REMARK ID 114278 DOMAINID 110960 MODEL 1 2021-08-21_00000149_1_19
MODEL     1
REMARK    Rerank model04.pdb to model01.pdb score: 48.157
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 6 cluster_threshold: 2.937218
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_rep:          45.643
REMARK    SCORE     hbond_sr_bb:         -39.971
REMARK    SCORE         p_aa_pp:         -11.425
REMARK    SCORE         fa_elec:        -104.232
REMARK    SCORE          fa_sol:         248.862
REMARK    SCORE     lk_ball_wtd:         -13.784
REMARK    SCORE     cart_bonded:          44.740
REMARK    SCORE     hbond_bb_sc:          -2.768
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE     rama_prepro:          -6.521
REMARK    SCORE       dslf_fa13:          -0.811
REMARK    SCORE           score:        -312.008
REMARK    SCORE          fa_dun:         108.676
REMARK    SCORE     hbond_lr_bb:          -5.559
REMARK    SCORE           omega:           1.177
REMARK    SCORE        hbond_sc:          -5.855
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     total_score:        -312.008
REMARK    SCORE    fa_intra_rep:           0.636
REMARK    SCORE fa_intra_sol_xover4:          14.162
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE          fa_atr:        -404.045
REMARK    SCORE atom_pair_constraint:        -208.160
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE             ref:          27.225
SSBOND     CYS A   25    CYS A   35                                       2.03  
ATOM      1  N   CYS A   1      -0.829  -0.255  -0.130  1.00  4.090          N  
ATOM      2  CA  CYS A   1       0.617  -0.397  -0.020  1.00  3.320          C  
ATOM      3  C   CYS A   1       1.438   0.888  -0.035  1.00  2.570          C  
ATOM      4  O   CYS A   1       1.771   1.395  -1.104  1.00  2.600          O  
ATOM      5  CB  CYS A   1       1.141  -1.230  -1.165  1.00  4.960          C  
ATOM      6  SG  CYS A   1       2.939  -1.408  -1.193  1.00  4.960          S  
ATOM      7 1H   CYS A   1      -1.257  -1.179  -0.270  1.00  4.910          H  
ATOM      8 2H   CYS A   1      -1.192   0.181   0.705  1.00  4.910          H  
ATOM      9 3H   CYS A   1      -1.034   0.316  -0.937  1.00  4.910          H  
ATOM     10  HA  CYS A   1       0.823  -0.918   0.913  1.00  3.980          H  
ATOM     11 1HB  CYS A   1       0.699  -2.207  -1.149  1.00  5.950          H  
ATOM     12 2HB  CYS A   1       0.846  -0.771  -2.082  1.00  5.950          H  
ATOM     13  HG  CYS A   1       3.154  -1.814   0.084  1.00  5.950          H  
ATOM     14  N   VAL A   2       1.799   1.386   1.146  1.00  2.580          N  
ATOM     15  CA  VAL A   2       2.726   2.519   1.223  1.00  2.670          C  
ATOM     16  C   VAL A   2       4.165   1.998   1.134  1.00  2.160          C  
ATOM     17  O   VAL A   2       5.046   2.665   0.591  1.00  2.460          O  
ATOM     18  CB  VAL A   2       2.506   3.413   2.475  1.00  3.700          C  
ATOM     19  CG1 VAL A   2       2.868   2.703   3.748  1.00  3.700          C  
ATOM     20  CG2 VAL A   2       3.346   4.675   2.325  1.00  3.700          C  
ATOM     21  H   VAL A   2       1.449   0.957   1.991  1.00  3.100          H  
ATOM     22  HA  VAL A   2       2.546   3.157   0.361  1.00  3.200          H  
ATOM     23  HB  VAL A   2       1.499   3.690   2.534  1.00  4.440          H  
ATOM     24 1HG1 VAL A   2       2.706   3.353   4.604  1.00  4.440          H  
ATOM     25 2HG1 VAL A   2       2.267   1.821   3.855  1.00  4.440          H  
ATOM     26 3HG1 VAL A   2       3.879   2.444   3.719  1.00  4.440          H  
ATOM     27 1HG2 VAL A   2       3.192   5.326   3.176  1.00  4.440          H  
ATOM     28 2HG2 VAL A   2       4.403   4.416   2.269  1.00  4.440          H  
ATOM     29 3HG2 VAL A   2       3.054   5.200   1.411  1.00  4.440          H  
ATOM     30  N   PHE A   3       4.412   0.834   1.738  1.00  1.970          N  
ATOM     31  CA  PHE A   3       5.733   0.233   1.742  1.00  2.100          C  
ATOM     32  C   PHE A   3       5.572  -1.157   1.149  1.00  2.020          C  
ATOM     33  O   PHE A   3       4.532  -1.792   1.345  1.00  2.640          O  
ATOM     34  CB  PHE A   3       6.310   0.108   3.160  1.00  2.890          C  
ATOM     35  CG  PHE A   3       6.358   1.402   3.949  1.00  2.890          C  
ATOM     36  CD1 PHE A   3       6.900   2.564   3.425  1.00  2.890          C  
ATOM     37  CD2 PHE A   3       5.846   1.444   5.254  1.00  2.890          C  
ATOM     38  CE1 PHE A   3       6.907   3.731   4.164  1.00  2.890          C  
ATOM     39  CE2 PHE A   3       5.855   2.608   5.988  1.00  2.890          C  
ATOM     40  CZ  PHE A   3       6.380   3.753   5.441  1.00  2.890          C  
ATOM     41  H   PHE A   3       3.648   0.345   2.171  1.00  2.360          H  
ATOM     42  HA  PHE A   3       6.405   0.809   1.106  1.00  2.520          H  
ATOM     43 1HB  PHE A   3       5.735  -0.605   3.711  1.00  3.470          H  
ATOM     44 2HB  PHE A   3       7.323  -0.283   3.098  1.00  3.470          H  
ATOM     45  HD1 PHE A   3       7.307   2.561   2.414  1.00  3.470          H  
ATOM     46  HD2 PHE A   3       5.431   0.547   5.689  1.00  3.470          H  
ATOM     47  HE1 PHE A   3       7.323   4.640   3.735  1.00  3.470          H  
ATOM     48  HE2 PHE A   3       5.443   2.629   7.000  1.00  3.470          H  
ATOM     49  HZ  PHE A   3       6.382   4.682   6.023  1.00  3.470          H  
ATOM     50  N   GLY A   4       6.612  -1.675   0.507  1.00  1.870          N  
ATOM     51  CA  GLY A   4       6.542  -3.011  -0.081  1.00  1.690          C  
ATOM     52  C   GLY A   4       6.150  -2.893  -1.548  1.00  1.630          C  
ATOM     53  O   GLY A   4       6.236  -1.807  -2.120  1.00  2.100          O  
ATOM     54  H   GLY A   4       7.449  -1.122   0.387  1.00  2.240          H  
ATOM     55 1HA  GLY A   4       7.508  -3.507   0.010  1.00  2.030          H  
ATOM     56 2HA  GLY A   4       5.811  -3.614   0.451  1.00  2.030          H  
ATOM     57  N   CYS A   5       5.802  -4.013  -2.184  1.00  1.680          N  
ATOM     58  CA  CYS A   5       5.498  -3.984  -3.610  1.00  1.660          C  
ATOM     59  C   CYS A   5       3.984  -3.842  -3.858  1.00  1.790          C  
ATOM     60  O   CYS A   5       3.273  -4.849  -3.713  1.00  2.310          O  
ATOM     61  CB  CYS A   5       5.983  -5.255  -4.289  1.00  2.330          C  
ATOM     62  SG  CYS A   5       5.651  -5.279  -6.049  1.00  2.330          S  
ATOM     63  H   CYS A   5       5.746  -4.880  -1.670  1.00  2.020          H  
ATOM     64  HA  CYS A   5       6.060  -3.164  -4.031  1.00  1.990          H  
ATOM     65 1HB  CYS A   5       7.059  -5.363  -4.145  1.00  2.800          H  
ATOM     66 2HB  CYS A   5       5.498  -6.122  -3.841  1.00  2.800          H  
ATOM     67  HG  CYS A   5       6.211  -6.462  -6.275  1.00  2.800          H  
ATOM     68  N   PRO A   6       3.511  -2.690  -4.418  1.00  1.860          N  
ATOM     69  CA  PRO A   6       2.120  -2.299  -4.594  1.00  2.470          C  
ATOM     70  C   PRO A   6       1.336  -3.220  -5.479  1.00  2.400          C  
ATOM     71  O   PRO A   6       0.111  -3.201  -5.414  1.00  2.550          O  
ATOM     72  CB  PRO A   6       2.222  -0.887  -5.175  1.00  3.710          C  
ATOM     73  CG  PRO A   6       3.542  -0.819  -5.827  1.00  3.710          C  
ATOM     74  CD  PRO A   6       4.454  -1.690  -4.985  1.00  3.710          C  
ATOM     75  HA  PRO A   6       1.643  -2.279  -3.621  1.00  2.960          H  
ATOM     76 1HB  PRO A   6       1.384  -0.699  -5.848  1.00  4.450          H  
ATOM     77 2HB  PRO A   6       2.154  -0.154  -4.362  1.00  4.450          H  
ATOM     78 1HG  PRO A   6       3.476  -1.148  -6.878  1.00  4.450          H  
ATOM     79 2HG  PRO A   6       3.860   0.230  -5.847  1.00  4.450          H  
ATOM     80 1HD  PRO A   6       5.178  -2.149  -5.673  1.00  4.450          H  
ATOM     81 2HD  PRO A   6       4.932  -1.098  -4.182  1.00  4.450          H  
ATOM     82  N   SER A   7       2.022  -4.033  -6.299  1.00  2.380          N  
ATOM     83  CA  SER A   7       1.358  -5.001  -7.158  1.00  2.310          C  
ATOM     84  C   SER A   7       0.161  -5.584  -6.421  1.00  1.770          C  
ATOM     85  O   SER A   7      -0.929  -5.715  -6.983  1.00  1.950          O  
ATOM     86  CB  SER A   7       2.312  -6.104  -7.558  1.00  3.260          C  
ATOM     87  OG  SER A   7       3.330  -5.610  -8.390  1.00  3.260          O  
ATOM     88  H   SER A   7       3.032  -4.002  -6.325  1.00  2.860          H  
ATOM     89  HA  SER A   7       1.023  -4.508  -8.062  1.00  2.770          H  
ATOM     90 1HB  SER A   7       2.751  -6.542  -6.662  1.00  3.910          H  
ATOM     91 2HB  SER A   7       1.765  -6.890  -8.072  1.00  3.910          H  
ATOM     92  HG  SER A   7       3.891  -6.363  -8.596  1.00  3.910          H  
ATOM     93  N   ALA A   8       0.403  -6.033  -5.182  1.00  1.360          N  
ATOM     94  CA  ALA A   8      -0.645  -6.578  -4.339  1.00  1.290          C  
ATOM     95  C   ALA A   8      -1.113  -5.489  -3.368  1.00  1.260          C  
ATOM     96  O   ALA A   8      -0.733  -5.522  -2.188  1.00  1.220          O  
ATOM     97  CB  ALA A   8      -0.160  -7.806  -3.600  1.00  1.830          C  
ATOM     98  H   ALA A   8       1.338  -5.878  -4.786  1.00  1.630          H  
ATOM     99  HA  ALA A   8      -1.493  -6.853  -4.968  1.00  1.550          H  
ATOM    100 1HB  ALA A   8      -0.979  -8.190  -3.005  1.00  2.200          H  
ATOM    101 2HB  ALA A   8       0.151  -8.561  -4.318  1.00  2.200          H  
ATOM    102 3HB  ALA A   8       0.679  -7.543  -2.962  1.00  2.200          H  
ATOM    103  N   ALA A   9      -1.881  -4.482  -3.829  1.00  1.430          N  
ATOM    104  CA  ALA A   9      -2.183  -3.366  -2.933  1.00  1.480          C  
ATOM    105  C   ALA A   9      -2.924  -3.824  -1.709  1.00  1.370          C  
ATOM    106  O   ALA A   9      -2.720  -3.241  -0.635  1.00  1.350          O  
ATOM    107  CB  ALA A   9      -2.992  -2.277  -3.610  1.00  2.050          C  
ATOM    108  H   ALA A   9      -2.256  -4.469  -4.789  1.00  1.720          H  
ATOM    109  HA  ALA A   9      -1.237  -2.939  -2.609  1.00  1.780          H  
ATOM    110 1HB  ALA A   9      -3.173  -1.474  -2.912  1.00  2.460          H  
ATOM    111 2HB  ALA A   9      -2.427  -1.906  -4.420  1.00  2.460          H  
ATOM    112 3HB  ALA A   9      -3.942  -2.684  -3.953  1.00  2.460          H  
ATOM    113  N   ASP A  10      -3.769  -4.857  -1.862  1.00  1.390          N  
ATOM    114  CA  ASP A  10      -4.606  -5.380  -0.803  1.00  1.370          C  
ATOM    115  C   ASP A  10      -3.790  -6.145   0.210  1.00  1.120          C  
ATOM    116  O   ASP A  10      -3.928  -5.953   1.421  1.00  1.090          O  
ATOM    117  CB  ASP A  10      -5.662  -6.318  -1.423  1.00  1.930          C  
ATOM    118  CG  ASP A  10      -5.050  -7.466  -2.268  1.00  1.930          C  
ATOM    119  OD1 ASP A  10      -3.908  -7.325  -2.700  1.00  1.930          O  
ATOM    120  OD2 ASP A  10      -5.704  -8.460  -2.458  1.00  1.930          O  
ATOM    121  H   ASP A  10      -3.856  -5.319  -2.771  1.00  1.670          H  
ATOM    122  HA  ASP A  10      -5.090  -4.549  -0.294  1.00  1.640          H  
ATOM    123 1HB  ASP A  10      -6.283  -6.747  -0.635  1.00  2.310          H  
ATOM    124 2HB  ASP A  10      -6.312  -5.761  -2.093  1.00  2.310          H  
ATOM    125  N   LYS A  11      -2.932  -7.021  -0.276  1.00  1.040          N  
ATOM    126  CA  LYS A  11      -2.132  -7.834   0.602  1.00  0.970          C  
ATOM    127  C   LYS A  11      -1.333  -6.930   1.505  1.00  0.840          C  
ATOM    128  O   LYS A  11      -1.382  -7.053   2.724  1.00  0.830          O  
ATOM    129  CB  LYS A  11      -1.182  -8.725  -0.194  1.00  1.390          C  
ATOM    130  CG  LYS A  11      -0.338  -9.709   0.629  1.00  1.390          C  
ATOM    131  CD  LYS A  11       0.582 -10.524  -0.296  1.00  1.390          C  
ATOM    132  CE  LYS A  11       1.285 -11.704   0.422  1.00  1.390          C  
ATOM    133  NZ  LYS A  11       2.246 -11.274   1.491  1.00  1.390          N  
ATOM    134  H   LYS A  11      -2.895  -7.133  -1.290  1.00  1.250          H  
ATOM    135  HA  LYS A  11      -2.789  -8.449   1.216  1.00  1.160          H  
ATOM    136 1HB  LYS A  11      -1.753  -9.287  -0.934  1.00  1.660          H  
ATOM    137 2HB  LYS A  11      -0.485  -8.090  -0.726  1.00  1.660          H  
ATOM    138 1HG  LYS A  11       0.272  -9.151   1.348  1.00  1.660          H  
ATOM    139 2HG  LYS A  11      -0.992 -10.382   1.183  1.00  1.660          H  
ATOM    140 1HD  LYS A  11      -0.004 -10.922  -1.125  1.00  1.660          H  
ATOM    141 2HD  LYS A  11       1.345  -9.861  -0.705  1.00  1.660          H  
ATOM    142 1HE  LYS A  11       0.532 -12.353   0.866  1.00  1.660          H  
ATOM    143 2HE  LYS A  11       1.837 -12.269  -0.329  1.00  1.660          H  
ATOM    144 1HZ  LYS A  11       2.675 -12.086   1.904  1.00  1.660          H  
ATOM    145 2HZ  LYS A  11       2.960 -10.683   1.103  1.00  1.660          H  
ATOM    146 3HZ  LYS A  11       1.751 -10.762   2.242  1.00  1.660          H  
ATOM    147  N   LEU A  12      -0.622  -5.966   0.928  1.00  0.880          N  
ATOM    148  CA  LEU A  12       0.229  -5.136   1.760  1.00  1.000          C  
ATOM    149  C   LEU A  12      -0.572  -4.227   2.690  1.00  1.030          C  
ATOM    150  O   LEU A  12      -0.261  -4.122   3.882  1.00  1.190          O  
ATOM    151  CB  LEU A  12       1.122  -4.279   0.854  1.00  1.350          C  
ATOM    152  CG  LEU A  12       2.508  -4.864   0.372  1.00  1.350          C  
ATOM    153  CD1 LEU A  12       3.438  -5.097   1.561  1.00  1.350          C  
ATOM    154  CD2 LEU A  12       2.273  -6.147  -0.423  1.00  1.350          C  
ATOM    155  H   LEU A  12      -0.645  -5.852  -0.094  1.00  1.060          H  
ATOM    156  HA  LEU A  12       0.829  -5.793   2.378  1.00  1.200          H  
ATOM    157 1HB  LEU A  12       0.545  -4.092  -0.042  1.00  1.620          H  
ATOM    158 2HB  LEU A  12       1.316  -3.334   1.349  1.00  1.620          H  
ATOM    159  HG  LEU A  12       2.989  -4.145  -0.278  1.00  1.620          H  
ATOM    160 1HD1 LEU A  12       4.390  -5.474   1.197  1.00  1.620          H  
ATOM    161 2HD1 LEU A  12       3.599  -4.153   2.079  1.00  1.620          H  
ATOM    162 3HD1 LEU A  12       3.017  -5.819   2.247  1.00  1.620          H  
ATOM    163 1HD2 LEU A  12       3.227  -6.529  -0.783  1.00  1.620          H  
ATOM    164 2HD2 LEU A  12       1.802  -6.903   0.201  1.00  1.620          H  
ATOM    165 3HD2 LEU A  12       1.633  -5.926  -1.279  1.00  1.620          H  
ATOM    166  N   TRP A  13      -1.645  -3.617   2.172  1.00  1.020          N  
ATOM    167  CA  TRP A  13      -2.469  -2.675   2.915  1.00  1.110          C  
ATOM    168  C   TRP A  13      -3.076  -3.293   4.158  1.00  1.100          C  
ATOM    169  O   TRP A  13      -3.056  -2.664   5.214  1.00  1.240          O  
ATOM    170  CB  TRP A  13      -3.506  -2.057   1.979  1.00  1.520          C  
ATOM    171  CG  TRP A  13      -4.423  -1.045   2.544  1.00  1.520          C  
ATOM    172  CD1 TRP A  13      -4.112   0.244   2.841  1.00  1.520          C  
ATOM    173  CD2 TRP A  13      -5.834  -1.176   2.778  1.00  1.520          C  
ATOM    174  NE1 TRP A  13      -5.218   0.910   3.267  1.00  1.520          N  
ATOM    175  CE2 TRP A  13      -6.287   0.064   3.223  1.00  1.520          C  
ATOM    176  CE3 TRP A  13      -6.736  -2.220   2.635  1.00  1.520          C  
ATOM    177  CZ2 TRP A  13      -7.613   0.292   3.526  1.00  1.520          C  
ATOM    178  CZ3 TRP A  13      -8.063  -1.993   2.937  1.00  1.520          C  
ATOM    179  CH2 TRP A  13      -8.495  -0.771   3.368  1.00  1.520          C  
ATOM    180  H   TRP A  13      -1.890  -3.751   1.188  1.00  1.220          H  
ATOM    181  HA  TRP A  13      -1.829  -1.863   3.245  1.00  1.330          H  
ATOM    182 1HB  TRP A  13      -3.000  -1.589   1.154  1.00  1.820          H  
ATOM    183 2HB  TRP A  13      -4.113  -2.860   1.561  1.00  1.820          H  
ATOM    184  HD1 TRP A  13      -3.124   0.679   2.753  1.00  1.820          H  
ATOM    185  HE1 TRP A  13      -5.245   1.878   3.557  1.00  1.820          H  
ATOM    186  HE3 TRP A  13      -6.406  -3.204   2.295  1.00  1.820          H  
ATOM    187  HZ2 TRP A  13      -7.971   1.262   3.874  1.00  1.820          H  
ATOM    188  HZ3 TRP A  13      -8.756  -2.823   2.829  1.00  1.820          H  
ATOM    189  HH2 TRP A  13      -9.551  -0.634   3.595  1.00  1.820          H  
ATOM    190  N   ASP A  14      -3.620  -4.510   4.062  1.00  1.060          N  
ATOM    191  CA  ASP A  14      -4.152  -5.104   5.277  1.00  1.210          C  
ATOM    192  C   ASP A  14      -3.082  -5.865   6.090  1.00  1.290          C  
ATOM    193  O   ASP A  14      -3.010  -5.711   7.309  1.00  1.510          O  
ATOM    194  CB  ASP A  14      -5.312  -6.055   4.965  1.00  1.630          C  
ATOM    195  CG  ASP A  14      -6.576  -5.358   4.446  1.00  1.630          C  
ATOM    196  OD1 ASP A  14      -7.098  -4.500   5.125  1.00  1.630          O  
ATOM    197  OD2 ASP A  14      -7.027  -5.723   3.386  1.00  1.630          O  
ATOM    198  H   ASP A  14      -3.663  -5.000   3.160  1.00  1.270          H  
ATOM    199  HA  ASP A  14      -4.546  -4.303   5.898  1.00  1.450          H  
ATOM    200 1HB  ASP A  14      -4.983  -6.769   4.206  1.00  1.960          H  
ATOM    201 2HB  ASP A  14      -5.564  -6.623   5.858  1.00  1.960          H  
ATOM    202  N   GLU A  15      -2.179  -6.618   5.443  1.00  1.280          N  
ATOM    203  CA  GLU A  15      -1.197  -7.423   6.183  1.00  1.640          C  
ATOM    204  C   GLU A  15      -0.323  -6.625   7.124  1.00  1.620          C  
ATOM    205  O   GLU A  15      -0.084  -7.038   8.260  1.00  1.960          O  
ATOM    206  CB  GLU A  15      -0.275  -8.162   5.212  1.00  2.150          C  
ATOM    207  CG  GLU A  15       0.800  -9.039   5.848  1.00  2.150          C  
ATOM    208  CD  GLU A  15       1.603  -9.752   4.802  1.00  2.150          C  
ATOM    209  OE1 GLU A  15       1.027 -10.112   3.799  1.00  2.150          O  
ATOM    210  OE2 GLU A  15       2.784  -9.929   4.978  1.00  2.150          O  
ATOM    211  H   GLU A  15      -2.189  -6.709   4.426  1.00  1.540          H  
ATOM    212  HA  GLU A  15      -1.742  -8.158   6.771  1.00  1.970          H  
ATOM    213 1HB  GLU A  15      -0.872  -8.788   4.550  1.00  2.580          H  
ATOM    214 2HB  GLU A  15       0.246  -7.431   4.592  1.00  2.580          H  
ATOM    215 1HG  GLU A  15       1.475  -8.419   6.441  1.00  2.580          H  
ATOM    216 2HG  GLU A  15       0.331  -9.762   6.514  1.00  2.580          H  
ATOM    217  N   ASN A  16       0.163  -5.482   6.656  1.00  1.400          N  
ATOM    218  CA  ASN A  16       1.048  -4.642   7.431  1.00  1.640          C  
ATOM    219  C   ASN A  16       0.358  -3.384   7.917  1.00  1.150          C  
ATOM    220  O   ASN A  16       1.040  -2.431   8.322  1.00  1.200          O  
ATOM    221  CB  ASN A  16       2.269  -4.301   6.606  1.00  2.200          C  
ATOM    222  CG  ASN A  16       3.133  -5.489   6.357  1.00  2.200          C  
ATOM    223  OD1 ASN A  16       3.402  -6.279   7.271  1.00  2.200          O  
ATOM    224  ND2 ASN A  16       3.582  -5.647   5.141  1.00  2.200          N  
ATOM    225  H   ASN A  16      -0.066  -5.186   5.701  1.00  1.680          H  
ATOM    226  HA  ASN A  16       1.364  -5.199   8.313  1.00  1.970          H  
ATOM    227 1HB  ASN A  16       1.937  -3.915   5.646  1.00  2.640          H  
ATOM    228 2HB  ASN A  16       2.852  -3.524   7.096  1.00  2.640          H  
ATOM    229 1HD2 ASN A  16       4.161  -6.436   4.923  1.00  2.640          H  
ATOM    230 2HD2 ASN A  16       3.350  -4.989   4.425  1.00  2.640          H  
ATOM    231  N   LYS A  17      -0.983  -3.390   7.948  1.00  0.850          N  
ATOM    232  CA  LYS A  17      -1.739  -2.201   8.319  1.00  0.710          C  
ATOM    233  C   LYS A  17      -1.242  -1.556   9.595  1.00  0.850          C  
ATOM    234  O   LYS A  17      -1.188  -0.332   9.660  1.00  1.110          O  
ATOM    235  CB  LYS A  17      -3.229  -2.503   8.476  1.00  1.050          C  
ATOM    236  CG  LYS A  17      -4.101  -1.257   8.741  1.00  1.050          C  
ATOM    237  CD  LYS A  17      -5.591  -1.607   8.765  1.00  1.050          C  
ATOM    238  CE  LYS A  17      -6.455  -0.362   8.991  1.00  1.050          C  
ATOM    239  NZ  LYS A  17      -7.924  -0.683   8.985  1.00  1.050          N  
ATOM    240  H   LYS A  17      -1.506  -4.229   7.670  1.00  1.020          H  
ATOM    241  HA  LYS A  17      -1.631  -1.478   7.509  1.00  0.850          H  
ATOM    242 1HB  LYS A  17      -3.597  -2.988   7.589  1.00  1.260          H  
ATOM    243 2HB  LYS A  17      -3.372  -3.199   9.301  1.00  1.260          H  
ATOM    244 1HG  LYS A  17      -3.831  -0.810   9.700  1.00  1.260          H  
ATOM    245 2HG  LYS A  17      -3.917  -0.522   7.956  1.00  1.260          H  
ATOM    246 1HD  LYS A  17      -5.868  -2.065   7.809  1.00  1.260          H  
ATOM    247 2HD  LYS A  17      -5.783  -2.324   9.561  1.00  1.260          H  
ATOM    248 1HE  LYS A  17      -6.194   0.091   9.947  1.00  1.260          H  
ATOM    249 2HE  LYS A  17      -6.252   0.355   8.194  1.00  1.260          H  
ATOM    250 1HZ  LYS A  17      -8.478   0.197   9.127  1.00  1.260          H  
ATOM    251 2HZ  LYS A  17      -8.178  -1.092   8.100  1.00  1.260          H  
ATOM    252 3HZ  LYS A  17      -8.133  -1.327   9.728  1.00  1.260          H  
ATOM    253  N   SER A  18      -0.912  -2.354  10.621  1.00  1.010          N  
ATOM    254  CA  SER A  18      -0.460  -1.804  11.894  1.00  1.360          C  
ATOM    255  C   SER A  18       0.870  -1.040  11.809  1.00  1.360          C  
ATOM    256  O   SER A  18       1.109  -0.108  12.589  1.00  1.630          O  
ATOM    257  CB  SER A  18      -0.325  -2.918  12.909  1.00  1.760          C  
ATOM    258  OG  SER A  18       0.695  -3.807  12.546  1.00  1.760          O  
ATOM    259  H   SER A  18      -0.968  -3.358  10.509  1.00  1.210          H  
ATOM    260  HA  SER A  18      -1.227  -1.123  12.251  1.00  1.630          H  
ATOM    261 1HB  SER A  18      -0.105  -2.489  13.887  1.00  2.120          H  
ATOM    262 2HB  SER A  18      -1.269  -3.453  12.990  1.00  2.120          H  
ATOM    263  HG  SER A  18       0.784  -4.423  13.281  1.00  2.120          H  
ATOM    264  N   HIS A  19       1.722  -1.379  10.837  1.00  1.230          N  
ATOM    265  CA  HIS A  19       3.000  -0.702  10.687  1.00  1.380          C  
ATOM    266  C   HIS A  19       2.758   0.578   9.930  1.00  1.390          C  
ATOM    267  O   HIS A  19       3.345   1.637  10.208  1.00  1.710          O  
ATOM    268  CB  HIS A  19       3.983  -1.566   9.886  1.00  1.870          C  
ATOM    269  CG  HIS A  19       4.431  -2.813  10.575  1.00  1.870          C  
ATOM    270  ND1 HIS A  19       5.285  -2.804  11.659  1.00  1.870          N  
ATOM    271  CD2 HIS A  19       4.144  -4.114  10.333  1.00  1.870          C  
ATOM    272  CE1 HIS A  19       5.506  -4.046  12.052  1.00  1.870          C  
ATOM    273  NE2 HIS A  19       4.828  -4.860  11.264  1.00  1.870          N  
ATOM    274  H   HIS A  19       1.498  -2.126  10.182  1.00  1.480          H  
ATOM    275  HA  HIS A  19       3.429  -0.466  11.661  1.00  1.660          H  
ATOM    276 1HB  HIS A  19       3.517  -1.855   8.943  1.00  2.250          H  
ATOM    277 2HB  HIS A  19       4.864  -0.978   9.642  1.00  2.250          H  
ATOM    278  HD2 HIS A  19       3.495  -4.499   9.546  1.00  2.250          H  
ATOM    279  HE1 HIS A  19       6.142  -4.347  12.884  1.00  2.250          H  
ATOM    280  HE2 HIS A  19       4.809  -5.869  11.331  1.00  2.250          H  
ATOM    281  N   PHE A  20       1.873   0.459   8.946  1.00  1.150          N  
ATOM    282  CA  PHE A  20       1.563   1.555   8.071  1.00  1.150          C  
ATOM    283  C   PHE A  20       0.851   2.649   8.850  1.00  1.180          C  
ATOM    284  O   PHE A  20       1.252   3.811   8.764  1.00  1.240          O  
ATOM    285  CB  PHE A  20       0.692   1.075   6.911  1.00  1.610          C  
ATOM    286  CG  PHE A  20       1.330   0.107   5.936  1.00  1.610          C  
ATOM    287  CD1 PHE A  20       2.676  -0.262   5.996  1.00  1.610          C  
ATOM    288  CD2 PHE A  20       0.562  -0.413   4.902  1.00  1.610          C  
ATOM    289  CE1 PHE A  20       3.204  -1.126   5.064  1.00  1.610          C  
ATOM    290  CE2 PHE A  20       1.111  -1.265   3.971  1.00  1.610          C  
ATOM    291  CZ  PHE A  20       2.427  -1.618   4.052  1.00  1.610          C  
ATOM    292  H   PHE A  20       1.447  -0.460   8.785  1.00  1.380          H  
ATOM    293  HA  PHE A  20       2.486   1.978   7.677  1.00  1.380          H  
ATOM    294 1HB  PHE A  20      -0.211   0.616   7.305  1.00  1.930          H  
ATOM    295 2HB  PHE A  20       0.404   1.903   6.351  1.00  1.930          H  
ATOM    296  HD1 PHE A  20       3.321   0.118   6.778  1.00  1.930          H  
ATOM    297  HD2 PHE A  20      -0.494  -0.138   4.833  1.00  1.930          H  
ATOM    298  HE1 PHE A  20       4.245  -1.419   5.131  1.00  1.930          H  
ATOM    299  HE2 PHE A  20       0.504  -1.667   3.178  1.00  1.930          H  
ATOM    300  HZ  PHE A  20       2.857  -2.299   3.317  1.00  1.930          H  
ATOM    301  N   ILE A  21      -0.101   2.271   9.714  1.00  1.190          N  
ATOM    302  CA  ILE A  21      -0.846   3.272  10.452  1.00  1.280          C  
ATOM    303  C   ILE A  21      -0.015   3.878  11.551  1.00  1.250          C  
ATOM    304  O   ILE A  21      -0.123   5.080  11.763  1.00  1.220          O  
ATOM    305  CB  ILE A  21      -2.227   2.773  10.950  1.00  1.760          C  
ATOM    306  CG1 ILE A  21      -2.102   1.595  11.911  1.00  1.760          C  
ATOM    307  CG2 ILE A  21      -3.120   2.432   9.745  1.00  1.760          C  
ATOM    308  CD1 ILE A  21      -2.179   1.954  13.386  1.00  1.760          C  
ATOM    309  H   ILE A  21      -0.360   1.288   9.767  1.00  1.430          H  
ATOM    310  HA  ILE A  21      -1.078   4.071   9.780  1.00  1.540          H  
ATOM    311  HB  ILE A  21      -2.701   3.572  11.508  1.00  2.110          H  
ATOM    312 1HG1 ILE A  21      -2.889   0.878  11.687  1.00  2.110          H  
ATOM    313 2HG1 ILE A  21      -1.150   1.126  11.743  1.00  2.110          H  
ATOM    314 1HG2 ILE A  21      -4.103   2.120  10.099  1.00  2.110          H  
ATOM    315 2HG2 ILE A  21      -3.227   3.311   9.115  1.00  2.110          H  
ATOM    316 3HG2 ILE A  21      -2.671   1.629   9.168  1.00  2.110          H  
ATOM    317 1HD1 ILE A  21      -2.072   1.045  13.977  1.00  2.110          H  
ATOM    318 2HD1 ILE A  21      -1.395   2.644  13.662  1.00  2.110          H  
ATOM    319 3HD1 ILE A  21      -3.144   2.411  13.592  1.00  2.110          H  
ATOM    320  N   GLU A  22       0.874   3.144  12.236  1.00  1.280          N  
ATOM    321  CA  GLU A  22       1.685   3.891  13.186  1.00  1.280          C  
ATOM    322  C   GLU A  22       2.427   5.021  12.448  1.00  1.200          C  
ATOM    323  O   GLU A  22       2.461   6.159  12.927  1.00  1.240          O  
ATOM    324  CB  GLU A  22       2.693   3.019  13.933  1.00  1.790          C  
ATOM    325  CG  GLU A  22       3.527   3.854  14.921  1.00  1.790          C  
ATOM    326  CD  GLU A  22       4.507   3.120  15.765  1.00  1.790          C  
ATOM    327  OE1 GLU A  22       4.589   1.922  15.677  1.00  1.790          O  
ATOM    328  OE2 GLU A  22       5.208   3.790  16.507  1.00  1.790          O  
ATOM    329  H   GLU A  22       0.972   2.127  12.133  1.00  1.540          H  
ATOM    330  HA  GLU A  22       1.025   4.345  13.923  1.00  1.540          H  
ATOM    331 1HB  GLU A  22       2.169   2.237  14.483  1.00  2.150          H  
ATOM    332 2HB  GLU A  22       3.363   2.534  13.218  1.00  2.150          H  
ATOM    333 1HG  GLU A  22       4.095   4.549  14.334  1.00  2.150          H  
ATOM    334 2HG  GLU A  22       2.856   4.429  15.559  1.00  2.150          H  
ATOM    335  N   ASP A  23       2.985   4.734  11.259  1.00  1.160          N  
ATOM    336  CA  ASP A  23       3.690   5.774  10.510  1.00  1.140          C  
ATOM    337  C   ASP A  23       2.760   6.936  10.099  1.00  1.090          C  
ATOM    338  O   ASP A  23       3.127   8.113  10.233  1.00  1.240          O  
ATOM    339  CB  ASP A  23       4.344   5.164   9.256  1.00  1.600          C  
ATOM    340  CG  ASP A  23       5.258   6.137   8.509  1.00  1.600          C  
ATOM    341  OD1 ASP A  23       6.266   6.519   9.055  1.00  1.600          O  
ATOM    342  OD2 ASP A  23       4.949   6.522   7.394  1.00  1.600          O  
ATOM    343  H   ASP A  23       2.964   3.771  10.897  1.00  1.390          H  
ATOM    344  HA  ASP A  23       4.474   6.176  11.149  1.00  1.370          H  
ATOM    345 1HB  ASP A  23       4.913   4.276   9.540  1.00  1.920          H  
ATOM    346 2HB  ASP A  23       3.559   4.833   8.571  1.00  1.920          H  
ATOM    347  N   PHE A  24       1.549   6.609   9.623  1.00  0.990          N  
ATOM    348  CA  PHE A  24       0.588   7.619   9.177  1.00  0.990          C  
ATOM    349  C   PHE A  24       0.150   8.479  10.344  1.00  0.970          C  
ATOM    350  O   PHE A  24       0.043   9.700  10.209  1.00  0.970          O  
ATOM    351  CB  PHE A  24      -0.635   6.949   8.566  1.00  1.390          C  
ATOM    352  CG  PHE A  24      -0.336   6.166   7.324  1.00  1.390          C  
ATOM    353  CD1 PHE A  24      -0.975   4.996   7.130  1.00  1.390          C  
ATOM    354  CD2 PHE A  24       0.585   6.554   6.367  1.00  1.390          C  
ATOM    355  CE1 PHE A  24      -0.740   4.222   6.050  1.00  1.390          C  
ATOM    356  CE2 PHE A  24       0.814   5.761   5.277  1.00  1.390          C  
ATOM    357  CZ  PHE A  24       0.139   4.592   5.129  1.00  1.390          C  
ATOM    358  H   PHE A  24       1.325   5.616   9.506  1.00  1.190          H  
ATOM    359  HA  PHE A  24       1.071   8.268   8.453  1.00  1.190          H  
ATOM    360 1HB  PHE A  24      -1.070   6.282   9.293  1.00  1.660          H  
ATOM    361 2HB  PHE A  24      -1.394   7.689   8.329  1.00  1.660          H  
ATOM    362  HD1 PHE A  24      -1.701   4.673   7.856  1.00  1.660          H  
ATOM    363  HD2 PHE A  24       1.139   7.482   6.466  1.00  1.660          H  
ATOM    364  HE1 PHE A  24      -1.285   3.291   5.934  1.00  1.660          H  
ATOM    365  HE2 PHE A  24       1.537   6.068   4.532  1.00  1.660          H  
ATOM    366  HZ  PHE A  24       0.299   3.962   4.283  1.00  1.660          H  
ATOM    367  N   CYS A  25      -0.090   7.849  11.490  1.00  1.000          N  
ATOM    368  CA  CYS A  25      -0.460   8.538  12.715  1.00  1.000          C  
ATOM    369  C   CYS A  25       0.623   9.523  13.108  1.00  0.920          C  
ATOM    370  O   CYS A  25       0.361  10.712  13.290  1.00  0.860          O  
ATOM    371  CB  CYS A  25      -0.685   7.533  13.848  1.00  1.400          C  
ATOM    372  SG  CYS A  25      -1.000   8.255  15.498  1.00  1.400          S  
ATOM    373  H   CYS A  25      -0.006   6.838  11.515  1.00  1.200          H  
ATOM    374  HA  CYS A  25      -1.386   9.083  12.537  1.00  1.200          H  
ATOM    375 1HB  CYS A  25      -1.527   6.889  13.594  1.00  1.680          H  
ATOM    376 2HB  CYS A  25       0.191   6.892  13.930  1.00  1.680          H  
ATOM    377  N   TRP A  26       1.883   9.089  13.134  1.00  0.960          N  
ATOM    378  CA  TRP A  26       2.902  10.045  13.521  1.00  0.970          C  
ATOM    379  C   TRP A  26       2.925  11.251  12.600  1.00  0.930          C  
ATOM    380  O   TRP A  26       3.027  12.385  13.080  1.00  0.950          O  
ATOM    381  CB  TRP A  26       4.295   9.424  13.542  1.00  1.350          C  
ATOM    382  CG  TRP A  26       4.561   8.610  14.743  1.00  1.350          C  
ATOM    383  CD1 TRP A  26       4.789   7.274  14.794  1.00  1.350          C  
ATOM    384  CD2 TRP A  26       4.610   9.082  16.106  1.00  1.350          C  
ATOM    385  NE1 TRP A  26       4.981   6.872  16.092  1.00  1.350          N  
ATOM    386  CE2 TRP A  26       4.872   7.970  16.911  1.00  1.350          C  
ATOM    387  CE3 TRP A  26       4.447  10.347  16.704  1.00  1.350          C  
ATOM    388  CZ2 TRP A  26       4.980   8.075  18.282  1.00  1.350          C  
ATOM    389  CZ3 TRP A  26       4.553  10.449  18.077  1.00  1.350          C  
ATOM    390  CH2 TRP A  26       4.813   9.342  18.847  1.00  1.350          C  
