.00  6.72           H  
ATOM    481 1HB  ARG A  28      -1.673   1.973 -11.432  1.00  6.96           H  
ATOM    482 2HB  ARG A  28      -2.070   3.193 -10.240  1.00  6.96           H  
ATOM    483 1HG  ARG A  28      -2.951   1.530  -8.735  1.00  6.96           H  
ATOM    484 2HG  ARG A  28      -2.707   0.261  -9.944  1.00  6.96           H  
ATOM    485 1HD  ARG A  28      -0.351   0.544  -9.887  1.00  6.96           H  
ATOM    486 2HD  ARG A  28      -0.498   2.014  -8.894  1.00  6.96           H  
ATOM    487  HE  ARG A  28      -1.709  -0.200  -7.554  1.00  6.96           H  
ATOM    488 1HH1 ARG A  28       1.498   1.067  -8.368  1.00  6.96           H  
ATOM    489 2HH1 ARG A  28       2.259   0.331  -6.975  1.00  6.96           H  
ATOM    490 1HH2 ARG A  28      -0.671  -1.103  -5.749  1.00  6.96           H  
ATOM    491 2HH2 ARG A  28       1.051  -0.854  -5.446  1.00  6.96           H  
ATOM    492  N   TYR A  29      -4.790   4.180  -9.936  1.00  5.53           N  
ATOM    493  CA  TYR A  29      -5.657   4.701  -8.896  1.00  5.60           C  
ATOM    494  C   TYR A  29      -6.557   5.796  -9.427  1.00  5.61           C  
ATOM    495  O   TYR A  29      -6.919   6.702  -8.667  1.00  5.76           O  
ATOM    496  CB  TYR A  29      -4.836   5.223  -7.717  1.00  5.81           C  
ATOM    497  CG  TYR A  29      -4.014   4.156  -7.046  1.00  5.81           C  
ATOM    498  CD1 TYR A  29      -2.633   4.190  -7.079  1.00  5.81           C  
ATOM    499  CD2 TYR A  29      -4.662   3.117  -6.415  1.00  5.81           C  
ATOM    500  CE1 TYR A  29      -1.914   3.187  -6.462  1.00  5.81           C  
ATOM    501  CE2 TYR A  29      -3.956   2.121  -5.821  1.00  5.81           C  
ATOM    502  CZ  TYR A  29      -2.600   2.146  -5.832  1.00  5.81           C  
ATOM    503  OH  TYR A  29      -1.917   1.123  -5.228  1.00  5.81           O  
ATOM    504  H   TYR A  29      -4.186   4.852 -10.415  1.00  6.64           H  
ATOM    505  HA  TYR A  29      -6.300   3.895  -8.547  1.00  6.72           H  
ATOM    506 1HB  TYR A  29      -4.166   6.005  -8.070  1.00  6.97           H  
ATOM    507 2HB  TYR A  29      -5.494   5.666  -6.971  1.00  6.97           H  
ATOM    508  HD1 TYR A  29      -2.125   4.998  -7.583  1.00  6.97           H  
ATOM    509  HD2 TYR A  29      -5.750   3.085  -6.398  1.00  6.97           H  
ATOM    510  HE1 TYR A  29      -0.825   3.199  -6.475  1.00  6.97           H  
ATOM    511  HE2 TYR A  29      -4.479   1.302  -5.331  1.00  6.97           H  
ATOM    512  HH  TYR A  29      -0.979   1.340  -5.195  1.00  6.97           H  
ATOM    513  N   GLN A  30      -6.952   5.694 -10.701  1.00  5.55           N  
ATOM    514  CA  GLN A  30      -7.723   6.726 -11.400  1.00  5.64           C  
ATOM    515  C   GLN A  30      -8.850   7.360 -10.582  1.00  5.58           C  
ATOM    516  O   GLN A  30      -9.064   8.569 -10.673  1.00  5.66           O  