ATOM    391  H   TRP A  26       2.108   8.104  12.954  1.00  1.150          H  
ATOM    392  HA  TRP A  26       2.663  10.388  14.522  1.00  1.160          H  
ATOM    393 1HB  TRP A  26       4.409   8.780  12.665  1.00  1.620          H  
ATOM    394 2HB  TRP A  26       5.039  10.202  13.475  1.00  1.620          H  
ATOM    395  HD1 TRP A  26       4.813   6.620  13.926  1.00  1.620          H  
ATOM    396  HE1 TRP A  26       5.165   5.877  16.385  1.00  1.620          H  
ATOM    397  HE3 TRP A  26       4.241  11.230  16.098  1.00  1.620          H  
ATOM    398  HZ2 TRP A  26       5.183   7.208  18.913  1.00  1.620          H  
ATOM    399  HZ3 TRP A  26       4.425  11.429  18.535  1.00  1.620          H  
ATOM    400  HH2 TRP A  26       4.890   9.457  19.928  1.00  1.620          H  
ATOM    401  N   LYS A  27       2.803  11.039  11.288  1.00  0.890          N  
ATOM    402  CA  LYS A  27       2.818  12.169  10.371  1.00  0.880          C  
ATOM    403  C   LYS A  27       1.601  13.075  10.562  1.00  0.790          C  
ATOM    404  O   LYS A  27       1.731  14.300  10.591  1.00  0.780          O  
ATOM    405  CB  LYS A  27       2.888  11.673   8.927  1.00  1.240          C  
ATOM    406  CG  LYS A  27       4.241  11.078   8.551  1.00  1.240          C  
ATOM    407  CD  LYS A  27       4.288  10.625   7.086  1.00  1.240          C  
ATOM    408  CE  LYS A  27       5.716  10.215   6.676  1.00  1.240          C  
ATOM    409  NZ  LYS A  27       6.175   8.964   7.356  1.00  1.240          N  
ATOM    410  H   LYS A  27       2.740  10.076  10.932  1.00  1.070          H  
ATOM    411  HA  LYS A  27       3.707  12.763  10.578  1.00  1.060          H  
ATOM    412 1HB  LYS A  27       2.127  10.899   8.778  1.00  1.480          H  
ATOM    413 2HB  LYS A  27       2.664  12.493   8.246  1.00  1.480          H  
ATOM    414 1HG  LYS A  27       5.017  11.822   8.724  1.00  1.480          H  
ATOM    415 2HG  LYS A  27       4.434  10.220   9.197  1.00  1.480          H  
ATOM    416 1HD  LYS A  27       3.626   9.761   6.956  1.00  1.480          H  
ATOM    417 2HD  LYS A  27       3.942  11.427   6.434  1.00  1.480          H  
ATOM    418 1HE  LYS A  27       5.754  10.065   5.598  1.00  1.480          H  
ATOM    419 2HE  LYS A  27       6.395  11.022   6.944  1.00  1.480          H  
ATOM    420 1HZ  LYS A  27       7.109   8.732   7.079  1.00  1.480          H  
ATOM    421 2HZ  LYS A  27       6.154   9.076   8.362  1.00  1.480          H  
ATOM    422 3HZ  LYS A  27       5.575   8.164   7.118  1.00  1.480          H  
ATOM    423  N   LEU A  28       0.423  12.478  10.717  1.00  0.780          N  
ATOM    424  CA  LEU A  28      -0.806  13.239  10.867  1.00  0.780          C  
ATOM    425  C   LEU A  28      -0.813  14.042  12.164  1.00  0.780          C  
ATOM    426  O   LEU A  28      -1.252  15.198  12.179  1.00  0.790          O  
ATOM    427  CB  LEU A  28      -1.993  12.275  10.792  1.00  1.090          C  
ATOM    428  CG  LEU A  28      -3.402  12.860  10.901  1.00  1.090          C  
ATOM    429  CD1 LEU A  28      -3.653  13.887   9.807  1.00  1.090          C  
ATOM    430  CD2 LEU A  28      -4.376  11.729  10.756  1.00  1.090          C  
ATOM    431  H   LEU A  28       0.365  11.458  10.675  1.00  0.940          H  
ATOM    432  HA  LEU A  28      -0.862  13.927  10.031  1.00  0.940          H  
ATOM    433 1HB  LEU A  28      -1.928  11.739   9.845  1.00  1.310          H  
ATOM    434 2HB  LEU A  28      -1.878  11.541  11.594  1.00  1.310          H  
ATOM    435  HG  LEU A  28      -3.526  13.336  11.867  1.00  1.310          H  
ATOM    436 1HD1 LEU A  28      -4.668  14.266   9.897  1.00  1.310          H  
ATOM    437 2HD1 LEU A  28      -2.959  14.717   9.894  1.00  1.310          H  
ATOM    438 3HD1 LEU A  28      -3.533  13.416   8.835  1.00  1.310          H  
ATOM    439 1HD2 LEU A  28      -5.388  12.107  10.830  1.00  1.310          H  
ATOM    440 2HD2 LEU A  28      -4.241  11.270   9.794  1.00  1.310          H  
ATOM    441 3HD2 LEU A  28      -4.205  11.001  11.529  1.00  1.310          H  
ATOM    442  N   HIS A  29      -0.333  13.425  13.240  1.00  0.840          N  
ATOM    443  CA  HIS A  29      -0.215  14.015  14.566  1.00  0.920          C  
ATOM    444  C   HIS A  29       0.756  15.200  14.549  1.00  0.890          C  
ATOM    445  O   HIS A  29       0.440  16.310  14.984  1.00  0.970          O  
ATOM    446  CB  HIS A  29       0.274  12.931  15.539  1.00  1.260          C  
ATOM    447  CG  HIS A  29       0.501  13.362  16.941  1.00  1.260          C  
ATOM    448  ND1 HIS A  29      -0.527  13.633  17.821  1.00  1.260          N  
ATOM    449  CD2 HIS A  29       1.651  13.559  17.628  1.00  1.260          C  
ATOM    450  CE1 HIS A  29      -0.017  13.981  18.991  1.00  1.260          C  
ATOM    451  NE2 HIS A  29       1.301  13.945  18.899  1.00  1.260          N  
ATOM    452  H   HIS A  29      -0.028  12.457  13.140  1.00  1.010          H  
ATOM    453  HA  HIS A  29      -1.190  14.372  14.900  1.00  1.100          H  
ATOM    454 1HB  HIS A  29      -0.444  12.120  15.551  1.00  1.510          H  
ATOM    455 2HB  HIS A  29       1.208  12.515  15.164  1.00  1.510          H  
ATOM    456  HD2 HIS A  29       2.664  13.433  17.240  1.00  1.510          H  
ATOM    457  HE1 HIS A  29      -0.587  14.254  19.878  1.00  1.510          H  
ATOM    458  HE2 HIS A  29       1.950  14.163  19.643  1.00  1.510          H  
ATOM    459  N   ARG A  30       1.954  14.978  14.003  1.00  0.920          N  
ATOM    460  CA  ARG A  30       2.993  16.001  13.923  1.00  1.070          C  
ATOM    461  C   ARG A  30       2.548  17.211  13.089  1.00  1.030          C  
ATOM    462  O   ARG A  30       2.918  18.349  13.384  1.00  1.190          O  
ATOM    463  CB  ARG A  30       4.265  15.373  13.388  1.00  1.440          C  
ATOM    464  CG  ARG A  30       4.935  14.424  14.398  1.00  1.440          C  
ATOM    465  CD  ARG A  30       6.053  13.651  13.813  1.00  1.440          C  
ATOM    466  NE  ARG A  30       6.638  12.741  14.804  1.00  1.440          N  
ATOM    467  CZ  ARG A  30       7.429  11.679  14.531  1.00  1.440          C  
ATOM    468  NH1 ARG A  30       7.736  11.373  13.285  1.00  1.440          N  
ATOM    469  NH2 ARG A  30       7.896  10.939  15.523  1.00  1.440          N  
ATOM    470  H   ARG A  30       2.175  14.043  13.654  1.00  1.100          H  
ATOM    471  HA  ARG A  30       3.199  16.346  14.936  1.00  1.280          H  
ATOM    472 1HB  ARG A  30       4.034  14.801  12.487  1.00  1.730          H  
ATOM    473 2HB  ARG A  30       4.977  16.150  13.118  1.00  1.730          H  
ATOM    474 1HG  ARG A  30       5.336  15.014  15.220  1.00  1.730          H  
ATOM    475 2HG  ARG A  30       4.202  13.724  14.794  1.00  1.730          H  
ATOM    476 1HD  ARG A  30       5.671  13.060  12.980  1.00  1.730          H  
ATOM    477 2HD  ARG A  30       6.829  14.330  13.464  1.00  1.730          H  
ATOM    478  HE  ARG A  30       6.441  12.936  15.779  1.00  1.730          H  
ATOM    479 1HH1 ARG A  30       7.385  11.934  12.523  1.00  1.730          H  
ATOM    480 2HH1 ARG A  30       8.328  10.578  13.090  1.00  1.730          H  
ATOM    481 1HH2 ARG A  30       7.667  11.172  16.481  1.00  1.730          H  
ATOM    482 2HH2 ARG A  30       8.481  10.140  15.331  1.00  1.730          H  
ATOM    483  N   ARG A  31       1.698  16.967  12.087  1.00  0.920          N  
ATOM    484  CA  ARG A  31       1.147  18.000  11.212  1.00  1.010          C  
ATOM    485  C   ARG A  31      -0.118  18.677  11.785  1.00  0.950          C  
ATOM    486  O   ARG A  31      -0.759  19.468  11.090  1.00  1.130          O  
ATOM    487  CB  ARG A  31       0.834  17.412   9.847  1.00  1.380          C  
ATOM    488  CG  ARG A  31       2.057  16.957   9.056  1.00  1.380          C  
ATOM    489  CD  ARG A  31       1.676  16.270   7.798  1.00  1.380          C  
ATOM    490  NE  ARG A  31       2.846  15.740   7.101  1.00  1.380          N  
ATOM    491  CZ  ARG A  31       2.834  15.124   5.897  1.00  1.380          C  
ATOM    492  NH1 ARG A  31       1.706  14.971   5.230  1.00  1.380          N  
ATOM    493  NH2 ARG A  31       3.968  14.674   5.385  1.00  1.380          N  
ATOM    494  H   ARG A  31       1.488  15.990  11.855  1.00  1.100          H  
ATOM    495  HA  ARG A  31       1.908  18.768  11.082  1.00  1.210          H  
ATOM    496 1HB  ARG A  31       0.184  16.545   9.976  1.00  1.650          H  
ATOM    497 2HB  ARG A  31       0.297  18.142   9.245  1.00  1.650          H  
ATOM    498 1HG  ARG A  31       2.640  17.835   8.785  1.00  1.650          H  
ATOM    499 2HG  ARG A  31       2.678  16.299   9.651  1.00  1.650          H  
ATOM    500 1HD  ARG A  31       1.008  15.437   8.035  1.00  1.650          H  
ATOM    501 2HD  ARG A  31       1.171  16.978   7.142  1.00  1.650          H  
ATOM    502  HE  ARG A  31       3.739  15.833   7.569  1.00  1.650          H  
ATOM    503 1HH1 ARG A  31       0.843  15.326   5.608  1.00  1.650          H  
ATOM    504 2HH1 ARG A  31       1.709  14.510   4.324  1.00  1.650          H  
ATOM    505 1HH2 ARG A  31       4.835  14.794   5.893  1.00  1.650          H  
ATOM    506 2HH2 ARG A  31       3.971  14.213   4.484  1.00  1.650          H  
ATOM    507  N   GLU A  32      -0.440  18.383  13.057  1.00  0.970          N  
ATOM    508  CA  GLU A  32      -1.576  18.895  13.834  1.00  1.090          C  
ATOM    509  C   GLU A  32      -2.971  18.422  13.412  1.00  0.970          C  
ATOM    510  O   GLU A  32      -3.951  19.162  13.545  1.00  1.210          O  
ATOM    511  CB  GLU A  32      -1.581  20.439  13.847  1.00  1.480          C  
ATOM    512  CG  GLU A  32      -0.349  21.097  14.474  1.00  1.480          C  
ATOM    513  CD  GLU A  32      -0.460  22.608  14.512  1.00  1.480          C  
ATOM    514  OE1 GLU A  32      -1.290  23.128  13.807  1.00  1.480          O  
ATOM    515  OE2 GLU A  32       0.276  23.230  15.243  1.00  1.480          O  
ATOM    516  H   GLU A  32       0.130  17.696  13.559  1.00  1.160          H  
ATOM    517  HA  GLU A  32      -1.426  18.558  14.861  1.00  1.310          H  
ATOM    518 1HB  GLU A  32      -1.708  20.831  12.846  1.00  1.770          H  
ATOM    519 2HB  GLU A  32      -2.438  20.781  14.426  1.00  1.770          H  
ATOM    520 1HG  GLU A  32      -0.225  20.722  15.488  1.00  1.770          H  
ATOM    521 2HG  GLU A  32       0.533  20.812  13.900  1.00  1.770          H  
ATOM    522  N   GLY A  33      -3.075  17.175  12.962  1.00  0.890          N  
ATOM    523  CA  GLY A  33      -4.351  16.542  12.688  1.00  1.110          C  
ATOM    524  C   GLY A  33      -4.563  15.563  13.833  1.00  1.150          C  
ATOM    525  O   GLY A  33      -3.997  15.744  14.912  1.00  1.130          O  
ATOM    526  H   GLY A  33      -2.246  16.597  12.822  1.00  1.070          H  
ATOM    527 1HA  GLY A  33      -5.151  17.280  12.651  1.00  1.330          H  
ATOM    528 2HA  GLY A  33      -4.313  16.018  11.736  1.00  1.330          H  
ATOM    529  N   ALA A  34      -5.345  14.511  13.622  1.00  1.450          N  
ATOM    530  CA  ALA A  34      -5.550  13.549  14.696  1.00  1.710          C  
ATOM    531  C   ALA A  34      -5.613  12.158  14.119  1.00  1.450          C  
ATOM    532  O   ALA A  34      -6.306  11.928  13.124  1.00  1.400          O  
ATOM    533  CB  ALA A  34      -6.821  13.865  15.462  1.00  2.290          C  
ATOM    534  H   ALA A  34      -5.819  14.394  12.738  1.00  1.740          H  
ATOM    535  HA  ALA A  34      -4.696  13.595  15.374  1.00  2.050          H  
ATOM    536 1HB  ALA A  34      -6.954  13.144  16.268  1.00  2.750          H  
ATOM    537 2HB  ALA A  34      -6.744  14.869  15.884  1.00  2.750          H  
ATOM    538 3HB  ALA A  34      -7.673  13.820  14.789  1.00  2.750          H  
ATOM    539  N   CYS A  35      -4.977  11.220  14.824  1.00  1.430          N  
ATOM    540  CA  CYS A  35      -4.827   9.829  14.402  1.00  1.370          C  
ATOM    541  C   CYS A  35      -6.106   9.057  14.198  1.00  1.260          C  
ATOM    542  O   CYS A  35      -6.103   8.018  13.540  1.00  1.310          O  
ATOM    543  CB  CYS A  35      -3.918   9.109  15.363  1.00  1.940          C  
ATOM    544  SG  CYS A  35      -2.287   9.807  15.277  1.00  1.940          S  
ATOM    545  H   CYS A  35      -4.486  11.513  15.661  1.00  1.720          H  
ATOM    546  HA  CYS A  35      -4.300   9.845  13.455  1.00  1.640          H  
ATOM    547 1HB  CYS A  35      -4.290   9.199  16.385  1.00  2.330          H  
ATOM    548 2HB  CYS A  35      -3.865   8.049  15.107  1.00  2.330          H  
ATOM    549  N   VAL A  36      -7.217   9.598  14.651  1.00  1.270          N  
ATOM    550  CA  VAL A  36      -8.496   8.945  14.439  1.00  1.390          C  
ATOM    551  C   VAL A  36      -8.767   8.851  12.926  1.00  1.380          C  
ATOM    552  O   VAL A  36      -9.512   7.981  12.475  1.00  1.620          O  
ATOM    553  CB  VAL A  36      -9.623   9.725  15.154  1.00  1.900          C  
ATOM    554  CG1 VAL A  36      -9.346   9.744  16.655  1.00  1.900          C  
ATOM    555  CG2 VAL A  36      -9.729  11.158  14.604  1.00  1.900          C  
ATOM    556  H   VAL A  36      -7.146  10.463  15.161  1.00  1.520          H  
ATOM    557  HA  VAL A  36      -8.451   7.938  14.850  1.00  1.670          H  
ATOM    558  HB  VAL A  36     -10.569   9.207  15.000  1.00  2.280          H  
ATOM    559 1HG1 VAL A  36     -10.152  10.271  17.169  1.00  2.280          H  
ATOM    560 2HG1 VAL A  36      -9.291   8.720  17.022  1.00  2.280          H  
ATOM    561 3HG1 VAL A  36      -8.405  10.248  16.854  1.00  2.280          H  
ATOM    562 1HG2 VAL A  36     -10.528  11.683  15.124  1.00  2.280          H  
ATOM    563 2HG2 VAL A  36      -8.799  11.685  14.754  1.00  2.280          H  
ATOM    564 3HG2 VAL A  36      -9.960  11.135  13.551  1.00  2.280          H  
ATOM    565  N   ASN A  37      -8.152   9.761  12.152  1.00  1.230          N  
ATOM    566  CA  ASN A  37      -8.268   9.811  10.710  1.00  1.320          C  
ATOM    567  C   ASN A  37      -7.013   9.277  10.004  1.00  1.090          C  
ATOM    568  O   ASN A  37      -6.867   9.456   8.786  1.00  1.050          O  
ATOM    569  CB  ASN A  37      -8.545  11.234  10.273  1.00  1.810          C  
ATOM    570  CG  ASN A  37      -9.891  11.722  10.714  1.00  1.810          C  
ATOM    571  OD1 ASN A  37     -10.902  11.016  10.617  1.00  1.810          O  
ATOM    572  ND2 ASN A  37      -9.928  12.937  11.204  1.00  1.810          N  
ATOM    573  H   ASN A  37      -7.552  10.460  12.602  1.00  1.480          H  
ATOM    574  HA  ASN A  37      -9.107   9.180  10.412  1.00  1.580          H  
ATOM    575 1HB  ASN A  37      -7.786  11.891  10.698  1.00  2.170          H  
ATOM    576 2HB  ASN A  37      -8.477  11.307   9.188  1.00  2.170          H  
ATOM    577 1HD2 ASN A  37     -10.796  13.325  11.516  1.00  2.170          H  
ATOM    578 2HD2 ASN A  37      -9.090  13.475  11.266  1.00  2.170          H  
ATOM    579  N   CYS A  38      -6.122   8.575  10.730  1.00  1.060          N  
ATOM    580  CA  CYS A  38      -4.882   8.102  10.113  1.00  0.950          C  
ATOM    581  C   CYS A  38      -5.145   7.088   9.020  1.00  0.850          C  
ATOM    582  O   CYS A  38      -4.350   6.982   8.090  1.00  0.950          O  
ATOM    583  CB  CYS A  38      -3.905   7.508  11.135  1.00  1.370          C  
ATOM    584  SG  CYS A  38      -4.455   6.005  11.943  1.00  1.370          S  
ATOM    585  H   CYS A  38      -6.288   8.404  11.722  1.00  1.270          H  
ATOM    586  HA  CYS A  38      -4.382   8.956   9.670  1.00  1.140          H  
ATOM    587 1HB  CYS A  38      -2.966   7.287  10.638  1.00  1.650          H  
ATOM    588 2HB  CYS A  38      -3.694   8.237  11.902  1.00  1.650          H  
ATOM    589  HG  CYS A  38      -5.332   6.630  12.772  1.00  1.650          H  
ATOM    590  N   GLU A  39      -6.279   6.391   9.081  1.00  0.900          N  
ATOM    591  CA  GLU A  39      -6.616   5.438   8.047  1.00  1.030          C  
ATOM    592  C   GLU A  39      -7.044   6.138   6.740  1.00  1.210          C  
ATOM    593  O   GLU A  39      -6.994   5.530   5.669  1.00  1.320          O  
ATOM    594  CB  GLU A  39      -7.658   4.451   8.563  1.00  1.390          C  
ATOM    595  CG  GLU A  39      -7.088   3.580   9.701  1.00  1.390          C  
ATOM    596  CD  GLU A  39      -7.983   2.466  10.193  1.00  1.390          C  
ATOM    597  OE1 GLU A  39      -8.877   2.055   9.477  1.00  1.390          O  
ATOM    598  OE2 GLU A  39      -7.746   1.991  11.279  1.00  1.390          O  
ATOM    599  H   GLU A  39      -6.879   6.471   9.895  1.00  1.080          H  
ATOM    600  HA  GLU A  39      -5.721   4.856   7.828  1.00  1.240          H  
ATOM    601 1HB  GLU A  39      -8.527   4.993   8.937  1.00  1.670          H  
ATOM    602 2HB  GLU A  39      -7.987   3.800   7.753  1.00  1.670          H  
ATOM    603 1HG  GLU A  39      -6.159   3.142   9.349  1.00  1.670          H  
ATOM    604 2HG  GLU A  39      -6.844   4.228  10.542  1.00  1.670          H  
ATOM    605  N   MET A  40      -7.531   7.392   6.791  1.00  1.380          N  
ATOM    606  CA  MET A  40      -7.852   8.030   5.516  1.00  1.730          C  
ATOM    607  C   MET A  40      -6.605   8.732   5.018  1.00  1.640          C  
ATOM    608  O   MET A  40      -6.400   8.897   3.807  1.00  2.060          O  
ATOM    609  CB  MET A  40      -9.066   8.933   5.577  1.00  2.280          C  
ATOM    610  CG  MET A  40     -10.355   8.154   5.820  1.00  2.280          C  
ATOM    611  SD  MET A  40     -11.841   9.156   5.775  1.00  2.280          S  
ATOM    612  CE  MET A  40     -12.004   9.412   3.994  1.00  2.280          C  
ATOM    613  H   MET A  40      -7.609   7.925   7.659  1.00  1.660          H  
ATOM    614  HA  MET A  40      -8.084   7.258   4.795  1.00  2.080          H  
ATOM    615 1HB  MET A  40      -8.942   9.651   6.392  1.00  2.740          H  
ATOM    616 2HB  MET A  40      -9.142   9.492   4.652  1.00  2.740          H  
ATOM    617 1HG  MET A  40     -10.443   7.386   5.062  1.00  2.740          H  
ATOM    618 2HG  MET A  40     -10.297   7.662   6.790  1.00  2.740          H  
ATOM    619 1HE  MET A  40     -12.900  10.000   3.790  1.00  2.740          H  
ATOM    620 2HE  MET A  40     -11.138   9.937   3.608  1.00  2.740          H  
ATOM    621 3HE  MET A  40     -12.089   8.456   3.506  1.00  2.740          H  
ATOM    622  N   HIS A  41      -5.746   9.103   5.971  1.00  1.250          N  
ATOM    623  CA  HIS A  41      -4.466   9.713   5.677  1.00  1.410          C  
ATOM    624  C   HIS A  41      -3.739   8.653   4.861  1.00  1.300          C  
ATOM    625  O   HIS A  41      -3.138   8.947   3.825  1.00  1.300          O  
ATOM    626  CB  HIS A  41      -3.716  10.060   6.967  1.00  1.910          C  
ATOM    627  CG  HIS A  41      -2.489  10.877   6.811  1.00  1.910          C  
ATOM    628  ND1 HIS A  41      -2.531  12.229   6.546  1.00  1.910          N  
ATOM    629  CD2 HIS A  41      -1.179  10.552   6.890  1.00  1.910          C  
ATOM    630  CE1 HIS A  41      -1.300  12.695   6.474  1.00  1.910          C  
ATOM    631  NE2 HIS A  41      -0.467  11.700   6.676  1.00  1.910          N  
ATOM    632  H   HIS A  41      -6.019   8.993   6.949  1.00  1.500          H  
ATOM    633  HA  HIS A  41      -4.582  10.612   5.073  1.00  1.690          H  
ATOM    634 1HB  HIS A  41      -4.394  10.580   7.633  1.00  2.290          H  
ATOM    635 2HB  HIS A  41      -3.417   9.150   7.456  1.00  2.290          H  
ATOM    636  HD2 HIS A  41      -0.764   9.573   7.085  1.00  2.290          H  
ATOM    637  HE1 HIS A  41      -1.021  13.729   6.277  1.00  2.290          H  
ATOM    638  HE2 HIS A  41       0.540  11.761   6.672  1.00  2.290          H  
ATOM    639  N   ALA A  42      -3.841   7.398   5.332  1.00  1.250          N  
ATOM    640  CA  ALA A  42      -3.241   6.246   4.700  1.00  1.150          C  
ATOM    641  C   ALA A  42      -3.655   6.090   3.270  1.00  1.020          C  
ATOM    642  O   ALA A  42      -2.817   6.020   2.379  1.00  0.970          O  
ATOM    643  CB  ALA A  42      -3.724   4.991   5.391  1.00  1.650          C  
ATOM    644  H   ALA A  42      -4.316   7.257   6.223  1.00  1.500          H  
ATOM    645  HA  ALA A  42      -2.164   6.360   4.760  1.00  1.380          H  
ATOM    646 1HB  ALA A  42      -3.272   4.123   4.926  1.00  1.980          H  
ATOM    647 2HB  ALA A  42      -3.495   5.022   6.435  1.00  1.980          H  
ATOM    648 3HB  ALA A  42      -4.775   4.916   5.285  1.00  1.980          H  
ATOM    649  N   LEU A  43      -4.948   6.205   3.008  1.00  0.970          N  
ATOM    650  CA  LEU A  43      -5.421   6.028   1.651  1.00  0.920          C  
ATOM    651  C   LEU A  43      -4.781   7.048   0.709  1.00  0.840          C  
ATOM    652  O   LEU A  43      -4.400   6.703  -0.421  1.00  0.910          O  
ATOM    653  CB  LEU A  43      -6.939   6.114   1.668  1.00  1.310          C  
ATOM    654  CG  LEU A  43      -7.641   4.938   2.382  1.00  1.310          C  
ATOM    655  CD1 LEU A  43      -9.077   5.288   2.586  1.00  1.310          C  
ATOM    656  CD2 LEU A  43      -7.522   3.640   1.533  1.00  1.310          C  
ATOM    657  H   LEU A  43      -5.615   6.276   3.783  1.00  1.160          H  
ATOM    658  HA  LEU A  43      -5.133   5.045   1.322  1.00  1.100          H  
ATOM    659 1HB  LEU A  43      -7.227   7.033   2.172  1.00  1.570          H  
ATOM    660 2HB  LEU A  43      -7.296   6.141   0.646  1.00  1.570          H  
ATOM    661  HG  LEU A  43      -7.188   4.776   3.353  1.00  1.570          H  
ATOM    662 1HD1 LEU A  43      -9.556   4.479   3.102  1.00  1.570          H  
ATOM    663 2HD1 LEU A  43      -9.162   6.184   3.177  1.00  1.570          H  
ATOM    664 3HD1 LEU A  43      -9.521   5.444   1.664  1.00  1.570          H  
ATOM    665 1HD2 LEU A  43      -8.030   2.830   2.040  1.00  1.570          H  
ATOM    666 2HD2 LEU A  43      -7.977   3.799   0.560  1.00  1.570          H  
ATOM    667 3HD2 LEU A  43      -6.491   3.359   1.397  1.00  1.570          H  
ATOM    668  N   ASN A  44      -4.581   8.276   1.184  1.00  0.740          N  
ATOM    669  CA  ASN A  44      -3.918   9.257   0.338  1.00  0.700          C  
ATOM    670  C   ASN A  44      -2.405   8.960   0.213  1.00  0.810          C  
ATOM    671  O   ASN A  44      -1.838   9.088  -0.881  1.00  0.800          O  
ATOM    672  CB  ASN A  44      -4.153  10.654   0.872  1.00  1.000          C  
ATOM    673  CG  ASN A  44      -5.553  11.136   0.621  1.00  1.000          C  
ATOM    674  OD1 ASN A  44      -5.899  11.501  -0.511  1.00  1.000          O  
ATOM    675  ND2 ASN A  44      -6.369  11.146   1.641  1.00  1.000          N  
ATOM    676  H   ASN A  44      -4.948   8.516   2.115  1.00  0.890          H  
ATOM    677  HA  ASN A  44      -4.348   9.195  -0.661  1.00  0.840          H  
ATOM    678 1HB  ASN A  44      -3.969  10.658   1.951  1.00  1.200          H  
ATOM    679 2HB  ASN A  44      -3.446  11.346   0.417  1.00  1.200          H  
ATOM    680 1HD2 ASN A  44      -7.311  11.455   1.522  1.00  1.200          H  
ATOM    681 2HD2 ASN A  44      -6.062  10.830   2.546  1.00  1.200          H  
ATOM    682  N   GLU A  45      -1.765   8.525   1.311  1.00  0.970          N  
ATOM    683  CA  GLU A  45      -0.328   8.204   1.312  1.00  1.120          C  
ATOM    684  C   GLU A  45       0.007   6.993   0.427  1.00  1.120          C  
ATOM    685  O   GLU A  45       1.074   6.949  -0.194  1.00  1.190          O  
ATOM    686  CB  GLU A  45       0.177   7.959   2.736  1.00  1.510          C  
ATOM    687  CG  GLU A  45       0.232   9.216   3.643  1.00  1.510          C  
ATOM    688  CD  GLU A  45       1.228  10.252   3.212  1.00  1.510          C  
ATOM    689  OE1 GLU A  45       2.400   9.961   3.158  1.00  1.510          O  
ATOM    690  OE2 GLU A  45       0.797  11.333   2.896  1.00  1.510          O  
ATOM    691  H   GLU A  45      -2.285   8.486   2.194  1.00  1.160          H  
ATOM    692  HA  GLU A  45       0.207   9.067   0.916  1.00  1.340          H  
ATOM    693 1HB  GLU A  45      -0.482   7.241   3.214  1.00  1.810          H  
ATOM    694 2HB  GLU A  45       1.171   7.521   2.695  1.00  1.810          H  
ATOM    695 1HG  GLU A  45      -0.749   9.679   3.651  1.00  1.810          H  
ATOM    696 2HG  GLU A  45       0.454   8.914   4.656  1.00  1.810          H  
ATOM    697  N   ILE A  46      -0.891   6.009   0.355  1.00  1.070          N  
ATOM    698  CA  ILE A  46      -0.629   4.855  -0.501  1.00  1.100          C  
ATOM    699  C   ILE A  46      -0.866   5.269  -1.959  1.00  0.990          C  
ATOM    700  O   ILE A  46      -0.057   4.938  -2.826  1.00  1.080          O  
ATOM    701  CB  ILE A  46      -1.457   3.594  -0.101  1.00  1.530          C  
ATOM    702  CG1 ILE A  46      -2.935   3.809  -0.333  1.00  1.530          C  
ATOM    703  CG2 ILE A  46      -1.181   3.224   1.357  1.00  1.530          C  
ATOM    704  CD1 ILE A  46      -3.803   2.636  -0.093  1.00  1.530          C  
ATOM    705  H   ILE A  46      -1.727   6.078   0.939  1.00  1.280          H  
ATOM    706  HA  ILE A  46       0.424   4.584  -0.402  1.00  1.320          H  
ATOM    707  HB  ILE A  46      -1.152   2.771  -0.738  1.00  1.830          H  
ATOM    708 1HG1 ILE A  46      -3.246   4.608   0.285  1.00  1.830          H  
ATOM    709 2HG1 ILE A  46      -3.107   4.071  -1.360  1.00  1.830          H  
ATOM    710 1HG2 ILE A  46      -1.699   2.333   1.653  1.00  1.830          H  
ATOM    711 2HG2 ILE A  46      -0.168   3.062   1.440  1.00  1.830          H  
ATOM    712 3HG2 ILE A  46      -1.471   4.036   2.009  1.00  1.830          H  
ATOM    713 1HD1 ILE A  46      -4.804   2.939  -0.302  1.00  1.830          H  
ATOM    714 2HD1 ILE A  46      -3.513   1.828  -0.748  1.00  1.830          H  
ATOM    715 3HD1 ILE A  46      -3.750   2.314   0.926  1.00  1.830          H  
ATOM    716  N   GLN A  47      -1.877   6.125  -2.218  1.00  0.860          N  
ATOM    717  CA  GLN A  47      -2.107   6.589  -3.577  1.00  0.780          C  
ATOM    718  C   GLN A  47      -0.898   7.340  -4.096  1.00  0.860          C  
ATOM    719  O   GLN A  47      -0.560   7.210  -5.270  1.00  0.870          O  
ATOM    720  CB  GLN A  47      -3.401   7.393  -3.697  1.00  1.120          C  
ATOM    721  CG  GLN A  47      -3.719   7.921  -5.127  1.00  1.120          C  
ATOM    722  CD  GLN A  47      -3.871   6.842  -6.236  1.00  1.120          C  
ATOM    723  OE1 GLN A  47      -4.549   5.798  -6.101  1.00  1.120          O  
ATOM    724  NE2 GLN A  47      -3.221   7.143  -7.357  1.00  1.120          N  
ATOM    725  H   GLN A  47      -2.543   6.388  -1.484  1.00  1.030          H  
ATOM    726  HA  GLN A  47      -2.234   5.722  -4.202  1.00  0.940          H  
ATOM    727 1HB  GLN A  47      -4.238   6.776  -3.365  1.00  1.350          H  
ATOM    728 2HB  GLN A  47      -3.350   8.251  -3.024  1.00  1.350          H  
ATOM    729 1HG  GLN A  47      -4.657   8.470  -5.073  1.00  1.350          H  
ATOM    730 2HG  GLN A  47      -2.924   8.601  -5.430  1.00  1.350          H  
ATOM    731 1HE2 GLN A  47      -3.236   6.545  -8.155  1.00  1.350          H  
ATOM    732 2HE2 GLN A  47      -2.690   8.011  -7.420  1.00  1.350          H  
ATOM    733  N   GLU A  48      -0.194   8.080  -3.242  1.00  0.970          N  
ATOM    734  CA  GLU A  48       1.009   8.759  -3.718  1.00  1.100          C  
ATOM    735  C   GLU A  48       1.996   7.745  -4.324  1.00  1.250          C  
ATOM    736  O   GLU A  48       2.616   8.025  -5.347  1.00  1.390          O  
ATOM    737  CB  GLU A  48       1.692   9.522  -2.576  1.00  1.490          C  
ATOM    738  CG  GLU A  48       2.963  10.336  -2.965  1.00  1.490          C  
ATOM    739  CD  GLU A  48       2.687  11.503  -3.888  1.00  1.490          C  
ATOM    740  OE1 GLU A  48       1.540  11.833  -4.066  1.00  1.490          O  
ATOM    741  OE2 GLU A  48       3.623  12.100  -4.367  1.00  1.490          O  
ATOM    742  H   GLU A  48      -0.551   8.229  -2.292  1.00  1.160          H  
ATOM    743  HA  GLU A  48       0.720   9.471  -4.490  1.00  1.320          H  
ATOM    744 1HB  GLU A  48       0.975  10.206  -2.122  1.00  1.790          H  
ATOM    745 2HB  GLU A  48       1.986   8.812  -1.804  1.00  1.790          H  
ATOM    746 1HG  GLU A  48       3.421  10.715  -2.053  1.00  1.790          H  
ATOM    747 2HG  GLU A  48       3.680   9.668  -3.442  1.00  1.790          H  
ATOM    748  N   VAL A  49       2.131   6.556  -3.724  1.00  1.260          N  
ATOM    749  CA  VAL A  49       3.073   5.561  -4.224  1.00  1.400          C  
ATOM    750  C   VAL A  49       2.608   5.055  -5.570  1.00  1.280          C  
ATOM    751  O   VAL A  49       3.385   4.955  -6.529  1.00  1.380          O  
ATOM    752  CB  VAL A  49       3.198   4.383  -3.226  1.00  1.900          C  
ATOM    753  CG1 VAL A  49       4.044   3.228  -3.819  1.00  1.900          C  
ATOM    754  CG2 VAL A  49       3.818   4.910  -1.938  1.00  1.900          C  
ATOM    755  H   VAL A  49       1.539   6.319  -2.927  1.00  1.510          H  
ATOM    756  HA  VAL A  49       4.046   6.029  -4.339  1.00  1.680          H  
ATOM    757  HB  VAL A  49       2.209   3.975  -3.014  1.00  2.280          H  
ATOM    758 1HG1 VAL A  49       4.102   2.416  -3.084  1.00  2.280          H  
ATOM    759 2HG1 VAL A  49       3.583   2.846  -4.732  1.00  2.280          H  
ATOM    760 3HG1 VAL A  49       5.046   3.587  -4.046  1.00  2.280          H  
ATOM    761 1HG2 VAL A  49       3.905   4.101  -1.227  1.00  2.280          H  
ATOM    762 2HG2 VAL A  49       4.804   5.311  -2.148  1.00  2.280          H  
ATOM    763 3HG2 VAL A  49       3.187   5.697  -1.519  1.00  2.280          H  
ATOM    764  N   PHE A  50       1.326   4.745  -5.634  1.00  1.100          N  
ATOM    765  CA  PHE A  50       0.726   4.222  -6.838  1.00  1.040          C  
ATOM    766  C   PHE A  50       0.896   5.223  -7.976  1.00  0.980          C  
ATOM    767  O   PHE A  50       1.299   4.846  -9.083  1.00  1.100          O  
ATOM    768  CB  PHE A  50      -0.768   4.010  -6.600  1.00  1.480          C  
ATOM    769  CG  PHE A  50      -1.118   3.022  -5.492  1.00  1.480          C  
ATOM    770  CD1 PHE A  50      -2.338   3.121  -4.878  1.00  1.480          C  
ATOM    771  CD2 PHE A  50      -0.250   2.036  -5.035  1.00  1.480          C  
ATOM    772  CE1 PHE A  50      -2.709   2.281  -3.861  1.00  1.480          C  
ATOM    773  CE2 PHE A  50      -0.631   1.196  -4.025  1.00  1.480          C  
ATOM    774  CZ  PHE A  50      -1.864   1.321  -3.441  1.00  1.480          C  
ATOM    775  H   PHE A  50       0.760   4.858  -4.782  1.00  1.320          H  
ATOM    776  HA  PHE A  50       1.225   3.297  -7.118  1.00  1.250          H  
ATOM    777 1HB  PHE A  50      -1.225   4.961  -6.356  1.00  1.780          H  
ATOM    778 2HB  PHE A  50      -1.233   3.671  -7.520  1.00  1.780          H  
ATOM    779  HD1 PHE A  50      -3.024   3.889  -5.214  1.00  1.780          H  
ATOM    780  HD2 PHE A  50       0.737   1.916  -5.473  1.00  1.780          H  
ATOM    781  HE1 PHE A  50      -3.684   2.385  -3.394  1.00  1.780          H  
ATOM    782  HE2 PHE A  50       0.046   0.438  -3.692  1.00  1.780          H  
ATOM    783  HZ  PHE A  50      -2.162   0.658  -2.647  1.00  1.780          H  
ATOM    784  N   THR A  51       0.670   6.503  -7.659  1.00  0.900          N  
ATOM    785  CA  THR A  51       0.741   7.614  -8.598  1.00  1.030          C  
ATOM    786  C   THR A  51       2.158   7.762  -9.147  1.00  1.210          C  
ATOM    787  O   THR A  51       2.362   7.873 -10.360  1.00  1.320          O  
ATOM    788  CB  THR A  51       0.308   8.936  -7.913  1.00  1.390          C  
ATOM    789  OG1 THR A  51      -1.041   8.803  -7.411  1.00  1.390          O  
ATOM    790  CG2 THR A  51       0.348  10.086  -8.917  1.00  1.390          C  
ATOM    791  H   THR A  51       0.378   6.713  -6.710  1.00  1.080          H  
ATOM    792  HA  THR A  51       0.064   7.404  -9.428  1.00  1.240          H  
ATOM    793  HB  THR A  51       0.979   9.156  -7.081  1.00  1.670          H  
ATOM    794  HG1 THR A  51      -0.994   8.237  -6.609  1.00  1.670          H  
ATOM    795 1HG2 THR A  51       0.035  11.001  -8.419  1.00  1.670          H  
ATOM    796 2HG2 THR A  51       1.359  10.215  -9.302  1.00  1.670          H  
ATOM    797 3HG2 THR A  51      -0.329   9.868  -9.741  1.00  1.670          H  
ATOM    798  N   LEU A  52       3.161   7.704  -8.264  1.00  1.310          N  