ATOM    517  CB  GLN A  30      -8.299   6.194 -12.704  1.00  5.86           C  
ATOM    518  CG  GLN A  30      -9.019   7.265 -13.502  1.00  5.86           C  
ATOM    519  CD  GLN A  30      -9.527   6.777 -14.813  1.00  5.86           C  
ATOM    520  OE1 GLN A  30     -10.228   5.765 -14.889  1.00  5.86           O  
ATOM    521  NE2 GLN A  30      -9.172   7.487 -15.874  1.00  5.86           N  
ATOM    522  H   GLN A  30      -6.644   4.880 -11.224  1.00  6.66           H  
ATOM    523  HA  GLN A  30      -7.028   7.510 -11.679  1.00  6.77           H  
ATOM    524 1HB  GLN A  30      -7.491   5.792 -13.323  1.00  7.03           H  
ATOM    525 2HB  GLN A  30      -8.999   5.385 -12.500  1.00  7.03           H  
ATOM    526 1HG  GLN A  30      -9.877   7.613 -12.937  1.00  7.03           H  
ATOM    527 2HG  GLN A  30      -8.332   8.095 -13.681  1.00  7.03           H  
ATOM    528 1HE2 GLN A  30      -9.473   7.211 -16.788  1.00  7.03           H  
ATOM    529 2HE2 GLN A  30      -8.581   8.289 -15.762  1.00  7.03           H  
ATOM    530  N   SER A  31      -9.596   6.585  -9.798  1.00  5.59           N  
ATOM    531  CA  SER A  31     -10.685   7.200  -9.043  1.00  5.67           C  
ATOM    532  C   SER A  31     -10.155   8.273  -8.077  1.00  5.69           C  
ATOM    533  O   SER A  31     -10.794   9.315  -7.874  1.00  5.81           O  
ATOM    534  CB  SER A  31     -11.441   6.144  -8.256  1.00  5.91           C  
ATOM    535  OG  SER A  31     -12.101   5.242  -9.108  1.00  5.91           O  
ATOM    536  H   SER A  31      -9.431   5.590  -9.733  1.00  6.71           H  
ATOM    537  HA  SER A  31     -11.368   7.676  -9.748  1.00  6.80           H  
ATOM    538 1HB  SER A  31     -10.744   5.603  -7.617  1.00  7.09           H  
ATOM    539 2HB  SER A  31     -12.166   6.631  -7.606  1.00  7.09           H  
ATOM    540  HG  SER A  31     -12.583   4.639  -8.534  1.00  7.09           H  
ATOM    541  N   ARG A  32      -8.994   8.001  -7.457  1.00  5.67           N  
ATOM    542  CA  ARG A  32      -8.408   8.915  -6.494  1.00  5.77           C  
ATOM    543  C   ARG A  32      -7.744  10.056  -7.220  1.00  5.74           C  
ATOM    544  O   ARG A  32      -7.698  11.168  -6.701  1.00  5.89           O  
ATOM    545  CB  ARG A  32      -7.427   8.252  -5.538  1.00  6.04           C  
ATOM    546  CG  ARG A  32      -6.825   9.223  -4.459  1.00  6.04           C  
ATOM    547  CD  ARG A  32      -7.915   9.848  -3.594  1.00  6.04           C  
ATOM    548  NE  ARG A  32      -7.403  10.710  -2.540  1.00  6.04           N  
ATOM    549  CZ  ARG A  32      -8.153  11.617  -1.858  1.00  6.04           C  
ATOM    550  NH1 ARG A  32      -9.444  11.781  -2.124  1.00  6.04           N  
ATOM    551  NH2 ARG A  32      -7.604  12.358  -0.904  1.00  6.04           N  