ATOM    799  CA  LEU A  52       4.557   7.829  -8.674  1.00  1.570          C  
ATOM    800  C   LEU A  52       4.944   6.722  -9.647  1.00  1.600          C  
ATOM    801  O   LEU A  52       5.737   6.938 -10.565  1.00  1.800          O  
ATOM    802  CB  LEU A  52       5.475   7.797  -7.439  1.00  2.090          C  
ATOM    803  CG  LEU A  52       5.427   9.044  -6.486  1.00  2.090          C  
ATOM    804  CD1 LEU A  52       6.194   8.723  -5.202  1.00  2.090          C  
ATOM    805  CD2 LEU A  52       6.045  10.261  -7.169  1.00  2.090          C  
ATOM    806  H   LEU A  52       2.942   7.636  -7.265  1.00  1.570          H  
ATOM    807  HA  LEU A  52       4.675   8.775  -9.191  1.00  1.880          H  
ATOM    808 1HB  LEU A  52       5.196   6.926  -6.841  1.00  2.510          H  
ATOM    809 2HB  LEU A  52       6.501   7.666  -7.774  1.00  2.510          H  
ATOM    810  HG  LEU A  52       4.405   9.276  -6.231  1.00  2.510          H  
ATOM    811 1HD1 LEU A  52       6.151   9.585  -4.534  1.00  2.510          H  
ATOM    812 2HD1 LEU A  52       5.731   7.866  -4.713  1.00  2.510          H  
ATOM    813 3HD1 LEU A  52       7.231   8.494  -5.437  1.00  2.510          H  
ATOM    814 1HD2 LEU A  52       5.999  11.109  -6.481  1.00  2.510          H  
ATOM    815 2HD2 LEU A  52       7.083  10.053  -7.423  1.00  2.510          H  
ATOM    816 3HD2 LEU A  52       5.497  10.510  -8.069  1.00  2.510          H  
ATOM    817  N   HIS A  53       4.351   5.539  -9.482  1.00  1.430          N  
ATOM    818  CA  HIS A  53       4.627   4.404 -10.352  1.00  1.480          C  
ATOM    819  C   HIS A  53       3.837   4.443 -11.677  1.00  1.410          C  
ATOM    820  O   HIS A  53       3.967   3.532 -12.499  1.00  1.460          O  
ATOM    821  CB  HIS A  53       4.307   3.076  -9.646  1.00  2.050          C  
ATOM    822  CG  HIS A  53       5.203   2.722  -8.476  1.00  2.050          C  
ATOM    823  ND1 HIS A  53       5.351   1.420  -8.037  1.00  2.050          N  
ATOM    824  CD2 HIS A  53       5.980   3.482  -7.655  1.00  2.050          C  
ATOM    825  CE1 HIS A  53       6.180   1.399  -7.004  1.00  2.050          C  
ATOM    826  NE2 HIS A  53       6.572   2.631  -6.757  1.00  2.050          N  
ATOM    827  H   HIS A  53       3.732   5.398  -8.673  1.00  1.720          H  
ATOM    828  HA  HIS A  53       5.686   4.401 -10.604  1.00  1.780          H  
ATOM    829 1HB  HIS A  53       3.281   3.117  -9.275  1.00  2.460          H  
ATOM    830 2HB  HIS A  53       4.355   2.263 -10.367  1.00  2.460          H  
ATOM    831  HD2 HIS A  53       6.118   4.559  -7.686  1.00  2.460          H  
ATOM    832  HE1 HIS A  53       6.487   0.511  -6.449  1.00  2.460          H  
ATOM    833  HE2 HIS A  53       7.206   2.912  -6.025  1.00  2.460          H  
ATOM    834  N   GLY A  54       2.999   5.474 -11.884  1.00  1.350          N  
ATOM    835  CA  GLY A  54       2.181   5.582 -13.093  1.00  1.390          C  
ATOM    836  C   GLY A  54       0.949   4.679 -13.048  1.00  1.370          C  
ATOM    837  O   GLY A  54       0.423   4.272 -14.089  1.00  1.480          O  
ATOM    838  H   GLY A  54       2.929   6.226 -11.197  1.00  1.620          H  
ATOM    839 1HA  GLY A  54       1.864   6.620 -13.206  1.00  1.670          H  
ATOM    840 2HA  GLY A  54       2.786   5.335 -13.962  1.00  1.670          H  
ATOM    841  N   MET A  55       0.511   4.358 -11.838  1.00  1.290          N  
ATOM    842  CA  MET A  55      -0.591   3.471 -11.533  1.00  1.360          C  
ATOM    843  C   MET A  55      -1.595   4.143 -10.606  1.00  1.130          C  
ATOM    844  O   MET A  55      -1.415   5.290 -10.200  1.00  1.050          O  
ATOM    845  CB  MET A  55      -0.014   2.220 -10.900  1.00  1.880          C  
ATOM    846  CG  MET A  55       0.883   1.363 -11.812  1.00  1.880          C  
ATOM    847  SD  MET A  55      -0.048   0.466 -13.059  1.00  1.880          S  
ATOM    848  CE  MET A  55      -0.707  -0.909 -12.067  1.00  1.880          C  
ATOM    849  H   MET A  55       0.965   4.755 -11.010  1.00  1.550          H  
ATOM    850  HA  MET A  55      -1.105   3.214 -12.457  1.00  1.630          H  
ATOM    851 1HB  MET A  55       0.594   2.524 -10.051  1.00  2.250          H  
ATOM    852 2HB  MET A  55      -0.827   1.611 -10.535  1.00  2.250          H  
ATOM    853 1HG  MET A  55       1.597   2.008 -12.321  1.00  2.250          H  
ATOM    854 2HG  MET A  55       1.450   0.652 -11.235  1.00  2.250          H  
ATOM    855 1HE  MET A  55      -1.314  -1.560 -12.697  1.00  2.250          H  
ATOM    856 2HE  MET A  55       0.119  -1.486 -11.654  1.00  2.250          H  
ATOM    857 3HE  MET A  55      -1.316  -0.536 -11.250  1.00  2.250          H  
ATOM    858  N   LYS A  56      -2.717   3.479 -10.390  1.00  1.200          N  
ATOM    859  CA  LYS A  56      -3.769   3.956  -9.501  1.00  1.080          C  
ATOM    860  C   LYS A  56      -4.148   2.864  -8.516  1.00  0.970          C  
ATOM    861  O   LYS A  56      -3.976   1.685  -8.803  1.00  1.080          O  
ATOM    862  CB  LYS A  56      -5.007   4.353 -10.298  1.00  1.560          C  
ATOM    863  CG  LYS A  56      -4.802   5.487 -11.282  1.00  1.560          C  
ATOM    864  CD  LYS A  56      -6.117   5.836 -11.973  1.00  1.560          C  
ATOM    865  CE  LYS A  56      -5.940   6.926 -13.016  1.00  1.560          C  
ATOM    866  NZ  LYS A  56      -7.227   7.237 -13.703  1.00  1.560          N  
ATOM    867  H   LYS A  56      -2.824   2.575 -10.820  1.00  1.440          H  
ATOM    868  HA  LYS A  56      -3.400   4.806  -8.936  1.00  1.300          H  
ATOM    869 1HB  LYS A  56      -5.370   3.491 -10.854  1.00  1.870          H  
ATOM    870 2HB  LYS A  56      -5.798   4.646  -9.610  1.00  1.870          H  
ATOM    871 1HG  LYS A  56      -4.413   6.361 -10.758  1.00  1.870          H  
ATOM    872 2HG  LYS A  56      -4.075   5.183 -12.034  1.00  1.870          H  
ATOM    873 1HD  LYS A  56      -6.520   4.947 -12.458  1.00  1.870          H  
ATOM    874 2HD  LYS A  56      -6.837   6.176 -11.229  1.00  1.870          H  
ATOM    875 1HE  LYS A  56      -5.566   7.830 -12.537  1.00  1.870          H  
ATOM    876 2HE  LYS A  56      -5.215   6.592 -13.758  1.00  1.870          H  
ATOM    877 1HZ  LYS A  56      -7.079   7.959 -14.395  1.00  1.870          H  
ATOM    878 2HZ  LYS A  56      -7.572   6.396 -14.156  1.00  1.870          H  
ATOM    879 3HZ  LYS A  56      -7.906   7.556 -13.026  1.00  1.870          H  
ATOM    880  N   CYS A  57      -4.753   3.216  -7.384  1.00  1.040          N  
ATOM    881  CA  CYS A  57      -5.194   2.171  -6.449  1.00  1.210          C  
ATOM    882  C   CYS A  57      -6.119   1.130  -7.076  1.00  1.370          C  
ATOM    883  O   CYS A  57      -6.005  -0.072  -6.794  1.00  1.660          O  
ATOM    884  CB  CYS A  57      -5.969   2.826  -5.311  1.00  1.630          C  
ATOM    885  SG  CYS A  57      -7.464   3.687  -5.870  1.00  1.630          S  
ATOM    886  H   CYS A  57      -4.854   4.204  -7.127  1.00  1.250          H  
ATOM    887  HA  CYS A  57      -4.321   1.652  -6.069  1.00  1.450          H  
ATOM    888 1HB  CYS A  57      -6.269   2.075  -4.619  1.00  1.950          H  
ATOM    889 2HB  CYS A  57      -5.347   3.545  -4.784  1.00  1.950          H  
ATOM    890  HG  CYS A  57      -7.927   4.048  -4.661  1.00  1.950          H  
ATOM    891  N   SER A  58      -6.928   1.561  -8.040  1.00  1.350          N  
ATOM    892  CA  SER A  58      -7.875   0.710  -8.734  1.00  1.640          C  
ATOM    893  C   SER A  58      -7.205  -0.247  -9.711  1.00  1.850          C  
ATOM    894  O   SER A  58      -7.836  -1.184 -10.205  1.00  2.110          O  
ATOM    895  CB  SER A  58      -8.910   1.565  -9.437  1.00  2.180          C  
ATOM    896  OG  SER A  58      -8.321   2.387 -10.395  1.00  2.180          O  
ATOM    897  H   SER A  58      -6.951   2.550  -8.255  1.00  1.620          H  
ATOM    898  HA  SER A  58      -8.396   0.112  -7.985  1.00  1.970          H  
ATOM    899 1HB  SER A  58      -9.619   0.911  -9.926  1.00  2.620          H  
ATOM    900 2HB  SER A  58      -9.458   2.165  -8.713  1.00  2.620          H  
ATOM    901  HG  SER A  58      -9.048   2.745 -10.924  1.00  2.620          H  
ATOM    902  N   HIS A  59      -5.918  -0.039  -9.978  1.00  1.860          N  
ATOM    903  CA  HIS A  59      -5.168  -0.869 -10.900  1.00  2.220          C  
ATOM    904  C   HIS A  59      -4.358  -1.919 -10.136  1.00  2.490          C  
ATOM    905  O   HIS A  59      -3.718  -2.779 -10.743  1.00  2.980          O  
ATOM    906  CB  HIS A  59      -4.199  -0.022 -11.735  1.00  2.960          C  
ATOM    907  CG  HIS A  59      -4.838   1.023 -12.613  1.00  2.960          C  
ATOM    908  ND1 HIS A  59      -4.092   1.907 -13.378  1.00  2.960          N  
ATOM    909  CD2 HIS A  59      -6.138   1.340 -12.841  1.00  2.960          C  
ATOM    910  CE1 HIS A  59      -4.906   2.712 -14.030  1.00  2.960          C  
ATOM    911  NE2 HIS A  59      -6.149   2.396 -13.725  1.00  2.960          N  
ATOM    912  H   HIS A  59      -5.427   0.725  -9.515  1.00  2.230          H  
ATOM    913  HA  HIS A  59      -5.849  -1.388 -11.574  1.00  2.660          H  
ATOM    914 1HB  HIS A  59      -3.501   0.476 -11.066  1.00  3.560          H  
ATOM    915 2HB  HIS A  59      -3.624  -0.677 -12.377  1.00  3.560          H  
ATOM    916  HD1 HIS A  59      -3.149   1.770 -13.689  1.00  3.560          H  
ATOM    917  HD2 HIS A  59      -7.079   0.937 -12.468  1.00  3.560          H  
ATOM    918  HE1 HIS A  59      -4.506   3.484 -14.687  1.00  3.560          H  
ATOM    919  N   PHE A  60      -4.364  -1.831  -8.796  1.00  2.250          N  
ATOM    920  CA  PHE A  60      -3.622  -2.758  -7.952  1.00  2.590          C  
ATOM    921  C   PHE A  60      -4.550  -3.553  -7.041  1.00  2.730          C  
ATOM    922  O   PHE A  60      -4.096  -4.256  -6.132  1.00  3.090          O  
ATOM    923  CB  PHE A  60      -2.633  -2.044  -7.066  1.00  3.490          C  
ATOM    924  CG  PHE A  60      -1.490  -1.345  -7.666  1.00  3.490          C  
ATOM    925  CD1 PHE A  60      -0.489  -2.070  -8.221  1.00  3.490          C  
ATOM    926  CD2 PHE A  60      -1.360   0.004  -7.591  1.00  3.490          C  
ATOM    927  CE1 PHE A  60       0.643  -1.482  -8.697  1.00  3.490          C  
ATOM    928  CE2 PHE A  60      -0.241   0.600  -8.061  1.00  3.490          C  
ATOM    929  CZ  PHE A  60       0.770  -0.140  -8.610  1.00  3.490          C  
ATOM    930  H   PHE A  60      -4.922  -1.117  -8.319  1.00  2.700          H  
ATOM    931  HA  PHE A  60      -3.086  -3.462  -8.586  1.00  3.110          H  
ATOM    932 1HB  PHE A  60      -3.182  -1.319  -6.467  1.00  4.190          H  
ATOM    933 2HB  PHE A  60      -2.213  -2.785  -6.404  1.00  4.190          H  
ATOM    934  HD1 PHE A  60      -0.614  -3.143  -8.256  1.00  4.190          H  
ATOM    935  HD2 PHE A  60      -2.154   0.598  -7.135  1.00  4.190          H  
ATOM    936  HE1 PHE A  60       1.440  -2.086  -9.129  1.00  4.190          H  
ATOM    937  HE2 PHE A  60      -0.143   1.662  -7.997  1.00  4.190          H  
ATOM    938  HZ  PHE A  60       1.674   0.346  -8.972  1.00  4.190          H  
ATOM    939  N   LYS A  61      -5.847  -3.423  -7.310  1.00  2.670          N  
ATOM    940  CA  LYS A  61      -6.948  -4.038  -6.570  1.00  2.800          C  
ATOM    941  C   LYS A  61      -7.067  -3.637  -5.092  1.00  2.490          C  
ATOM    942  O   LYS A  61      -7.349  -4.482  -4.245  1.00  2.510          O  
ATOM    943  CB  LYS A  61      -6.849  -5.564  -6.652  1.00  3.870          C  
ATOM    944  CG  LYS A  61      -6.886  -6.120  -8.067  1.00  3.870          C  
ATOM    945  CD  LYS A  61      -6.867  -7.641  -8.058  1.00  3.870          C  
ATOM    946  CE  LYS A  61      -6.862  -8.209  -9.472  1.00  3.870          C  
ATOM    947  NZ  LYS A  61      -6.805  -9.701  -9.473  1.00  3.870          N  
ATOM    948  H   LYS A  61      -6.080  -2.838  -8.103  1.00  3.200          H  
ATOM    949  HA  LYS A  61      -7.877  -3.732  -7.055  1.00  3.360          H  
ATOM    950 1HB  LYS A  61      -5.938  -5.912  -6.163  1.00  4.640          H  
ATOM    951 2HB  LYS A  61      -7.687  -6.003  -6.113  1.00  4.640          H  
ATOM    952 1HG  LYS A  61      -7.785  -5.769  -8.572  1.00  4.640          H  
ATOM    953 2HG  LYS A  61      -6.017  -5.757  -8.617  1.00  4.640          H  
ATOM    954 1HD  LYS A  61      -5.977  -7.987  -7.529  1.00  4.640          H  
ATOM    955 2HD  LYS A  61      -7.746  -8.009  -7.530  1.00  4.640          H  
ATOM    956 1HE  LYS A  61      -7.768  -7.890  -9.988  1.00  4.640          H  
ATOM    957 2HE  LYS A  61      -5.996  -7.822 -10.008  1.00  4.640          H  
ATOM    958 1HZ  LYS A  61      -6.803 -10.039 -10.425  1.00  4.640          H  
ATOM    959 2HZ  LYS A  61      -5.962 -10.007  -9.007  1.00  4.640          H  
ATOM    960 3HZ  LYS A  61      -7.610 -10.071  -8.988  1.00  4.640          H  
ATOM    961  N   LEU A  62      -6.887  -2.358  -4.764  1.00  2.440          N  
ATOM    962  CA  LEU A  62      -7.060  -1.946  -3.372  1.00  2.330          C  
ATOM    963  C   LEU A  62      -8.537  -2.238  -2.953  1.00  2.470          C  
ATOM    964  O   LEU A  62      -9.437  -1.918  -3.733  1.00  2.770          O  
ATOM    965  CB  LEU A  62      -6.756  -0.449  -3.224  1.00  3.310          C  
ATOM    966  CG  LEU A  62      -6.756   0.135  -1.780  1.00  3.310          C  
ATOM    967  CD1 LEU A  62      -5.557  -0.411  -0.952  1.00  3.310          C  
ATOM    968  CD2 LEU A  62      -6.691   1.627  -1.861  1.00  3.310          C  
ATOM    969  H   LEU A  62      -6.637  -1.665  -5.478  1.00  2.930          H  
ATOM    970  HA  LEU A  62      -6.340  -2.493  -2.792  1.00  2.800          H  
ATOM    971 1HB  LEU A  62      -5.777  -0.255  -3.666  1.00  3.970          H  
ATOM    972 2HB  LEU A  62      -7.502   0.101  -3.802  1.00  3.970          H  
ATOM    973  HG  LEU A  62      -7.690  -0.152  -1.279  1.00  3.970          H  
ATOM    974 1HD1 LEU A  62      -5.598   0.023   0.046  1.00  3.970          H  
ATOM    975 2HD1 LEU A  62      -5.579  -1.481  -0.865  1.00  3.970          H  
ATOM    976 3HD1 LEU A  62      -4.630  -0.125  -1.431  1.00  3.970          H  
ATOM    977 1HD2 LEU A  62      -6.738   2.033  -0.860  1.00  3.970          H  
ATOM    978 2HD2 LEU A  62      -5.770   1.932  -2.340  1.00  3.970          H  
ATOM    979 3HD2 LEU A  62      -7.519   1.988  -2.427  1.00  3.970          H  
ATOM    980  N   PRO A  63      -8.826  -2.864  -1.775  1.00  2.400          N  
ATOM    981  CA  PRO A  63     -10.159  -3.176  -1.258  1.00  2.580          C  
ATOM    982  C   PRO A  63     -10.974  -1.925  -1.034  1.00  2.880          C  
ATOM    983  O   PRO A  63     -10.409  -0.877  -0.748  1.00  3.090          O  
ATOM    984  CB  PRO A  63      -9.873  -3.859   0.083  1.00  3.870          C  
ATOM    985  CG  PRO A  63      -8.476  -4.360  -0.035  1.00  3.870          C  
ATOM    986  CD  PRO A  63      -7.771  -3.314  -0.867  1.00  3.870          C  
ATOM    987  HA  PRO A  63     -10.669  -3.856  -1.955  1.00  3.100          H  
ATOM    988 1HB  PRO A  63     -10.015  -3.134   0.897  1.00  4.640          H  
ATOM    989 2HB  PRO A  63     -10.598  -4.667   0.252  1.00  4.640          H  
ATOM    990 1HG  PRO A  63      -8.028  -4.498   0.969  1.00  4.640          H  
ATOM    991 2HG  PRO A  63      -8.477  -5.349  -0.513  1.00  4.640          H  
ATOM    992 1HD  PRO A  63      -7.448  -2.499  -0.223  1.00  4.640          H  
ATOM    993 2HD  PRO A  63      -6.981  -3.794  -1.374  1.00  4.640          H  
ATOM    994  N   ASP A  64     -12.300  -2.054  -1.088  1.00  3.290          N  
ATOM    995  CA  ASP A  64     -13.211  -0.930  -0.883  1.00  3.660          C  
ATOM    996  C   ASP A  64     -12.781  -0.097   0.314  1.00  3.300          C  
ATOM    997  O   ASP A  64     -12.484  -0.631   1.388  1.00  3.690          O  
ATOM    998  CB  ASP A  64     -14.633  -1.431  -0.617  1.00  4.980          C  
ATOM    999  CG  ASP A  64     -15.262  -2.197  -1.779  1.00  4.980          C  
ATOM   1000  OD1 ASP A  64     -14.651  -2.319  -2.819  1.00  4.980          O  
ATOM   1001  OD2 ASP A  64     -16.359  -2.662  -1.608  1.00  4.980          O  
ATOM   1002  H   ASP A  64     -12.706  -2.946  -1.340  1.00  3.950          H  
ATOM   1003  HA  ASP A  64     -13.195  -0.299  -1.764  1.00  4.390          H  
ATOM   1004 1HB  ASP A  64     -14.629  -2.075   0.263  1.00  5.970          H  
ATOM   1005 2HB  ASP A  64     -15.269  -0.576  -0.388  1.00  5.970          H  
ATOM   1006  N   TYR A  65     -12.781   1.220   0.132  1.00  2.970          N  
ATOM   1007  CA  TYR A  65     -12.331   2.137   1.156  1.00  3.010          C  
ATOM   1008  C   TYR A  65     -13.220   3.406   1.284  1.00  3.190          C  
ATOM   1009  O   TYR A  65     -13.955   3.716   0.354  1.00  3.350          O  
ATOM   1010  CB  TYR A  65     -10.862   2.430   0.807  1.00  4.200          C  
ATOM   1011  CG  TYR A  65     -10.601   3.082  -0.577  1.00  4.200          C  
ATOM   1012  CD1 TYR A  65     -10.633   4.407  -0.694  1.00  4.200          C  
ATOM   1013  CD2 TYR A  65     -10.272   2.330  -1.699  1.00  4.200          C  
ATOM   1014  CE1 TYR A  65     -10.352   5.040  -1.865  1.00  4.200          C  
ATOM   1015  CE2 TYR A  65      -9.990   2.974  -2.901  1.00  4.200          C  
ATOM   1016  CZ  TYR A  65     -10.036   4.345  -2.956  1.00  4.200          C  
ATOM   1017  OH  TYR A  65      -9.754   5.043  -4.112  1.00  4.200          O  
ATOM   1018  H   TYR A  65     -13.061   1.588  -0.769  1.00  3.560          H  
ATOM   1019  HA  TYR A  65     -12.365   1.596   2.099  1.00  3.610          H  
ATOM   1020 1HB  TYR A  65     -10.433   3.059   1.532  1.00  5.040          H  
ATOM   1021 2HB  TYR A  65     -10.301   1.489   0.839  1.00  5.040          H  
ATOM   1022  HD1 TYR A  65     -10.885   4.973   0.146  1.00  5.040          H  
ATOM   1023  HD2 TYR A  65     -10.225   1.255  -1.645  1.00  5.040          H  
ATOM   1024  HE1 TYR A  65     -10.386   6.122  -1.923  1.00  5.040          H  
ATOM   1025  HE2 TYR A  65      -9.727   2.394  -3.786  1.00  5.040          H  
ATOM   1026  HH  TYR A  65     -10.214   5.937  -4.078  1.00  5.040          H  
ATOM   1027  N   PRO A  66     -13.225   4.113   2.457  1.00  3.710          N  
ATOM   1028  CA  PRO A  66     -13.957   5.364   2.769  1.00  4.480          C  
ATOM   1029  C   PRO A  66     -13.625   6.629   1.958  1.00  4.860          C  
ATOM   1030  O   PRO A  66     -14.402   7.581   1.935  1.00  5.270          O  
ATOM   1031  CB  PRO A  66     -13.635   5.574   4.259  1.00  6.720          C  
ATOM   1032  CG  PRO A  66     -12.369   4.805   4.512  1.00  6.720          C  
ATOM   1033  CD  PRO A  66     -12.480   3.586   3.633  1.00  6.720          C  
ATOM   1034  HA  PRO A  66     -15.033   5.149   2.663  1.00  5.380          H  
ATOM   1035 1HB  PRO A  66     -13.521   6.648   4.466  1.00  8.060          H  
ATOM   1036 2HB  PRO A  66     -14.476   5.225   4.875  1.00  8.060          H  
ATOM   1037 1HG  PRO A  66     -11.501   5.426   4.276  1.00  8.060          H  
ATOM   1038 2HG  PRO A  66     -12.291   4.556   5.583  1.00  8.060          H  
ATOM   1039 1HD  PRO A  66     -11.489   3.235   3.407  1.00  8.060          H  
ATOM   1040 2HD  PRO A  66     -13.077   2.812   4.141  1.00  8.060          H  
ATOM   1041  N   LEU A  67     -12.464   6.657   1.343  1.00  4.940          N  
ATOM   1042  CA  LEU A  67     -12.008   7.783   0.535  1.00  5.450          C  
ATOM   1043  C   LEU A  67     -12.573   7.544  -0.857  1.00  5.250          C  
ATOM   1044  O   LEU A  67     -12.907   6.417  -1.195  1.00  5.340          O  
ATOM   1045  CB  LEU A  67     -10.466   7.899   0.549  1.00  7.430          C  
ATOM   1046  CG  LEU A  67      -9.795   9.066  -0.218  1.00  7.430          C  
ATOM   1047  CD1 LEU A  67     -10.139  10.401   0.443  1.00  7.430          C  
ATOM   1048  CD2 LEU A  67      -8.288   8.836  -0.224  1.00  7.430          C  
ATOM   1049  H   LEU A  67     -11.870   5.851   1.413  1.00  5.930          H  
ATOM   1050  HA  LEU A  67     -12.439   8.698   0.931  1.00  6.540          H  
ATOM   1051 1HB  LEU A  67     -10.149   7.975   1.586  1.00  8.910          H  
ATOM   1052 2HB  LEU A  67     -10.048   7.019   0.146  1.00  8.910          H  
ATOM   1053  HG  LEU A  67     -10.145   9.086  -1.248  1.00  8.910          H  
ATOM   1054 1HD1 LEU A  67      -9.649  11.210  -0.105  1.00  8.910          H  
ATOM   1055 2HD1 LEU A  67     -11.210  10.569   0.437  1.00  8.910          H  
ATOM   1056 3HD1 LEU A  67      -9.782  10.396   1.473  1.00  8.910          H  
ATOM   1057 1HD2 LEU A  67      -7.801   9.642  -0.770  1.00  8.910          H  
ATOM   1058 2HD2 LEU A  67      -7.913   8.818   0.796  1.00  8.910          H  
ATOM   1059 3HD2 LEU A  67      -8.067   7.890  -0.712  1.00  8.910          H  
ATOM   1060  N   LEU A  68     -12.765   8.578  -1.658  1.00  5.230          N  
ATOM   1061  CA  LEU A  68     -13.343   8.328  -2.972  1.00  5.200          C  
ATOM   1062  C   LEU A  68     -12.623   7.231  -3.770  1.00  5.120          C  
ATOM   1063  O   LEU A  68     -11.399   7.256  -3.981  1.00  5.210          O  
ATOM   1064  CB  LEU A  68     -13.326   9.629  -3.793  1.00  7.290          C  
ATOM   1065  CG  LEU A  68     -13.975   9.594  -5.218  1.00  7.290          C  
ATOM   1066  CD1 LEU A  68     -15.490   9.387  -5.117  1.00  7.290          C  
ATOM   1067  CD2 LEU A  68     -13.655  10.903  -5.931  1.00  7.290          C  
ATOM   1068  H   LEU A  68     -12.516   9.512  -1.370  1.00  6.280          H  
ATOM   1069  HA  LEU A  68     -14.371   8.010  -2.817  1.00  6.240          H  
ATOM   1070 1HB  LEU A  68     -13.836  10.401  -3.220  1.00  8.750          H  
ATOM   1071 2HB  LEU A  68     -12.288   9.934  -3.919  1.00  8.750          H  
ATOM   1072  HG  LEU A  68     -13.557   8.763  -5.796  1.00  8.750          H  
ATOM   1073 1HD1 LEU A  68     -15.917   9.369  -6.122  1.00  8.750          H  
ATOM   1074 2HD1 LEU A  68     -15.712   8.448  -4.627  1.00  8.750          H  
ATOM   1075 3HD1 LEU A  68     -15.934  10.205  -4.552  1.00  8.750          H  
ATOM   1076 1HD2 LEU A  68     -14.089  10.886  -6.932  1.00  8.750          H  
ATOM   1077 2HD2 LEU A  68     -14.070  11.741  -5.369  1.00  8.750          H  
ATOM   1078 3HD2 LEU A  68     -12.573  11.014  -6.007  1.00  8.750          H  
ATOM   1079  N   MET A  69     -13.439   6.283  -4.232  1.00  5.220          N  
ATOM   1080  CA  MET A  69     -13.033   5.149  -5.042  1.00  5.240          C  
ATOM   1081  C   MET A  69     -12.972   5.513  -6.516  1.00  4.930          C  
ATOM   1082  O   MET A  69     -13.778   6.309  -6.994  1.00  5.320          O  
ATOM   1083  CB  MET A  69     -13.981   3.990  -4.775  1.00  7.330          C  
ATOM   1084  CG  MET A  69     -13.837   3.421  -3.351  1.00  7.330          C  
ATOM   1085  SD  MET A  69     -15.033   2.133  -2.936  1.00  7.330          S  
ATOM   1086  CE  MET A  69     -14.585   0.799  -4.038  1.00  7.330          C  
ATOM   1087  H   MET A  69     -14.413   6.355  -3.976  1.00  6.260          H  
ATOM   1088  HA  MET A  69     -12.045   4.843  -4.746  1.00  6.290          H  
ATOM   1089 1HB  MET A  69     -15.010   4.312  -4.917  1.00  8.790          H  
ATOM   1090 2HB  MET A  69     -13.780   3.193  -5.491  1.00  8.790          H  
ATOM   1091 1HG  MET A  69     -12.849   3.000  -3.251  1.00  8.790          H  
ATOM   1092 2HG  MET A  69     -13.924   4.230  -2.612  1.00  8.790          H  
ATOM   1093 1HE  MET A  69     -15.238  -0.056  -3.861  1.00  8.790          H  
ATOM   1094 2HE  MET A  69     -14.707   1.115  -5.071  1.00  8.790          H  
ATOM   1095 3HE  MET A  69     -13.552   0.500  -3.876  1.00  8.790          H  
ATOM   1096  N   ASN A  70     -12.029   4.903  -7.242  1.00  4.610          N  
ATOM   1097  CA  ASN A  70     -11.889   5.113  -8.683  1.00  4.700          C  
ATOM   1098  C   ASN A  70     -12.390   3.908  -9.476  1.00  4.510          C  
ATOM   1099  O   ASN A  70     -12.126   3.788 -10.674  1.00  4.970          O  
ATOM   1100  CB  ASN A  70     -10.445   5.418  -9.033  1.00  6.540          C  
ATOM   1101  CG  ASN A  70      -9.987   6.748  -8.493  1.00  6.540          C  
ATOM   1102  OD1 ASN A  70     -10.711   7.750  -8.544  1.00  6.540          O  
ATOM   1103  ND2 ASN A  70      -8.786   6.780  -7.984  1.00  6.540          N  
ATOM   1104  H   ASN A  70     -11.402   4.246  -6.796  1.00  5.530          H  
ATOM   1105  HA  ASN A  70     -12.505   5.966  -8.971  1.00  5.640          H  
ATOM   1106 1HB  ASN A  70      -9.800   4.637  -8.629  1.00  7.850          H  
ATOM   1107 2HB  ASN A  70     -10.322   5.417 -10.115  1.00  7.850          H  
ATOM   1108 1HD2 ASN A  70      -8.425   7.636  -7.609  1.00  7.850          H  
ATOM   1109 2HD2 ASN A  70      -8.229   5.952  -7.967  1.00  7.850          H  
ATOM   1110  N   ALA A  71     -13.090   3.022  -8.778  1.00  4.350          N  
ATOM   1111  CA  ALA A  71     -13.661   1.779  -9.284  1.00  4.770          C  
ATOM   1112  C   ALA A  71     -14.136   0.965  -8.098  1.00  5.330          C  
ATOM   1113  O   ALA A  71     -15.324   0.665  -7.980  1.00  5.470          O  
ATOM   1114  OXT ALA A  71     -13.397   0.933  -7.115  1.00  7.150          O  
ATOM   1115  CB  ALA A  71     -12.657   0.952 -10.079  1.00  6.190          C  
ATOM   1116  H   ALA A  71     -13.248   3.236  -7.805  1.00  5.220          H  
ATOM   1117  HA  ALA A  71     -14.518   2.020  -9.913  1.00  5.720          H  
ATOM   1118 1HB  ALA A  71     -13.144   0.035 -10.409  1.00  7.420          H  
ATOM   1119 2HB  ALA A  71     -12.295   1.479 -10.950  1.00  7.420          H  
ATOM   1120 3HB  ALA A  71     -11.828   0.703  -9.435  1.00  7.420          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 -404.019 45.6422 299.758 -23.5007 5.95405 16.6264 147.065 -162.665 -0.71954 -4.20917 -118.69 -16.0673 -45.2922 -6.29535 -4.1278 -5.28439 -0.81136 1.37616 5.60084 36.1799 78.2323 -11.6045 4.52995 0.75494 -7.24056 44.8113 -123.996
CYS:NtermProteinFull_1 -8.40018 0.8962 4.12292 -0.08576 0.06829 0.08124 2.02175 -2.32827 -0.04022 -0.12983 0.65627 0.6613 0 0 0 0 0 0.43995 0.12239 0.34144 0 0 0 3.6196 0 0.36191 2.409
VAL_2 -6.38888 1.26556 -0.88004 -0.36158 0.23594 0.08715 0.51016 -1.11418 -0 -0 0.03633 0.01423 0 0 0 0 0 -0.03975 0.06657 1.06058 0 -0.18228 0 1.9342 0.03172 0.68966 -3.03462
PHE_3 -5.44186 0.90703 1.30896 -0.56509 0.06567 0.33404 0.88739 -1.45922 -0 -0 -0.90681 0.15791 0 0 0 0 0 0.0334 0.37135 0 3.46617 -0.31932 0 1.0402 -0.14631 0.59511 0.32863
GLY_4 -1.80788 0.15033 0.9048 -0.00054 0 0 0.19342 -0.52243 -0 -0 -0.01996 -0.22461 0 0 0 0 0 -0.04549 0 0 0 -1.53062 0 0.83697 -0.02812 0.33988 -1.75426
CYS_5 -3.32085 0.51383 2.50982 -0.07298 0.01414 0.0669 1.20965 -1.21054 -0 -0 -0.16835 -0.46343 0 0 0 0 0 0.08137 0 0.29442 0 0.01582 0 3.6196 0.58375 0.95088 4.62402
PRO_6 -6.86793 1.48439 2.79919 -0.09255 0.00055 0.05829 1.23056 -1.58632 -0.00238 -0.015 -0.06472 0.68412 0 0 0 0 0 -0.03404 0.01134 0.57656 0 -0.4714 0 -2.4119 0.22009 1.1607 -3.32045
SER_7 -3.27856 0.53703 2.6525 -0.02274 0 0.02118 1.08197 -1.38347 -0 -0 -0.25788 -0.59177 0 0 0 0 0 0.16698 0.00935 0.60159 0 0.22816 0.60002 -0.77834 0.57694 0.46825 0.63121
ALA_8 -4.23757 0.71745 3.81787 -0.02963 0.01079 0 2.37754 -2.24846 -0.01151 -0.0828 -1.86999 -0.51016 0 0 0 0 0 0.10117 0 0 0 0.05977 0 1.8394 1.25176 0.46642 1.65204
ALA_9 -6.06369 0.67307 3.98772 -0.02391 5e-05 0 2.98628 -2.75931 -0 -0 -2.28079 -0.38866 0 0 0 0 0 -0.06568 0 0 0 -0.33633 0 1.8394 0.09554 0.53928 -1.79701
ASP_10 -5.30646 0.67866 6.68132 -0.16277 0.03198 0.55906 2.52058 -3.00444 -0.04372 -0.20663 -2.45951 -2.61502 0 0 -0.31447 0 0 -0.03034 0.00699 0 4.40012 0.13384 0 -2.3716 -0.25899 0.42937 -1.33206
LYS_11 -4.95666 0.60301 6.32955 -0.42275 0.04876 0.23344 3.07115 -2.86694 -0.01412 -0.06966 -4.68955 0.13512 0 0 -0.31447 -0.8534 0 0.03615 0.16109 2.17688 0 0.08168 0 -1.5107 0.15891 0.48501 -2.1775
LEU_12 -8.19321 0.55672 5.16801 -0.68214 0.39464 0.17161 2.61621 -3.0469 -0.00197 -0.02226 -1.32443 0.29389 0 0 0 0 0 -0.03629 0.01362 2.98802 0 -0.23947 0 0.18072 -0.01973 0.60943 -0.57351
TRP_13 -8.55743 0.64242 5.47789 -1.03436 0.03612 0.40925 2.41182 -3.14692 -0.03985 -0.14137 -1.05573 -0.32406 0 0 0 0 0 0.09019 0.00699 0 2.23335 -0.20605 0 1.6906 -0.13545 0.83179 -0.81078
ASP_14 -4.12541 0.20017 5.40318 -0.10144 0.00235 0.31102 1.90467 -2.45377 -0 -0 -2.17851 -0.32551 0 0 0 0 0 -0.04796 0.02722 0 2.23165 -0.1173 0 -2.3716 -0.06953 0.84937 -0.8614
GLU_15 -3.86653 0.29514 5.65686 -0.35041 0.09478 0.41833 2.55792 -2.34145 -0.03591 -0.23195 -3.13722 -0.59622 0 0 0 -0.8534 0 -0.03543 0.02489 0 3.68356 -0.12462 0 -2.7348 -0.18372 0.45115 -1.30905
ASN_16 -6.20767 0.39766 5.38986 -0.20116 0.04695 0.32709 2.91678 -2.80917 -0.03059 -0.22395 -3.39575 -0.51691 0 0 0 0 0 0.0849 0.00014 0 2.14417 -0.62486 0 -0.93687 -0.46575 0.29348 -3.81163
LYS_17 -6.06872 0.53331 7.32518 -0.43535 0.08341 0.26497 3.84157 -3.22346 -0 -0 -4.55563 -0.21263 0 0 0 -0.39742 0 -0.05084 0.14798 1.77295 0 -0.05758 0 -1.5107 -0.30094 0.33817 -2.50576
SER_18 -3.15486 0.2812 3.4948 -0.02759 0 0.04239 1.19446 -1.74194 -0 -0 -0.55639 -1.05561 0 0 0 0 0 -0.04291 0.00278 0.22323 0 0.03077 0.62198 -0.77834 -0.33182 0.30166 -1.49619
HIS_19 -4.37267 0.19623 4.30769 -0.39133 0.00314 0.44688 2.21596 -2.15324 -0 -0 -1.42447 -0.32223 0 0 0 0 0 -0.04943 0.0041 0 2.10969 -0.07906 0 -0.45461 -0.2269 0.32272 0.13245
PHE_20 -11.2861 1.08632 4.65632 -0.55171 0.34168 0.25772 3.61448 -3.6523 -0 -0 -1.67569 -0.2979 0 0 0 0 0 -0.03795 0.16937 0 3.60449 -0.06207 0 1.0402 0.03897 0.62715 -2.12704
ILE_21 -7.84248 0.97543 5.46753 -0.60104 0.23622 0.14822 3.12332 -3.07932 -0.00243 -0.02344 -2.54614 0.19535 0 0 0 0 0 0.27134 0.17217 2.40799 0 -0.14166 0 0.73287 -0.06374 1.30262 0.73281
GLU_22 -4.87899 0.46512 5.72625 -0.3531 0.12442 0.41077 2.72634 -2.70361 -0 -0 -2.47522 -0.58832 0 0 0 -0.89259 0 0.00094 0.02825 0 3.16883 -0.14749 0 -2.7348 -0.20826 1.23296 -1.09851
ASP_23 -5.44606 0.40435 7.68578 -0.22527 0.00092 0.73366 3.45035 -3.36433 -0.02614 -0.08314 -5.77844 -0.04982 0 0 0 -0.49878 0 -0.03285 0.00744 0 3.159 0.29677 0 -2.3716 -0.24858 0.50682 -1.87994
PHE_24 -11.2612 2.12982 4.89603 -0.62388 0.24584 0.32407 3.07708 -3.56705 -0 -0 -1.93516 -0.15091 0 0 0 0 0 0.15161 0.2973 0 3.12107 -0.01045 0 1.0402 -0.14038 0.41484 -1.99116
CYS:disulfide_25 -6.14091 0.44657 5.78385 -0.06209 0 0.05527 2.86673 -2.81692 -0.01687 -0.0919 -3.17879 -0.38278 0 0 0 0 -0.40568 1e-05 0.22281 0.66306 0 0.26702 0 3.6196 0.33181 0.55291 1.71372
TRP_26 -7.41038 0.49788 6.86037 -1.00645 0.17571 0.32321 3.21314 -3.30433 -0 -0 -3.57062 -0.48291 0 0 0 -0.89259 0 -0.01382 0.08837 0 2.18331 -0.09195 0 1.6906 0.30786 0.47217 -0.96041
LYS_27 -6.33405 0.44644 8.54707 -0.35466 0.04216 0.20569 3.64855 -3.56633 -0.02614 -0.08314 -5.67482 0.33503 0 0 0 -0.49878 0 -0.0364 0.0369 2.34553 0 0.01197 0 -1.5107 -0.25416 0.35436 -2.36548
LEU_28 -9.00808 0.53266 6.40017 -0.69839 0.22037 0.26403 2.5874 -3.74533 -0 -0 -2.68205 0.12577 0 0 0 0 0 0.07353 0.01176 0.98348 0 -0.26519 0 0.18072 -0.26537 0.35435 -4.93017
HIS_29 -5.1746 0.2717 5.2824 -0.61678 0.00618 0.60795 2.09465 -2.60412 -0.02885 -0.23499 -2.40274 -0.36022 0 0 0 0 0 0.00466 0.02641 0 1.53807 -0.24805 0 -0.45461 -0.02923 0.36795 -1.95421
ARG_30 -5.09293 0.30051 4.79472 -0.44592 0.06757 0.22783 1.63529 -2.21319 -0.01687 -0.0919 -1.00909 0.31332 0 0 0 0 0 0.0184 0.22681 2.06682 0 -0.18654 0 -1.2888 -0.18227 0.4339 -0.44235
ARG_31 -4.26777 0.39239 4.79172 -0.46516 0.06959 0.26941 1.31656 -2.07379 -0.03861 -0.25788 -1.18974 0.17254 0 0 0 0 0 -0.0817 0.13968 1.83428 0 -0.01049 0 -1.2888 -0.34427 0.54707 -0.48498
GLU_32 -1.97016 0.23329 2.70733 -0.24772 0.07433 0.4357 1.12637 -1.25277 -0.01392 -0.11296 -1.36375 -0.49986 0 0 0 0 0 0.20926 0.00086 0 2.72799 0.27586 0 -2.7348 0.19899 0.63419 0.42823
GLY_33 -2.1936 0.11087 2.17798 -0.00055 0 0 0.85342 -1.1909 -0.02885 -0.23499 -1.03175 -0.16451 0 0 0 0 0 -0.0157 0 0 0 -1.11297 0 0.83697 0.44577 0.65674 -0.89206
ALA_34 -3.16634 0.44337 2.3767 -0.02438 0.00028 0 1.35153 -1.54222 -0.01757 -0.08651 -0.92731 -0.43491 0 0 0 0 0 0.30039 0 0 0 -0.07721 0 1.8394 0.37846 0.52319 0.93688
CYS:disulfide_35 -4.66856 0.77199 2.73647 -0.04827 0.00252 0.02234 1.25908 -1.61464 -0.00652 -0.04156 -1.53769 -0.403 0 0 0 0 -0.40568 -0.05034 0.00328 0.54115 0 0.2846 0 3.6196 0.16701 0.67311 1.30489
VAL_36 -2.91891 0.43983 1.66123 -0.27785 0.16105 0.0465 0.82694 -1.27915 -0.00016 -0.0009 0.14205 0.33302 0 0 0 0 0 -0.08765 0.00347 0.612 0 0.35945 0 1.9342 -0.17667 0.54236 2.32081
ASN_37 -4.49624 0.681 4.12657 -0.19546 0.0344 0.31427 2.48783 -2.2779 -0.01773 -0.08741 -2.80563 -0.47855 0 0 0 0 0 -0.00169 0.00518 0 2.05575 -0.56686 0 -0.93687 -0.4916 0.29695 -2.354