ATOM    552  H   ARG A  32      -8.479   7.158  -7.705  1.00  6.80           H  
ATOM    553  HA  ARG A  32      -9.226   9.313  -5.901  1.00  6.92           H  
ATOM    554 1HB  ARG A  32      -7.917   7.433  -5.018  1.00  7.25           H  
ATOM    555 2HB  ARG A  32      -6.593   7.832  -6.107  1.00  7.25           H  
ATOM    556 1HG  ARG A  32      -6.166   8.655  -3.804  1.00  7.25           H  
ATOM    557 2HG  ARG A  32      -6.248  10.018  -4.933  1.00  7.25           H  
ATOM    558 1HD  ARG A  32      -8.540  10.466  -4.212  1.00  7.25           H  
ATOM    559 2HD  ARG A  32      -8.517   9.063  -3.138  1.00  7.25           H  
ATOM    560  HE  ARG A  32      -6.424  10.624  -2.291  1.00  7.25           H  
ATOM    561 1HH1 ARG A  32      -9.923  11.229  -2.850  1.00  7.25           H  
ATOM    562 2HH1 ARG A  32      -9.980  12.457  -1.605  1.00  7.25           H  
ATOM    563 1HH2 ARG A  32      -6.606  12.271  -0.651  1.00  7.25           H  
ATOM    564 2HH2 ARG A  32      -8.162  13.026  -0.400  1.00  7.25           H  
ATOM    565  N   VAL A  33      -7.194   9.765  -8.390  1.00  5.67           N  
ATOM    566  CA  VAL A  33      -6.504  10.755  -9.206  1.00  5.78           C  
ATOM    567  C   VAL A  33      -7.487  11.865  -9.541  1.00  5.83           C  
ATOM    568  O   VAL A  33      -7.197  13.052  -9.374  1.00  5.96           O  
ATOM    569  CB  VAL A  33      -6.074  10.114 -10.535  1.00  6.05           C  
ATOM    570  CG1 VAL A  33      -5.522  11.100 -11.465  1.00  6.05           C  
ATOM    571  CG2 VAL A  33      -5.110   9.060 -10.300  1.00  6.05           C  
ATOM    572  H   VAL A  33      -7.236   8.784  -8.685  1.00  6.80           H  
ATOM    573  HA  VAL A  33      -5.658  11.160  -8.663  1.00  6.94           H  
ATOM    574  HB  VAL A  33      -6.947   9.708 -10.999  1.00  7.26           H  
ATOM    575 1HG1 VAL A  33      -5.274  10.591 -12.374  1.00  7.26           H  
ATOM    576 2HG1 VAL A  33      -6.236  11.891 -11.683  1.00  7.26           H  
ATOM    577 3HG1 VAL A  33      -4.632  11.517 -11.024  1.00  7.26           H  
ATOM    578 1HG2 VAL A  33      -4.861   8.598 -11.228  1.00  7.26           H  
ATOM    579 2HG2 VAL A  33      -4.273   9.459  -9.883  1.00  7.26           H  
ATOM    580 3HG2 VAL A  33      -5.498   8.331  -9.647  1.00  7.26           H  
ATOM    581  N   ILE A  34      -8.689  11.471  -9.953  1.00  5.84           N  
ATOM    582  CA  ILE A  34      -9.724  12.427 -10.293  1.00  6.09           C  
ATOM    583  C   ILE A  34     -10.082  13.287  -9.082  1.00  6.17           C  
ATOM    584  O   ILE A  34     -10.229  14.501  -9.215  1.00  6.39           O  
ATOM    585  CB  ILE A  34     -10.965  11.702 -10.854  1.00  6.43           C  
ATOM    586  CG1 ILE A  34     -10.594  11.081 -12.240  1.00  6.43           C  
ATOM    587  CG2 ILE A  34     -12.156  12.692 -10.972  1.00  6.43           C  
ATOM    588  CD1 ILE A  34     -11.593  10.073 -12.779  1.00  6.43           C  
ATOM    589  H   ILE A  34      -8.862  10.468 -10.076  1.00  7.01           H  
ATOM    590  HA  ILE A  34      -9.339  13.085 -11.070  1.00  7.31           H  
ATOM    591  HB  ILE A  34     -11.234  10.878 -10.186  1.00  7.72           H  
ATOM    592 1HG1 ILE A  34     -10.496  11.887 -12.963  1.00  7.72           H  
ATOM    593 2HG1 ILE A  34      -9.630  10.581 -12.152  1.00  7.72           H  
ATOM    594 1HG2 ILE A  34     -13.027  12.182 -11.364  1.00  7.72           H  
ATOM    595 2HG2 ILE A  34     -12.408  13.101  -9.995  1.00  7.72           H  
ATOM    596 3HG2 ILE A  34     -11.882  13.510 -11.642  1.00  7.72           H  
ATOM    597 1HD1 ILE A  34     -11.241   9.699 -13.741  1.00  7.72           H  
ATOM    598 2HD1 ILE A  34     -11.678   9.241 -12.076  1.00  7.72           H  
ATOM    599 3HD1 ILE A  34     -12.563  10.535 -12.913  1.00  7.72           H  
ATOM    600  N   GLN A  35     -10.255  12.664  -7.916  1.00  6.09           N  
ATOM    601  CA  GLN A  35     -10.561  13.404  -6.695  1.00  6.33           C  
ATOM    602  C   GLN A  35      -9.414  14.313  -6.193  1.00  6.37           C  
ATOM    603  O   GLN A  35      -9.661  15.415  -5.697  1.00  6.58           O  
ATOM    604  CB  GLN A  35     -10.857  12.407  -5.579  1.00  6.77           C  
ATOM    605  CG  GLN A  35     -12.119  11.611  -5.732  1.00  6.77           C  
ATOM    606  CD  GLN A  35     -12.202  10.514  -4.682  1.00  6.77           C  
ATOM    607  OE1 GLN A  35     -11.281  10.355  -3.856  1.00  6.77           O  
ATOM    608  NE2 GLN A  35     -13.288   9.753  -4.702  1.00  6.77           N  
ATOM    609  H   GLN A  35     -10.190  11.643  -7.879  1.00  7.31           H  
ATOM    610  HA  GLN A  35     -11.435  14.025  -6.884  1.00  7.60           H  
ATOM    611 1HB  GLN A  35     -10.035  11.708  -5.518  1.00  8.12           H  
ATOM    612 2HB  GLN A  35     -10.904  12.936  -4.630  1.00  8.12           H  
ATOM    613 1HG  GLN A  35     -12.973  12.273  -5.609  1.00  8.12           H  
ATOM    614 2HG  GLN A  35     -12.140  11.152  -6.719  1.00  8.12           H  
ATOM    615 1HE2 GLN A  35     -13.397   9.014  -4.035  1.00  8.12           H  
ATOM    616 2HE2 GLN A  35     -14.004   9.914  -5.385  1.00  8.12           H  
ATOM    617  N   GLY A  36      -8.170  13.822  -6.283  1.00  6.24           N  
ATOM    618  CA  GLY A  36      -6.979  14.499  -5.759  1.00  6.36           C  
ATOM    619  C   GLY A  36      -6.326  15.593  -6.613  1.00  6.59           C  
ATOM    620  O   GLY A  36      -5.712  16.496  -6.046  1.00  6.77           O  
ATOM    621  H   GLY A  36      -8.049  12.896  -6.677  1.00  7.49           H  
ATOM    622 1HA  GLY A  36      -7.231  14.923  -4.790  1.00  7.63           H  
ATOM    623 2HA  GLY A  36      -6.230  13.734  -5.557  1.00  7.63           H  