CYS_38 -7.44207 0.55746 4.89447 -0.07057 6e-05 0.03834 2.84945 -2.53367 -0 -0 -2.83637 0.00101 0 0 0 0 0 0.04451 0.00171 0.49703 0 0.2845 0 3.6196 -0.51702 0.39446 -0.2171
GLU_39 -4.56327 0.64902 4.91494 -0.21478 0.0457 0.2987 1.82991 -2.28942 -0.00652 -0.04156 -2.53699 -0.58572 0 0 0 -0.39742 0 0.19589 0.13401 0 3.48701 -0.24724 0 -2.7348 -0.42717 0.76084 -1.72885
MET_40 -6.18631 0.56732 4.37409 -0.32588 0.1213 0.03301 2.28296 -2.44573 -0 -0 -1.28462 -0.25867 0 0 0 0 0 0.35795 0.23286 1.19442 0 0.05045 0 0.60916 -0.22846 0.88414 -0.02201
HIS_41 -8.27184 0.49158 7.25474 -0.53532 0.00298 0.52712 3.15494 -3.56965 -0.00558 -0.0509 -1.62086 -0.40196 0 0 0 0 0 0.01836 0.19533 0 1.7458 -0.01136 0 -0.45461 -0.03111 0.80311 -0.75923
ALA_42 -6.81095 1.58661 4.52124 -0.02135 0 0 3.08352 -3.199 -0.01287 -0.0768 -2.17544 -0.30194 0 0 0 0 0 -0.02363 0 0 0 -0.04762 0 1.8394 -0.02813 1.07528 -0.59168
LEU_43 -9.20884 1.34368 3.36938 -0.49779 0.29569 0.11718 2.64534 -2.70235 -0 -0 -1.43553 0.26518 0 0 0 0 0 0.12622 0.15807 0.30287 0 -0.27287 0 0.18072 -0.14366 0.96091 -4.49581
ASN_44 -5.13281 0.25121 5.49044 -0.20065 0.00455 0.27582 2.80764 -2.81614 -0 -0 -2.20674 -0.34484 0 0 0 0 0 0.02574 0.00787 0 2.74447 0.31484 0 -0.93687 -0.06264 0.50177 0.72364
GLU_45 -6.06556 0.35525 5.80691 -0.42133 0.03687 0.81344 2.33406 -2.72021 -0.03027 -0.19581 -2.09122 -0.46166 0 0 0 0 0 0.06048 0.02789 0 3.40343 -0.35788 0 -2.7348 -0.18298 0.34693 -2.07648
ILE_46 -10.1578 1.5552 5.17976 -0.49429 0.38098 0.08118 3.53746 -3.68406 -0.01187 -0.07126 -2.45247 0.43727 0 0 0 0 0 0.06584 0.07061 1.2901 0 -0.20558 0 0.73287 -0.29582 0.86082 -3.18102
GLN_47 -7.92475 0.74854 8.04558 -0.87219 0.069 0.95974 4.49193 -3.82411 -0.01287 -0.0768 -5.11209 -0.8415 0 0 -1.07559 0 0 0.1274 0.26523 0 2.88286 -0.24227 0 -0.18838 -0.1951 1.17512 -1.60027
GLU_48 -5.06162 0.42034 5.70223 -0.5949 0.12118 1.08017 2.49519 -2.65822 -0 -0 -2.37294 -0.73542 0 0 0 0 0 -0.06278 0.00037 0 3.68796 -0.2393 0 -2.7348 -0.47054 0.70849 -0.71459
VAL_49 -6.78921 0.46047 5.00227 -0.29956 0.16649 0.06657 3.22537 -2.97493 -0 -0 -1.60666 -0.10616 0 0 0 0 0 -0.06828 0.00196 0.08365 0 -0.36824 0 1.9342 -0.29198 0.3274 -1.23664
PHE_50 -13.1093 1.23975 5.55103 -0.58845 0.22104 0.30642 3.39558 -4.05387 -0 -0 -1.72017 -0.2991 0 0 0 0 0 -0.04046 0.53212 0 3.17614 -0.13163 0 1.0402 -0.10642 0.45897 -4.12813
THR_51 -5.13327 0.33048 6.71921 -0.19704 0.09557 0.06932 3.02905 -3.03955 -0.01467 -0.1403 -3.80055 0.00802 0 0 0 0 0 0.00738 0.07762 0.07632 0 -0.01886 2.27387 -1.0874 -0.04274 0.5109 -0.27665
LEU_52 -4.08975 0.32629 3.78555 -0.47216 0.19061 0.11452 1.61364 -1.87246 -0 -0 -0.81607 0.21284 0 0 0 0 0 -0.03019 0.10399 0.27808 0 -0.28111 0 0.18072 -0.13888 0.30778 -0.58661
HIS_53 -4.74131 0.3064 4.11224 -0.43049 0.18238 0.43749 1.55793 -2.03572 -0 -0 -0.92118 -0.48131 0 0 0 0 0 -0.07464 0.00127 0 3.69241 -0.0819 0 -0.45461 -0.4032 0.31615 0.98192
GLY_54 -1.90201 0.15359 2.53224 -5e-05 0 0 0.9946 -1.16984 -0.00176 -0.02889 -1.21947 -0.39463 0 0 0 0 0 -0.08456 0 0 0 -1.3215 0 0.83697 -0.55399 0.29158 -1.86773
MET_55 -6.7604 0.78122 4.03929 -0.37011 0.13476 0.03961 1.55153 -2.15598 -0.01467 -0.1403 -0.97681 -0.1507 0 0 0 0 0 -0.00898 0.51506 1.56992 0 0.19253 0 0.60916 0.02512 0.48156 -0.63816
LYS_56 -6.4878 0.38383 5.68 -0.297 0.03467 0.14451 2.15609 -2.63253 -0.01074 -0.07901 -1.01126 -0.21908 0 0 0 0 0 -0.00608 0.04189 2.04798 0 0.05111 0 -1.5107 0.32658 0.57072 -0.81682
CYS_57 -6.55065 0.83167 4.03526 -0.05796 0 0.0331 2.52653 -2.11403 -0 -0 -2.99341 -0.30332 0 0 -1.07559 0 0 -0.08907 0.00873 0.88626 0 0.36133 0 3.6196 0.00967 0.53708 -0.3348
SER_58 -3.76026 0.40377 3.24205 -0.02945 0.00161 0.0469 0.9786 -1.57954 -0.00339 -0.05999 -0.06751 -1.04411 0 0 0 0 0 -0.04847 0.15086 0.19288 0 -0.35205 0.68631 -0.77834 -0.26382 0.42785 -1.85609
HIS_D_59 -5.77941 0.3865 4.72227 -0.3892 0.08209 0.44005 1.96425 -2.325 -0.0125 -0.1079 -0.82277 -0.58089 0 0 0 0 0 -0.02841 0.04444 0 3.13891 -0.22248 0 -0.45461 -0.50447 0.21596 -0.23317
PHE_60 -10.1565 1.68489 3.49829 -0.5707 0.07227 0.27852 2.38936 -2.87917 -0.05218 -0.23905 -1.40881 0.01621 0 0 0 0 0 -0.03867 0.06133 0 2.07964 -0.14203 0 1.0402 -0.25877 0.78308 -3.84213
LYS_61 -2.57242 0.15622 2.81042 -0.34175 0.07569 0.22595 1.11516 -1.29914 -0 -0 -0.59748 -0.37562 0 0 0 0 0 -0.08094 0.01176 1.51741 0 -0.13034 0 -1.5107 -0.18006 0.8894 -0.28644
LEU_62 -7.20174 1.24278 0.896 -0.50265 0.14344 0.10516 0.79772 -1.45443 -0.03 -0.14289 -0.55949 0.3241 0 0 0 0 0 -0.07285 0.04027 0.50032 0 -0.11947 0 0.18072 -0.27311 1.36665 -4.75948
PRO_63 -4.52858 1.05873 2.7425 -0.14128 0.00072 0.09903 1.15294 -1.12331 -0 -0 -0.26898 0.22679 0 0 0 0 0 -0.02191 0.00401 0.22365 0 -1.16302 0 -2.4119 -0.46923 1.34937 -3.27046
ASP_64 -2.34282 0.23998 1.36303 -0.11739 0.00294 0.35451 0.16132 -0.75481 -8e-05 -0.00211 -0.61893 -0.9001 0 0 0 0 0 0.03048 0.18345 0 2.37057 -0.13499 0 -2.3716 -0.21723 0.2984 -2.45539
TYR_65 -9.29535 2.00421 3.0388 -0.94008 0.06085 0.57745 2.53244 -2.24139 -0.00255 -0.00972 -0.35752 -0.27497 0 0 -0.67383 0 0 0.00748 0.14541 0 1.95884 -0.32697 0.34777 1.2797 0.29753 1.52628 -0.34561
PRO_66 -2.94559 0.52094 0.65975 -0.08486 0.00052 0.05202 0.05692 -0.40854 -0 -0 0.38468 0.63689 0 0 0 0 0 -0.13426 0.01739 0.54865 0 -0.38216 0 -2.4119 -0.04557 1.9006 -1.63453
LEU_67 -6.45777 1.10654 2.75467 -0.45511 0.14358 0.05671 1.90503 -1.99936 -0 -0 0.58836 0.33765 0 0 0 0 0 0.15778 0.01463 1.7229 0 -0.2869 0 0.18072 -0.4209 0.94931 0.29784
LEU_68 -2.62338 0.22019 2.4076 -0.56031 0.16738 0.13524 0.7959 -1.24069 -0 -0 -1.05403 0.31863 0 0 -0.67383 0 0 -0.08135 0.00925 0.41285 0 -0.01499 0 0.18072 -0.23328 0.73771 -1.09639
MET_69 -5.85657 0.51948 3.81751 -0.3212 0.12394 0.03146 1.71098 -1.93335 -0 -0 0.03663 0.03723 0 0 0 0 0 -0.0232 0.12361 1.34462 0 -0.06552 0 0.60916 -0.27045 0.39044 0.27478
ASN_70 -2.27165 0.23574 2.06158 -0.19059 0.03409 0.30765 0.34516 -0.9054 -0.02102 -0.13071 -0.40265 -0.4887 0 0 0 0 0 -0.05859 0.00096 0 2.0371 -0.52686 0 -0.93687 -0.53411 0.25762 -1.18724
ALA:CtermProteinFull_71 -1.66329 0.36338 1.59573 -0.0315 0.00031 0 0.58791 -0.78077 -0.01508 -0.061 -1.05488 -0.31982 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.32438 0.46677 0.60278
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114278 DOMAINID 110960 MODEL 2 2021-08-21_00000149_1_19
MODEL     2
REMARK    Rerank model02.pdb score: 47.444
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 13 cluster_threshold: 2.937218
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     hbond_bb_sc:          -3.113
REMARK    SCORE     hbond_sr_bb:         -45.040
REMARK    SCORE          fa_rep:          42.691
REMARK    SCORE         p_aa_pp:         -10.263
REMARK    SCORE          fa_sol:         248.040
REMARK    SCORE         fa_elec:        -107.387
REMARK    SCORE     lk_ball_wtd:         -15.017
REMARK    SCORE     cart_bonded:          40.014
REMARK    SCORE            time:           0.000
REMARK    SCORE     rama_prepro:         -10.497
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE           score:        -327.532
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE          fa_dun:          95.398
REMARK    SCORE     hbond_lr_bb:          -3.482
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     total_score:        -327.532
REMARK    SCORE    fa_intra_rep:           0.666
REMARK    SCORE        hbond_sc:          -6.196
REMARK    SCORE           omega:           0.146
REMARK    SCORE fa_intra_sol_xover4:          13.988
REMARK    SCORE     description: cluster0002_0001
REMARK    SCORE          fa_atr:        -389.087
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE             ref:          27.225
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE atom_pair_constraint:        -205.618
ATOM      1  N   CYS A   1      -0.341   0.228  -0.092  1.00  3.890          N  
ATOM      2  CA  CYS A   1       1.093   0.370   0.037  1.00  3.200          C  
ATOM      3  C   CYS A   1       1.522   1.822   0.072  1.00  2.580          C  
ATOM      4  O   CYS A   1       2.702   2.113  -0.076  1.00  3.150          O  
ATOM      5  CB  CYS A   1       1.847  -0.340  -1.081  1.00  4.760          C  
ATOM      6  SG  CYS A   1       1.788  -2.120  -1.048  1.00  4.760          S  
ATOM      7 1H   CYS A   1      -0.616  -0.725   0.092  1.00  4.670          H  
ATOM      8 2H   CYS A   1      -0.767   0.851   0.593  1.00  4.670          H  
ATOM      9 3H   CYS A   1      -0.632   0.493  -1.025  1.00  4.670          H  
ATOM     10  HA  CYS A   1       1.398  -0.085   0.975  1.00  3.840          H  
ATOM     11 1HB  CYS A   1       1.430  -0.022  -2.032  1.00  5.710          H  
ATOM     12 2HB  CYS A   1       2.896  -0.044  -1.053  1.00  5.710          H  
ATOM     13  HG  CYS A   1       2.658  -2.242  -0.019  1.00  5.710          H  
ATOM     14  N   VAL A   2       0.600   2.753   0.346  1.00  1.980          N  
ATOM     15  CA  VAL A   2       1.015   4.153   0.395  1.00  2.130          C  
ATOM     16  C   VAL A   2       1.871   4.276   1.633  1.00  2.240          C  
ATOM     17  O   VAL A   2       2.813   5.065   1.695  1.00  2.850          O  
ATOM     18  CB  VAL A   2      -0.180   5.153   0.472  1.00  2.920          C  
ATOM     19  CG1 VAL A   2      -0.781   5.295   1.921  1.00  2.920          C  
ATOM     20  CG2 VAL A   2       0.261   6.492  -0.036  1.00  2.920          C  
ATOM     21  H   VAL A   2      -0.362   2.507   0.543  1.00  2.380          H  
ATOM     22  HA  VAL A   2       1.614   4.387  -0.484  1.00  2.560          H  
ATOM     23  HB  VAL A   2      -0.968   4.772  -0.165  1.00  3.510          H  
ATOM     24 1HG1 VAL A   2      -1.603   5.992   1.875  1.00  3.510          H  
ATOM     25 2HG1 VAL A   2      -1.128   4.382   2.307  1.00  3.510          H  
ATOM     26 3HG1 VAL A   2      -0.030   5.707   2.596  1.00  3.510          H  
ATOM     27 1HG2 VAL A   2      -0.583   7.183  -0.027  1.00  3.510          H  
ATOM     28 2HG2 VAL A   2       1.057   6.883   0.604  1.00  3.510          H  
ATOM     29 3HG2 VAL A   2       0.635   6.395  -1.059  1.00  3.510          H  
ATOM     30  N   PHE A   3       1.528   3.454   2.617  1.00  2.290          N  
ATOM     31  CA  PHE A   3       2.201   3.447   3.896  1.00  2.730          C  
ATOM     32  C   PHE A   3       3.414   2.482   3.987  1.00  2.550          C  
ATOM     33  O   PHE A   3       4.066   2.436   5.029  1.00  3.050          O  
ATOM     34  CB  PHE A   3       1.197   3.073   4.987  1.00  3.650          C  
ATOM     35  CG  PHE A   3       1.508   3.666   6.315  1.00  3.650          C  
ATOM     36  CD1 PHE A   3       1.136   4.969   6.589  1.00  3.650          C  
ATOM     37  CD2 PHE A   3       2.178   2.960   7.283  1.00  3.650          C  
ATOM     38  CE1 PHE A   3       1.414   5.537   7.814  1.00  3.650          C  
ATOM     39  CE2 PHE A   3       2.457   3.511   8.504  1.00  3.650          C  
ATOM     40  CZ  PHE A   3       2.072   4.806   8.777  1.00  3.650          C  
ATOM     41  H   PHE A   3       0.689   2.883   2.479  1.00  2.750          H  
ATOM     42  HA  PHE A   3       2.562   4.462   4.087  1.00  3.280          H  
ATOM     43 1HB  PHE A   3       0.197   3.392   4.696  1.00  4.380          H  
ATOM     44 2HB  PHE A   3       1.169   1.986   5.101  1.00  4.380          H  
ATOM     45  HD1 PHE A   3       0.612   5.546   5.828  1.00  4.380          H  
ATOM     46  HD2 PHE A   3       2.490   1.934   7.069  1.00  4.380          H  
ATOM     47  HE1 PHE A   3       1.112   6.562   8.022  1.00  4.380          H  
ATOM     48  HE2 PHE A   3       2.984   2.920   9.257  1.00  4.380          H  
ATOM     49  HZ  PHE A   3       2.289   5.247   9.748  1.00  4.380          H  
ATOM     50  N   GLY A   4       3.712   1.650   2.965  1.00  2.370          N  
ATOM     51  CA  GLY A   4       4.828   0.712   3.173  1.00  2.550          C  
ATOM     52  C   GLY A   4       4.918  -0.534   2.270  1.00  2.630          C  
ATOM     53  O   GLY A   4       4.132  -0.739   1.345  1.00  2.930          O  
ATOM     54  H   GLY A   4       3.243   1.713   2.060  1.00  2.840          H  
ATOM     55 1HA  GLY A   4       5.752   1.279   3.071  1.00  3.060          H  
ATOM     56 2HA  GLY A   4       4.797   0.383   4.209  1.00  3.060          H  
ATOM     57  N   CYS A   5       5.910  -1.373   2.596  1.00  2.810          N  
ATOM     58  CA  CYS A   5       6.276  -2.598   1.883  1.00  2.880          C  
ATOM     59  C   CYS A   5       5.157  -3.642   1.779  1.00  2.880          C  
ATOM     60  O   CYS A   5       4.708  -4.127   2.822  1.00  3.030          O  
ATOM     61  CB  CYS A   5       7.457  -3.261   2.600  1.00  4.000          C  
ATOM     62  SG  CYS A   5       8.036  -4.810   1.861  1.00  4.000          S  
ATOM     63  H   CYS A   5       6.475  -1.113   3.396  1.00  3.370          H  
ATOM     64  HA  CYS A   5       6.607  -2.264   0.911  1.00  3.460          H  
ATOM     65 1HB  CYS A   5       8.300  -2.567   2.629  1.00  4.800          H  
ATOM     66 2HB  CYS A   5       7.172  -3.469   3.630  1.00  4.800          H  
ATOM     67  HG  CYS A   5       8.952  -5.067   2.796  1.00  4.800          H  
ATOM     68  N   PRO A   6       4.829  -4.135   0.557  1.00  3.090          N  
ATOM     69  CA  PRO A   6       3.748  -5.051   0.215  1.00  3.550          C  
ATOM     70  C   PRO A   6       3.773  -6.413   0.886  1.00  3.570          C  
ATOM     71  O   PRO A   6       2.756  -7.102   0.896  1.00  3.650          O  
ATOM     72  CB  PRO A   6       3.912  -5.214  -1.301  1.00  5.320          C  
ATOM     73  CG  PRO A   6       5.316  -4.870  -1.599  1.00  5.320          C  
ATOM     74  CD  PRO A   6       5.656  -3.775  -0.640  1.00  5.320          C  
ATOM     75  HA  PRO A   6       2.792  -4.563   0.421  1.00  4.260          H  
ATOM     76 1HB  PRO A   6       3.675  -6.242  -1.582  1.00  6.390          H  
ATOM     77 2HB  PRO A   6       3.217  -4.567  -1.815  1.00  6.390          H  
ATOM     78 1HG  PRO A   6       5.957  -5.755  -1.480  1.00  6.390          H  
ATOM     79 2HG  PRO A   6       5.408  -4.551  -2.649  1.00  6.390          H  
ATOM     80 1HD  PRO A   6       6.727  -3.853  -0.472  1.00  6.390          H  
ATOM     81 2HD  PRO A   6       5.352  -2.793  -1.037  1.00  6.390          H  
ATOM     82  N   SER A   7       4.917  -6.844   1.412  1.00  3.670          N  
ATOM     83  CA  SER A   7       4.951  -8.140   2.072  1.00  3.780          C  
ATOM     84  C   SER A   7       4.169  -8.091   3.392  1.00  3.220          C  
ATOM     85  O   SER A   7       3.743  -9.124   3.932  1.00  3.390          O  
ATOM     86  CB  SER A   7       6.382  -8.563   2.326  1.00  5.250          C  
ATOM     87  OG  SER A   7       6.988  -7.758   3.295  1.00  5.250          O  
ATOM     88  H   SER A   7       5.760  -6.287   1.393  1.00  4.400          H  
ATOM     89  HA  SER A   7       4.478  -8.876   1.416  1.00  4.540          H  
ATOM     90 1HB  SER A   7       6.400  -9.604   2.652  1.00  6.300          H  
ATOM     91 2HB  SER A   7       6.946  -8.502   1.397  1.00  6.300          H  
ATOM     92  HG  SER A   7       7.888  -8.080   3.385  1.00  6.300          H  
ATOM     93  N   ALA A   8       3.916  -6.884   3.899  1.00  2.670          N  
ATOM     94  CA  ALA A   8       3.197  -6.698   5.144  1.00  2.190          C  
ATOM     95  C   ALA A   8       1.701  -6.761   4.877  1.00  1.800          C  
ATOM     96  O   ALA A   8       0.973  -5.770   5.022  1.00  1.560          O  
ATOM     97  CB  ALA A   8       3.594  -5.373   5.757  1.00  3.260          C  
ATOM     98  H   ALA A   8       4.243  -6.051   3.402  1.00  3.200          H  
ATOM     99  HA  ALA A   8       3.461  -7.509   5.826  1.00  2.630          H  
ATOM    100 1HB  ALA A   8       3.087  -5.244   6.675  1.00  3.910          H  
ATOM    101 2HB  ALA A   8       4.674  -5.371   5.932  1.00  3.910          H  
ATOM    102 3HB  ALA A   8       3.347  -4.575   5.077  1.00  3.910          H  
ATOM    103  N   ALA A   9       1.224  -7.950   4.531  1.00  1.810          N  
ATOM    104  CA  ALA A   9      -0.153  -8.106   4.073  1.00  1.620          C  
ATOM    105  C   ALA A   9      -1.208  -7.620   5.071  1.00  1.370          C  
ATOM    106  O   ALA A   9      -2.197  -7.016   4.665  1.00  1.220          O  
ATOM    107  CB  ALA A   9      -0.438  -9.555   3.734  1.00  2.340          C  
ATOM    108  H   ALA A   9       1.906  -8.712   4.469  1.00  2.170          H  
ATOM    109  HA  ALA A   9      -0.241  -7.535   3.167  1.00  1.940          H  
ATOM    110 1HB  ALA A   9      -1.451  -9.642   3.332  1.00  2.810          H  
ATOM    111 2HB  ALA A   9       0.276  -9.894   2.989  1.00  2.810          H  
ATOM    112 3HB  ALA A   9      -0.351 -10.165   4.631  1.00  2.810          H  
ATOM    113  N   ASP A  10      -1.000  -7.833   6.373  1.00  1.480          N  
ATOM    114  CA  ASP A  10      -2.019  -7.372   7.317  1.00  1.440          C  
ATOM    115  C   ASP A  10      -1.801  -5.963   7.831  1.00  1.220          C  
ATOM    116  O   ASP A  10      -2.754  -5.206   8.057  1.00  1.210          O  
ATOM    117  CB  ASP A  10      -2.185  -8.329   8.488  1.00  2.030          C  
ATOM    118  CG  ASP A  10      -2.798  -9.640   8.052  1.00  2.030          C  
ATOM    119  OD1 ASP A  10      -3.953  -9.618   7.620  1.00  2.030          O  
ATOM    120  OD2 ASP A  10      -2.139 -10.643   8.120  1.00  2.030          O  
ATOM    121  H   ASP A  10      -0.172  -8.329   6.675  1.00  1.780          H  
ATOM    122  HA  ASP A  10      -2.953  -7.390   6.789  1.00  1.730          H  
ATOM    123 1HB  ASP A  10      -1.217  -8.520   8.951  1.00  2.440          H  
ATOM    124 2HB  ASP A  10      -2.829  -7.872   9.242  1.00  2.440          H  
ATOM    125  N   LYS A  11      -0.547  -5.591   8.018  1.00  1.190          N  
ATOM    126  CA  LYS A  11      -0.298  -4.275   8.549  1.00  1.120          C  
ATOM    127  C   LYS A  11      -0.751  -3.241   7.541  1.00  0.970          C  
ATOM    128  O   LYS A  11      -1.410  -2.269   7.908  1.00  0.970          O  
ATOM    129  CB  LYS A  11       1.170  -4.079   8.899  1.00  1.600          C  
ATOM    130  CG  LYS A  11       1.643  -4.890  10.099  1.00  1.600          C  
ATOM    131  CD  LYS A  11       3.129  -4.668  10.368  1.00  1.600          C  
ATOM    132  CE  LYS A  11       3.609  -5.475  11.577  1.00  1.600          C  
ATOM    133  NZ  LYS A  11       5.073  -5.301  11.820  1.00  1.600          N  
ATOM    134  H   LYS A  11       0.203  -6.231   7.816  1.00  1.430          H  
ATOM    135  HA  LYS A  11      -0.891  -4.138   9.453  1.00  1.340          H  
ATOM    136 1HB  LYS A  11       1.767  -4.319   8.055  1.00  1.920          H  
ATOM    137 2HB  LYS A  11       1.347  -3.022   9.122  1.00  1.920          H  
ATOM    138 1HG  LYS A  11       1.072  -4.586  10.978  1.00  1.920          H  
ATOM    139 2HG  LYS A  11       1.461  -5.946   9.917  1.00  1.920          H  
ATOM    140 1HD  LYS A  11       3.704  -4.964   9.491  1.00  1.920          H  
ATOM    141 2HD  LYS A  11       3.305  -3.607  10.557  1.00  1.920          H  
ATOM    142 1HE  LYS A  11       3.064  -5.151  12.462  1.00  1.920          H  
ATOM    143 2HE  LYS A  11       3.403  -6.532  11.403  1.00  1.920          H  
ATOM    144 1HZ  LYS A  11       5.348  -5.850  12.623  1.00  1.920          H  
ATOM    145 2HZ  LYS A  11       5.590  -5.611  11.009  1.00  1.920          H  
ATOM    146 3HZ  LYS A  11       5.274  -4.327  11.994  1.00  1.920          H  
ATOM    147  N   LEU A  12      -0.482  -3.476   6.250  1.00  0.990          N  
ATOM    148  CA  LEU A  12      -0.882  -2.471   5.295  1.00  1.050          C  
ATOM    149  C   LEU A  12      -2.375  -2.266   5.162  1.00  0.940          C  
ATOM    150  O   LEU A  12      -2.807  -1.121   5.033  1.00  1.040          O  
ATOM    151  CB  LEU A  12      -0.312  -2.771   3.913  1.00  1.450          C  
ATOM    152  CG  LEU A  12       1.203  -2.593   3.759  1.00  1.450          C  
ATOM    153  CD1 LEU A  12       1.562  -3.058   2.434  1.00  1.450          C  
ATOM    154  CD2 LEU A  12       1.654  -1.139   3.937  1.00  1.450          C  
ATOM    155  H   LEU A  12       0.049  -4.297   5.944  1.00  1.190          H  
ATOM    156  HA  LEU A  12      -0.470  -1.535   5.640  1.00  1.260          H  
ATOM    157 1HB  LEU A  12      -0.531  -3.816   3.687  1.00  1.740          H  
ATOM    158 2HB  LEU A  12      -0.814  -2.157   3.174  1.00  1.740          H  
ATOM    159  HG  LEU A  12       1.706  -3.200   4.496  1.00  1.740          H  
ATOM    160 1HD1 LEU A  12       2.611  -2.952   2.302  1.00  1.740          H  
ATOM    161 2HD1 LEU A  12       1.283  -4.080   2.336  1.00  1.740          H  
ATOM    162 3HD1 LEU A  12       1.047  -2.465   1.705  1.00  1.740          H  
ATOM    163 1HD2 LEU A  12       2.717  -1.112   3.811  1.00  1.740          H  
ATOM    164 2HD2 LEU A  12       1.197  -0.516   3.204  1.00  1.740          H  
ATOM    165 3HD2 LEU A  12       1.417  -0.767   4.929  1.00  1.740          H  
ATOM    166  N   TRP A  13      -3.229  -3.294   5.172  1.00  0.940          N  
ATOM    167  CA  TRP A  13      -4.622  -2.876   5.013  1.00  1.050          C  
ATOM    168  C   TRP A  13      -5.068  -1.996   6.173  1.00  1.160          C  
ATOM    169  O   TRP A  13      -5.801  -1.029   5.967  1.00  1.370          O  
ATOM    170  CB  TRP A  13      -5.635  -4.032   4.807  1.00  1.430          C  
ATOM    171  CG  TRP A  13      -5.793  -5.034   5.934  1.00  1.430          C  
ATOM    172  CD1 TRP A  13      -5.183  -6.230   5.993  1.00  1.430          C  
ATOM    173  CD2 TRP A  13      -6.565  -4.920   7.161  1.00  1.430          C  
ATOM    174  NE1 TRP A  13      -5.517  -6.890   7.165  1.00  1.430          N  
ATOM    175  CE2 TRP A  13      -6.351  -6.097   7.887  1.00  1.430          C  
ATOM    176  CE3 TRP A  13      -7.392  -3.936   7.692  1.00  1.430          C  
ATOM    177  CZ2 TRP A  13      -6.928  -6.308   9.120  1.00  1.430          C  
ATOM    178  CZ3 TRP A  13      -7.970  -4.147   8.929  1.00  1.430          C  
ATOM    179  CH2 TRP A  13      -7.743  -5.301   9.626  1.00  1.430          C  
ATOM    180  H   TRP A  13      -2.932  -4.262   5.255  1.00  1.130          H  
ATOM    181  HA  TRP A  13      -4.684  -2.270   4.108  1.00  1.260          H  
ATOM    182 1HB  TRP A  13      -6.618  -3.608   4.611  1.00  1.710          H  
ATOM    183 2HB  TRP A  13      -5.354  -4.595   3.921  1.00  1.710          H  
ATOM    184  HD1 TRP A  13      -4.524  -6.624   5.224  1.00  1.710          H  
ATOM    185  HE1 TRP A  13      -5.156  -7.836   7.444  1.00  1.710          H  
ATOM    186  HE3 TRP A  13      -7.572  -3.017   7.149  1.00  1.710          H  
ATOM    187  HZ2 TRP A  13      -6.754  -7.221   9.691  1.00  1.710          H  
ATOM    188  HZ3 TRP A  13      -8.603  -3.366   9.340  1.00  1.710          H  
ATOM    189  HH2 TRP A  13      -8.210  -5.432  10.601  1.00  1.710          H  
ATOM    190  N   ASP A  14      -4.534  -2.216   7.377  1.00  1.200          N  
ATOM    191  CA  ASP A  14      -4.949  -1.372   8.491  1.00  1.490          C  
ATOM    192  C   ASP A  14      -4.357   0.047   8.373  1.00  1.570          C  
ATOM    193  O   ASP A  14      -5.071   1.052   8.509  1.00  1.910          O  
ATOM    194  CB  ASP A  14      -4.551  -2.047   9.812  1.00  1.970          C  
ATOM    195  CG  ASP A  14      -5.111  -1.372  11.085  1.00  1.970          C  
ATOM    196  OD1 ASP A  14      -6.312  -1.281  11.218  1.00  1.970          O  
ATOM    197  OD2 ASP A  14      -4.325  -0.981  11.919  1.00  1.970          O  
ATOM    198  H   ASP A  14      -3.925  -3.035   7.534  1.00  1.440          H  
ATOM    199  HA  ASP A  14      -6.034  -1.287   8.468  1.00  1.790          H  
ATOM    200 1HB  ASP A  14      -4.888  -3.085   9.788  1.00  2.360          H  
ATOM    201 2HB  ASP A  14      -3.459  -2.070   9.877  1.00  2.360          H  
ATOM    202  N   GLU A  15      -3.049   0.121   8.086  1.00  1.380          N  
ATOM    203  CA  GLU A  15      -2.328   1.392   7.995  1.00  1.640          C  
ATOM    204  C   GLU A  15      -2.829   2.281   6.853  1.00  1.630          C  
ATOM    205  O   GLU A  15      -2.915   3.514   7.005  1.00  1.930          O  
ATOM    206  CB  GLU A  15      -0.843   1.104   7.783  1.00  2.190          C  
ATOM    207  CG  GLU A  15      -0.105   0.521   9.004  1.00  2.190          C  
ATOM    208  CD  GLU A  15       1.277   0.008   8.678  1.00  2.190          C  
ATOM    209  OE1 GLU A  15       1.537  -0.237   7.526  1.00  2.190          O  
ATOM    210  OE2 GLU A  15       2.070  -0.130   9.577  1.00  2.190          O  
ATOM    211  H   GLU A  15      -2.525  -0.747   7.960  1.00  1.660          H  
ATOM    212  HA  GLU A  15      -2.453   1.927   8.928  1.00  1.970          H  
ATOM    213 1HB  GLU A  15      -0.719   0.429   6.944  1.00  2.630          H  
ATOM    214 2HB  GLU A  15      -0.375   2.024   7.527  1.00  2.630          H  
ATOM    215 1HG  GLU A  15      -0.020   1.302   9.755  1.00  2.630          H  
ATOM    216 2HG  GLU A  15      -0.702  -0.286   9.427  1.00  2.630          H  
ATOM    217  N   ASN A  16      -3.164   1.664   5.723  1.00  1.440          N  
ATOM    218  CA  ASN A  16      -3.629   2.396   4.565  1.00  1.640          C  
ATOM    219  C   ASN A  16      -5.066   2.827   4.790  1.00  1.460          C  
ATOM    220  O   ASN A  16      -5.396   3.989   4.558  1.00  1.470          O  
ATOM    221  CB  ASN A  16      -3.467   1.553   3.314  1.00  2.220          C  
ATOM    222  CG  ASN A  16      -2.000   1.414   2.876  1.00  2.220          C  
ATOM    223  OD1 ASN A  16      -1.448   2.087   1.977  1.00  2.220          O  
ATOM    224  ND2 ASN A  16      -1.341   0.557   3.540  1.00  2.220          N  
ATOM    225  H   ASN A  16      -3.059   0.647   5.672  1.00  1.730          H  
ATOM    226  HA  ASN A  16      -3.027   3.298   4.459  1.00  1.970          H  
ATOM    227 1HB  ASN A  16      -3.895   0.561   3.480  1.00  2.660          H  
ATOM    228 2HB  ASN A  16      -4.010   2.009   2.520  1.00  2.660          H  
ATOM    229 1HD2 ASN A  16      -0.377   0.406   3.368  1.00  2.660          H  
ATOM    230 2HD2 ASN A  16      -1.807   0.036   4.266  1.00  2.660          H  
ATOM    231  N   LYS A  17      -5.930   1.958   5.344  1.00  1.430          N  
ATOM    232  CA  LYS A  17      -7.296   2.407   5.569  1.00  1.540          C  
ATOM    233  C   LYS A  17      -7.303   3.635   6.450  1.00  1.540          C  
ATOM    234  O   LYS A  17      -7.976   4.616   6.140  1.00  1.690          O  
ATOM    235  CB  LYS A  17      -8.167   1.326   6.209  1.00  2.110          C  
ATOM    236  CG  LYS A  17      -8.629   0.214   5.279  1.00  2.110          C  
ATOM    237  CD  LYS A  17      -9.407  -0.875   6.056  1.00  2.110          C  
ATOM    238  CE  LYS A  17     -10.851  -0.421   6.407  1.00  2.110          C  
ATOM    239  NZ  LYS A  17     -11.634  -1.481   7.126  1.00  2.110          N  
ATOM    240  H   LYS A  17      -5.679   0.989   5.560  1.00  1.720          H  
ATOM    241  HA  LYS A  17      -7.743   2.684   4.621  1.00  1.850          H  
ATOM    242 1HB  LYS A  17      -7.600   0.853   7.013  1.00  2.530          H  
ATOM    243 2HB  LYS A  17      -9.021   1.784   6.654  1.00  2.530          H  
ATOM    244 1HG  LYS A  17      -9.286   0.652   4.527  1.00  2.530          H  
ATOM    245 2HG  LYS A  17      -7.780  -0.224   4.770  1.00  2.530          H  
ATOM    246 1HD  LYS A  17      -9.444  -1.789   5.465  1.00  2.530          H  
ATOM    247 2HD  LYS A  17      -8.878  -1.088   6.985  1.00  2.530          H  
ATOM    248 1HE  LYS A  17     -10.821   0.460   7.032  1.00  2.530          H  
ATOM    249 2HE  LYS A  17     -11.369  -0.179   5.479  1.00  2.530          H  
ATOM    250 1HZ  LYS A  17     -12.595  -1.140   7.319  1.00  2.530          H  
ATOM    251 2HZ  LYS A  17     -11.700  -2.302   6.554  1.00  2.530          H  
ATOM    252 3HZ  LYS A  17     -11.196  -1.709   7.998  1.00  2.530          H  
ATOM    253  N   SER A  18      -6.485   3.658   7.502  1.00  1.520          N  
ATOM    254  CA  SER A  18      -6.493   4.832   8.357  1.00  1.690          C  
ATOM    255  C   SER A  18      -6.143   6.096   7.569  1.00  1.600          C  
ATOM    256  O   SER A  18      -6.883   7.091   7.602  1.00  1.870          O  
ATOM    257  CB  SER A  18      -5.519   4.644   9.499  1.00  2.300          C  
ATOM    258  OG  SER A  18      -5.500   5.767  10.338  1.00  2.300          O  
ATOM    259  H   SER A  18      -5.918   2.837   7.749  1.00  1.820          H  
ATOM    260  HA  SER A  18      -7.496   4.950   8.769  1.00  2.030          H  
ATOM    261 1HB  SER A  18      -5.798   3.757  10.072  1.00  2.760          H  
ATOM    262 2HB  SER A  18      -4.520   4.467   9.096  1.00  2.760          H  
ATOM    263  HG  SER A  18      -4.864   5.569  11.027  1.00  2.760          H  
ATOM    264  N   HIS A  19      -5.059   6.045   6.784  1.00  1.310          N  
ATOM    265  CA  HIS A  19      -4.625   7.208   6.012  1.00  1.300          C  
ATOM    266  C   HIS A  19      -5.684   7.724   5.034  1.00  1.140          C  
ATOM    267  O   HIS A  19      -6.025   8.921   5.023  1.00  1.290          O  
ATOM    268  CB  HIS A  19      -3.372   6.851   5.196  1.00  1.820          C  
ATOM    269  CG  HIS A  19      -2.871   7.963   4.327  1.00  1.820          C  
ATOM    270  ND1 HIS A  19      -2.142   9.027   4.821  1.00  1.820          N  
ATOM    271  CD2 HIS A  19      -3.010   8.187   2.997  1.00  1.820          C  
ATOM    272  CE1 HIS A  19      -1.845   9.847   3.828  1.00  1.820          C  
ATOM    273  NE2 HIS A  19      -2.359   9.362   2.715  1.00  1.820          N  
ATOM    274  H   HIS A  19      -4.492   5.188   6.769  1.00  1.570          H  
ATOM    275  HA  HIS A  19      -4.379   8.017   6.694  1.00  1.560          H  
ATOM    276 1HB  HIS A  19      -2.572   6.551   5.872  1.00  2.190          H  
ATOM    277 2HB  HIS A  19      -3.587   5.993   4.555  1.00  2.190          H  
ATOM    278  HD1 HIS A  19      -2.100   9.303   5.782  1.00  2.190          H  
ATOM    279  HD2 HIS A  19      -3.508   7.634   2.203  1.00  2.190          H  
ATOM    280  HE1 HIS A  19      -1.269  10.754   4.011  1.00  2.190          H  
ATOM    281  N   PHE A  20      -6.190   6.814   4.208  1.00  0.950          N  
ATOM    282  CA  PHE A  20      -7.122   7.175   3.160  1.00  0.870          C  
ATOM    283  C   PHE A  20      -8.501   7.551   3.688  1.00  0.800          C  
ATOM    284  O   PHE A  20      -9.146   8.452   3.134  1.00  0.850          O  
ATOM    285  CB  PHE A  20      -7.223   6.045   2.148  1.00  1.250          C  
ATOM    286  CG  PHE A  20      -6.050   5.924   1.221  1.00  1.250          C  
ATOM    287  CD1 PHE A  20      -5.008   5.067   1.488  1.00  1.250          C  
ATOM    288  CD2 PHE A  20      -6.004   6.653   0.058  1.00  1.250          C  
ATOM    289  CE1 PHE A  20      -3.959   4.935   0.626  1.00  1.250          C  
ATOM    290  CE2 PHE A  20      -4.944   6.530  -0.809  1.00  1.250          C  
ATOM    291  CZ  PHE A  20      -3.923   5.668  -0.517  1.00  1.250          C  
ATOM    292  H   PHE A  20      -5.893   5.840   4.315  1.00  1.140          H  
ATOM    293  HA  PHE A  20      -6.715   8.045   2.642  1.00  1.040          H  
ATOM    294 1HB  PHE A  20      -7.336   5.104   2.679  1.00  1.500          H  
ATOM    295 2HB  PHE A  20      -8.099   6.197   1.535  1.00  1.500          H  
ATOM    296  HD1 PHE A  20      -5.024   4.482   2.378  1.00  1.500          H  
ATOM    297  HD2 PHE A  20      -6.824   7.338  -0.180  1.00  1.500          H  
ATOM    298  HE1 PHE A  20      -3.158   4.242   0.856  1.00  1.500          H  
ATOM    299  HE2 PHE A  20      -4.925   7.117  -1.730  1.00  1.500          H  
ATOM    300  HZ  PHE A  20      -3.096   5.571  -1.194  1.00  1.500          H  
ATOM    301  N   ILE A  21      -8.979   6.865   4.732  1.00  0.790          N  
ATOM    302  CA  ILE A  21     -10.291   7.172   5.252  1.00  0.810          C  
ATOM    303  C   ILE A  21     -10.286   8.546   5.874  1.00  0.910          C  
ATOM    304  O   ILE A  21     -11.190   9.324   5.579  1.00  0.830          O  
ATOM    305  CB  ILE A  21     -10.798   6.127   6.271  1.00  1.130          C  
ATOM    306  CG1 ILE A  21     -11.031   4.814   5.545  1.00  1.130          C  
ATOM    307  CG2 ILE A  21     -12.095   6.617   6.921  1.00  1.130          C  
ATOM    308  CD1 ILE A  21     -11.281   3.617   6.428  1.00  1.130          C  
ATOM    309  H   ILE A  21      -8.440   6.112   5.159  1.00  0.950          H  
ATOM    310  HA  ILE A  21     -10.996   7.184   4.429  1.00  0.970          H  
ATOM    311  HB  ILE A  21     -10.037   5.960   7.037  1.00  1.350          H  