ATOM    624  N   LEU A  37      -6.440  15.533  -7.940  1.00  6.72           N  
ATOM    625  CA  LEU A  37      -5.788  16.525  -8.795  1.00  7.11           C  
ATOM    626  C   LEU A  37      -6.748  17.615  -9.278  1.00  7.56           C  
ATOM    627  O   LEU A  37      -7.151  18.484  -8.502  1.00  7.83           O  
ATOM    628  OXT LEU A  37      -6.821  17.821 -10.489  1.00  8.17           O  
ATOM    629  CB  LEU A  37      -5.172  15.836 -10.024  1.00  7.62           C  
ATOM    630  CG  LEU A  37      -4.153  14.690  -9.757  1.00  7.62           C  
ATOM    631  CD1 LEU A  37      -3.677  14.138 -11.079  1.00  7.62           C  
ATOM    632  CD2 LEU A  37      -3.005  15.202  -9.001  1.00  7.62           C  
ATOM    633  H   LEU A  37      -6.929  14.744  -8.373  1.00  8.06           H  
ATOM    634  HA  LEU A  37      -5.012  17.019  -8.226  1.00  8.53           H  
ATOM    635 1HB  LEU A  37      -5.987  15.412 -10.612  1.00  9.14           H  
ATOM    636 2HB  LEU A  37      -4.673  16.598 -10.626  1.00  9.14           H  
ATOM    637  HG  LEU A  37      -4.645  13.890  -9.199  1.00  9.14           H  
ATOM    638 1HD1 LEU A  37      -2.976  13.331 -10.910  1.00  9.14           H  
ATOM    639 2HD1 LEU A  37      -4.529  13.772 -11.641  1.00  9.14           H  
ATOM    640 3HD1 LEU A  37      -3.190  14.930 -11.643  1.00  9.14           H  
ATOM    641 1HD2 LEU A  37      -2.281  14.410  -8.830  1.00  9.14           H  
ATOM    642 2HD2 LEU A  37      -2.580  15.955  -9.585  1.00  9.14           H  
ATOM    643 3HD2 LEU A  37      -3.321  15.613  -8.056  1.00  9.14           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 -217.274 21.8117 157.974 -15.5936 3.89622 10.3912 82.3054 -88.7827 -0.26807 -1.95056 -81.2435 -7.17185 -30.8448 0 -3.48795 -8.58238 0 -0.15346 2.49008 22.119 40.5193 -2.59516 0.65469 -1.53515 1.40156 21.6898 -94.2304
ASP:NtermProteinFull_1 -3.11352 0.07836 5.46011 -0.25135 0.05833 0.89153 2.4277 -2.27484 -0.02754 -0.22504 -4.65108 -1.53433 0 0 -0.58431 -0.69946 0 0.01498 0.13595 0 1.65559 0 0 -2.3716 0 0.14325 -4.86728
TRP_2 -5.67986 0.48861 2.17078 -1.42756 0.1445 0.70385 1.46353 -1.79114 -0 -0 -1.31089 -0.24611 0 0 0 0 0 -0.00788 0.00747 0 1.75968 -0.18312 0 1.6906 -0.07153 0.29794 -1.99113
PHE_3 -7.13634 0.72225 4.39933 -0.64508 0.03905 0.29329 2.32412 -2.68925 -0 -0 -1.43925 0.03009 0 0 0 0 0 0.06017 0.016 0 3.04121 -0.19661 0 1.0402 -0.15099 0.39882 0.107
LYS_4 -7.06855 0.44029 8.2267 -0.46617 0.08616 0.33286 3.53003 -3.58657 -0.00855 -0.05826 -4.92956 0.05802 0 0 -0.58431 -0.7702 0 -0.00391 0.06796 2.31423 0 0.0701 0 -1.5107 -0.12403 0.55098 -3.43347
ALA_5 -4.28557 0.25636 4.77519 -0.02108 0 0 2.33801 -2.45676 -0.01471 -0.12176 -1.94789 -0.36226 0 0 0 0 0 0.12546 0 0 0 -0.25954 0 1.8394 -0.22061 0.38496 0.02919
PHE_6 -8.84788 0.77038 3.78881 -0.82856 0.04238 0.22955 2.70855 -2.87498 -0 -0 -2.79201 -0.18575 0 0 0 0 0 0.00309 0.43147 0 2.09759 -0.41952 0 1.0402 -0.15184 0.37096 -4.61755
TYR_7 -12.7568 1.88712 5.10901 -0.59283 0.31325 0.28946 4.03098 -3.97848 -0.00304 -0.01845 -2.47619 -0.35934 0 0 0 -0.7226 0 -0.03639 0.32098 0 3.41663 -0.04222 0.0058 1.2797 -0.07723 0.67423 -3.73643
ASP_8 -6.13124 0.23815 8.65338 -0.10117 0.00262 0.29994 3.71789 -3.7024 -0 -0 -5.82281 -0.341 0 0 0 -0.7702 0 -0.0135 2e-05 0 1.79203 0.2745 0 -2.3716 -0.15506 0.60525 -3.8252
LYS_9 -5.51048 0.2547 6.36092 -0.3033 0.02797 0.13647 2.63291 -2.87952 -0.02628 -0.21445 -2.53494 -0.022 0 0 0 0 0 0.04456 0.03301 1.74712 0 -0.00765 0 -1.5107 -0.2686 0.34744 -1.6928
VAL_10 -7.79305 0.64362 3.3731 -0.31178 0.18771 0.07197 3.20918 -2.83034 -0.00404 -0.02542 -2.64866 -0.19671 0 0 0 0 0 -0.03585 0.03908 0.05199 0 -0.29571 0 1.9342 -0.25685 0.32747 -4.56009
ALA_11 -6.0341 0.61223 4.1934 -0.01989 0 0 2.52097 -2.90492 -0.00118 -0.00579 -2.10486 -0.32994 0 0 0 0 0 -0.03156 0 0 0 -0.10382 0 1.8394 -0.10943 0.4835 -1.996
GLU_12 -4.61938 0.16913 6.39622 -0.22111 0.04245 0.33099 2.8718 -2.74325 -0.01773 -0.15619 -3.56227 -0.61254 0 0 -0.51742 -0.77702 0 -0.04781 0.10037 0 3.01364 -0.22203 0 -2.7348 -0.32999 0.40568 -3.23124
LYS_13 -4.19523 0.18892 3.67635 -0.31451 0.03102 0.14642 1.26845 -1.73618 -0 -0 -1.07464 -0.01873 0 0 0 0 0 0.06303 0.01377 1.93876 0 -0.12542 0 -1.5107 -0.31559 0.38163 -1.58266
PHE_14 -6.25695 0.75007 2.79939 -0.68463 0.06454 0.42462 1.80509 -1.84246 -0 -0 -1.53524 0.23238 0 0 0 0 0 -0.06433 0.12661 0 2.02335 -0.2027 0 1.0402 -0.04237 0.60546 -0.75696
LYS_15 -4.49074 0.18706 5.13814 -0.64598 0.14564 0.66477 2.57831 -2.30955 -0.00118 -0.00579 -3.80939 0.09694 0 0 -0.51742 0 0 -0.00715 0.12863 1.63221 0 -0.02369 0 -1.5107 -0.04998 0.65141 -2.14845
GLU_16 -4.37004 0.67199 3.43632 -0.3637 0.10535 0.48341 1.09805 -1.81712 -0.00404 -0.02542 -0.44648 -0.66564 0 0 0 0 0 -0.00647 0.04095 0 3.41641 -0.04842 0 -2.7348 0.01903 0.46145 -0.74918
ALA_17 -4.34146 0.33149 -0.23198 -0.02707 0.0018 0 0.22593 -0.92839 -0 -0 0.26514 -0.41284 0 0 0 0 0 -0.01834 0 0 0 0.59514 0 1.8394 0.46708 0.25182 -1.98228
PHE_18 -6.84125 0.97038 3.18357 -0.5598 0.26182 0.26765 2.53363 -2.2582 -0.0125 -0.09538 -3.27534 -0.04022 0 0 0 0 0 0.00741 0.08746 0 3.34595 0.17983 0 1.0402 0.2826 1.36302 0.44083
PRO_19 -3.91576 0.59191 3.59076 -0.06221 0 0.03942 1.38233 -1.64655 -0 -0 -0.61786 0.60223 0 0 0 0 0 -0.11078 0.02996 0.14635 0 -0.55638 0 -2.4119 0.14296 1.67638 -1.11915
ASP_20 -3.49794 0.30051 3.56711 -0.11821 0.01572 0.36326 1.12486 -1.73667 -0.00304 -0.01845 -1.93907 -0.44293 0 0 0 -0.63948 0 -0.02324 0.00261 0 2.2814 -0.17558 0 -2.3716 0.18348 0.67193 -2.45534
VAL_21 -9.60647 1.97486 2.72635 -0.2802 0.19886 0.05397 3.26701 -2.92206 -0.00903 -0.04384 -3.10422 -0.14769 0 0 0 0 0 0.12111 0.01174 0.11256 0 -0.51863 0 1.9342 0.04319 0.72349 -5.4648
CYS_22 -6.1769 0.58169 4.36442 -0.14221 0.02294 0.07794 2.08675 -2.38329 -0 -0 -1.68804 -0.9264 0 0 0 0 0 -0.03804 0.0003 1.06428 0 0.27574 0 3.6196 0.38434 0.77146 1.89455