ATOM    312 1HG1 ILE A  21     -11.853   4.949   4.875  1.00  1.350          H  
ATOM    313 2HG1 ILE A  21     -10.148   4.597   4.958  1.00  1.350          H  
ATOM    314 1HG2 ILE A  21     -12.460   5.888   7.633  1.00  1.350          H  
ATOM    315 2HG2 ILE A  21     -11.910   7.541   7.450  1.00  1.350          H  
ATOM    316 3HG2 ILE A  21     -12.851   6.778   6.151  1.00  1.350          H  
ATOM    317 1HD1 ILE A  21     -11.400   2.743   5.804  1.00  1.350          H  
ATOM    318 2HD1 ILE A  21     -10.430   3.486   7.088  1.00  1.350          H  
ATOM    319 3HD1 ILE A  21     -12.178   3.751   7.022  1.00  1.350          H  
ATOM    320  N   GLU A  22      -9.302   8.876   6.728  1.00  1.140          N  
ATOM    321  CA  GLU A  22      -9.334  10.204   7.328  1.00  1.300          C  
ATOM    322  C   GLU A  22      -9.327  11.308   6.279  1.00  1.220          C  
ATOM    323  O   GLU A  22     -10.098  12.269   6.383  1.00  1.220          O  
ATOM    324  CB  GLU A  22      -8.172  10.432   8.298  1.00  1.760          C  
ATOM    325  CG  GLU A  22      -8.237  11.827   8.937  1.00  1.760          C  
ATOM    326  CD  GLU A  22      -7.215  12.138   9.974  1.00  1.760          C  
ATOM    327  OE1 GLU A  22      -6.408  11.302  10.293  1.00  1.760          O  
ATOM    328  OE2 GLU A  22      -7.249  13.256  10.454  1.00  1.760          O  
ATOM    329  H   GLU A  22      -8.555   8.214   6.975  1.00  1.370          H  
ATOM    330  HA  GLU A  22     -10.257  10.293   7.898  1.00  1.560          H  
ATOM    331 1HB  GLU A  22      -8.189   9.677   9.085  1.00  2.110          H  
ATOM    332 2HB  GLU A  22      -7.223  10.333   7.764  1.00  2.110          H  
ATOM    333 1HG  GLU A  22      -8.089  12.538   8.145  1.00  2.110          H  
ATOM    334 2HG  GLU A  22      -9.237  11.988   9.347  1.00  2.110          H  
ATOM    335  N   ASP A  23      -8.481  11.184   5.250  1.00  1.210          N  
ATOM    336  CA  ASP A  23      -8.424  12.224   4.231  1.00  1.270          C  
ATOM    337  C   ASP A  23      -9.772  12.392   3.525  1.00  1.030          C  
ATOM    338  O   ASP A  23     -10.276  13.516   3.360  1.00  1.150          O  
ATOM    339  CB  ASP A  23      -7.340  11.893   3.204  1.00  1.750          C  
ATOM    340  CG  ASP A  23      -7.139  12.986   2.152  1.00  1.750          C  
ATOM    341  OD1 ASP A  23      -6.647  14.033   2.475  1.00  1.750          O  
ATOM    342  OD2 ASP A  23      -7.537  12.769   1.012  1.00  1.750          O  
ATOM    343  H   ASP A  23      -7.836  10.386   5.198  1.00  1.450          H  
ATOM    344  HA  ASP A  23      -8.170  13.165   4.718  1.00  1.520          H  
ATOM    345 1HB  ASP A  23      -6.394  11.719   3.725  1.00  2.100          H  
ATOM    346 2HB  ASP A  23      -7.601  10.954   2.703  1.00  2.100          H  
ATOM    347  N   PHE A  24     -10.384  11.273   3.140  1.00  0.750          N  
ATOM    348  CA  PHE A  24     -11.643  11.344   2.435  1.00  0.610          C  
ATOM    349  C   PHE A  24     -12.748  11.854   3.364  1.00  0.520          C  
ATOM    350  O   PHE A  24     -13.657  12.564   2.918  1.00  0.560          O  
ATOM    351  CB  PHE A  24     -11.961  10.018   1.770  1.00  0.910          C  
ATOM    352  CG  PHE A  24     -13.072  10.121   0.795  1.00  0.910          C  
ATOM    353  CD1 PHE A  24     -12.941  10.871  -0.363  1.00  0.910          C  
ATOM    354  CD2 PHE A  24     -14.200   9.464   1.004  1.00  0.910          C  
ATOM    355  CE1 PHE A  24     -13.967  10.941  -1.266  1.00  0.910          C  
ATOM    356  CE2 PHE A  24     -15.246   9.509   0.118  1.00  0.910          C  
ATOM    357  CZ  PHE A  24     -15.124  10.253  -1.028  1.00  0.910          C  
ATOM    358  H   PHE A  24      -9.943  10.359   3.295  1.00  0.900          H  
ATOM    359  HA  PHE A  24     -11.532  12.072   1.636  1.00  0.730          H  
ATOM    360 1HB  PHE A  24     -11.075   9.638   1.256  1.00  1.090          H  
ATOM    361 2HB  PHE A  24     -12.228   9.287   2.541  1.00  1.090          H  
ATOM    362  HD1 PHE A  24     -12.017  11.403  -0.556  1.00  1.090          H  
ATOM    363  HD2 PHE A  24     -14.246   8.891   1.889  1.00  1.090          H  
ATOM    364  HE1 PHE A  24     -13.857  11.529  -2.171  1.00  1.090          H  
ATOM    365  HE2 PHE A  24     -16.166   8.957   0.312  1.00  1.090          H  
ATOM    366  HZ  PHE A  24     -15.944  10.291  -1.744  1.00  1.090          H  
ATOM    367  N   CYS A  25     -12.717  11.470   4.648  1.00  0.570          N  
ATOM    368  CA  CYS A  25     -13.719  11.952   5.589  1.00  0.640          C  
ATOM    369  C   CYS A  25     -13.659  13.460   5.680  1.00  0.690          C  
ATOM    370  O   CYS A  25     -14.703  14.104   5.676  1.00  0.640          O  
ATOM    371  CB  CYS A  25     -13.524  11.386   6.991  1.00  0.870          C  
ATOM    372  SG  CYS A  25     -13.883   9.651   7.135  1.00  0.870          S  
ATOM    373  H   CYS A  25     -11.989  10.831   4.964  1.00  0.680          H  
ATOM    374  HA  CYS A  25     -14.704  11.683   5.239  1.00  0.770          H  
ATOM    375 1HB  CYS A  25     -12.494  11.546   7.308  1.00  1.040          H  
ATOM    376 2HB  CYS A  25     -14.170  11.925   7.688  1.00  1.040          H  
ATOM    377  HG  CYS A  25     -12.781   9.262   6.449  1.00  1.040          H  
ATOM    378  N   TRP A  26     -12.455  14.047   5.694  1.00  0.910          N  
ATOM    379  CA  TRP A  26     -12.381  15.500   5.754  1.00  1.110          C  
ATOM    380  C   TRP A  26     -13.016  16.138   4.532  1.00  1.070          C  
ATOM    381  O   TRP A  26     -13.705  17.162   4.657  1.00  1.110          O  
ATOM    382  CB  TRP A  26     -10.950  15.989   5.932  1.00  1.470          C  
ATOM    383  CG  TRP A  26     -10.460  15.819   7.323  1.00  1.470          C  
ATOM    384  CD1 TRP A  26      -9.450  15.022   7.745  1.00  1.470          C  
ATOM    385  CD2 TRP A  26     -10.994  16.455   8.506  1.00  1.470          C  
ATOM    386  NE1 TRP A  26      -9.309  15.115   9.111  1.00  1.470          N  
ATOM    387  CE2 TRP A  26     -10.250  15.985   9.590  1.00  1.470          C  
ATOM    388  CE3 TRP A  26     -12.035  17.373   8.731  1.00  1.470          C  
ATOM    389  CZ2 TRP A  26     -10.509  16.393  10.882  1.00  1.470          C  
ATOM    390  CZ3 TRP A  26     -12.295  17.777  10.024  1.00  1.470          C  
ATOM    391  CH2 TRP A  26     -11.552  17.302  11.073  1.00  1.470          C  
ATOM    392  H   TRP A  26     -11.606  13.469   5.746  1.00  1.090          H  
ATOM    393  HA  TRP A  26     -12.945  15.821   6.615  1.00  1.330          H  
ATOM    394 1HB  TRP A  26     -10.293  15.425   5.264  1.00  1.770          H  
ATOM    395 2HB  TRP A  26     -10.883  17.034   5.661  1.00  1.770          H  
ATOM    396  HD1 TRP A  26      -8.842  14.397   7.094  1.00  1.770          H  
ATOM    397  HE1 TRP A  26      -8.595  14.588   9.678  1.00  1.770          H  
ATOM    398  HE3 TRP A  26     -12.630  17.758   7.904  1.00  1.770          H  
ATOM    399  HZ2 TRP A  26      -9.930  16.027  11.730  1.00  1.770          H  
ATOM    400  HZ3 TRP A  26     -13.105  18.486  10.189  1.00  1.770          H  
ATOM    401  HH2 TRP A  26     -11.785  17.642  12.081  1.00  1.770          H  
ATOM    402  N   LYS A  27     -12.812  15.537   3.356  1.00  1.060          N  
ATOM    403  CA  LYS A  27     -13.430  16.061   2.146  1.00  1.180          C  
ATOM    404  C   LYS A  27     -14.957  16.011   2.278  1.00  1.040          C  
ATOM    405  O   LYS A  27     -15.648  16.987   1.965  1.00  1.240          O  
ATOM    406  CB  LYS A  27     -12.977  15.266   0.915  1.00  1.600          C  
ATOM    407  CG  LYS A  27     -11.511  15.477   0.518  1.00  1.600          C  
ATOM    408  CD  LYS A  27     -11.142  14.677  -0.740  1.00  1.600          C  
ATOM    409  CE  LYS A  27      -9.704  14.977  -1.231  1.00  1.600          C  
ATOM    410  NZ  LYS A  27      -8.653  14.481  -0.281  1.00  1.600          N  
ATOM    411  H   LYS A  27     -12.171  14.732   3.323  1.00  1.270          H  
ATOM    412  HA  LYS A  27     -13.140  17.104   2.027  1.00  1.420          H  
ATOM    413 1HB  LYS A  27     -13.122  14.204   1.098  1.00  1.920          H  
ATOM    414 2HB  LYS A  27     -13.604  15.530   0.064  1.00  1.920          H  
ATOM    415 1HG  LYS A  27     -11.340  16.532   0.335  1.00  1.920          H  
ATOM    416 2HG  LYS A  27     -10.877  15.159   1.347  1.00  1.920          H  
ATOM    417 1HD  LYS A  27     -11.213  13.616  -0.513  1.00  1.920          H  
ATOM    418 2HD  LYS A  27     -11.846  14.906  -1.538  1.00  1.920          H  
ATOM    419 1HE  LYS A  27      -9.559  14.494  -2.197  1.00  1.920          H  
ATOM    420 2HE  LYS A  27      -9.585  16.053  -1.352  1.00  1.920          H  
ATOM    421 1HZ  LYS A  27      -7.730  14.675  -0.622  1.00  1.920          H  
ATOM    422 2HZ  LYS A  27      -8.753  14.925   0.624  1.00  1.920          H  
ATOM    423 3HZ  LYS A  27      -8.727  13.459  -0.157  1.00  1.920          H  
ATOM    424  N   LEU A  28     -15.478  14.899   2.813  1.00  0.760          N  
ATOM    425  CA  LEU A  28     -16.916  14.754   2.998  1.00  0.750          C  
ATOM    426  C   LEU A  28     -17.458  15.676   4.081  1.00  0.670          C  
ATOM    427  O   LEU A  28     -18.589  16.170   3.962  1.00  0.770          O  
ATOM    428  CB  LEU A  28     -17.263  13.294   3.308  1.00  1.050          C  
ATOM    429  CG  LEU A  28     -17.627  12.382   2.118  1.00  1.050          C  
ATOM    430  CD1 LEU A  28     -19.015  12.711   1.646  1.00  1.050          C  
ATOM    431  CD2 LEU A  28     -16.611  12.557   0.995  1.00  1.050          C  
ATOM    432  H   LEU A  28     -14.852  14.112   3.020  1.00  0.910          H  
ATOM    433  HA  LEU A  28     -17.397  15.039   2.075  1.00  0.900          H  
ATOM    434 1HB  LEU A  28     -16.421  12.843   3.831  1.00  1.260          H  
ATOM    435 2HB  LEU A  28     -18.122  13.297   3.966  1.00  1.260          H  
ATOM    436  HG  LEU A  28     -17.633  11.349   2.439  1.00  1.260          H  
ATOM    437 1HD1 LEU A  28     -19.285  12.051   0.827  1.00  1.260          H  
ATOM    438 2HD1 LEU A  28     -19.690  12.553   2.473  1.00  1.260          H  
ATOM    439 3HD1 LEU A  28     -19.079  13.740   1.313  1.00  1.260          H  
ATOM    440 1HD2 LEU A  28     -16.895  11.912   0.185  1.00  1.260          H  
ATOM    441 2HD2 LEU A  28     -16.582  13.566   0.630  1.00  1.260          H  
ATOM    442 3HD2 LEU A  28     -15.619  12.285   1.353  1.00  1.260          H  
ATOM    443  N   HIS A  29     -16.671  15.945   5.127  1.00  0.590          N  
ATOM    444  CA  HIS A  29     -17.144  16.831   6.177  1.00  0.690          C  
ATOM    445  C   HIS A  29     -17.336  18.227   5.594  1.00  0.760          C  
ATOM    446  O   HIS A  29     -18.346  18.878   5.869  1.00  0.800          O  
ATOM    447  CB  HIS A  29     -16.160  16.907   7.364  1.00  0.930          C  
ATOM    448  CG  HIS A  29     -16.083  15.659   8.235  1.00  0.930          C  
ATOM    449  ND1 HIS A  29     -17.195  15.096   8.823  1.00  0.930          N  
ATOM    450  CD2 HIS A  29     -15.024  14.906   8.644  1.00  0.930          C  
ATOM    451  CE1 HIS A  29     -16.825  14.044   9.537  1.00  0.930          C  
ATOM    452  NE2 HIS A  29     -15.518  13.911   9.446  1.00  0.930          N  
ATOM    453  H   HIS A  29     -15.776  15.468   5.211  1.00  0.710          H  
ATOM    454  HA  HIS A  29     -18.103  16.481   6.549  1.00  0.830          H  
ATOM    455 1HB  HIS A  29     -15.158  17.104   6.981  1.00  1.110          H  
ATOM    456 2HB  HIS A  29     -16.431  17.747   8.000  1.00  1.110          H  
ATOM    457  HD1 HIS A  29     -18.128  15.196   8.478  1.00  1.110          H  
ATOM    458  HD2 HIS A  29     -13.956  14.958   8.462  1.00  1.110          H  
ATOM    459  HE1 HIS A  29     -17.566  13.455  10.076  1.00  1.110          H  
ATOM    460  N   ARG A  30     -16.390  18.672   4.753  1.00  0.880          N  
ATOM    461  CA  ARG A  30     -16.479  19.976   4.095  1.00  1.070          C  
ATOM    462  C   ARG A  30     -17.663  20.053   3.127  1.00  1.140          C  
ATOM    463  O   ARG A  30     -18.352  21.071   3.055  1.00  1.270          O  
ATOM    464  CB  ARG A  30     -15.188  20.318   3.368  1.00  1.420          C  
ATOM    465  CG  ARG A  30     -14.018  20.676   4.286  1.00  1.420          C  
ATOM    466  CD  ARG A  30     -12.881  21.299   3.542  1.00  1.420          C  
ATOM    467  NE  ARG A  30     -12.213  20.368   2.624  1.00  1.420          N  
ATOM    468  CZ  ARG A  30     -11.180  19.549   2.950  1.00  1.420          C  
ATOM    469  NH1 ARG A  30     -10.690  19.531   4.174  1.00  1.420          N  
ATOM    470  NH2 ARG A  30     -10.651  18.771   2.025  1.00  1.420          N  
ATOM    471  H   ARG A  30     -15.557  18.089   4.605  1.00  1.060          H  
ATOM    472  HA  ARG A  30     -16.631  20.729   4.868  1.00  1.280          H  
ATOM    473 1HB  ARG A  30     -14.878  19.459   2.768  1.00  1.710          H  
ATOM    474 2HB  ARG A  30     -15.358  21.151   2.690  1.00  1.710          H  
ATOM    475 1HG  ARG A  30     -14.357  21.378   5.045  1.00  1.710          H  
ATOM    476 2HG  ARG A  30     -13.657  19.769   4.771  1.00  1.710          H  
ATOM    477 1HD  ARG A  30     -13.271  22.126   2.948  1.00  1.710          H  
ATOM    478 2HD  ARG A  30     -12.150  21.688   4.243  1.00  1.710          H  
ATOM    479  HE  ARG A  30     -12.540  20.345   1.667  1.00  1.710          H  
ATOM    480 1HH1 ARG A  30     -11.083  20.123   4.889  1.00  1.710          H  
ATOM    481 2HH1 ARG A  30      -9.903  18.939   4.393  1.00  1.710          H  
ATOM    482 1HH2 ARG A  30     -11.017  18.790   1.082  1.00  1.710          H  
ATOM    483 2HH2 ARG A  30      -9.881  18.158   2.256  1.00  1.710          H  
ATOM    484  N   ARG A  31     -17.900  18.957   2.392  1.00  1.140          N  
ATOM    485  CA  ARG A  31     -19.010  18.855   1.446  1.00  1.330          C  
ATOM    486  C   ARG A  31     -20.355  18.742   2.162  1.00  1.320          C  
ATOM    487  O   ARG A  31     -21.395  19.058   1.579  1.00  1.550          O  
ATOM    488  CB  ARG A  31     -18.859  17.623   0.565  1.00  1.790          C  
ATOM    489  CG  ARG A  31     -17.719  17.645  -0.434  1.00  1.790          C  
ATOM    490  CD  ARG A  31     -17.586  16.330  -1.108  1.00  1.790          C  
ATOM    491  NE  ARG A  31     -16.429  16.277  -1.986  1.00  1.790          N  
ATOM    492  CZ  ARG A  31     -16.011  15.179  -2.657  1.00  1.790          C  
ATOM    493  NH1 ARG A  31     -16.674  14.042  -2.563  1.00  1.790          N  
ATOM    494  NH2 ARG A  31     -14.931  15.252  -3.418  1.00  1.790          N  
ATOM    495  H   ARG A  31     -17.244  18.173   2.463  1.00  1.370          H  
ATOM    496  HA  ARG A  31     -19.017  19.746   0.823  1.00  1.600          H  
ATOM    497 1HB  ARG A  31     -18.725  16.758   1.200  1.00  2.140          H  
ATOM    498 2HB  ARG A  31     -19.781  17.469   0.008  1.00  2.140          H  
ATOM    499 1HG  ARG A  31     -17.932  18.392  -1.196  1.00  2.140          H  
ATOM    500 2HG  ARG A  31     -16.789  17.895   0.052  1.00  2.140          H  
ATOM    501 1HD  ARG A  31     -17.477  15.560  -0.352  1.00  2.140          H  
ATOM    502 2HD  ARG A  31     -18.479  16.140  -1.701  1.00  2.140          H  
ATOM    503  HE  ARG A  31     -15.889  17.128  -2.094  1.00  2.140          H  
ATOM    504 1HH1 ARG A  31     -17.508  13.986  -1.997  1.00  2.140          H  
ATOM    505 2HH1 ARG A  31     -16.362  13.230  -3.076  1.00  2.140          H  
ATOM    506 1HH2 ARG A  31     -14.425  16.125  -3.494  1.00  2.140          H  
ATOM    507 2HH2 ARG A  31     -14.612  14.442  -3.927  1.00  2.140          H  
ATOM    508  N   GLU A  32     -20.311  18.282   3.419  1.00  1.140          N  
ATOM    509  CA  GLU A  32     -21.455  17.980   4.269  1.00  1.250          C  
ATOM    510  C   GLU A  32     -22.241  16.822   3.669  1.00  1.380          C  
ATOM    511  O   GLU A  32     -23.473  16.832   3.619  1.00  1.660          O  
ATOM    512  CB  GLU A  32     -22.363  19.208   4.469  1.00  1.710          C  
ATOM    513  CG  GLU A  32     -21.692  20.403   5.158  1.00  1.710          C  
ATOM    514  CD  GLU A  32     -22.655  21.547   5.401  1.00  1.710          C  
ATOM    515  OE1 GLU A  32     -23.685  21.556   4.772  1.00  1.710          O  
ATOM    516  OE2 GLU A  32     -22.371  22.394   6.218  1.00  1.710          O  
ATOM    517  H   GLU A  32     -19.399  18.039   3.805  1.00  1.370          H  
ATOM    518  HA  GLU A  32     -21.078  17.668   5.244  1.00  1.500          H  
ATOM    519 1HB  GLU A  32     -22.764  19.545   3.521  1.00  2.050          H  
ATOM    520 2HB  GLU A  32     -23.213  18.920   5.085  1.00  2.050          H  
ATOM    521 1HG  GLU A  32     -21.274  20.075   6.109  1.00  2.050          H  
ATOM    522 2HG  GLU A  32     -20.865  20.749   4.534  1.00  2.050          H  
ATOM    523  N   GLY A  33     -21.494  15.821   3.202  1.00  1.220          N  
ATOM    524  CA  GLY A  33     -22.067  14.618   2.623  1.00  1.370          C  
ATOM    525  C   GLY A  33     -22.147  13.493   3.647  1.00  1.390          C  
ATOM    526  O   GLY A  33     -22.004  13.718   4.851  1.00  1.370          O  
ATOM    527  H   GLY A  33     -20.479  15.910   3.312  1.00  1.460          H  
ATOM    528 1HA  GLY A  33     -23.065  14.840   2.246  1.00  1.640          H  
ATOM    529 2HA  GLY A  33     -21.472  14.304   1.768  1.00  1.640          H  
ATOM    530  N   ALA A  34     -22.374  12.273   3.162  1.00  1.550          N  
ATOM    531  CA  ALA A  34     -22.491  11.115   4.037  1.00  1.680          C  
ATOM    532  C   ALA A  34     -21.166  10.375   4.173  1.00  1.380          C  
ATOM    533  O   ALA A  34     -20.768   9.618   3.274  1.00  1.280          O  
ATOM    534  CB  ALA A  34     -23.548  10.158   3.518  1.00  2.300          C  
ATOM    535  H   ALA A  34     -22.478  12.155   2.165  1.00  1.860          H  
ATOM    536  HA  ALA A  34     -22.786  11.468   5.023  1.00  2.020          H  
ATOM    537 1HB  ALA A  34     -23.644   9.311   4.198  1.00  2.760          H  
ATOM    538 2HB  ALA A  34     -24.505  10.677   3.451  1.00  2.760          H  
ATOM    539 3HB  ALA A  34     -23.264   9.795   2.531  1.00  2.760          H  
ATOM    540  N   CYS A  35     -20.529  10.506   5.348  1.00  1.540          N  
ATOM    541  CA  CYS A  35     -19.208   9.912   5.596  1.00  1.580          C  
ATOM    542  C   CYS A  35     -19.289   8.403   5.778  1.00  1.600          C  
ATOM    543  O   CYS A  35     -18.282   7.706   5.885  1.00  1.680          O  
ATOM    544  CB  CYS A  35     -18.527  10.523   6.821  1.00  2.200          C  
ATOM    545  SG  CYS A  35     -18.030  12.241   6.614  1.00  2.200          S  
ATOM    546  H   CYS A  35     -20.939  11.116   6.050  1.00  1.850          H  
ATOM    547  HA  CYS A  35     -18.598  10.128   4.731  1.00  1.900          H  
ATOM    548 1HB  CYS A  35     -19.194  10.464   7.678  1.00  2.640          H  
ATOM    549 2HB  CYS A  35     -17.632   9.948   7.059  1.00  2.640          H  
ATOM    550  HG  CYS A  35     -17.243  12.032   5.561  1.00  2.640          H  
ATOM    551  N   VAL A  36     -20.503   7.902   5.722  1.00  1.730          N  
ATOM    552  CA  VAL A  36     -20.825   6.503   5.841  1.00  2.150          C  
ATOM    553  C   VAL A  36     -20.073   5.708   4.790  1.00  2.090          C  
ATOM    554  O   VAL A  36     -19.615   4.596   5.056  1.00  2.530          O  
ATOM    555  CB  VAL A  36     -22.346   6.310   5.646  1.00  2.840          C  
ATOM    556  CG1 VAL A  36     -22.697   4.824   5.555  1.00  2.840          C  
ATOM    557  CG2 VAL A  36     -23.081   6.981   6.803  1.00  2.840          C  
ATOM    558  H   VAL A  36     -21.250   8.565   5.621  1.00  2.080          H  
ATOM    559  HA  VAL A  36     -20.533   6.153   6.832  1.00  2.580          H  
ATOM    560  HB  VAL A  36     -22.649   6.771   4.704  1.00  3.410          H  
ATOM    561 1HG1 VAL A  36     -23.769   4.715   5.412  1.00  3.410          H  
ATOM    562 2HG1 VAL A  36     -22.183   4.356   4.713  1.00  3.410          H  
ATOM    563 3HG1 VAL A  36     -22.400   4.322   6.477  1.00  3.410          H  
ATOM    564 1HG2 VAL A  36     -24.157   6.862   6.669  1.00  3.410          H  
ATOM    565 2HG2 VAL A  36     -22.777   6.515   7.740  1.00  3.410          H  
ATOM    566 3HG2 VAL A  36     -22.840   8.039   6.835  1.00  3.410          H  
ATOM    567  N   ASN A  37     -19.962   6.255   3.580  1.00  1.760          N  
ATOM    568  CA  ASN A  37     -19.323   5.525   2.505  1.00  2.000          C  
ATOM    569  C   ASN A  37     -17.847   5.890   2.312  1.00  1.610          C  
ATOM    570  O   ASN A  37     -17.247   5.546   1.281  1.00  1.590          O  
ATOM    571  CB  ASN A  37     -20.110   5.724   1.233  1.00  2.700          C  
ATOM    572  CG  ASN A  37     -21.476   5.092   1.324  1.00  2.700          C  
ATOM    573  OD1 ASN A  37     -21.667   4.016   1.904  1.00  2.700          O  
ATOM    574  ND2 ASN A  37     -22.453   5.768   0.770  1.00  2.700          N  
ATOM    575  H   ASN A  37     -20.326   7.200   3.401  1.00  2.110          H  
ATOM    576  HA  ASN A  37     -19.353   4.461   2.753  1.00  2.400          H  
ATOM    577 1HB  ASN A  37     -20.220   6.790   1.033  1.00  3.240          H  
ATOM    578 2HB  ASN A  37     -19.571   5.278   0.395  1.00  3.240          H  
ATOM    579 1HD2 ASN A  37     -23.388   5.413   0.800  1.00  3.240          H  
ATOM    580 2HD2 ASN A  37     -22.263   6.653   0.341  1.00  3.240          H  
ATOM    581  N   CYS A  38     -17.237   6.587   3.284  1.00  1.350          N  
ATOM    582  CA  CYS A  38     -15.837   6.928   3.120  1.00  0.980          C  
ATOM    583  C   CYS A  38     -14.949   5.706   3.097  1.00  0.960          C  
ATOM    584  O   CYS A  38     -13.938   5.691   2.392  1.00  0.800          O  
ATOM    585  CB  CYS A  38     -15.342   7.896   4.194  1.00  1.520          C  
ATOM    586  SG  CYS A  38     -15.983   9.569   4.022  1.00  1.520          S  
ATOM    587  H   CYS A  38     -17.733   6.872   4.137  1.00  1.620          H  
ATOM    588  HA  CYS A  38     -15.746   7.415   2.161  1.00  1.180          H  
ATOM    589 1HB  CYS A  38     -15.641   7.521   5.175  1.00  1.820          H  
ATOM    590 2HB  CYS A  38     -14.248   7.945   4.185  1.00  1.820          H  
ATOM    591  HG  CYS A  38     -15.241   9.931   2.971  1.00  1.820          H  
ATOM    592  N   GLU A  39     -15.304   4.674   3.866  1.00  1.200          N  
ATOM    593  CA  GLU A  39     -14.491   3.471   3.883  1.00  1.260          C  
ATOM    594  C   GLU A  39     -14.421   2.851   2.506  1.00  1.220          C  
ATOM    595  O   GLU A  39     -13.346   2.458   2.057  1.00  1.180          O  
ATOM    596  CB  GLU A  39     -15.022   2.459   4.880  1.00  1.740          C  
ATOM    597  CG  GLU A  39     -14.187   1.195   4.967  1.00  1.740          C  
ATOM    598  CD  GLU A  39     -14.640   0.275   6.053  1.00  1.740          C  
ATOM    599  OE1 GLU A  39     -15.660   0.535   6.630  1.00  1.740          O  
ATOM    600  OE2 GLU A  39     -13.930  -0.676   6.348  1.00  1.740          O  
ATOM    601  H   GLU A  39     -16.137   4.742   4.434  1.00  1.440          H  
ATOM    602  HA  GLU A  39     -13.490   3.734   4.179  1.00  1.510          H  
ATOM    603 1HB  GLU A  39     -15.057   2.907   5.874  1.00  2.090          H  
ATOM    604 2HB  GLU A  39     -16.042   2.175   4.611  1.00  2.090          H  
ATOM    605 1HG  GLU A  39     -14.253   0.666   4.018  1.00  2.090          H  
ATOM    606 2HG  GLU A  39     -13.155   1.468   5.114  1.00  2.090          H  
ATOM    607  N   MET A  40     -15.560   2.784   1.821  1.00  1.310          N  
ATOM    608  CA  MET A  40     -15.611   2.191   0.493  1.00  1.380          C  
ATOM    609  C   MET A  40     -14.735   2.953  -0.487  1.00  1.170          C  
ATOM    610  O   MET A  40     -13.971   2.357  -1.254  1.00  1.140          O  
ATOM    611  CB  MET A  40     -17.045   2.180  -0.004  1.00  1.900          C  
ATOM    612  CG  MET A  40     -17.968   1.222   0.739  1.00  1.900          C  
ATOM    613  SD  MET A  40     -19.704   1.389   0.255  1.00  1.900          S  
ATOM    614  CE  MET A  40     -19.724   0.711  -1.409  1.00  1.900          C  
ATOM    615  H   MET A  40     -16.410   3.119   2.257  1.00  1.570          H  
ATOM    616  HA  MET A  40     -15.235   1.167   0.554  1.00  1.660          H  
ATOM    617 1HB  MET A  40     -17.460   3.186   0.089  1.00  2.280          H  
ATOM    618 2HB  MET A  40     -17.050   1.924  -1.061  1.00  2.280          H  
ATOM    619 1HG  MET A  40     -17.646   0.195   0.552  1.00  2.280          H  
ATOM    620 2HG  MET A  40     -17.890   1.409   1.812  1.00  2.280          H  
ATOM    621 1HE  MET A  40     -20.742   0.756  -1.800  1.00  2.280          H  
ATOM    622 2HE  MET A  40     -19.072   1.292  -2.054  1.00  2.280          H  
ATOM    623 3HE  MET A  40     -19.388  -0.328  -1.387  1.00  2.280          H  
ATOM    624  N   HIS A  41     -14.819   4.284  -0.445  1.00  1.070          N  
ATOM    625  CA  HIS A  41     -14.010   5.087  -1.344  1.00  0.990          C  
ATOM    626  C   HIS A  41     -12.534   4.851  -1.064  1.00  0.770          C  
ATOM    627  O   HIS A  41     -11.739   4.620  -1.992  1.00  0.800          O  
ATOM    628  CB  HIS A  41     -14.278   6.570  -1.189  1.00  1.420          C  
ATOM    629  CG  HIS A  41     -13.507   7.369  -2.179  1.00  1.420          C  
ATOM    630  ND1 HIS A  41     -13.935   7.558  -3.480  1.00  1.420          N  
ATOM    631  CD2 HIS A  41     -12.316   7.975  -2.085  1.00  1.420          C  
ATOM    632  CE1 HIS A  41     -13.031   8.266  -4.132  1.00  1.420          C  
ATOM    633  NE2 HIS A  41     -12.038   8.525  -3.311  1.00  1.420          N  
ATOM    634  H   HIS A  41     -15.481   4.739   0.191  1.00  1.280          H  
ATOM    635  HA  HIS A  41     -14.211   4.803  -2.375  1.00  1.190          H  
ATOM    636 1HB  HIS A  41     -15.335   6.773  -1.313  1.00  1.700          H  
ATOM    637 2HB  HIS A  41     -14.002   6.873  -0.192  1.00  1.700          H  
ATOM    638  HD2 HIS A  41     -11.681   8.005  -1.205  1.00  1.700          H  
ATOM    639  HE1 HIS A  41     -13.092   8.564  -5.178  1.00  1.700          H  
ATOM    640  HE2 HIS A  41     -11.162   9.047  -3.521  1.00  1.700          H  
ATOM    641  N   ALA A  42     -12.164   4.934   0.221  1.00  0.640          N  
ATOM    642  CA  ALA A  42     -10.788   4.781   0.628  1.00  0.560          C  
ATOM    643  C   ALA A  42     -10.235   3.446   0.184  1.00  0.590          C  
ATOM    644  O   ALA A  42      -9.126   3.387  -0.338  1.00  0.630          O  
ATOM    645  CB  ALA A  42     -10.693   4.895   2.129  1.00  0.820          C  
ATOM    646  H   ALA A  42     -12.871   5.126   0.940  1.00  0.770          H  
ATOM    647  HA  ALA A  42     -10.199   5.570   0.157  1.00  0.670          H  
ATOM    648 1HB  ALA A  42      -9.677   4.788   2.450  1.00  0.980          H  
ATOM    649 2HB  ALA A  42     -11.076   5.865   2.436  1.00  0.980          H  
ATOM    650 3HB  ALA A  42     -11.293   4.110   2.573  1.00  0.980          H  
ATOM    651  N   LEU A  43     -11.032   2.383   0.306  1.00  0.710          N  
ATOM    652  CA  LEU A  43     -10.558   1.086  -0.114  1.00  0.780          C  
ATOM    653  C   LEU A  43     -10.287   1.057  -1.606  1.00  0.730          C  
ATOM    654  O   LEU A  43      -9.250   0.531  -2.021  1.00  0.750          O  
ATOM    655  CB  LEU A  43     -11.570   0.018   0.258  1.00  1.060          C  
ATOM    656  CG  LEU A  43     -11.726  -0.304   1.769  1.00  1.060          C  
ATOM    657  CD1 LEU A  43     -12.941  -1.203   1.950  1.00  1.060          C  
ATOM    658  CD2 LEU A  43     -10.471  -0.996   2.291  1.00  1.060          C  
ATOM    659  H   LEU A  43     -11.946   2.472   0.760  1.00  0.850          H  
ATOM    660  HA  LEU A  43      -9.630   0.882   0.392  1.00  0.940          H  
ATOM    661 1HB  LEU A  43     -12.542   0.327  -0.125  1.00  1.280          H  
ATOM    662 2HB  LEU A  43     -11.278  -0.870  -0.234  1.00  1.280          H  
ATOM    663  HG  LEU A  43     -11.879   0.605   2.332  1.00  1.280          H  
ATOM    664 1HD1 LEU A  43     -13.067  -1.436   3.007  1.00  1.280          H  
ATOM    665 2HD1 LEU A  43     -13.832  -0.692   1.586  1.00  1.280          H  
ATOM    666 3HD1 LEU A  43     -12.805  -2.122   1.389  1.00  1.280          H  
ATOM    667 1HD2 LEU A  43     -10.610  -1.230   3.335  1.00  1.280          H  
ATOM    668 2HD2 LEU A  43     -10.311  -1.894   1.757  1.00  1.280          H  
ATOM    669 3HD2 LEU A  43      -9.601  -0.359   2.186  1.00  1.280          H  
ATOM    670  N   ASN A  44     -11.139   1.682  -2.418  1.00  0.810          N  
ATOM    671  CA  ASN A  44     -10.850   1.698  -3.844  1.00  0.930          C  
ATOM    672  C   ASN A  44      -9.557   2.464  -4.161  1.00  0.880          C  
ATOM    673  O   ASN A  44      -8.791   2.030  -5.028  1.00  1.030          O  
ATOM    674  CB  ASN A  44     -12.031   2.237  -4.627  1.00  1.250          C  
ATOM    675  CG  ASN A  44     -13.145   1.227  -4.701  1.00  1.250          C  
ATOM    676  OD1 ASN A  44     -12.924   0.026  -4.511  1.00  1.250          O  
ATOM    677  ND2 ASN A  44     -14.336   1.684  -4.970  1.00  1.250          N  
ATOM    678  H   ASN A  44     -12.019   2.075  -2.046  1.00  0.970          H  
ATOM    679  HA  ASN A  44     -10.694   0.668  -4.164  1.00  1.120          H  
ATOM    680 1HB  ASN A  44     -12.404   3.146  -4.142  1.00  1.500          H  
ATOM    681 2HB  ASN A  44     -11.716   2.499  -5.634  1.00  1.500          H  
ATOM    682 1HD2 ASN A  44     -15.108   1.050  -5.023  1.00  1.500          H  
ATOM    683 2HD2 ASN A  44     -14.482   2.665  -5.108  1.00  1.500          H  
ATOM    684  N   GLU A  45      -9.284   3.579  -3.464  1.00  0.750          N  
ATOM    685  CA  GLU A  45      -8.020   4.295  -3.702  1.00  0.860          C  
ATOM    686  C   GLU A  45      -6.822   3.418  -3.309  1.00  0.800          C  
ATOM    687  O   GLU A  45      -5.788   3.412  -3.993  1.00  0.890          O  
ATOM    688  CB  GLU A  45      -7.975   5.648  -2.983  1.00  1.160          C  
ATOM    689  CG  GLU A  45      -8.908   6.714  -3.600  1.00  1.160          C  
ATOM    690  CD  GLU A  45      -8.874   8.065  -2.897  1.00  1.160          C  
ATOM    691  OE1 GLU A  45      -8.375   8.117  -1.813  1.00  1.160          O  
ATOM    692  OE2 GLU A  45      -9.349   9.039  -3.459  1.00  1.160          O  
ATOM    693  H   GLU A  45      -9.989   3.937  -2.805  1.00  0.900          H  
ATOM    694  HA  GLU A  45      -7.944   4.497  -4.774  1.00  1.030          H  
ATOM    695 1HB  GLU A  45      -8.262   5.503  -1.940  1.00  1.390          H  
ATOM    696 2HB  GLU A  45      -6.961   6.029  -2.999  1.00  1.390          H  
ATOM    697 1HG  GLU A  45      -8.647   6.843  -4.646  1.00  1.390          H  
ATOM    698 2HG  GLU A  45      -9.927   6.329  -3.557  1.00  1.390          H  
ATOM    699  N   ILE A  46      -6.986   2.649  -2.229  1.00  0.740          N  
ATOM    700  CA  ILE A  46      -5.971   1.716  -1.759  1.00  0.870          C  
ATOM    701  C   ILE A  46      -5.736   0.646  -2.831  1.00  0.870          C  
ATOM    702  O   ILE A  46      -4.583   0.304  -3.117  1.00  0.970          O  
ATOM    703  CB  ILE A  46      -6.378   1.107  -0.406  1.00  1.170          C  
ATOM    704  CG1 ILE A  46      -6.342   2.202   0.619  1.00  1.170          C  
ATOM    705  CG2 ILE A  46      -5.433  -0.009  -0.034  1.00  1.170          C  
ATOM    706  CD1 ILE A  46      -7.002   1.915   1.932  1.00  1.170          C  
ATOM    707  H   ILE A  46      -7.845   2.772  -1.686  1.00  0.890          H  
ATOM    708  HA  ILE A  46      -5.042   2.261  -1.611  1.00  1.040          H  
ATOM    709  HB  ILE A  46      -7.383   0.728  -0.459  1.00  1.400          H  
ATOM    710 1HG1 ILE A  46      -5.317   2.414   0.794  1.00  1.400          H  
ATOM    711 2HG1 ILE A  46      -6.798   3.080   0.195  1.00  1.400          H  
ATOM    712 1HG2 ILE A  46      -5.704  -0.444   0.922  1.00  1.400          H  
ATOM    713 2HG2 ILE A  46      -5.497  -0.759  -0.789  1.00  1.400          H  
ATOM    714 3HG2 ILE A  46      -4.411   0.369   0.022  1.00  1.400          H  
ATOM    715 1HD1 ILE A  46      -6.886   2.783   2.553  1.00  1.400          H  
ATOM    716 2HD1 ILE A  46      -8.056   1.723   1.785  1.00  1.400          H  
ATOM    717 3HD1 ILE A  46      -6.546   1.062   2.418  1.00  1.400          H  
ATOM    718  N   GLN A  47      -6.823   0.104  -3.406  1.00  0.810          N  
ATOM    719  CA  GLN A  47      -6.713  -0.875  -4.481  1.00  0.850          C  
ATOM    720  C   GLN A  47      -5.882  -0.334  -5.627  1.00  0.800          C  
ATOM    721  O   GLN A  47      -5.027  -1.061  -6.157  1.00  0.860          O  
ATOM    722  CB  GLN A  47      -8.082  -1.264  -5.047  1.00  1.170          C  
ATOM    723  CG  GLN A  47      -8.018  -2.242  -6.222  1.00  1.170          C  
ATOM    724  CD  GLN A  47      -9.360  -2.660  -6.723  1.00  1.170          C  
ATOM    725  OE1 GLN A  47     -10.368  -1.986  -6.495  1.00  1.170          O  
ATOM    726  NE2 GLN A  47      -9.389  -3.788  -7.419  1.00  1.170          N  
ATOM    727  H   GLN A  47      -7.748   0.387  -3.063  1.00  0.970          H  
ATOM    728  HA  GLN A  47      -6.226  -1.761  -4.088  1.00  1.020          H  
ATOM    729 1HB  GLN A  47      -8.706  -1.676  -4.269  1.00  1.410          H  
ATOM    730 2HB  GLN A  47      -8.578  -0.380  -5.409  1.00  1.410          H  
ATOM    731 1HG  GLN A  47      -7.523  -1.743  -7.056  1.00  1.410          H  
ATOM    732 2HG  GLN A  47      -7.455  -3.110  -5.959  1.00  1.410          H  
ATOM    733 1HE2 GLN A  47     -10.256  -4.133  -7.795  1.00  1.410          H  
ATOM    734 2HE2 GLN A  47      -8.545  -4.304  -7.587  1.00  1.410          H  
ATOM    735  N   GLU A  48      -6.129   0.924  -6.035  1.00  0.740          N  
ATOM    736  CA  GLU A  48      -5.351   1.496  -7.125  1.00  0.760          C  
ATOM    737  C   GLU A  48      -3.874   1.569  -6.772  1.00  0.790          C  
ATOM    738  O   GLU A  48      -3.039   1.242  -7.610  1.00  0.850          O  
ATOM    739  CB  GLU A  48      -5.848   2.888  -7.522  1.00  1.060          C  
ATOM    740  CG  GLU A  48      -7.204   2.910  -8.225  1.00  1.060          C  
ATOM    741  CD  GLU A  48      -7.648   4.306  -8.601  1.00  1.060          C  
ATOM    742  OE1 GLU A  48      -6.985   5.240  -8.213  1.00  1.060          O  
ATOM    743  OE2 GLU A  48      -8.641   4.436  -9.277  1.00  1.060          O  
ATOM    744  H   GLU A  48      -6.902   1.451  -5.602  1.00  0.890          H  
ATOM    745  HA  GLU A  48      -5.463   0.846  -7.992  1.00  0.910          H  
ATOM    746 1HB  GLU A  48      -5.922   3.511  -6.632  1.00  1.270          H  
ATOM    747 2HB  GLU A  48      -5.116   3.354  -8.186  1.00  1.270          H  
ATOM    748 1HG  GLU A  48      -7.144   2.305  -9.130  1.00  1.270          H  
ATOM    749 2HG  GLU A  48      -7.947   2.460  -7.569  1.00  1.270          H  
ATOM    750  N   VAL A  49      -3.547   1.936  -5.525  1.00  0.810          N  
ATOM    751  CA  VAL A  49      -2.140   1.991  -5.130  1.00  0.900          C  
ATOM    752  C   VAL A  49      -1.508   0.607  -5.178  1.00  0.910          C  
ATOM    753  O   VAL A  49      -0.392   0.460  -5.689  1.00  0.990          O  
ATOM    754  CB  VAL A  49      -1.964   2.597  -3.722  1.00  1.220          C  
ATOM    755  CG1 VAL A  49      -0.503   2.445  -3.246  1.00  1.220          C  
ATOM    756  CG2 VAL A  49      -2.320   4.057  -3.776  1.00  1.220          C  
ATOM    757  H   VAL A  49      -4.294   2.251  -4.895  1.00  0.970          H  
ATOM    758  HA  VAL A  49      -1.613   2.630  -5.832  1.00  1.080          H  
ATOM    759  HB  VAL A  49      -2.615   2.078  -3.014  1.00  1.470          H  
ATOM    760 1HG1 VAL A  49      -0.398   2.888  -2.270  1.00  1.470          H  
ATOM    761 2HG1 VAL A  49      -0.218   1.400  -3.195  1.00  1.470          H  
ATOM    762 3HG1 VAL A  49       0.156   2.955  -3.946  1.00  1.470          H  
ATOM    763 1HG2 VAL A  49      -2.193   4.483  -2.800  1.00  1.470          H  
ATOM    764 2HG2 VAL A  49      -1.665   4.564  -4.482  1.00  1.470          H  
ATOM    765 3HG2 VAL A  49      -3.354   4.173  -4.095  1.00  1.470          H  
ATOM    766  N   PHE A  50      -2.201  -0.409  -4.651  1.00  0.880          N  
ATOM    767  CA  PHE A  50      -1.653  -1.753  -4.676  1.00  0.980          C  
ATOM    768  C   PHE A  50      -1.378  -2.173  -6.114  1.00  0.940          C  
ATOM    769  O   PHE A  50      -0.277  -2.667  -6.422  1.00  1.050          O  
ATOM    770  CB  PHE A  50      -2.654  -2.768  -4.065  1.00  1.330          C  
ATOM    771  CG  PHE A  50      -2.808  -2.804  -2.529  1.00  1.330          C  
ATOM    772  CD1 PHE A  50      -4.057  -3.001  -1.954  1.00  1.330          C  
ATOM    773  CD2 PHE A  50      -1.730  -2.680  -1.679  1.00  1.330          C  
ATOM    774  CE1 PHE A  50      -4.213  -3.071  -0.587  1.00  1.330          C  
ATOM    775  CE2 PHE A  50      -1.889  -2.740  -0.300  1.00  1.330          C  
ATOM    776  CZ  PHE A  50      -3.126  -2.931   0.242  1.00  1.330          C  
ATOM    777  H   PHE A  50      -3.111  -0.224  -4.211  1.00  1.060          H  
ATOM    778  HA  PHE A  50      -0.713  -1.763  -4.131  1.00  1.180          H  
ATOM    779 1HB  PHE A  50      -3.639  -2.556  -4.481  1.00  1.600          H  
ATOM    780 2HB  PHE A  50      -2.391  -3.769  -4.398  1.00  1.600          H  
ATOM    781  HD1 PHE A  50      -4.920  -3.102  -2.585  1.00  1.600          H  
ATOM    782  HD2 PHE A  50      -0.754  -2.548  -2.097  1.00  1.600          H  
ATOM    783  HE1 PHE A  50      -5.203  -3.231  -0.158  1.00  1.600          H  
ATOM    784  HE2 PHE A  50      -1.033  -2.656   0.355  1.00  1.600          H  
ATOM    785  HZ  PHE A  50      -3.251  -2.988   1.326  1.00  1.600          H  
ATOM    786  N   THR A  51      -2.343  -1.888  -7.000  1.00  0.860          N  
ATOM    787  CA  THR A  51      -2.287  -2.251  -8.406  1.00  0.910          C  
ATOM    788  C   THR A  51      -1.102  -1.587  -9.101  1.00  0.950          C  
ATOM    789  O   THR A  51      -0.356  -2.245  -9.835  1.00  1.040          O  
ATOM    790  CB  THR A  51      -3.598  -1.816  -9.111  1.00  1.250          C  
ATOM    791  OG1 THR A  51      -4.723  -2.483  -8.495  1.00  1.250          O  
ATOM    792  CG2 THR A  51      -3.556  -2.173 -10.594  1.00  1.250          C  
ATOM    793  H   THR A  51      -3.203  -1.454  -6.663  1.00  1.030          H  
ATOM    794  HA  THR A  51      -2.177  -3.333  -8.480  1.00  1.090          H  
ATOM    795  HB  THR A  51      -3.725  -0.746  -9.008  1.00  1.500          H  
ATOM    796  HG1 THR A  51      -4.833  -2.124  -7.586  1.00  1.500          H  
ATOM    797 1HG2 THR A  51      -4.488  -1.860 -11.061  1.00  1.500          H  
ATOM    798 2HG2 THR A  51      -2.725  -1.665 -11.082  1.00  1.500          H  
ATOM    799 3HG2 THR A  51      -3.437  -3.249 -10.704  1.00  1.500          H  
ATOM    800  N   LEU A  52      -0.919  -0.288  -8.860  1.00  0.960          N  
ATOM    801  CA  LEU A  52       0.169   0.490  -9.438  1.00  1.050          C  
ATOM    802  C   LEU A  52       1.529  -0.001  -8.977  1.00  1.170          C  
ATOM    803  O   LEU A  52       2.485  -0.013  -9.754  1.00  1.300          O  
ATOM    804  CB  LEU A  52       0.002   1.964  -9.056  1.00  1.430          C  
ATOM    805  CG  LEU A  52      -1.187   2.725  -9.702  1.00  1.430          C  
ATOM    806  CD1 LEU A  52      -1.349   4.063  -8.994  1.00  1.430          C  
ATOM    807  CD2 LEU A  52      -0.933   2.940 -11.196  1.00  1.430          C  
ATOM    808  H   LEU A  52      -1.601   0.196  -8.269  1.00  1.150          H  
ATOM    809  HA  LEU A  52       0.128   0.377 -10.517  1.00  1.260          H  
ATOM    810 1HB  LEU A  52      -0.135   2.008  -7.973  1.00  1.720          H  
ATOM    811 2HB  LEU A  52       0.920   2.490  -9.303  1.00  1.720          H  
ATOM    812  HG  LEU A  52      -2.097   2.157  -9.586  1.00  1.720          H  
ATOM    813 1HD1 LEU A  52      -2.188   4.606  -9.430  1.00  1.720          H  
ATOM    814 2HD1 LEU A  52      -1.544   3.891  -7.937  1.00  1.720          H  
ATOM    815 3HD1 LEU A  52      -0.439   4.650  -9.107  1.00  1.720          H  
ATOM    816 1HD2 LEU A  52      -1.775   3.481 -11.627  1.00  1.720          H  
ATOM    817 2HD2 LEU A  52      -0.021   3.519 -11.331  1.00  1.720          H  
ATOM    818 3HD2 LEU A  52      -0.833   1.988 -11.705  1.00  1.720          H  
ATOM    819  N   HIS A  53       1.620  -0.408  -7.707  1.00  1.170          N  
ATOM    820  CA  HIS A  53       2.877  -0.909  -7.174  1.00  1.330          C  
ATOM    821  C   HIS A  53       3.178  -2.335  -7.669  1.00  1.330          C  
ATOM    822  O   HIS A  53       4.346  -2.729  -7.736  1.00  1.440          O  
ATOM    823  CB  HIS A  53       2.896  -0.845  -5.643  1.00  1.800          C  
ATOM    824  CG  HIS A  53       2.932   0.570  -5.100  1.00  1.800          C  
ATOM    825  ND1 HIS A  53       3.261   0.852  -3.794  1.00  1.800          N  
ATOM    826  CD2 HIS A  53       2.660   1.766  -5.684  1.00  1.800          C  
ATOM    827  CE1 HIS A  53       3.189   2.158  -3.597  1.00  1.800          C  
ATOM    828  NE2 HIS A  53       2.830   2.732  -4.725  1.00  1.800          N  
ATOM    829  H   HIS A  53       0.808  -0.315  -7.086  1.00  1.400          H  
ATOM    830  HA  HIS A  53       3.687  -0.273  -7.526  1.00  1.600          H  
ATOM    831 1HB  HIS A  53       1.992  -1.331  -5.256  1.00  2.160          H  
ATOM    832 2HB  HIS A  53       3.753  -1.391  -5.261  1.00  2.160          H  
ATOM    833  HD1 HIS A  53       3.874   0.281  -3.244  1.00  2.160          H  
ATOM    834  HD2 HIS A  53       2.354   2.057  -6.688  1.00  2.160          H  
ATOM    835  HE1 HIS A  53       3.414   2.581  -2.616  1.00  2.160          H  
ATOM    836  N   GLY A  54       2.141  -3.097  -8.053  1.00  1.250          N  
ATOM    837  CA  GLY A  54       2.335  -4.448  -8.577  1.00  1.340          C  
ATOM    838  C   GLY A  54       1.673  -5.581  -7.788  1.00  1.280          C  
ATOM    839  O   GLY A  54       1.948  -6.756  -8.046  1.00  1.450          O  
ATOM    840  H   GLY A  54       1.184  -2.759  -7.929  1.00  1.500          H  
ATOM    841 1HA  GLY A  54       1.951  -4.467  -9.597  1.00  1.610          H  
ATOM    842 2HA  GLY A  54       3.401  -4.646  -8.652  1.00  1.610          H  
ATOM    843  N   MET A  55       0.825  -5.251  -6.820  1.00  1.140          N  
ATOM    844  CA  MET A  55       0.136  -6.262  -6.033  1.00  1.160          C  
ATOM    845  C   MET A  55      -1.337  -6.352  -6.356  1.00  1.140          C  
ATOM    846  O   MET A  55      -1.965  -5.365  -6.727  1.00  1.150          O  
ATOM    847  CB  MET A  55       0.264  -5.949  -4.563  1.00  1.620          C  
ATOM    848  CG  MET A  55       1.655  -5.883  -4.043  1.00  1.620          C  
ATOM    849  SD  MET A  55       2.495  -7.487  -4.032  1.00  1.620          S  
ATOM    850  CE  MET A  55       1.687  -8.359  -2.666  1.00  1.620          C  
ATOM    851  H   MET A  55       0.602  -4.276  -6.635  1.00  1.370          H  
ATOM    852  HA  MET A  55       0.582  -7.232  -6.243  1.00  1.390          H  
ATOM    853 1HB  MET A  55      -0.215  -4.992  -4.356  1.00  1.940          H  
ATOM    854 2HB  MET A  55      -0.267  -6.708  -4.025  1.00  1.940          H  
ATOM    855 1HG  MET A  55       2.241  -5.187  -4.643  1.00  1.940          H  
ATOM    856 2HG  MET A  55       1.605  -5.507  -3.043  1.00  1.940          H  
ATOM    857 1HE  MET A  55       2.119  -9.353  -2.562  1.00  1.940          H  
ATOM    858 2HE  MET A  55       1.835  -7.811  -1.732  1.00  1.940          H  
ATOM    859 3HE  MET A  55       0.625  -8.455  -2.857  1.00  1.940          H  
ATOM    860  N   LYS A  56      -1.909  -7.525  -6.157  1.00  1.370          N  
ATOM    861  CA  LYS A  56      -3.349  -7.653  -6.260  1.00  1.630          C  
ATOM    862  C   LYS A  56      -3.913  -7.306  -4.893  1.00  1.480          C  
ATOM    863  O   LYS A  56      -3.454  -7.844  -3.888  1.00  1.330          O  
ATOM    864  CB  LYS A  56      -3.743  -9.062  -6.694  1.00  2.180          C  
ATOM    865  CG  LYS A  56      -3.295  -9.420  -8.110  1.00  2.180          C  
ATOM    866  CD  LYS A  56      -3.734 -10.833  -8.501  1.00  2.180          C  
ATOM    867  CE  LYS A  56      -3.272 -11.195  -9.915  1.00  2.180          C  
ATOM    868  NZ  LYS A  56      -3.680 -12.580 -10.299  1.00  2.180          N  
ATOM    869  H   LYS A  56      -1.343  -8.320  -5.896  1.00  1.640          H  
ATOM    870  HA  LYS A  56      -3.731  -6.932  -6.986  1.00  1.960          H  
ATOM    871 1HB  LYS A  56      -3.313  -9.789  -6.006  1.00  2.610          H  
ATOM    872 2HB  LYS A  56      -4.829  -9.166  -6.642  1.00  2.610          H  
ATOM    873 1HG  LYS A  56      -3.729  -8.704  -8.811  1.00  2.610          H  
ATOM    874 2HG  LYS A  56      -2.210  -9.345  -8.175  1.00  2.610          H  
ATOM    875 1HD  LYS A  56      -3.314 -11.550  -7.795  1.00  2.610          H  
ATOM    876 2HD  LYS A  56      -4.820 -10.900  -8.458  1.00  2.610          H  
ATOM    877 1HE  LYS A  56      -3.704 -10.490 -10.623  1.00  2.610          H  
ATOM    878 2HE  LYS A  56      -2.184 -11.122  -9.964  1.00  2.610          H  
ATOM    879 1HZ  LYS A  56      -3.356 -12.780 -11.236  1.00  2.610          H  
ATOM    880 2HZ  LYS A  56      -3.273 -13.245  -9.655  1.00  2.610          H  
ATOM    881 3HZ  LYS A  56      -4.687 -12.657 -10.269  1.00  2.610          H  
ATOM    882  N   CYS A  57      -4.946  -6.468  -4.845  1.00  1.740          N  
ATOM    883  CA  CYS A  57      -5.528  -6.030  -3.573  1.00  1.810          C  
ATOM    884  C   CYS A  57      -6.159  -7.145  -2.751  1.00  1.760          C  
ATOM    885  O   CYS A  57      -6.300  -7.026  -1.524  1.00  1.760          O  
ATOM    886  CB  CYS A  57      -6.598  -5.000  -3.836  1.00  2.510          C  
ATOM    887  SG  CYS A  57      -8.002  -5.677  -4.699  1.00  2.510          S  
ATOM    888  H   CYS A  57      -5.293  -6.076  -5.714  1.00  2.090          H  
ATOM    889  HA  CYS A  57      -4.733  -5.570  -2.991  1.00  2.170          H  
ATOM    890 1HB  CYS A  57      -6.937  -4.595  -2.897  1.00  3.010          H  
ATOM    891 2HB  CYS A  57      -6.180  -4.197  -4.422  1.00  3.010          H  
ATOM    892  HG  CYS A  57      -8.741  -4.579  -4.686  1.00  3.010          H  
ATOM    893  N   SER A  58      -6.515  -8.245  -3.414  1.00  1.920          N  
ATOM    894  CA  SER A  58      -7.081  -9.376  -2.717  1.00  2.080          C  
ATOM    895  C   SER A  58      -6.057  -9.976  -1.762  1.00  1.970          C  
ATOM    896  O   SER A  58      -6.418 -10.539  -0.735  1.00  2.250          O  
ATOM    897  CB  SER A  58      -7.547 -10.423  -3.706  1.00  2.850          C  
ATOM    898  OG  SER A  58      -6.460 -10.991  -4.397  1.00  2.850          O  
ATOM    899  H   SER A  58      -6.412  -8.298  -4.416  1.00  2.300          H  
ATOM    900  HA  SER A  58      -7.935  -9.031  -2.136  1.00  2.500          H  
ATOM    901 1HB  SER A  58      -8.098 -11.201  -3.178  1.00  3.420          H  
ATOM    902 2HB  SER A  58      -8.234  -9.964  -4.415  1.00  3.420          H  
ATOM    903  HG  SER A  58      -6.838 -11.660  -4.973  1.00  3.420          H  
ATOM    904  N   HIS A  59      -4.759  -9.753  -2.017  1.00  1.780          N  
ATOM    905  CA  HIS A  59      -3.666 -10.269  -1.195  1.00  1.990          C  
ATOM    906  C   HIS A  59      -3.720  -9.735   0.224  1.00  1.930          C  
ATOM    907  O   HIS A  59      -3.195 -10.334   1.161  1.00  2.270          O  
ATOM    908  CB  HIS A  59      -2.314  -9.872  -1.795  1.00  2.700          C  
ATOM    909  CG  HIS A  59      -1.133 -10.438  -1.079  1.00  2.700          C  
ATOM    910  ND1 HIS A  59      -0.751 -11.763  -1.185  1.00  2.700          N  
ATOM    911  CD2 HIS A  59      -0.265  -9.864  -0.220  1.00  2.700          C  
ATOM    912  CE1 HIS A  59       0.313 -11.968  -0.429  1.00  2.700          C  
ATOM    913  NE2 HIS A  59       0.625 -10.832   0.163  1.00  2.700          N  
ATOM    914  H   HIS A  59      -4.487  -9.218  -2.847  1.00  2.140          H  
ATOM    915  HA  HIS A  59      -3.723 -11.355  -1.149  1.00  2.390          H  
ATOM    916 1HB  HIS A  59      -2.273 -10.189  -2.835  1.00  3.240          H  
ATOM    917 2HB  HIS A  59      -2.221  -8.802  -1.791  1.00  3.240          H  
ATOM    918  HD2 HIS A  59      -0.271  -8.829   0.108  1.00  3.240          H  
ATOM    919  HE1 HIS A  59       0.839 -12.914  -0.310  1.00  3.240          H  
ATOM    920  HE2 HIS A  59       1.388 -10.684   0.804  1.00  3.240          H  
ATOM    921  N   PHE A  60      -4.326  -8.562   0.372  1.00  1.750          N  
ATOM    922  CA  PHE A  60      -4.386  -7.853   1.626  1.00  2.000          C  
ATOM    923  C   PHE A  60      -5.779  -7.997   2.210  1.00  2.090          C  
ATOM    924  O   PHE A  60      -6.129  -7.314   3.170  1.00  2.860          O  
ATOM    925  CB  PHE A  60      -4.081  -6.394   1.339  1.00  2.700          C  
ATOM    926  CG  PHE A  60      -2.738  -6.228   0.704  1.00  2.700          C  
ATOM    927  CD1 PHE A  60      -2.623  -6.236  -0.667  1.00  2.700          C  
ATOM    928  CD2 PHE A  60      -1.615  -6.058   1.437  1.00  2.700          C  
ATOM    929  CE1 PHE A  60      -1.416  -6.089  -1.270  1.00  2.700          C  
ATOM    930  CE2 PHE A  60      -0.385  -5.922   0.837  1.00  2.700          C  
ATOM    931  CZ  PHE A  60      -0.284  -5.935  -0.514  1.00  2.700          C  
ATOM    932  H   PHE A  60      -4.811  -8.135  -0.423  1.00  2.100          H  
ATOM    933  HA  PHE A  60      -3.657  -8.272   2.321  1.00  2.400          H  
ATOM    934 1HB  PHE A  60      -4.839  -5.984   0.671  1.00  3.240          H  
ATOM    935 2HB  PHE A  60      -4.095  -5.829   2.264  1.00  3.240          H  
ATOM    936  HD1 PHE A  60      -3.508  -6.366  -1.268  1.00  3.240          H  
ATOM    937  HD2 PHE A  60      -1.705  -6.033   2.516  1.00  3.240          H  
ATOM    938  HE1 PHE A  60      -1.378  -6.103  -2.336  1.00  3.240          H  
ATOM    939  HE2 PHE A  60       0.507  -5.812   1.433  1.00  3.240          H  
ATOM    940  HZ  PHE A  60       0.692  -5.826  -0.981  1.00  3.240          H  
ATOM    941  N   LYS A  61      -6.568  -8.896   1.605  1.00  1.710          N  
ATOM    942  CA  LYS A  61      -7.943  -9.180   1.953  1.00  1.910          C  
ATOM    943  C   LYS A  61      -8.841  -7.957   1.868  1.00  2.050          C  
ATOM    944  O   LYS A  61      -9.682  -7.758   2.744  1.00  2.540          O  
ATOM    945  CB  LYS A  61      -8.029  -9.780   3.361  1.00  2.590          C  
ATOM    946  CG  LYS A  61      -7.341 -11.148   3.514  1.00  2.590          C  
ATOM    947  CD  LYS A  61      -7.570 -11.766   4.915  1.00  2.590          C  
ATOM    948  CE  LYS A  61      -6.727 -11.082   6.027  1.00  2.590          C  
ATOM    949  NZ  LYS A  61      -5.270 -11.415   5.947  1.00  2.590          N  
ATOM    950  H   LYS A  61      -6.199  -9.437   0.820  1.00  2.050          H  
ATOM    951  HA  LYS A  61      -8.319  -9.911   1.235  1.00  2.290          H  
ATOM    952 1HB  LYS A  61      -7.610  -9.084   4.071  1.00  3.110          H  
ATOM    953 2HB  LYS A  61      -9.075  -9.917   3.628  1.00  3.110          H  
ATOM    954 1HG  LYS A  61      -7.750 -11.825   2.769  1.00  3.110          H  
ATOM    955 2HG  LYS A  61      -6.278 -11.036   3.320  1.00  3.110          H  
ATOM    956 1HD  LYS A  61      -8.627 -11.674   5.176  1.00  3.110          H  
ATOM    957 2HD  LYS A  61      -7.317 -12.824   4.885  1.00  3.110          H  
ATOM    958 1HE  LYS A  61      -6.830 -10.006   5.946  1.00  3.110          H  
ATOM    959 2HE  LYS A  61      -7.103 -11.396   6.999  1.00  3.110          H  
ATOM    960 1HZ  LYS A  61      -4.778 -10.904   6.703  1.00  3.110          H  
ATOM    961 2HZ  LYS A  61      -5.124 -12.405   6.055  1.00  3.110          H  
ATOM    962 3HZ  LYS A  61      -4.890 -11.114   5.068  1.00  3.110          H  
ATOM    963  N   LEU A  62      -8.720  -7.149   0.804  1.00  1.840          N  
ATOM    964  CA  LEU A  62      -9.599  -5.996   0.708  1.00  2.250          C  
ATOM    965  C   LEU A  62     -11.023  -6.586   0.751  1.00  2.310          C  
ATOM    966  O   LEU A  62     -11.296  -7.504  -0.016  1.00  1.970          O  
ATOM    967  CB  LEU A  62      -9.359  -5.244  -0.621  1.00  2.990          C  
ATOM    968  CG  LEU A  62      -9.927  -3.750  -0.763  1.00  2.990          C  
ATOM    969  CD1 LEU A  62      -9.169  -3.042  -1.865  1.00  2.990          C  
ATOM    970  CD2 LEU A  62     -11.440  -3.724  -1.047  1.00  2.990          C  
ATOM    971  H   LEU A  62      -8.000  -7.305   0.087  1.00  2.210          H  
ATOM    972  HA  LEU A  62      -9.387  -5.329   1.531  1.00  2.700          H  
ATOM    973 1HB  LEU A  62      -8.279  -5.197  -0.775  1.00  3.580          H  
ATOM    974 2HB  LEU A  62      -9.771  -5.846  -1.424  1.00  3.580          H  
ATOM    975  HG  LEU A  62      -9.729  -3.220   0.141  1.00  3.580          H  
ATOM    976 1HD1 LEU A  62      -9.527  -2.016  -1.942  1.00  3.580          H  
ATOM    977 2HD1 LEU A  62      -8.108  -3.029  -1.631  1.00  3.580          H  
ATOM    978 3HD1 LEU A  62      -9.331  -3.550  -2.805  1.00  3.580          H  
ATOM    979 1HD2 LEU A  62     -11.789  -2.718  -1.153  1.00  3.580          H  
ATOM    980 2HD2 LEU A  62     -11.658  -4.234  -1.933  1.00  3.580          H  
ATOM    981 3HD2 LEU A  62     -11.958  -4.165  -0.258  1.00  3.580          H  
ATOM    982  N   PRO A  63     -11.954  -6.075   1.589  1.00  2.870          N  
ATOM    983  CA  PRO A  63     -13.329  -6.554   1.764  1.00  3.100          C  
ATOM    984  C   PRO A  63     -14.162  -6.808   0.506  1.00  3.030          C  
ATOM    985  O   PRO A  63     -14.977  -7.728   0.498  1.00  3.270          O  
ATOM    986  CB  PRO A  63     -13.946  -5.404   2.572  1.00  4.650          C  
ATOM    987  CG  PRO A  63     -12.803  -4.871   3.394  1.00  4.650          C  
ATOM    988  CD  PRO A  63     -11.591  -4.965   2.509  1.00  4.650          C  
ATOM    989  HA  PRO A  63     -13.294  -7.469   2.372  1.00  3.720          H  
ATOM    990 1HB  PRO A  63     -14.384  -4.652   1.890  1.00  5.580          H  
ATOM    991 2HB  PRO A  63     -14.773  -5.787   3.190  1.00  5.580          H  
ATOM    992 1HG  PRO A  63     -13.014  -3.842   3.716  1.00  5.580          H  
ATOM    993 2HG  PRO A  63     -12.693  -5.471   4.308  1.00  5.580          H  
ATOM    994 1HD  PRO A  63     -11.411  -4.031   1.980  1.00  5.580          H  
ATOM    995 2HD  PRO A  63     -10.750  -5.255   3.160  1.00  5.580          H  
ATOM    996  N   ASP A  64     -13.952  -6.045  -0.563  1.00  2.920          N  
ATOM    997  CA  ASP A  64     -14.730  -6.232  -1.781  1.00  3.160          C  
ATOM    998  C   ASP A  64     -14.124  -7.304  -2.681  1.00  2.850          C  
ATOM    999  O   ASP A  64     -14.738  -7.729  -3.665  1.00  3.250          O  
ATOM   1000  CB  ASP A  64     -14.809  -4.915  -2.537  1.00  4.330          C  
ATOM   1001  CG  ASP A  64     -15.561  -3.838  -1.768  1.00  4.330          C  
ATOM   1002  OD1 ASP A  64     -16.408  -4.142  -0.962  1.00  4.330          O  
ATOM   1003  OD2 ASP A  64     -15.254  -2.702  -1.990  1.00  4.330          O  
ATOM   1004  H   ASP A  64     -13.309  -5.270  -0.538  1.00  3.500          H  
ATOM   1005  HA  ASP A  64     -15.739  -6.542  -1.506  1.00  3.790          H  
ATOM   1006 1HB  ASP A  64     -13.817  -4.558  -2.749  1.00  5.190          H  
ATOM   1007 2HB  ASP A  64     -15.303  -5.077  -3.497  1.00  5.190          H  
ATOM   1008  N   TYR A  65     -12.888  -7.694  -2.369  1.00  2.300          N  
ATOM   1009  CA  TYR A  65     -12.115  -8.654  -3.133  1.00  2.150          C  
ATOM   1010  C   TYR A  65     -11.419  -9.595  -2.141  1.00  2.050          C  
ATOM   1011  O   TYR A  65     -10.209  -9.775  -2.232  1.00  2.280          O  
ATOM   1012  CB  TYR A  65     -11.050  -7.930  -3.965  1.00  3.070          C  
ATOM   1013  CG  TYR A  65     -11.596  -6.776  -4.769  1.00  3.070          C  
ATOM   1014  CD1 TYR A  65     -11.358  -5.525  -4.306  1.00  3.070          C  
ATOM   1015  CD2 TYR A  65     -12.338  -6.951  -5.914  1.00  3.070          C  
ATOM   1016  CE1 TYR A  65     -11.834  -4.424  -4.941  1.00  3.070          C  
ATOM   1017  CE2 TYR A  65     -12.836  -5.840  -6.575  1.00  3.070          C  
ATOM   1018  CZ  TYR A  65     -12.581  -4.577  -6.083  1.00  3.070          C  
ATOM   1019  OH  TYR A  65     -13.066  -3.465  -6.732  1.00  3.070          O  
ATOM   1020  H   TYR A  65     -12.469  -7.363  -1.503  1.00  2.760          H  
ATOM   1021  HA  TYR A  65     -12.774  -9.229  -3.780  1.00  2.580          H  
ATOM   1022 1HB  TYR A  65     -10.270  -7.546  -3.302  1.00  3.680          H  
ATOM   1023 2HB  TYR A  65     -10.578  -8.633  -4.650  1.00  3.680          H  
ATOM   1024  HD1 TYR A  65     -10.771  -5.421  -3.418  1.00  3.680          H  
ATOM   1025  HD2 TYR A  65     -12.541  -7.953  -6.289  1.00  3.680          H  
ATOM   1026  HE1 TYR A  65     -11.622  -3.426  -4.546  1.00  3.680          H  
ATOM   1027  HE2 TYR A  65     -13.429  -5.962  -7.480  1.00  3.680          H  
ATOM   1028  HH  TYR A  65     -12.783  -2.664  -6.261  1.00  3.680          H  
ATOM   1029  N   PRO A  66     -12.132 -10.217  -1.193  1.00  2.430          N  
ATOM   1030  CA  PRO A  66     -11.561 -10.965  -0.098  1.00  2.940          C  
ATOM   1031  C   PRO A  66     -10.942 -12.245  -0.593  1.00  2.820          C  
ATOM   1032  O   PRO A  66     -11.345 -12.755  -1.641  1.00  3.070          O  
ATOM   1033  CB  PRO A  66     -12.785 -11.297   0.759  1.00  4.410          C  
ATOM   1034  CG  PRO A  66     -13.925 -11.373  -0.243  1.00  4.410          C  
ATOM   1035  CD  PRO A  66     -13.608 -10.313  -1.271  1.00  4.410          C  
ATOM   1036  HA  PRO A  66     -10.834 -10.340   0.443  1.00  3.530          H  
ATOM   1037 1HB  PRO A  66     -12.619 -12.248   1.295  1.00  5.290          H  
ATOM   1038 2HB  PRO A  66     -12.935 -10.510   1.514  1.00  5.290          H  
ATOM   1039 1HG  PRO A  66     -13.975 -12.385  -0.680  1.00  5.290          H  
ATOM   1040 2HG  PRO A  66     -14.883 -11.194   0.267  1.00  5.290          H  
ATOM   1041 1HD  PRO A  66     -13.937 -10.621  -2.272  1.00  5.290          H  
ATOM   1042 2HD  PRO A  66     -14.092  -9.419  -0.934  1.00  5.290          H  
ATOM   1043  N   LEU A  67     -10.014 -12.793   0.174  1.00  2.860          N  
ATOM   1044  CA  LEU A  67      -9.505 -14.104  -0.167  1.00  2.990          C  
ATOM   1045  C   LEU A  67     -10.521 -15.103   0.344  1.00  2.910          C  
ATOM   1046  O   LEU A  67     -11.131 -14.886   1.390  1.00  3.200          O  
ATOM   1047  CB  LEU A  67      -8.152 -14.382   0.512  1.00  4.130          C  
ATOM   1048  CG  LEU A  67      -6.980 -13.455   0.157  1.00  4.130          C  
ATOM   1049  CD1 LEU A  67      -5.775 -13.804   1.024  1.00  4.130          C  
ATOM   1050  CD2 LEU A  67      -6.617 -13.590  -1.324  1.00  4.130          C  
ATOM   1051  H   LEU A  67      -9.696 -12.317   1.005  1.00  3.430          H  
ATOM   1052  HA  LEU A  67      -9.429 -14.203  -1.247  1.00  3.590          H  
ATOM   1053 1HB  LEU A  67      -8.293 -14.332   1.590  1.00  4.960          H  
ATOM   1054 2HB  LEU A  67      -7.844 -15.388   0.258  1.00  4.960          H  
ATOM   1055  HG  LEU A  67      -7.262 -12.438   0.373  1.00  4.960          H  
ATOM   1056 1HD1 LEU A  67      -4.951 -13.123   0.779  1.00  4.960          H  
ATOM   1057 2HD1 LEU A  67      -6.032 -13.695   2.073  1.00  4.960          H  
ATOM   1058 3HD1 LEU A  67      -5.466 -14.828   0.831  1.00  4.960          H  
ATOM   1059 1HD2 LEU A  67      -5.784 -12.925  -1.551  1.00  4.960          H  
ATOM   1060 2HD2 LEU A  67      -6.327 -14.613  -1.541  1.00  4.960          H  
ATOM   1061 3HD2 LEU A  67      -7.462 -13.313  -1.943  1.00  4.960          H  
ATOM   1062  N   LEU A  68     -10.669 -16.216  -0.358  1.00  3.150          N  
ATOM   1063  CA  LEU A  68     -11.560 -17.287   0.080  1.00  3.600          C  
ATOM   1064  C   LEU A  68     -10.744 -18.468   0.593  1.00  3.570          C  
ATOM   1065  O   LEU A  68     -11.241 -19.590   0.710  1.00  3.770          O  
ATOM   1066  CB  LEU A  68     -12.471 -17.696  -1.076  1.00  4.860          C  
ATOM   1067  CG  LEU A  68     -13.363 -16.546  -1.673  1.00  4.860          C  
ATOM   1068  CD1 LEU A  68     -14.161 -17.110  -2.836  1.00  4.860          C  
ATOM   1069  CD2 LEU A  68     -14.289 -15.939  -0.601  1.00  4.860          C  
ATOM   1070  H   LEU A  68     -10.162 -16.322  -1.228  1.00  3.780          H  
ATOM   1071  HA  LEU A  68     -12.161 -16.931   0.911  1.00  4.320          H  
ATOM   1072 1HB  LEU A  68     -11.854 -18.095  -1.879  1.00  5.830          H  
ATOM   1073 2HB  LEU A  68     -13.135 -18.489  -0.728  1.00  5.830          H  
ATOM   1074  HG  LEU A  68     -12.720 -15.753  -2.062  1.00  5.830          H  
ATOM   1075 1HD1 LEU A  68     -14.765 -16.318  -3.280  1.00  5.830          H  
ATOM   1076 2HD1 LEU A  68     -13.479 -17.508  -3.587  1.00  5.830          H  
ATOM   1077 3HD1 LEU A  68     -14.813 -17.906  -2.479  1.00  5.830          H  
ATOM   1078 1HD2 LEU A  68     -14.888 -15.148  -1.052  1.00  5.830          H  
ATOM   1079 2HD2 LEU A  68     -14.948 -16.712  -0.204  1.00  5.830          H  
ATOM   1080 3HD2 LEU A  68     -13.704 -15.509   0.210  1.00  5.830          H  
ATOM   1081  N   MET A  69      -9.471 -18.192   0.830  1.00  3.850          N  
ATOM   1082  CA  MET A  69      -8.467 -19.129   1.288  1.00  4.550          C  
ATOM   1083  C   MET A  69      -8.602 -19.411   2.779  1.00  4.790          C  
ATOM   1084  O   MET A  69      -8.921 -18.519   3.560  1.00  5.260          O  
ATOM   1085  CB  MET A  69      -7.105 -18.509   1.001  1.00  6.090          C  
ATOM   1086  CG  MET A  69      -6.797 -18.351  -0.488  1.00  6.090          C  
ATOM   1087  SD  MET A  69      -5.258 -17.453  -0.812  1.00  6.090          S  
ATOM   1088  CE  MET A  69      -3.987 -18.593  -0.278  1.00  6.090          C  
ATOM   1089  H   MET A  69      -9.188 -17.235   0.698  1.00  4.620          H  
ATOM   1090  HA  MET A  69      -8.581 -20.068   0.747  1.00  5.460          H  
ATOM   1091 1HB  MET A  69      -7.042 -17.529   1.470  1.00  7.310          H  
ATOM   1092 2HB  MET A  69      -6.330 -19.136   1.445  1.00  7.310          H  
ATOM   1093 1HG  MET A  69      -6.723 -19.338  -0.942  1.00  7.310          H  
ATOM   1094 2HG  MET A  69      -7.612 -17.819  -0.975  1.00  7.310          H  
ATOM   1095 1HE  MET A  69      -3.008 -18.148  -0.441  1.00  7.310          H  
ATOM   1096 2HE  MET A  69      -4.101 -18.816   0.785  1.00  7.310          H  
ATOM   1097 3HE  MET A  69      -4.061 -19.520  -0.847  1.00  7.310          H  
ATOM   1098  N   ASN A  70      -8.285 -20.637   3.186  1.00  4.970          N  
ATOM   1099  CA  ASN A  70      -8.285 -21.007   4.596  1.00  5.670          C  
ATOM   1100  C   ASN A  70      -6.913 -21.505   5.017  1.00  6.110          C  
ATOM   1101  O   ASN A  70      -6.770 -22.192   6.031  1.00  6.760          O  
ATOM   1102  CB  ASN A  70      -9.332 -22.062   4.846  1.00  7.660          C  
ATOM   1103  CG  ASN A  70      -9.045 -23.314   4.070  1.00  7.660          C  
ATOM   1104  OD1 ASN A  70      -8.279 -23.295   3.086  1.00  7.660          O  
ATOM   1105  ND2 ASN A  70      -9.642 -24.404   4.479  1.00  7.660          N  
ATOM   1106  H   ASN A  70      -8.041 -21.354   2.506  1.00  5.960          H  
ATOM   1107  HA  ASN A  70      -8.512 -20.126   5.195  1.00  6.800          H  
ATOM   1108 1HB  ASN A  70      -9.367 -22.303   5.909  1.00  9.190          H  
ATOM   1109 2HB  ASN A  70     -10.313 -21.680   4.559  1.00  9.190          H  
ATOM   1110 1HD2 ASN A  70      -9.489 -25.268   4.000  1.00  9.190          H  
ATOM   1111 2HD2 ASN A  70     -10.248 -24.374   5.273  1.00  9.190          H  
ATOM   1112  N   ALA A  71      -5.922 -21.144   4.217  1.00  6.090          N  
ATOM   1113  CA  ALA A  71      -4.532 -21.518   4.387  1.00  6.870          C  
ATOM   1114  C   ALA A  71      -3.726 -20.925   3.245  1.00  7.470          C  
ATOM   1115  O   ALA A  71      -2.823 -20.120   3.467  1.00  8.180          O  
ATOM   1116  OXT ALA A  71      -4.215 -20.993   2.118  1.00 10.300          O  
ATOM   1117  CB  ALA A  71      -4.368 -23.034   4.407  1.00  8.810          C  
ATOM   1118  H   ALA A  71      -6.166 -20.562   3.431  1.00  7.310          H  
ATOM   1119  HA  ALA A  71      -4.166 -21.096   5.324  1.00  8.240          H  
ATOM   1120 1HB  ALA A  71      -3.315 -23.278   4.529  1.00 10.570          H  
ATOM   1121 2HB  ALA A  71      -4.926 -23.476   5.226  1.00 10.570          H  
ATOM   1122 3HB  ALA A  71      -4.730 -23.446   3.468  1.00 10.570          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 -389.018 42.6598 299.721 -24.2433 6.60079 16.3391 146.092 -159.049 -0.72481 -4.49659 -122.713 -14.0614 -51.0365 -3.94767 -3.12295 -5.85343 0 0.16944 4.57405 32.6215 73.9025 -10.4363 4.10968 0.75494 -11.6594 40.0072 -132.809
CYS:NtermProteinFull_1 -7.57197 0.96307 4.34413 -0.06647 0.04644 0.02504 3.00809 -2.49829 -0.05442 -0.18274 -0.3479 0.58089 0 0 -0.73508 0 0 0.01983 0.11766 0.26052 0 0 0 3.6196 0 0.31307 1.84145