ARG_23 -4.53114 0.34483 5.8173 -0.79312 0.09979 0.53796 2.22643 -2.59656 -0.0125 -0.09538 -3.19798 0.3676 0 0 -0.64224 -0.63948 0 -0.06657 0.04109 1.58903 0 -0.2021 0 -1.2888 0.10553 0.51479 -2.42152
ASN_24 -4.66314 0.35797 5.19773 -0.1688 0.01172 0.24738 2.87739 -2.45408 -0.0188 -0.08663 -3.10799 -0.25262 0 0 0 -0.7226 0 0.0307 0 0 1.95825 0.27596 0 -0.93687 0.33208 0.39135 -0.731
PHE_25 -11.4977 1.89495 3.22912 -0.67647 0.02425 0.181 2.56333 -3.19564 -0 -0 -2.0438 -0.11789 0 0 0 0 0 0.05622 0.00061 0 2.39482 -0.42607 0 1.0402 0.53483 0.93414 -5.10415
MET_26 -5.3116 0.52103 2.4607 -0.71303 0.1775 0.37767 1.09398 -1.59742 -0.02839 -0.15842 -0.76745 -0.23919 0 0 0 0 0 -0.13205 0.24826 2.08899 0 -0.01672 0 0.60916 -0.06609 1.02898 -0.42409
ARG_27 -3.03485 0.25525 3.85326 -0.61234 0.07766 0.42058 1.78853 -1.73811 -0 -0 -1.67597 0.18322 0 0 -0.64224 0 0 -0.02587 0.10537 1.92096 0 -0.22594 0 -1.2888 0.04975 0.50136 -0.08818
ARG_28 -5.51095 0.30665 4.89153 -0.54583 0.06731 0.3329 2.1136 -2.24106 -0 -0 -1.80304 0.26141 0 0 0 -0.69946 0 -0.049 0.15358 2.45348 0 -0.11648 0 -1.2888 0.16737 0.41623 -1.09056
TYR_29 -8.72027 0.89912 5.23814 -0.65319 0.10223 0.37918 3.14569 -2.82744 -0.03188 -0.19341 -3.17548 -0.18855 0 0 0 0 0 0.24872 0.00023 0 2.29183 -0.09259 0.04483 1.2797 0.19641 0.41317 -1.64355
GLN_30 -4.79283 0.48409 4.47941 -0.42646 0.15361 0.26354 2.12903 -2.31494 -0.01937 -0.11458 -1.48531 -0.66342 0 0 0 0 0 -0.07872 0.02065 0 3.19851 0.04334 0 -0.18838 0.54068 0.50543 1.73427
SER_31 -2.99349 0.24546 3.57952 -0.02392 0 0.02189 1.36281 -1.69757 -0 -0 -0.75159 -0.36062 0 0 0 0 0 -0.05913 0.00057 0.55795 0 0.26859 0.60407 -0.77834 0.27107 0.37605 0.62331
ARG_32 -6.68432 0.34849 7.25374 -0.9568 0.47313 0.85177 3.49849 -3.21251 -0.01201 -0.14221 -4.42945 -0.10784 0 0 0 -1.45945 0 -0.00692 0.09687 2.87304 0 -0.15243 0 -1.2888 -0.19139 0.46434 -2.78426
VAL_33 -8.83151 1.69219 3.76497 -0.30347 0.25634 0.06519 2.58533 -3.04064 -0 -0 -1.70752 0.12609 0 0 0 0 0 -0.02433 0.03804 0.05395 0 -0.25059 0 1.9342 -0.11649 0.91991 -2.83834
ILE_34 -4.09987 0.21344 3.71551 -0.49858 0.32251 0.10201 1.35213 -1.87612 -0.00024 -0.00349 -0.66324 0.0107 0 0 0 0 0 0.00132 0.02498 0.55487 0 -0.40417 0 0.73287 -0.01005 0.71749 0.19208
GLN_35 -4.16506 0.15164 4.31202 -0.28299 0.05472 0.23111 1.79477 -1.99627 -0.01201 -0.14221 -1.0125 -0.47718 0 0 0 -0.68244 0 0.01522 0.09447 0 2.83244 -0.10877 0 -0.18838 -0.10817 0.45629 0.76671
GLY_36 -3.20819 0.08063 3.24302 -5e-05 0 0 1.37433 -1.72792 -0 -0 -1.33643 -0.34583 0 0 0 0 0 -0.05758 0 0 0 0.79854 0 0.83697 0.19039 0.67911 0.52698
LEU:CtermProteinFull_37 -6.55994 0.90587 1.78091 -0.5502 0.28336 0.27766 1.25345 -1.9735 -0 -0 -0.64017 0.45707 0 0 0 0 0 0 0.07099 1.01922 0 0 0 0.18072 0.30705 0.82263 -2.36487
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