VAL_2 -4.14116 0.67288 1.23016 -0.35388 0.13403 0.08513 1.0386 -1.20941 -0 -0 0.32378 -0.0962 0 0 -0.40396 0 0 -0.03768 0.31094 0.83364 0 0.0892 0 1.9342 -0.087 0.88318 1.20643
PHE_3 -4.42416 0.76596 2.29541 -0.87905 0.24911 0.48784 0.44842 -1.34605 -0.05256 -0.16273 0.32439 -0.19943 0 0 -0.42243 0 0 -0.02896 0.68114 0 4.05794 -0.02711 0 1.0402 -0.31608 1.14864 3.6405
GLY_4 -2.80036 0.1971 2.41625 -0.00075 0 0 1.48876 -1.36531 -0.00018 -0.00397 -0.70007 -0.28416 0 0 0 0 0 -0.07635 0 0 0 -1.53394 0 0.83697 0.05917 1.04187 -0.72496
CYS_5 -3.29504 0.76043 2.32321 -0.07346 0.00435 0.05739 1.52921 -1.2543 -0 -0 -0.86818 -0.31697 0 0 0 0 0 0.07384 0.01642 0.38577 0 0.01237 0 3.6196 0.02134 1.37282 4.36879
PRO_6 -5.16951 1.11093 1.54349 -0.09086 0.00138 0.05635 0.9083 -0.92699 -0.02041 -0.12224 0.16243 0.67137 0 0 0 0 0 -0.15428 0.00484 0.62362 0 -0.55081 0 -2.4119 -0.44462 1.33846 -3.47045
SER_7 -2.24695 0.23618 2.27065 -0.02902 0 0.04818 1.3641 -1.12981 -0 -0 -0.96873 -1.07604 0 0 0 0 0 -0.05078 0.00538 0.18289 0 -0.26311 0.60048 -0.77834 -0.51875 0.50365 -1.85001
ALA_8 -4.13344 0.57772 3.36159 -0.03045 0.00749 0 2.29228 -2.06478 -0.0133 -0.10048 -1.74143 -0.51148 0 0 0 0 0 0.19195 0 0 0 -0.09434 0 1.8394 -0.19906 0.33023 -0.28807
ALA_9 -3.92192 0.60558 3.02655 -0.02264 0 0 1.73729 -1.94717 -0.01015 -0.05433 -1.33269 -0.36401 0 0 0 0 0 -0.04998 0 0 0 -0.37902 0 1.8394 -0.1264 0.54567 -0.45382
ASP_10 -3.98044 0.52925 5.57134 -0.11597 0.00607 0.36308 2.70123 -2.53763 -0 -0 -4.15655 -0.32139 0 0 0 -1.61398 0 -0.03143 0.11176 0 2.12555 -0.22817 0 -2.3716 -0.32322 0.53517 -3.73692
LYS_11 -4.13466 0.28561 4.73665 -0.29935 0.0269 0.13044 1.72057 -2.17734 -0.00508 -0.04362 -1.25548 -0.05848 0 0 0 0 0 -0.04234 0.00721 1.77182 0 -0.01058 0 -1.5107 -0.24149 0.52107 -0.57886
LEU_12 -10.1543 1.51041 5.61542 -0.53133 0.30951 0.13861 3.52574 -3.87196 -0.01379 -0.06156 -2.53715 0.26662 0 0 0 0 0 -0.03057 0.02626 0.37006 0 -0.27514 0 0.18072 -0.32738 1.3041 -4.55573
TRP_13 -7.54189 0.80634 7.18024 -1.22426 0.17645 0.35908 3.50396 -3.48356 -0.04611 -0.26102 -2.09263 -0.48598 0 0 0 -0.86683 0 -0.02632 0.06878 0 2.00723 0.14738 0 1.6906 -0.37431 1.76323 1.30037
ASP_14 -4.68628 0.34595 5.22627 -0.19503 0.00072 0.63691 2.12223 -2.51463 -0 -0 -1.6657 -0.16061 0 0 0 0 0 -0.03414 0.01127 0 3.17916 0.13014 0 -2.3716 -0.14605 0.88785 0.76646
GLU_15 -6.66759 0.46132 7.06583 -0.21622 0.04051 0.32349 2.26201 -3.14818 -0 -0 -2.44044 -0.58329 0 0 0 0 0 -0.04642 0.17905 0 3.0655 -0.29156 0 -2.7348 -0.20464 0.26277 -2.67267
ASN_16 -9.35467 1.08994 8.3336 -0.21669 0.05438 0.27121 5.49184 -4.38592 -0.01994 -0.12656 -5.19277 -0.19901 0 0 -1.56148 0 0 0.0735 0.00138 0 3.57832 0.34249 0 -0.93687 -0.10652 0.57267 -2.29111
LYS_17 -7.59553 0.90491 7.3049 -0.42069 0.15181 0.13742 3.81416 -3.40113 -0.03807 -0.18068 -4.44151 0.04717 0 0 0 0 0 -0.02906 0.20361 2.59961 0 -0.00154 0 -1.5107 0.00573 0.78776 -1.66186
SER_18 -3.41367 0.2233 4.68367 -0.02535 0 0.05965 1.83155 -2.15556 -0.0037 -0.03272 -1.80155 -0.66192 0 0 0 0 0 -0.01293 0.00033 0.5865 0 0.36482 0.6 -0.77834 0.01809 0.4316 -0.08623
HIS_D_19 -4.82356 0.19859 4.15247 -0.72498 0.02401 0.737 1.87451 -2.22238 -0 -0 -1.48191 -0.27906 0 0 0 0 0 0.07412 0.01292 0 1.51983 -0.31266 0 -0.45461 0.37746 0.23123 -1.09703
PHE_20 -9.465 1.10242 3.94769 -0.59504 0.02248 0.2694 2.59494 -2.87317 -0.0077 -0.11471 -2.7365 0.03012 0 0 0 0 0 -0.02865 0.01677 0 2.4061 0.04575 0 1.0402 0.14212 0.31373 -3.88904
ILE_21 -7.84063 0.93276 4.98732 -0.5128 0.41399 0.1027 2.64736 -2.9126 -0.01468 -0.07897 -3.33375 0.00562 0 0 0 0 0 -0.06924 0.00412 0.51976 0 -0.49154 0 0.73287 0.00517 0.54786 -4.35468
GLU_22 -4.83321 0.3294 5.58893 -0.36106 0.13208 0.4244 2.75372 -2.61059 -0.02428 -0.11912 -2.69951 -0.58192 0 0 0 -0.91715 0 -0.0301 0.02016 0 3.16105 -0.12412 0 -2.7348 -0.13635 0.63634 -2.12612
ASP_23 -4.51416 0.51281 6.95868 -0.22471 0.0003 0.73344 2.8197 -3.01837 -0.00647 -0.07663 -5.28057 -0.164 0 0 0 0 0 -0.0264 0.00407 0 3.10434 0.31767 0 -2.3716 -0.14083 0.39303 -0.97972
PHE_24 -9.60274 1.30667 5.35864 -0.9016 0.11551 0.37676 2.63688 -3.19969 -0 -0 -2.15706 0.11984 0 0 0 0 0 0.08711 0.18716 0 2.86852 0.11605 0 1.0402 -0.0467 0.51898 -1.17548
CYS_25 -7.83546 0.75605 5.94186 -0.04917 0 0.01784 3.01086 -3.00649 -0 -0 -3.52876 -0.04228 0 0 0 0 0 0.0293 0.0006 0.28411 0 0.26201 0 3.6196 0.04979 0.66062 0.17049
TRP_26 -6.83783 0.49519 6.62686 -1.02259 0.2228 0.34462 3.22222 -3.25209 -0 -0 -3.2385 -0.47222 0 0 0 -0.91715 0 0.10259 0.04832 0 1.92759 0.06828 0 1.6906 -0.02693 0.49598 -0.52225
LYS_27 -6.93936 0.68618 8.50027 -0.33755 0.03177 0.18357 3.35954 -3.7126 -0.00031 -0.00313 -5.66829 0.34588 0 0 0 0 0 0.01405 0.01947 2.35369 0 0.02061 0 -1.5107 -0.3463 0.44282 -2.56039
LEU_28 -9.35276 0.88776 5.63614 -0.74911 0.48745 0.21155 3.26966 -3.37524 -0 -0 -2.9269 0.3461 0 0 0 0 0 0.02152 0.26498 2.7956 0 -0.31437 0 0.18072 -0.34368 0.46095 -2.49963
HIS_D_29 -6.06207 0.32903 5.26611 -0.35357 0.01043 0.41264 2.12243 -2.68538 -0 -0 -1.44661 -0.41747 0 0 0 0 0 0.08977 0.00121 0 2.68038 0.02954 0 -0.45461 -0.2499 0.427 -0.30109
ARG_30 -4.38257 0.23247 5.11482 -0.73561 0.10961 0.4721 1.49851 -2.30282 -0.00031 -0.00313 -0.62032 0.34157 0 0 0 0 0 0.06227 0.06079 1.44624 0 -0.09314 0 -1.2888 -0.30011 0.32082 -0.0676
ARG_31 -4.87004 0.37098 4.46773 -0.45607 0.05058 0.24234 1.38298 -2.09495 -0.01493 -0.13019 -0.45659 0.32983 0 0 0 0 0 0.04149 0.14893 2.07413 0 -0.13336 0 -1.2888 -0.43531 0.38806 -0.3832
GLU_32 -2.51699 0.23644 3.2793 -0.23425 0.03945 0.4045 1.62818 -1.49124 -0.01493 -0.13019 -0.79991 -0.54588 0 0 0 0 0 -0.10827 0.00029 0 2.72082 0.1343 0 -2.7348 -0.07036 0.39414 0.19061
GLY_33 -2.00964 0.16114 1.94175 -0.00035 0 0 0.6933 -1.07207 -0 -0 -0.45299 -0.17892 0 0 0 0 0 -0.12149 0 0 0 -0.95796 0 0.83697 0.22828 0.17801 -0.75397
ALA_34 -2.19243 0.40121 1.65585 -0.02941 0.00793 0 0.83568 -1.03313 -0.00738 -0.0733 0.04838 -0.42711 0 0 0 0 0 -0.08238 0 0 0 0.48879 0 1.8394 0.49095 0.18216 2.10521
CYS_35 -5.33977 0.55384 2.776 -0.05161 0.00771 0.02137 1.01316 -1.41605 -0.02648 -0.16001 -1.2207 -0.49171 0 0 0 0 0 -0.0449 0.01856 0.43826 0 0.17268 0 3.6196 0.29364 0.3378 0.50138
VAL_36 -2.63477 0.46198 2.01747 -0.31377 0.24872 0.07198 0.82725 -1.20897 -0 -0 0.12252 -0.10849 0 0 0 0 0 -0.00097 0.00018 0.32824 0 -0.00535 0 1.9342 -0.20571 0.28231 1.81683
ASN_37 -4.06545 0.28591 3.82852 -0.19788 0.04111 0.31709 1.46812 -1.87894 -0.00738 -0.0733 -1.52911 -0.46686 0 0 0 0 0 -0.06771 0.0375 0 2.05882 -0.6066 0 -0.93687 -0.44053 0.30761 -1.92595
CYS_38 -7.87314 1.11835 4.1961 -0.04561 0.00013 0.01967 2.50158 -2.27311 -0 -0 -2.27472 -0.41613 0 0 0 0 0 -0.01779 0.03869 0.34774 0 0.29791 0 3.6196 -0.38062 0.35348 -0.78787
GLU_39 -5.28728 0.66138 5.48224 -0.34772 0.07435 0.40844 2.59156 -2.59198 -0.02648 -0.16001 -3.4706 -0.63646 0 0 0 0 0 -0.02804 0.0408 0 3.3007 -0.13528 0 -2.7348 -0.21223 0.23704 -2.83437
MET_40 -4.52759 0.19068 4.62731 -0.31714 0.09767 0.02797 1.61469 -2.16957 -0 -0 -1.03365 0.03155 0 0 0 0 0 0.00431 0.01144 1.0731 0 0.06336 0 0.60916 -0.13824 0.16012 0.32517
HIS_41 -6.85673 0.68245 6.41815 -0.76624 0.0509 0.82938 2.62431 -3.20908 -0 -0 -2.58506 -0.31948 0 0 0 -0.39558 0 -0.01278 0.03399 0 1.75884 -0.18471 0 -0.45461 0.09685 0.27129 -2.0181
ALA_42 -6.64702 0.62475 4.45153 -0.02173 0 0 2.90106 -2.99508 -0.00394 -0.05592 -2.24053 -0.35268 0 0 0 0 0 -0.00531 0 0 0 -0.28551 0 1.8394 -0.14852 0.37215 -2.56735
LEU_43 -8.60593 0.95119 5.21018 -0.49122 0.25212 0.11627 2.76863 -3.01858 -0 -0 -2.61023 0.23522 0 0 0 0 0 0.11262 0.05509 0.35122 0 -0.27565 0 0.18072 -0.34747 0.48279 -4.63303
ASN_44 -4.83245 0.28109 5.93196 -0.18222 0.06712 0.2759 2.87071 -2.811 -0.00101 -0.00972 -1.94235 -0.30758 0 0 0 0 0 0.16285 0.00905 0 1.41069 0.39997 0 -0.93687 -0.11463 0.5268 0.79831
GLU_45 -6.23176 0.38073 6.91594 -0.19867 0.01895 0.25213 3.09576 -3.18919 -0.0244 -0.27844 -3.57665 -0.54104 0 0 0 -0.39558 0 0.14988 0.04124 0 3.02746 -0.31641 0 -2.7348 -0.26475 0.44907 -3.42055
ILE_46 -9.57418 1.3534 4.64605 -0.51373 0.40302 0.10308 2.96673 -3.30394 -0.00187 -0.02001 -2.15575 0.01559 0 0 0 0 0 0.06372 0.04481 0.56775 0 -0.42028 0 0.73287 -0.31176 0.55151 -4.85298
GLN_47 -7.81748 0.59377 6.43539 -0.40451 0.10579 0.25732 3.2877 -3.21843 -0 -0 -3.64185 -0.64243 0 0 0 0 0 0.00701 0.10222 0 3.16419 0.04887 0 -0.18838 0.03287 0.55649 -1.32149
GLU_48 -5.06306 0.37022 5.8128 -0.21157 0.0214 0.2789 2.60891 -2.72297 -0.01554 -0.15172 -2.34097 -0.5769 0 0 0 0 0 0.04147 0.03049 0 3.00731 -0.22943 0 -2.7348 -0.23923 0.43267 -1.68201
VAL_49 -7.08569 0.47201 5.36119 -0.31598 0.22306 0.07235 3.12652 -3.16456 -0 -0 -1.93223 -0.15446 0 0 0 0 0 -0.05308 0.00783 0.07106 0 -0.31138 0 1.9342 -0.33108 0.34301 -1.73724
PHE_50 -11.1434 1.09116 5.20407 -0.48165 0.16417 0.18737 3.93444 -3.60693 -0 -0 -3.03712 -0.12367 0 0 0 0 0 -0.03179 0.00755 0 3.42721 -0.23432 0 1.0402 -0.12135 0.52309 -3.20094
THR_51 -4.43503 0.23416 5.64656 -0.20076 0.1092 0.07132 2.46884 -2.60628 -0.01371 -0.11544 -2.23497 0.01796 0 0 0 0 0 0.01459 0.02007 0.06536 0 -0.01326 2.3062 -1.0874 -0.0127 0.50098 0.7357
LEU_52 -3.87578 0.27254 3.50341 -0.48558 0.20034 0.11755 1.39926 -1.79965 -0 -0 -0.81591 0.22665 0 0 0 0 0 0.00358 0.1117 0.29234 0 -0.29529 0 0.18072 -0.12644 0.25221 -0.83834
HIS_D_53 -4.74934 0.30956 4.01083 -0.39624 0.14462 0.41722 1.50194 -2.07248 -0 -0 -1.01117 -0.56104 0 0 0 0 0 0.11458 0.00049 0 3.25357 -0.09984 0 -0.45461 -0.33305 0.32207 0.39712
GLY_54 -1.89177 0.12341 2.45028 -7e-05 0 0 1.07817 -1.16057 -0.01525 -0.11452 -0.77163 -0.29943 0 0 0 0 0 -0.17242 0 0 0 -1.54169 0 0.83697 0.09111 0.38641 -1.00101
MET_55 -6.0469 0.56322 3.50464 -0.44538 0.17471 0.05711 1.24911 -1.81024 -0.02896 -0.22996 -1.07969 -0.08131 0 0 0 0 0 0.21839 0.09726 1.4968 0 -0.01849 0 0.60916 0.23826 0.40464 -1.12764
LYS_56 -2.78955 0.22922 2.93781 -0.30309 0.03161 0.15042 1.52712 -1.35234 -0 -0 -1.14144 -0.10281 0 0 0 0 0 0.04136 0.00132 2.30515 0 0.05898 0 -1.5107 -0.0959 0.41621 0.40337
CYS_57 -6.74511 0.85959 3.2606 -0.07033 0.00031 0.04315 1.40245 -1.74964 -0 -0 -1.29409 -0.37334 0 0 0 0 0 0.01956 0.00043 0.4931 0 0.2788 0 3.6196 -0.27601 0.35383 -0.17711
SER_58 -4.80961 0.83397 4.50434 -0.02761 0 0.04361 2.35736 -2.28238 -0.00676 -0.03395 -1.19831 -1.08863 0 0 0 0 0 -0.06483 0.00175 0.18352 0 -0.08993 0.60249 -0.77834 -0.54455 0.32966 -2.06821
HIS_59 -5.46237 0.57659 2.99018 -0.79054 0.06116 0.95575 1.7796 -2.02672 -0.02042 -0.12243 -1.18948 -0.16177 0 0 0 0 0 0.01012 0.01402 0 2.61757 0.07355 0 -0.45461 -0.52627 0.33941 -1.33667
PHE_60 -10.9329 1.60648 2.21355 -0.69215 0.12536 0.42098 2.22288 -2.54314 -0.03867 -0.16749 -0.82525 0.17554 0 0 0 0 0 -0.04608 0.13214 0 2.11269 -0.21176 0 1.0402 -0.44604 0.5202 -5.33351
LYS_61 -4.60564 0.32155 5.13092 -0.54828 0.22939 0.512 2.65106 -2.20289 -0.03283 -0.16073 -3.87154 -0.23903 0 0 0 -0.74715 0 -0.10868 0.05462 3.00583 0 -0.15345 0 -1.5107 -0.42462 0.69145 -2.0087
LEU_62 -8.76282 1.66521 3.5204 -0.55682 0.16623 0.15136 2.41046 -2.48689 -0.02853 -0.11316 -1.24924 0.10391 0 0 0 0 0 -0.06488 0.28627 1.86946 0 -0.10216 0 0.18072 -0.22282 1.54868 -1.6846
PRO_63 -3.80804 0.70545 1.68898 -0.06796 0 0.0424 0.69784 -0.82776 -0 -0 0.26772 0.57766 0 0 0 0 0 -0.19472 0.09772 0.18718 0 -0.68547 0 -2.4119 0.09806 1.69584 -1.93699
ASP_64 -3.68183 0.47248 2.29007 -0.12068 0.01056 0.37293 0.57353 -1.28864 -0.00101 -0.00972 -0.38388 -0.25056 0 0 0 0 0 -0.04559 0.05181 0 2.06434 -0.23612 0 -2.3716 -0.03295 0.65324 -1.93364
TYR_65 -7.07514 1.23664 3.77354 -0.69213 0.07835 0.45338 2.14248 -2.26607 -0.00676 -0.03396 -2.26573 -0.18821 0 0 0 0 0 0.40364 0.37342 0 2.04898 -0.02945 0.00052 1.2797 -0.14224 1.12864 0.21959
PRO_66 -3.94437 0.58847 2.28575 -0.20486 0.01426 0.1533 0.41405 -1.09025 -0 -0 -0.40362 -0.006 0 0 0 0 0 0.08765 0.05033 0.48625 0 -0.99733 0 -2.4119 -0.14532 1.21528 -3.9083
LEU_67 -5.22832 0.42112 2.50555 -0.46343 0.16757 0.08661 1.05322 -1.3831 -0 -0 0.45219 0.24443 0 0 0 0 0 -0.01061 0.01482 0.41936 0 -0.24192 0 0.18072 -0.45966 0.49372 -1.74774
LEU_68 -1.65484 0.05641 1.36626 -0.50709 0.24259 0.14657 0.06727 -0.69605 -0 -0 0.06644 0.02495 0 0 0 0 0 -0.04595 0.11085 0.28684 0 0.03564 0 0.18072 -0.40349 0.47123 -0.25164
MET_69 -3.12182 0.16934 2.29057 -0.32178 0.11155 0.04264 0.9303 -1.0221 -0 -0 0.13318 0.07479 0 0 0 0 0 0.00049 0.10434 1.26503 0 -0.02549 0 0.60916 -0.42893 0.39347 1.20475
ASN_70 -1.10085 0.18028 1.03766 -0.37706 0.07911 0.74884 0.21418 -0.55514 -0.02806 -0.21202 -0.20206 -1.62461 0 0 0 0 0 -0.03386 0.03539 0 2.24784 -0.60646 0 -0.93687 -0.39562 0.2775 -1.25182
ALA:CtermProteinFull_71 -1.39797 0.17528 1.54083 -0.03088 0.00012 0 0.61082 -0.76696 -0.02806 -0.21202 -0.71331 -0.33217 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.1236 0.2897 0.85118
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114278 DOMAINID 110960 MODEL 3 2021-08-21_00000149_1_19
MODEL     3
REMARK    Rerank model05.pdb to model03.pdb score: 45.466
REMARK    S_0000_0009
REMARK    SCORE          fa_atr:        -391.373
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE             ref:          27.225
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE atom_pair_constraint:        -209.270
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE    fa_intra_rep:           0.656
REMARK    SCORE     total_score:        -353.273
REMARK    SCORE           omega:           0.350
REMARK    SCORE        hbond_sc:          -6.852
REMARK    SCORE fa_intra_sol_xover4:          15.423
REMARK    SCORE     rama_prepro:          -2.992
REMARK    SCORE            time:           0.000
REMARK    SCORE           score:        -353.273
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     hbond_lr_bb:          -3.707
REMARK    SCORE          fa_dun:          93.922
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     hbond_bb_sc:          -6.462
REMARK    SCORE          fa_sol:         220.236
REMARK    SCORE         p_aa_pp:          -8.633
REMARK    SCORE         fa_elec:        -118.067
REMARK    SCORE     hbond_sr_bb:         -47.249
REMARK    SCORE          fa_rep:          50.886
REMARK    SCORE     cart_bonded:          45.038
REMARK    SCORE     lk_ball_wtd:         -12.403
ATOM      1  N   CYS A   1       0.514  -0.795   0.938  1.00  3.88           N  
ATOM      2  CA  CYS A   1       1.859  -0.815   0.367  1.00  3.07           C  
ATOM      3  C   CYS A   1       2.534   0.560   0.333  1.00  2.47           C  
ATOM      4  O   CYS A   1       3.726   0.669   0.622  1.00  2.70           O  
ATOM      5  CB  CYS A   1       1.823  -1.356  -1.053  1.00  4.63           C  
ATOM      6  SG  CYS A   1       1.317  -3.086  -1.185  1.00  4.63           S  
ATOM      7 1H   CYS A   1       0.378  -1.644   1.468  1.00  4.66           H  
ATOM      8 2H   CYS A   1       0.392  -0.003   1.551  1.00  4.66           H  
ATOM      9 3H   CYS A   1      -0.169  -0.759   0.194  1.00  4.66           H  
ATOM     10  HA  CYS A   1       2.473  -1.485   0.973  1.00  3.68           H  
ATOM     11 1HB  CYS A   1       1.155  -0.754  -1.665  1.00  5.56           H  
ATOM     12 2HB  CYS A   1       2.819  -1.270  -1.474  1.00  5.56           H  
ATOM     13  HG  CYS A   1       2.284  -3.581  -0.371  1.00  5.56           H  
ATOM     14  N   VAL A   2       1.763   1.623   0.074  1.00  2.28           N  
ATOM     15  CA  VAL A   2       2.343   2.967  -0.073  1.00  2.43           C  
ATOM     16  C   VAL A   2       3.148   3.458   1.127  1.00  2.27           C  
ATOM     17  O   VAL A   2       4.065   4.250   0.948  1.00  2.76           O  
ATOM     18  CB  VAL A   2       1.246   3.981  -0.455  1.00  3.34           C  
ATOM     19  CG1 VAL A   2       0.288   4.187   0.687  1.00  3.34           C  
ATOM     20  CG2 VAL A   2       1.906   5.321  -0.861  1.00  3.34           C  
ATOM     21  H   VAL A   2       0.781   1.500  -0.115  1.00  2.74           H  
ATOM     22  HA  VAL A   2       3.029   2.931  -0.909  1.00  2.92           H  
ATOM     23  HB  VAL A   2       0.683   3.583  -1.292  1.00  4.01           H  
ATOM     24 1HG1 VAL A   2      -0.474   4.882   0.409  1.00  4.01           H  
ATOM     25 2HG1 VAL A   2      -0.175   3.249   0.962  1.00  4.01           H  
ATOM     26 3HG1 VAL A   2       0.810   4.578   1.514  1.00  4.01           H  
ATOM     27 1HG2 VAL A   2       1.146   6.023  -1.155  1.00  4.01           H  
ATOM     28 2HG2 VAL A   2       2.462   5.748  -0.030  1.00  4.01           H  
ATOM     29 3HG2 VAL A   2       2.582   5.156  -1.696  1.00  4.01           H  
ATOM     30  N   PHE A   3       2.814   3.037   2.343  1.00  2.11           N  
ATOM     31  CA  PHE A   3       3.633   3.424   3.478  1.00  2.38           C  
ATOM     32  C   PHE A   3       4.125   2.188   4.222  1.00  2.11           C  
ATOM     33  O   PHE A   3       4.329   2.235   5.434  1.00  2.62           O  
ATOM     34  CB  PHE A   3       2.916   4.399   4.412  1.00  3.23           C  
ATOM     35  CG  PHE A   3       2.550   5.692   3.722  1.00  3.23           C  
ATOM     36  CD1 PHE A   3       1.231   6.101   3.624  1.00  3.23           C  
ATOM     37  CD2 PHE A   3       3.530   6.479   3.118  1.00  3.23           C  
ATOM     38  CE1 PHE A   3       0.903   7.257   2.953  1.00  3.23           C  
ATOM     39  CE2 PHE A   3       3.198   7.624   2.450  1.00  3.23           C  
ATOM     40  CZ  PHE A   3       1.884   8.015   2.364  1.00  3.23           C  
ATOM     41  H   PHE A   3       2.012   2.446   2.484  1.00  2.53           H  
ATOM     42  HA  PHE A   3       4.518   3.932   3.105  1.00  2.86           H  
ATOM     43 1HB  PHE A   3       2.007   3.939   4.793  1.00  3.88           H  
ATOM     44 2HB  PHE A   3       3.554   4.630   5.264  1.00  3.88           H  
ATOM     45  HD1 PHE A   3       0.447   5.496   4.078  1.00  3.88           H  
ATOM     46  HD2 PHE A   3       4.575   6.175   3.167  1.00  3.88           H  
ATOM     47  HE1 PHE A   3      -0.138   7.566   2.880  1.00  3.88           H  
ATOM     48  HE2 PHE A   3       3.973   8.219   1.981  1.00  3.88           H  
ATOM     49  HZ  PHE A   3       1.622   8.926   1.824  1.00  3.88           H  
ATOM     50  N   GLY A   4       4.273   1.062   3.498  1.00  1.90           N  
ATOM     51  CA  GLY A   4       4.755  -0.205   4.071  1.00  1.99           C  
ATOM     52  C   GLY A   4       6.172  -0.102   4.638  1.00  1.98           C  
ATOM     53  O   GLY A   4       6.510  -0.725   5.643  1.00  2.30           O  
ATOM     54  H   GLY A   4       4.053   1.073   2.498  1.00  2.28           H  
ATOM     55 1HA  GLY A   4       4.073  -0.529   4.855  1.00  2.39           H  
ATOM     56 2HA  GLY A   4       4.732  -0.976   3.296  1.00  2.39           H  
ATOM     57  N   CYS A   5       6.997   0.693   3.976  1.00  2.05           N  
ATOM     58  CA  CYS A   5       8.379   0.961   4.333  1.00  2.13           C  
ATOM     59  C   CYS A   5       8.638   2.411   3.957  1.00  2.05           C  
ATOM     60  O   CYS A   5       9.443   2.668   3.060  1.00  2.20           O  
ATOM     61  CB  CYS A   5       9.320   0.066   3.536  1.00  2.95           C  
ATOM     62  SG  CYS A   5       9.098  -1.673   3.837  1.00  2.95           S  
ATOM     63  H   CYS A   5       6.629   1.139   3.148  1.00  2.46           H  
ATOM     64  HA  CYS A   5       8.532   0.773   5.390  1.00  2.56           H  
ATOM     65 1HB  CYS A   5       9.147   0.240   2.471  1.00  3.54           H  
ATOM     66 2HB  CYS A   5      10.357   0.326   3.748  1.00  3.54           H  
ATOM     67  HG  CYS A   5       7.782  -1.592   4.103  1.00  3.54           H  
ATOM     68  N   PRO A   6       8.051   3.363   4.704  1.00  2.16           N  
ATOM     69  CA  PRO A   6       7.925   4.778   4.392  1.00  2.45           C  
ATOM     70  C   PRO A   6       9.256   5.498   4.284  1.00  2.42           C  
ATOM     71  O   PRO A   6       9.316   6.602   3.757  1.00  2.55           O  
ATOM     72  CB  PRO A   6       7.091   5.306   5.563  1.00  3.68           C  
ATOM     73  CG  PRO A   6       7.359   4.353   6.697  1.00  3.68           C  
ATOM     74  CD  PRO A   6       7.559   3.010   6.059  1.00  3.68           C  
ATOM     75  HA  PRO A   6       7.362   4.888   3.459  1.00  2.94           H  
ATOM     76 1HB  PRO A   6       7.380   6.341   5.795  1.00  4.42           H  
ATOM     77 2HB  PRO A   6       6.027   5.326   5.275  1.00  4.42           H  
ATOM     78 1HG  PRO A   6       8.235   4.685   7.273  1.00  4.42           H  
ATOM     79 2HG  PRO A   6       6.505   4.356   7.393  1.00  4.42           H  
ATOM     80 1HD  PRO A   6       8.324   2.489   6.645  1.00  4.42           H  
ATOM     81 2HD  PRO A   6       6.625   2.457   6.027  1.00  4.42           H  
ATOM     82  N   SER A   7      10.314   4.900   4.825  1.00  2.50           N  
ATOM     83  CA  SER A   7      11.636   5.490   4.787  1.00  2.61           C  
ATOM     84  C   SER A   7      12.257   5.546   3.389  1.00  2.27           C  
ATOM     85  O   SER A   7      13.215   6.299   3.185  1.00  2.47           O  
ATOM     86  CB  SER A   7      12.562   4.713   5.692  1.00  3.61           C  
ATOM     87  OG  SER A   7      12.762   3.417   5.194  1.00  3.61           O  
ATOM     88  H   SER A   7      10.227   3.994   5.256  1.00  3.00           H  
ATOM     89  HA  SER A   7      11.555   6.511   5.161  1.00  3.13           H  
ATOM     90 1HB  SER A   7      13.518   5.231   5.757  1.00  4.33           H  
ATOM     91 2HB  SER A   7      12.142   4.663   6.694  1.00  4.33           H  
ATOM     92  HG  SER A   7      13.488   3.045   5.696  1.00  4.33           H  
ATOM     93  N   ALA A   8      11.744   4.762   2.425  1.00  1.92           N  
ATOM     94  CA  ALA A   8      12.334   4.822   1.087  1.00  1.80           C  
ATOM     95  C   ALA A   8      11.392   4.372  -0.018  1.00  1.57           C  
ATOM     96  O   ALA A   8      10.867   3.256  -0.003  1.00  1.40           O  
ATOM     97  CB  ALA A   8      13.580   3.959   1.023  1.00  2.57           C  
ATOM     98  H   ALA A   8      10.954   4.140   2.635  1.00  2.30           H  
ATOM     99  HA  ALA A   8      12.608   5.860   0.892  1.00  2.16           H  
ATOM    100 1HB  ALA A   8      14.010   4.058   0.039  1.00  3.08           H  
ATOM    101 2HB  ALA A   8      14.295   4.292   1.773  1.00  3.08           H  
ATOM    102 3HB  ALA A   8      13.320   2.924   1.210  1.00  3.08           H  
ATOM    103  N   ALA A   9      11.380   5.168  -1.081  1.00  1.69           N  
ATOM    104  CA  ALA A   9      10.625   4.977  -2.321  1.00  1.62           C  
ATOM    105  C   ALA A   9      11.017   3.679  -3.013  1.00  1.44           C  
ATOM    106  O   ALA A   9      10.206   3.026  -3.673  1.00  1.34           O  
ATOM    107  CB  ALA A   9      10.846   6.162  -3.244  1.00  2.29           C  
ATOM    108  H   ALA A   9      11.915   6.027  -0.996  1.00  2.03           H  
ATOM    109  HA  ALA A   9       9.571   4.921  -2.070  1.00  1.94           H  
ATOM    110 1HB  ALA A   9      10.253   6.027  -4.131  1.00  2.75           H  
ATOM    111 2HB  ALA A   9      10.536   7.065  -2.750  1.00  2.75           H  
ATOM    112 3HB  ALA A   9      11.902   6.230  -3.502  1.00  2.75           H  
ATOM    113  N   ASP A  10      12.241   3.233  -2.776  1.00  1.52           N  
ATOM    114  CA  ASP A  10      12.742   2.031  -3.399  1.00  1.48           C  
ATOM    115  C   ASP A  10      12.148   0.807  -2.715  1.00  1.23           C  
ATOM    116  O   ASP A  10      11.891  -0.214  -3.368  1.00  1.19           O  
ATOM    117  CB  ASP A  10      14.268   1.986  -3.226  1.00  2.09           C  
ATOM    118  CG  ASP A  10      15.015   3.071  -4.015  1.00  2.09           C  
ATOM    119  OD1 ASP A  10      15.170   2.905  -5.208  1.00  2.09           O  
ATOM    120  OD2 ASP A  10      15.395   4.089  -3.436  1.00  2.09           O  
ATOM    121  H   ASP A  10      12.870   3.790  -2.212  1.00  1.82           H  
ATOM    122  HA  ASP A  10      12.467   2.027  -4.454  1.00  1.78           H  
ATOM    123 1HB  ASP A  10      14.512   2.080  -2.171  1.00  2.51           H  
ATOM    124 2HB  ASP A  10      14.632   1.011  -3.552  1.00  2.51           H  
ATOM    125  N   LYS A  11      11.904   0.900  -1.406  1.00  1.20           N  
ATOM    126  CA  LYS A  11      11.363  -0.233  -0.692  1.00  1.12           C  
ATOM    127  C   LYS A  11       9.863  -0.248  -0.928  1.00  0.93           C  
ATOM    128  O   LYS A  11       9.261  -1.315  -1.115  1.00  0.90           O  
ATOM    129  CB  LYS A  11      11.723  -0.158   0.791  1.00  1.61           C  
ATOM    130  CG  LYS A  11      13.225  -0.362   1.055  1.00  1.61           C  
ATOM    131  CD  LYS A  11      13.575  -0.327   2.548  1.00  1.61           C  
ATOM    132  CE  LYS A  11      15.086  -0.523   2.758  1.00  1.61           C  
ATOM    133  NZ  LYS A  11      15.474  -0.551   4.210  1.00  1.61           N  
ATOM    134  H   LYS A  11      12.043   1.773  -0.903  1.00  1.44           H  
ATOM    135  HA  LYS A  11      11.781  -1.150  -1.105  1.00  1.34           H  
ATOM    136 1HB  LYS A  11      11.428   0.819   1.191  1.00  1.93           H  
ATOM    137 2HB  LYS A  11      11.174  -0.922   1.337  1.00  1.93           H  
ATOM    138 1HG  LYS A  11      13.527  -1.325   0.642  1.00  1.93           H  
ATOM    139 2HG  LYS A  11      13.784   0.419   0.540  1.00  1.93           H  
ATOM    140 1HD  LYS A  11      13.276   0.637   2.968  1.00  1.93           H  
ATOM    141 2HD  LYS A  11      13.031  -1.116   3.070  1.00  1.93           H  
ATOM    142 1HE  LYS A  11      15.385  -1.463   2.298  1.00  1.93           H  
ATOM    143 2HE  LYS A  11      15.619   0.296   2.269  1.00  1.93           H  
ATOM    144 1HZ  LYS A  11      16.475  -0.687   4.279  1.00  1.93           H  
ATOM    145 2HZ  LYS A  11      15.228   0.316   4.673  1.00  1.93           H  
ATOM    146 3HZ  LYS A  11      15.001  -1.316   4.670  1.00  1.93           H  
ATOM    147  N   LEU A  12       9.268   0.949  -0.972  1.00  0.93           N  
ATOM    148  CA  LEU A  12       7.843   1.077  -1.174  1.00  0.93           C  
ATOM    149  C   LEU A  12       7.433   0.551  -2.537  1.00  0.87           C  
ATOM    150  O   LEU A  12       6.393  -0.106  -2.660  1.00  0.97           O  
ATOM    151  CB  LEU A  12       7.432   2.548  -1.054  1.00  1.30           C  
ATOM    152  CG  LEU A  12       7.548   3.214   0.320  1.00  1.30           C  
ATOM    153  CD1 LEU A  12       7.223   4.700   0.176  1.00  1.30           C  
ATOM    154  CD2 LEU A  12       6.638   2.528   1.260  1.00  1.30           C  
ATOM    155  H   LEU A  12       9.830   1.790  -0.807  1.00  1.12           H  
ATOM    156  HA  LEU A  12       7.332   0.465  -0.437  1.00  1.12           H  
ATOM    157 1HB  LEU A  12       8.025   3.129  -1.754  1.00  1.56           H  
ATOM    158 2HB  LEU A  12       6.407   2.638  -1.338  1.00  1.56           H  
ATOM    159  HG  LEU A  12       8.555   3.144   0.696  1.00  1.56           H  
ATOM    160 1HD1 LEU A  12       7.305   5.188   1.139  1.00  1.56           H  
ATOM    161 2HD1 LEU A  12       7.918   5.162  -0.511  1.00  1.56           H  
ATOM    162 3HD1 LEU A  12       6.213   4.818  -0.205  1.00  1.56           H  
ATOM    163 1HD2 LEU A  12       6.678   3.010   2.208  1.00  1.56           H  
ATOM    164 2HD2 LEU A  12       5.658   2.572   0.882  1.00  1.56           H  
ATOM    165 3HD2 LEU A  12       6.920   1.502   1.361  1.00  1.56           H  
ATOM    166  N   TRP A  13       8.235   0.828  -3.574  1.00  0.90           N  
ATOM    167  CA  TRP A  13       7.922   0.331  -4.901  1.00  1.01           C  
ATOM    168  C   TRP A  13       8.089  -1.169  -4.968  1.00  1.04           C  
ATOM    169  O   TRP A  13       7.229  -1.873  -5.496  1.00  1.23           O  
ATOM    170  CB  TRP A  13       8.755   1.016  -5.975  1.00  1.38           C  
ATOM    171  CG  TRP A  13       8.460   0.581  -7.444  1.00  1.38           C  
ATOM    172  CD1 TRP A  13       9.414   0.396  -8.396  1.00  1.38           C  
ATOM    173  CD2 TRP A  13       7.178   0.252  -8.112  1.00  1.38           C  
ATOM    174  NE1 TRP A  13       8.839   0.024  -9.594  1.00  1.38           N  
ATOM    175  CE2 TRP A  13       7.488  -0.081  -9.437  1.00  1.38           C  
ATOM    176  CE3 TRP A  13       5.822   0.223  -7.707  1.00  1.38           C  
ATOM    177  CZ2 TRP A  13       6.510  -0.437 -10.357  1.00  1.38           C  
ATOM    178  CZ3 TRP A  13       4.858  -0.139  -8.633  1.00  1.38           C  
ATOM    179  CH2 TRP A  13       5.190  -0.461  -9.925  1.00  1.38           C  
ATOM    180  H   TRP A  13       9.056   1.431  -3.452  1.00  1.08           H  
ATOM    181  HA  TRP A  13       6.884   0.566  -5.089  1.00  1.21           H  
ATOM    182 1HB  TRP A  13       8.676   2.082  -5.885  1.00  1.66           H  
ATOM    183 2HB  TRP A  13       9.804   0.787  -5.779  1.00  1.66           H  
ATOM    184  HD1 TRP A  13      10.480   0.553  -8.242  1.00  1.66           H  
ATOM    185  HE1 TRP A  13       9.343  -0.137 -10.491  1.00  1.66           H  
ATOM    186  HE3 TRP A  13       5.532   0.476  -6.715  1.00  1.66           H  
ATOM    187  HZ2 TRP A  13       6.765  -0.692 -11.385  1.00  1.66           H  
ATOM    188  HZ3 TRP A  13       3.824  -0.161  -8.308  1.00  1.66           H  
ATOM    189  HH2 TRP A  13       4.402  -0.739 -10.623  1.00  1.66           H  
ATOM    190  N   ASP A  14       9.173  -1.699  -4.377  1.00  1.01           N  
ATOM    191  CA  ASP A  14       9.376  -3.133  -4.474  1.00  1.21           C  
ATOM    192  C   ASP A  14       8.171  -3.879  -3.879  1.00  1.28           C  
ATOM    193  O   ASP A  14       7.771  -4.921  -4.398  1.00  1.54           O  
ATOM    194  CB  ASP A  14      10.679  -3.540  -3.773  1.00  1.62           C  
ATOM    195  CG  ASP A  14      11.148  -4.962  -4.132  1.00  1.62           C  
ATOM    196  OD1 ASP A  14      11.512  -5.174  -5.290  1.00  1.62           O  
ATOM    197  OD2 ASP A  14      11.165  -5.806  -3.269  1.00  1.62           O  
ATOM    198  H   ASP A  14       9.894  -1.123  -3.929  1.00  1.21           H  
ATOM    199  HA  ASP A  14       9.459  -3.391  -5.524  1.00  1.45           H  
ATOM    200 1HB  ASP A  14      11.467  -2.830  -4.034  1.00  1.94           H  
ATOM    201 2HB  ASP A  14      10.537  -3.474  -2.690  1.00  1.94           H  
ATOM    202  N   GLU A  15       7.556  -3.345  -2.818  1.00  1.17           N  
ATOM    203  CA  GLU A  15       6.361  -3.999  -2.308  1.00  1.44           C  
ATOM    204  C   GLU A  15       5.130  -3.720  -3.194  1.00  1.51           C  
ATOM    205  O   GLU A  15       4.442  -4.651  -3.621  1.00  1.82           O  
ATOM    206  CB  GLU A  15       6.038  -3.556  -0.882  1.00  1.91           C  
ATOM    207  CG  GLU A  15       4.811  -4.267  -0.294  1.00  1.91           C  
ATOM    208  CD  GLU A  15       4.459  -3.825   1.076  1.00  1.91           C  
ATOM    209  OE1 GLU A  15       5.208  -3.071   1.634  1.00  1.91           O  
ATOM    210  OE2 GLU A  15       3.420  -4.208   1.557  1.00  1.91           O  
ATOM    211  H   GLU A  15       7.963  -2.525  -2.350  1.00  1.40           H  
ATOM    212  HA  GLU A  15       6.539  -5.073  -2.304  1.00  1.73           H  
ATOM    213 1HB  GLU A  15       6.894  -3.752  -0.237  1.00  2.29           H  
ATOM    214 2HB  GLU A  15       5.854  -2.478  -0.868  1.00  2.29           H  
ATOM    215 1HG  GLU A  15       3.974  -4.105  -0.939  1.00  2.29           H  
ATOM    216 2HG  GLU A  15       5.009  -5.336  -0.277  1.00  2.29           H  
ATOM    217  N   ASN A  16       4.843  -2.436  -3.491  1.00  1.36           N  
ATOM    218  CA  ASN A  16       3.628  -2.040  -4.225  1.00  1.64           C  
ATOM    219  C   ASN A  16       3.497  -2.683  -5.597  1.00  1.44           C  
ATOM    220  O   ASN A  16       2.387  -3.042  -6.029  1.00  1.48           O  
ATOM    221  CB  ASN A  16       3.578  -0.533  -4.354  1.00  2.18           C  
ATOM    222  CG  ASN A  16       2.259   0.039  -4.854  1.00  2.18           C  
ATOM    223  OD1 ASN A  16       1.232  -0.042  -4.167  1.00  2.18           O  
ATOM    224  ND2 ASN A  16       2.284   0.625  -6.024  1.00  2.18           N  
ATOM    225  H   ASN A  16       5.464  -1.692  -3.156  1.00  1.63           H  
ATOM    226  HA  ASN A  16       2.767  -2.368  -3.653  1.00  1.97           H  
ATOM    227 1HB  ASN A  16       3.795  -0.099  -3.382  1.00  2.62           H  
ATOM    228 2HB  ASN A  16       4.367  -0.214  -5.011  1.00  2.62           H  
ATOM    229 1HD2 ASN A  16       1.459   1.069  -6.390  1.00  2.62           H  
ATOM    230 2HD2 ASN A  16       3.142   0.678  -6.530  1.00  2.62           H  
ATOM    231  N   LYS A  17       4.623  -2.902  -6.275  1.00  1.36           N  
ATOM    232  CA  LYS A  17       4.567  -3.482  -7.600  1.00  1.44           C  
ATOM    233  C   LYS A  17       3.898  -4.848  -7.569  1.00  1.45           C  
ATOM    234  O   LYS A  17       3.240  -5.216  -8.537  1.00  1.67           O  
ATOM    235  CB  LYS A  17       5.977  -3.607  -8.214  1.00  1.98           C  
ATOM    236  CG  LYS A  17       6.859  -4.658  -7.607  1.00  1.98           C  
ATOM    237  CD  LYS A  17       8.280  -4.643  -8.194  1.00  1.98           C  
ATOM    238  CE  LYS A  17       9.153  -5.746  -7.544  1.00  1.98           C  
ATOM    239  NZ  LYS A  17      10.585  -5.688  -7.980  1.00  1.98           N  
ATOM    240  H   LYS A  17       5.523  -2.590  -5.893  1.00  1.63           H  
ATOM    241  HA  LYS A  17       3.969  -2.835  -8.237  1.00  1.73           H  
ATOM    242 1HB  LYS A  17       5.919  -3.782  -9.265  1.00  2.38           H  
ATOM    243 2HB  LYS A  17       6.502  -2.670  -8.074  1.00  2.38           H  
ATOM    244 1HG  LYS A  17       6.905  -4.478  -6.554  1.00  2.38           H  
ATOM    245 2HG  LYS A  17       6.435  -5.643  -7.773  1.00  2.38           H  
ATOM    246 1HD  LYS A  17       8.235  -4.813  -9.268  1.00  2.38           H  
ATOM    247 2HD  LYS A  17       8.738  -3.668  -8.012  1.00  2.38           H  
ATOM    248 1HE  LYS A  17       9.115  -5.630  -6.468  1.00  2.38           H  
ATOM    249 2HE  LYS A  17       8.747  -6.722  -7.806  1.00  2.38           H  
ATOM    250 1HZ  LYS A  17      11.106  -6.418  -7.511  1.00  2.38           H  
ATOM    251 2HZ  LYS A  17      10.672  -5.813  -9.002  1.00  2.38           H  
ATOM    252 3HZ  LYS A  17      10.980  -4.790  -7.727  1.00  2.38           H  
ATOM    253  N   SER A  18       3.947  -5.574  -6.440  1.00  1.42           N  
ATOM    254  CA  SER A  18       3.362  -6.907  -6.389  1.00  1.63           C  
ATOM    255  C   SER A  18       1.851  -6.911  -6.595  1.00  1.61           C  
ATOM    256  O   SER A  18       1.273  -7.942  -6.944  1.00  1.89           O  
ATOM    257  CB  SER A  18       3.674  -7.561  -5.057  1.00  2.20           C  
ATOM    258  OG  SER A  18       3.002  -6.917  -4.006  1.00  2.20           O  
ATOM    259  H   SER A  18       4.410  -5.227  -5.596  1.00  1.70           H  
ATOM    260  HA  SER A  18       3.815  -7.502  -7.182  1.00  1.96           H  
ATOM    261 1HB  SER A  18       3.376  -8.606  -5.094  1.00  2.64           H  
ATOM    262 2HB  SER A  18       4.749  -7.528  -4.877  1.00  2.64           H  
ATOM    263  HG  SER A  18       3.528  -6.114  -3.800  1.00  2.64           H  
ATOM    264  N   HIS A  19       1.201  -5.772  -6.369  1.00  1.39           N  
ATOM    265  CA  HIS A  19      -0.235  -5.677  -6.530  1.00  1.46           C  
ATOM    266  C   HIS A  19      -0.611  -5.110  -7.896  1.00  1.34           C  
ATOM    267  O   HIS A  19      -1.548  -5.584  -8.535  1.00  1.51           O  
ATOM    268  CB  HIS A  19      -0.864  -4.811  -5.437  1.00  2.01           C  
ATOM    269  CG  HIS A  19      -2.368  -4.859  -5.447  1.00  2.01           C  
ATOM    270  ND1 HIS A  19      -3.075  -5.956  -4.987  1.00  2.01           N  
ATOM    271  CD2 HIS A  19      -3.295  -3.978  -5.885  1.00  2.01           C  
ATOM    272  CE1 HIS A  19      -4.369  -5.732  -5.127  1.00  2.01           C  
ATOM    273  NE2 HIS A  19      -4.529  -4.543  -5.667  1.00  2.01           N  
ATOM    274  H   HIS A  19       1.733  -4.948  -6.093  1.00  1.67           H  
ATOM    275  HA  HIS A  19      -0.674  -6.670  -6.458  1.00  1.75           H  
ATOM    276 1HB  HIS A  19      -0.512  -5.146  -4.461  1.00  2.41           H  
ATOM    277 2HB  HIS A  19      -0.545  -3.782  -5.559  1.00  2.41           H  
ATOM    278  HD1 HIS A  19      -2.692  -6.862  -4.807  1.00  2.41           H  
ATOM    279  HD2 HIS A  19      -3.226  -3.005  -6.336  1.00  2.41           H  
ATOM    280  HE1 HIS A  19      -5.098  -6.479  -4.818  1.00  2.41           H  
ATOM    281  N   PHE A  20       0.102  -4.065  -8.332  1.00  1.17           N  
ATOM    282  CA  PHE A  20      -0.282  -3.345  -9.551  1.00  1.15           C  
ATOM    283  C   PHE A  20       0.519  -3.607 -10.841  1.00  1.06           C  
ATOM    284  O   PHE A  20       0.039  -3.297 -11.946  1.00  1.09           O  
ATOM    285  CB  PHE A  20      -0.157  -1.854  -9.280  1.00  1.62           C  
ATOM    286  CG  PHE A  20      -1.057  -1.304  -8.238  1.00  1.62           C  
ATOM    287  CD1 PHE A  20      -0.649  -1.246  -6.922  1.00  1.62           C  
ATOM    288  CD2 PHE A  20      -2.305  -0.807  -8.572  1.00  1.62           C  
ATOM    289  CE1 PHE A  20      -1.477  -0.726  -5.956  1.00  1.62           C  
ATOM    290  CE2 PHE A  20      -3.127  -0.282  -7.606  1.00  1.62           C  
ATOM    291  CZ  PHE A  20      -2.721  -0.243  -6.300  1.00  1.62           C  
ATOM    292  H   PHE A  20       0.882  -3.737  -7.758  1.00  1.40           H  
ATOM    293  HA  PHE A  20      -1.328  -3.583  -9.754  1.00  1.38           H  
ATOM    294 1HB  PHE A  20       0.871  -1.618  -9.008  1.00  1.94           H  
ATOM    295 2HB  PHE A  20      -0.379  -1.353 -10.178  1.00  1.94           H  
ATOM    296  HD1 PHE A  20       0.340  -1.624  -6.643  1.00  1.94           H  
ATOM    297  HD2 PHE A  20      -2.635  -0.837  -9.616  1.00  1.94           H  
ATOM    298  HE1 PHE A  20      -1.145  -0.695  -4.915  1.00  1.94           H  
ATOM    299  HE2 PHE A  20      -4.095   0.099  -7.873  1.00  1.94           H  
ATOM    300  HZ  PHE A  20      -3.383   0.170  -5.533  1.00  1.94           H  
ATOM    301  N   ILE A  21       1.723  -4.173 -10.736  1.00  1.02           N  
ATOM    302  CA  ILE A  21       2.564  -4.296 -11.918  1.00  1.02           C  
ATOM    303  C   ILE A  21       1.913  -5.217 -12.935  1.00  0.99           C  
ATOM    304  O   ILE A  21       2.095  -5.013 -14.129  1.00  0.93           O  
ATOM    305  CB  ILE A  21       3.992  -4.756 -11.551  1.00  1.43           C  
ATOM    306  CG1 ILE A  21       4.972  -4.410 -12.699  1.00  1.43           C  
ATOM    307  CG2 ILE A  21       4.031  -6.301 -11.294  1.00  1.43           C  
ATOM    308  CD1 ILE A  21       6.453  -4.463 -12.311  1.00  1.43           C  
ATOM    309  H   ILE A  21       2.089  -4.469  -9.830  1.00  1.22           H  
ATOM    310  HA  ILE A  21       2.652  -3.312 -12.372  1.00  1.22           H  
ATOM    311  HB  ILE A  21       4.295  -4.233 -10.671  1.00  1.72           H  
ATOM    312 1HG1 ILE A  21       4.812  -5.099 -13.505  1.00  1.72           H  
ATOM    313 2HG1 ILE A  21       4.752  -3.410 -13.056  1.00  1.72           H  
ATOM    314 1HG2 ILE A  21       5.029  -6.601 -11.009  1.00  1.72           H  
ATOM    315 2HG2 ILE A  21       3.352  -6.567 -10.496  1.00  1.72           H  
ATOM    316 3HG2 ILE A  21       3.750  -6.845 -12.191  1.00  1.72           H  
ATOM    317 1HD1 ILE A  21       7.060  -4.214 -13.162  1.00  1.72           H  
ATOM    318 2HD1 ILE A  21       6.647  -3.747 -11.515  1.00  1.72           H  
ATOM    319 3HD1 ILE A  21       6.725  -5.455 -11.974  1.00  1.72           H  
ATOM    320  N   GLU A  22       1.137  -6.208 -12.482  1.00  1.12           N  
ATOM    321  CA  GLU A  22       0.459  -7.128 -13.381  1.00  1.20           C  
ATOM    322  C   GLU A  22      -0.546  -6.445 -14.314  1.00  1.12           C  
ATOM    323  O   GLU A  22      -0.760  -6.921 -15.438  1.00  1.14           O  
ATOM    324  CB  GLU A  22      -0.237  -8.241 -12.601  1.00  1.65           C  
ATOM    325  CG  GLU A  22       0.720  -9.240 -11.958  1.00  1.65           C  
ATOM    326  CD  GLU A  22       0.008 -10.358 -11.235  1.00  1.65           C  
ATOM    327  OE1 GLU A  22      -1.191 -10.286 -11.103  1.00  1.65           O  
ATOM    328  OE2 GLU A  22       0.662 -11.290 -10.833  1.00  1.65           O  
ATOM    329  H   GLU A  22       1.062  -6.355 -11.482  1.00  1.34           H  
ATOM    330  HA  GLU A  22       1.216  -7.602 -13.996  1.00  1.44           H  
ATOM    331 1HB  GLU A  22      -0.847  -7.801 -11.810  1.00  1.98           H  
ATOM    332 2HB  GLU A  22      -0.906  -8.788 -13.265  1.00  1.98           H  
ATOM    333 1HG  GLU A  22       1.354  -9.667 -12.733  1.00  1.98           H  
ATOM    334 2HG  GLU A  22       1.362  -8.709 -11.254  1.00  1.98           H  
ATOM    335  N   ASP A  23      -1.203  -5.355 -13.879  1.00  1.13           N  
ATOM    336  CA  ASP A  23      -2.163  -4.726 -14.779  1.00  1.20           C  
ATOM    337  C   ASP A  23      -1.369  -4.073 -15.887  1.00  1.08           C  
ATOM    338  O   ASP A  23      -1.723  -4.130 -17.074  1.00  1.20           O  
ATOM    339  CB  ASP A  23      -2.989  -3.661 -14.060  1.00  1.65           C  
ATOM    340  CG  ASP A  23      -4.021  -4.200 -13.074  1.00  1.65           C  
ATOM    341  OD1 ASP A  23      -4.388  -5.352 -13.137  1.00  1.65           O  
ATOM    342  OD2 ASP A  23      -4.412  -3.428 -12.237  1.00  1.65           O  
ATOM    343  H   ASP A  23      -1.019  -4.936 -12.964  1.00  1.36           H  
ATOM    344  HA  ASP A  23      -2.820  -5.486 -15.203  1.00  1.44           H  
ATOM    345 1HB  ASP A  23      -2.312  -3.000 -13.513  1.00  1.98           H  
ATOM    346 2HB  ASP A  23      -3.505  -3.052 -14.800  1.00  1.98           H  
ATOM    347  N   PHE A  24      -0.253  -3.474 -15.484  1.00  0.94           N  
ATOM    348  CA  PHE A  24       0.630  -2.837 -16.433  1.00  0.95           C  
ATOM    349  C   PHE A  24       1.232  -3.860 -17.378  1.00  0.88           C  
ATOM    350  O   PHE A  24       1.302  -3.621 -18.579  1.00  0.99           O  
ATOM    351  CB  PHE A  24       1.723  -2.053 -15.764  1.00  1.33           C  
ATOM    352  CG  PHE A  24       2.546  -1.354 -16.748  1.00  1.33           C  
ATOM    353  CD1 PHE A  24       2.050  -0.253 -17.390  1.00  1.33           C  
ATOM    354  CD2 PHE A  24       3.812  -1.744 -17.028  1.00  1.33           C  
ATOM    355  CE1 PHE A  24       2.809   0.432 -18.286  1.00  1.33           C  
ATOM    356  CE2 PHE A  24       4.559  -1.046 -17.925  1.00  1.33           C  
ATOM    357  CZ  PHE A  24       4.056   0.038 -18.551  1.00  1.33           C  
ATOM    358  H   PHE A  24      -0.052  -3.452 -14.476  1.00  1.13           H  
ATOM    359  HA  PHE A  24       0.039  -2.143 -17.028  1.00  1.14           H  
ATOM    360 1HB  PHE A  24       1.294  -1.327 -15.088  1.00  1.60           H  
ATOM    361 2HB  PHE A  24       2.362  -2.718 -15.184  1.00  1.60           H  
ATOM    362  HD1 PHE A  24       1.035   0.079 -17.181  1.00  1.60           H  
ATOM    363  HD2 PHE A  24       4.215  -2.609 -16.523  1.00  1.60           H  
ATOM    364  HE1 PHE A  24       2.408   1.298 -18.783  1.00  1.60           H  
ATOM    365  HE2 PHE A  24       5.551  -1.343 -18.149  1.00  1.60           H  
ATOM    366  HZ  PHE A  24       4.658   0.590 -19.269  1.00  1.60           H  
ATOM    367  N   CYS A  25       1.700  -4.990 -16.838  1.00  0.84           N  
ATOM    368  CA  CYS A  25       2.343  -6.023 -17.637  1.00  0.91           C  
ATOM    369  C   CYS A  25       1.407  -6.500 -18.726  1.00  0.95           C  
ATOM    370  O   CYS A  25       1.837  -6.723 -19.856  1.00  0.99           O  
ATOM    371  CB  CYS A  25       2.724  -7.237 -16.784  1.00  1.25           C  
ATOM    372  SG  CYS A  25       4.033  -6.965 -15.555  1.00  1.25           S  
ATOM    373  H   CYS A  25       1.620  -5.112 -15.834  1.00  1.01           H  
ATOM    374  HA  CYS A  25       3.227  -5.607 -18.105  1.00  1.09           H  
ATOM    375 1HB  CYS A  25       1.841  -7.597 -16.268  1.00  1.50           H  
ATOM    376 2HB  CYS A  25       3.057  -8.036 -17.446  1.00  1.50           H  
ATOM    377  HG  CYS A  25       3.320  -6.094 -14.799  1.00  1.50           H  
ATOM    378  N   TRP A  26       0.117  -6.655 -18.414  1.00  1.02           N  
ATOM    379  CA  TRP A  26      -0.832  -7.068 -19.436  1.00  1.18           C  
ATOM    380  C   TRP A  26      -0.865  -6.023 -20.559  1.00  1.21           C  
ATOM    381  O   TRP A  26      -0.714  -6.360 -21.742  1.00  1.31           O  
ATOM    382  CB  TRP A  26      -2.218  -7.245 -18.804  1.00  1.59           C  
ATOM    383  CG  TRP A  26      -3.313  -7.700 -19.734  1.00  1.59           C  
ATOM    384  CD1 TRP A  26      -3.617  -8.988 -20.050  1.00  1.59           C  
ATOM    385  CD2 TRP A  26      -4.274  -6.879 -20.442  1.00  1.59           C  
ATOM    386  NE1 TRP A  26      -4.692  -9.026 -20.900  1.00  1.59           N  
ATOM    387  CE2 TRP A  26      -5.108  -7.744 -21.146  1.00  1.59           C  
ATOM    388  CE3 TRP A  26      -4.493  -5.510 -20.524  1.00  1.59           C  
ATOM    389  CZ2 TRP A  26      -6.153  -7.279 -21.930  1.00  1.59           C  
ATOM    390  CZ3 TRP A  26      -5.529  -5.037 -21.308  1.00  1.59           C  
ATOM    391  CH2 TRP A  26      -6.340  -5.899 -21.995  1.00  1.59           C  
ATOM    392  H   TRP A  26      -0.191  -6.535 -17.441  1.00  1.22           H  
ATOM    393  HA  TRP A  26      -0.508  -8.019 -19.852  1.00  1.42           H  
ATOM    394 1HB  TRP A  26      -2.143  -7.966 -17.990  1.00  1.91           H  
ATOM    395 2HB  TRP A  26      -2.526  -6.301 -18.355  1.00  1.91           H  
ATOM    396  HD1 TRP A  26      -3.087  -9.863 -19.677  1.00  1.91           H  
ATOM    397  HE1 TRP A  26      -5.114  -9.864 -21.277  1.00  1.91           H  
ATOM    398  HE3 TRP A  26      -3.862  -4.836 -19.982  1.00  1.91           H  
ATOM    399  HZ2 TRP A  26      -6.810  -7.951 -22.483  1.00  1.91           H  
ATOM    400  HZ3 TRP A  26      -5.685  -3.960 -21.362  1.00  1.91           H  
ATOM    401  HH2 TRP A  26      -7.150  -5.497 -22.602  1.00  1.91           H  
ATOM    402  N   LYS A  27      -1.002  -4.740 -20.191  1.00  1.19           N  
ATOM    403  CA  LYS A  27      -1.062  -3.692 -21.207  1.00  1.32           C  
ATOM    404  C   LYS A  27       0.234  -3.565 -22.017  1.00  1.26           C  
ATOM    405  O   LYS A  27       0.189  -3.429 -23.249  1.00  1.40           O  
ATOM    406  CB  LYS A  27      -1.385  -2.337 -20.567  1.00  1.80           C  
ATOM    407  CG  LYS A  27      -2.813  -2.201 -20.049  1.00  1.80           C  
ATOM    408  CD  LYS A  27      -3.079  -0.827 -19.441  1.00  1.80           C  
ATOM    409  CE  LYS A  27      -4.531  -0.706 -18.970  1.00  1.80           C  
ATOM    410  NZ  LYS A  27      -4.831   0.632 -18.376  1.00  1.80           N  
ATOM    411  H   LYS A  27      -1.106  -4.509 -19.194  1.00  1.43           H  
ATOM    412  HA  LYS A  27      -1.861  -3.944 -21.902  1.00  1.58           H  
ATOM    413 1HB  LYS A  27      -0.711  -2.171 -19.721  1.00  2.16           H  
ATOM    414 2HB  LYS A  27      -1.205  -1.539 -21.286  1.00  2.16           H  
ATOM    415 1HG  LYS A  27      -3.518  -2.389 -20.858  1.00  2.16           H  
ATOM    416 2HG  LYS A  27      -2.966  -2.942 -19.268  1.00  2.16           H  
ATOM    417 1HD  LYS A  27      -2.414  -0.677 -18.585  1.00  2.16           H  
ATOM    418 2HD  LYS A  27      -2.875  -0.046 -20.176  1.00  2.16           H  
ATOM    419 1HE  LYS A  27      -5.190  -0.867 -19.821  1.00  2.16           H  
ATOM    420 2HE  LYS A  27      -4.727  -1.475 -18.222  1.00  2.16           H  
ATOM    421 1HZ  LYS A  27      -5.809   0.668 -18.082  1.00  2.16           H  
ATOM    422 2HZ  LYS A  27      -4.241   0.806 -17.567  1.00  2.16           H  
ATOM    423 3HZ  LYS A  27      -4.668   1.360 -19.060  1.00  2.16           H  
ATOM    424  N   LEU A  28       1.386  -3.627 -21.340  1.00  1.11           N  
ATOM    425  CA  LEU A  28       2.669  -3.503 -22.006  1.00  1.14           C  
ATOM    426  C   LEU A  28       2.836  -4.686 -22.935  1.00  1.13           C  
ATOM    427  O   LEU A  28       3.231  -4.524 -24.090  1.00  1.25           O  
ATOM    428  CB  LEU A  28       3.858  -3.423 -21.018  1.00  1.59           C  
ATOM    429  CG  LEU A  28       5.271  -3.058 -21.693  1.00  1.59           C  
ATOM    430  CD1 LEU A  28       6.218  -2.418 -20.700  1.00  1.59           C  
ATOM    431  CD2 LEU A  28       5.941  -4.274 -22.243  1.00  1.59           C  
ATOM    432  H   LEU A  28       1.360  -3.734 -20.330  1.00  1.33           H  
ATOM    433  HA  LEU A  28       2.665  -2.591 -22.600  1.00  1.37           H  
ATOM    434 1HB  LEU A  28       3.628  -2.670 -20.264  1.00  1.91           H  
ATOM    435 2HB  LEU A  28       3.958  -4.387 -20.510  1.00  1.91           H  
ATOM    436  HG  LEU A  28       5.100  -2.335 -22.480  1.00  1.91           H  
ATOM    437 1HD1 LEU A  28       7.154  -2.170 -21.211  1.00  1.91           H  
ATOM    438 2HD1 LEU A  28       5.775  -1.520 -20.335  1.00  1.91           H  
ATOM    439 3HD1 LEU A  28       6.428  -3.093 -19.887  1.00  1.91           H  
ATOM    440 1HD2 LEU A  28       6.881  -3.959 -22.677  1.00  1.91           H  
ATOM    441 2HD2 LEU A  28       6.101  -4.937 -21.464  1.00  1.91           H  
ATOM    442 3HD2 LEU A  28       5.391  -4.766 -22.982  1.00  1.91           H  
ATOM    443  N   HIS A  29       2.541  -5.899 -22.467  1.00  1.09           N  
ATOM    444  CA  HIS A  29       2.697  -7.075 -23.304  1.00  1.24           C  
ATOM    445  C   HIS A  29       1.978  -6.877 -24.631  1.00  1.41           C  
ATOM    446  O   HIS A  29       2.529  -7.158 -25.700  1.00  1.55           O  
ATOM    447  CB  HIS A  29       2.155  -8.321 -22.610  1.00  1.68           C  
ATOM    448  CG  HIS A  29       2.224  -9.536 -23.457  1.00  1.68           C  
ATOM    449  ND1 HIS A  29       3.409 -10.184 -23.746  1.00  1.68           N  
ATOM    450  CD2 HIS A  29       1.251 -10.228 -24.093  1.00  1.68           C  
ATOM    451  CE1 HIS A  29       3.158 -11.225 -24.519  1.00  1.68           C  
ATOM    452  NE2 HIS A  29       1.858 -11.273 -24.745  1.00  1.68           N  
ATOM    453  H   HIS A  29       2.222  -6.031 -21.506  1.00  1.31           H  
ATOM    454  HA  HIS A  29       3.751  -7.238 -23.497  1.00  1.49           H  
ATOM    455 1HB  HIS A  29       2.711  -8.502 -21.695  1.00  2.02           H  
ATOM    456 2HB  HIS A  29       1.116  -8.156 -22.327  1.00  2.02           H  
ATOM    457  HD2 HIS A  29       0.185  -9.993 -24.087  1.00  2.02           H  
ATOM    458  HE1 HIS A  29       3.899 -11.922 -24.908  1.00  2.02           H  
ATOM    459  HE2 HIS A  29       1.381 -11.965 -25.307  1.00  2.02           H  
ATOM    460  N   ARG A  30       0.727  -6.420 -24.566  1.00  1.49           N  
ATOM    461  CA  ARG A  30      -0.049  -6.171 -25.769  1.00  1.77           C  
ATOM    462  C   ARG A  30       0.552  -5.088 -26.695  1.00  1.84           C  
ATOM    463  O   ARG A  30       0.559  -5.257 -27.917  1.00  2.02           O  
ATOM    464  CB  ARG A  30      -1.455  -5.773 -25.366  1.00  2.37           C  
ATOM    465  CG  ARG A  30      -2.276  -6.909 -24.794  1.00  2.37           C  
ATOM    466  CD  ARG A  30      -3.537  -6.436 -24.198  1.00  2.37           C  
ATOM    467  NE  ARG A  30      -4.434  -5.801 -25.164  1.00  2.37           N  
ATOM    468  CZ  ARG A  30      -5.326  -6.446 -25.951  1.00  2.37           C  
ATOM    469  NH1 ARG A  30      -5.446  -7.759 -25.900  1.00  2.37           N  
ATOM    470  NH2 ARG A  30      -6.085  -5.747 -26.782  1.00  2.37           N  
ATOM    471  H   ARG A  30       0.303  -6.257 -23.643  1.00  1.79           H  
ATOM    472  HA  ARG A  30      -0.102  -7.104 -26.326  1.00  2.12           H  
ATOM    473 1HB  ARG A  30      -1.407  -4.991 -24.609  1.00  2.84           H  
ATOM    474 2HB  ARG A  30      -1.979  -5.369 -26.228  1.00  2.84           H  
ATOM    475 1HG  ARG A  30      -2.506  -7.621 -25.582  1.00  2.84           H  
ATOM    476 2HG  ARG A  30      -1.705  -7.408 -24.010  1.00  2.84           H  
ATOM    477 1HD  ARG A  30      -4.036  -7.281 -23.762  1.00  2.84           H  
ATOM    478 2HD  ARG A  30      -3.308  -5.712 -23.415  1.00  2.84           H  
ATOM    479  HE  ARG A  30      -4.391  -4.792 -25.239  1.00  2.84           H  
ATOM    480 1HH1 ARG A  30      -4.873  -8.298 -25.270  1.00  2.84           H  
ATOM    481 2HH1 ARG A  30      -6.115  -8.229 -26.494  1.00  2.84           H  
ATOM    482 1HH2 ARG A  30      -5.996  -4.740 -26.824  1.00  2.84           H  
ATOM    483 2HH2 ARG A  30      -6.753  -6.216 -27.376  1.00  2.84           H  
ATOM    484  N   ARG A  31       1.053  -3.984 -26.115  1.00  1.75           N  
ATOM    485  CA  ARG A  31       1.600  -2.861 -26.892  1.00  1.90           C  
ATOM    486  C   ARG A  31       3.092  -2.934 -27.284  1.00  1.75           C  
ATOM    487  O   ARG A  31       3.445  -2.661 -28.433  1.00  1.90           O  
ATOM    488  CB  ARG A  31       1.371  -1.560 -26.120  1.00  2.60           C  
ATOM    489  CG  ARG A  31       1.799  -0.260 -26.844  1.00  2.60           C  
ATOM    490  CD  ARG A  31       1.471   0.974 -26.036  1.00  2.60           C  
ATOM    491  NE  ARG A  31       2.302   1.135 -24.809  1.00  2.60           N  
ATOM    492  CZ  ARG A  31       1.897   1.699 -23.643  1.00  2.60           C  
ATOM    493  NH1 ARG A  31       0.682   2.148 -23.436  1.00  2.60           N  
ATOM    494  NH2 ARG A  31       2.754   1.816 -22.668  1.00  2.60           N  
ATOM    495  H   ARG A  31       0.964  -3.891 -25.097  1.00  2.10           H  
ATOM    496  HA  ARG A  31       1.022  -2.805 -27.814  1.00  2.28           H  
ATOM    497 1HB  ARG A  31       0.316  -1.471 -25.873  1.00  3.12           H  
ATOM    498 2HB  ARG A  31       1.917  -1.609 -25.176  1.00  3.12           H  
ATOM    499 1HG  ARG A  31       2.873  -0.267 -27.021  1.00  3.12           H  
ATOM    500 2HG  ARG A  31       1.280  -0.193 -27.799  1.00  3.12           H  
ATOM    501 1HD  ARG A  31       1.625   1.853 -26.663  1.00  3.12           H  
ATOM    502 2HD  ARG A  31       0.427   0.922 -25.743  1.00  3.12           H  
ATOM    503  HE  ARG A  31       3.301   0.859 -24.831  1.00  3.12           H  
ATOM    504 1HH1 ARG A  31      -0.027   2.094 -24.145  1.00  3.12           H  
ATOM    505 2HH1 ARG A  31       0.485   2.567 -22.508  1.00  3.12           H  
ATOM    506 1HH2 ARG A  31       3.721   1.489 -22.811  1.00  3.12           H  
ATOM    507 2HH2 ARG A  31       2.432   2.260 -21.795  1.00  3.12           H  
ATOM    508  N   GLU A  32       3.968  -3.197 -26.313  1.00  1.65           N  
ATOM    509  CA  GLU A  32       5.422  -3.175 -26.499  1.00  1.75           C  
ATOM    510  C   GLU A  32       6.088  -4.557 -26.414  1.00  1.56           C  
ATOM    511  O   GLU A  32       7.189  -4.757 -26.931  1.00  1.79           O  
ATOM    512  CB  GLU A  32       6.041  -2.285 -25.434  1.00  2.41           C  
ATOM    513  CG  GLU A  32       5.531  -0.864 -25.437  1.00  2.41           C  
ATOM    514  CD  GLU A  32       6.077  -0.030 -24.318  1.00  2.41           C  
ATOM    515  OE1 GLU A  32       7.168  -0.286 -23.872  1.00  2.41           O  
ATOM    516  OE2 GLU A  32       5.359   0.846 -23.873  1.00  2.41           O  
ATOM    517  H   GLU A  32       3.597  -3.433 -25.405  1.00  1.98           H  
ATOM    518  HA  GLU A  32       5.633  -2.757 -27.483  1.00  2.10           H  
ATOM    519 1HB  GLU A  32       5.844  -2.707 -24.494  1.00  2.89           H  
ATOM    520 2HB  GLU A  32       7.123  -2.263 -25.558  1.00  2.89           H  
ATOM    521 1HG  GLU A  32       5.775  -0.398 -26.390  1.00  2.89           H  
ATOM    522 2HG  GLU A  32       4.457  -0.894 -25.342  1.00  2.89           H  
ATOM    523  N   GLY A  33       5.505  -5.473 -25.638  1.00  1.37           N  
ATOM    524  CA  GLY A  33       6.054  -6.829 -25.436  1.00  1.45           C  
ATOM    525  C   GLY A  33       7.156  -6.933 -24.364  1.00  1.33           C  
ATOM    526  O   GLY A  33       7.162  -7.830 -23.507  1.00  1.40           O  
ATOM    527  H   GLY A  33       4.623  -5.222 -25.187  1.00  1.64           H  
ATOM    528 1HA  GLY A  33       5.239  -7.507 -25.189  1.00  1.74           H  
ATOM    529 2HA  GLY A  33       6.449  -7.184 -26.385  1.00  1.74           H  
ATOM    530  N   ALA A  34       8.076  -5.978 -24.386  1.00  1.41           N  
ATOM    531  CA  ALA A  34       9.251  -5.949 -23.509  1.00  1.54           C  
ATOM    532  C   ALA A  34       8.930  -5.642 -22.048  1.00  1.28           C  
ATOM    533  O   ALA A  34       9.288  -4.581 -21.526  1.00  1.14           O  
ATOM    534  CB  ALA A  34      10.226  -4.901 -24.017  1.00  2.10           C  
ATOM    535  H   ALA A  34       7.971  -5.298 -25.143  1.00  1.69           H  
ATOM    536  HA  ALA A  34       9.718  -6.934 -23.553  1.00  1.85           H  
ATOM    537 1HB  ALA A  34      11.121  -4.897 -23.402  1.00  2.52           H  
ATOM    538 2HB  ALA A  34      10.495  -5.126 -25.049  1.00  2.52           H  
ATOM    539 3HB  ALA A  34       9.750  -3.920 -23.972  1.00  2.52           H  
ATOM    540  N   CYS A  35       8.344  -6.625 -21.360  1.00  1.44           N  
ATOM    541  CA  CYS A  35       7.885  -6.492 -19.966  1.00  1.42           C  
ATOM    542  C   CYS A  35       9.011  -6.383 -18.961  1.00  1.39           C  
ATOM    543  O   CYS A  35       8.802  -6.076 -17.787  1.00  1.41           O  
ATOM    544  CB  CYS A  35       6.945  -7.632 -19.588  1.00  2.00           C  
ATOM    545  SG  CYS A  35       5.348  -7.569 -20.465  1.00  2.00           S  
ATOM    546  H   CYS A  35       8.106  -7.456 -21.907  1.00  1.73           H  
ATOM    547  HA  CYS A  35       7.323  -5.575 -19.883  1.00  1.70           H  
ATOM    548 1HB  CYS A  35       7.417  -8.590 -19.804  1.00  2.40           H  
ATOM    549 2HB  CYS A  35       6.742  -7.595 -18.519  1.00  2.40           H  
ATOM    550  HG  CYS A  35       5.816  -7.992 -21.653  1.00  2.40           H  
ATOM    551  N   VAL A  36      10.223  -6.510 -19.450  1.00  1.52           N  
ATOM    552  CA  VAL A  36      11.421  -6.330 -18.658  1.00  1.80           C  
ATOM    553  C   VAL A  36      11.488  -4.880 -18.151  1.00  1.73           C  
ATOM    554  O   VAL A  36      12.175  -4.583 -17.176  1.00  2.08           O  
ATOM    555  CB  VAL A  36      12.666  -6.674 -19.506  1.00  2.41           C  
ATOM    556  CG1 VAL A  36      12.594  -8.134 -19.939  1.00  2.41           C  
ATOM    557  CG2 VAL A  36      12.751  -5.752 -20.742  1.00  2.41           C  
ATOM    558  H   VAL A  36      10.288  -6.762 -20.422  1.00  1.82           H  
ATOM    559  HA  VAL A  36      11.380  -7.002 -17.801  1.00  2.16           H  
ATOM    560  HB  VAL A  36      13.560  -6.550 -18.894  1.00  2.89           H  
ATOM    561 1HG1 VAL A  36      13.483  -8.387 -20.519  1.00  2.89           H  
ATOM    562 2HG1 VAL A  36      12.546  -8.768 -19.054  1.00  2.89           H  
ATOM    563 3HG1 VAL A  36      11.710  -8.300 -20.547  1.00  2.89           H  
ATOM    564 1HG2 VAL A  36      13.635  -6.012 -21.321  1.00  2.89           H  
ATOM    565 2HG2 VAL A  36      11.874  -5.873 -21.359  1.00  2.89           H  
ATOM    566 3HG2 VAL A  36      12.831  -4.719 -20.433  1.00  2.89           H  
ATOM    567  N   ASN A  37      10.759  -3.982 -18.830  1.00  1.45           N  
ATOM    568  CA  ASN A  37      10.706  -2.577 -18.496  1.00  1.63           C  
ATOM    569  C   ASN A  37       9.504  -2.212 -17.604  1.00  1.36           C  
ATOM    570  O   ASN A  37       9.267  -1.032 -17.304  1.00  1.38           O  
ATOM    571  CB  ASN A  37      10.641  -1.798 -19.789  1.00  2.21           C  
ATOM    572  CG  ASN A  37      11.881  -1.954 -20.625  1.00  2.21           C  
ATOM    573  OD1 ASN A  37      13.013  -2.016 -20.130  1.00  2.21           O  
ATOM    574  ND2 ASN A  37      11.683  -2.032 -21.914  1.00  2.21           N  
ATOM    575  H   ASN A  37      10.216  -4.304 -19.638  1.00  1.74           H  
ATOM    576  HA  ASN A  37      11.614  -2.318 -17.954  1.00  1.96           H  
ATOM    577 1HB  ASN A  37       9.778  -2.135 -20.371  1.00  2.65           H  
ATOM    578 2HB  ASN A  37      10.504  -0.756 -19.570  1.00  2.65           H  
ATOM    579 1HD2 ASN A  37      12.460  -2.140 -22.535  1.00  2.65           H  
ATOM    580 2HD2 ASN A  37      10.750  -1.984 -22.283  1.00  2.65           H  
ATOM    581  N   CYS A  38       8.726  -3.196 -17.144  1.00  1.19           N  
ATOM    582  CA  CYS A  38       7.551  -2.858 -16.347  1.00  0.99           C  
ATOM    583  C   CYS A  38       7.892  -2.156 -15.047  1.00  0.94           C  
ATOM    584  O   CYS A  38       7.215  -1.210 -14.640  1.00  0.91           O  
ATOM    585  CB  CYS A  38       6.689  -4.082 -16.090  1.00  1.47           C  
ATOM    586  SG  CYS A  38       5.838  -4.668 -17.558  1.00  1.47           S  
ATOM    587  H   CYS A  38       8.923  -4.177 -17.371  1.00  1.43           H  
ATOM    588  HA  CYS A  38       6.961  -2.176 -16.926  1.00  1.19           H  
ATOM    589 1HB  CYS A  38       7.307  -4.898 -15.708  1.00  1.76           H  
ATOM    590 2HB  CYS A  38       5.944  -3.850 -15.346  1.00  1.76           H  
ATOM    591  HG  CYS A  38       5.255  -5.719 -16.971  1.00  1.76           H  
ATOM    592  N   GLU A  39       8.992  -2.534 -14.428  1.00  1.05           N  
ATOM    593  CA  GLU A  39       9.387  -1.920 -13.173  1.00  1.10           C  
ATOM    594  C   GLU A  39       9.709  -0.428 -13.325  1.00  1.13           C  
ATOM    595  O   GLU A  39       9.827   0.279 -12.320  1.00  1.14           O  
ATOM    596  CB  GLU A  39      10.558  -2.671 -12.543  1.00  1.52           C  
ATOM    597  CG  GLU A  39      10.177  -4.063 -12.041  1.00  1.52           C  
ATOM    598  CD  GLU A  39      11.299  -4.791 -11.362  1.00  1.52           C  
ATOM    599  OE1 GLU A  39      12.396  -4.295 -11.362  1.00  1.52           O  
ATOM    600  OE2 GLU A  39      11.045  -5.847 -10.810  1.00  1.52           O  
ATOM    601  H   GLU A  39       9.538  -3.295 -14.813  1.00  1.26           H  
ATOM    602  HA  GLU A  39       8.548  -2.003 -12.483  1.00  1.32           H  
ATOM    603 1HB  GLU A  39      11.360  -2.777 -13.276  1.00  1.82           H  
ATOM    604 2HB  GLU A  39      10.950  -2.098 -11.702  1.00  1.82           H  
ATOM    605 1HG  GLU A  39       9.355  -3.956 -11.336  1.00  1.82           H  
ATOM    606 2HG  GLU A  39       9.821  -4.655 -12.882  1.00  1.82           H  
ATOM    607  N   MET A  40       9.965   0.036 -14.561  1.00  1.25           N  
ATOM    608  CA  MET A  40      10.287   1.434 -14.803  1.00  1.40           C  
ATOM    609  C   MET A  40       9.065   2.272 -15.214  1.00  1.28           C  
ATOM    610  O   MET A  40       8.923   3.418 -14.781  1.00  1.39           O  
ATOM    611  CB  MET A  40      11.338   1.528 -15.897  1.00  1.90           C  
ATOM    612  CG  MET A  40      12.703   1.003 -15.499  1.00  1.90           C  
ATOM    613  SD  MET A  40      13.968   1.340 -16.742  1.00  1.90           S  
ATOM    614  CE  MET A  40      13.555   0.161 -18.023  1.00  1.90           C  
ATOM    615  H   MET A  40       9.851  -0.578 -15.367  1.00  1.50           H  
ATOM    616  HA  MET A  40      10.685   1.859 -13.884  1.00  1.68           H  
ATOM    617 1HB  MET A  40      10.990   0.963 -16.757  1.00  2.28           H  
ATOM    618 2HB  MET A  40      11.444   2.566 -16.211  1.00  2.28           H  
ATOM    619 1HG  MET A  40      13.006   1.460 -14.558  1.00  2.28           H  
ATOM    620 2HG  MET A  40      12.641  -0.076 -15.348  1.00  2.28           H  
ATOM    621 1HE  MET A  40      14.260   0.257 -18.849  1.00  2.28           H  
ATOM    622 2HE  MET A  40      13.610  -0.852 -17.620  1.00  2.28           H  
ATOM    623 3HE  MET A  40      12.551   0.349 -18.392  1.00  2.28           H  
ATOM    624  N   HIS A  41       8.171   1.701 -16.036  1.00  1.15           N  
ATOM    625  CA  HIS A  41       7.039   2.481 -16.554  1.00  1.18           C  
ATOM    626  C   HIS A  41       5.664   2.190 -15.934  1.00  1.02           C  
ATOM    627  O   HIS A  41       4.728   3.002 -16.082  1.00  1.05           O  
ATOM    628  CB  HIS A  41       6.984   2.305 -18.068  1.00  1.65           C  
ATOM    629  CG  HIS A  41       8.190   2.887 -18.740  1.00  1.65           C  
ATOM    630  ND1 HIS A  41       8.365   4.247 -18.910  1.00  1.65           N  
ATOM    631  CD2 HIS A  41       9.295   2.301 -19.248  1.00  1.65           C  
ATOM    632  CE1 HIS A  41       9.522   4.465 -19.508  1.00  1.65           C  
ATOM    633  NE2 HIS A  41      10.106   3.303 -19.724  1.00  1.65           N  
ATOM    634  H   HIS A  41       8.346   0.752 -16.377  1.00  1.38           H  
ATOM    635  HA  HIS A  41       7.242   3.534 -16.371  1.00  1.42           H  
ATOM    636 1HB  HIS A  41       6.941   1.241 -18.306  1.00  1.98           H  
ATOM    637 2HB  HIS A  41       6.091   2.778 -18.468  1.00  1.98           H  
ATOM    638  HD1 HIS A  41       7.652   4.945 -18.822  1.00  1.98           H  
ATOM    639  HD2 HIS A  41       9.602   1.268 -19.321  1.00  1.98           H  
ATOM    640  HE1 HIS A  41       9.846   5.480 -19.737  1.00  1.98           H  
ATOM    641  N   ALA A  42       5.544   1.092 -15.180  1.00  0.92           N  
ATOM    642  CA  ALA A  42       4.281   0.731 -14.560  1.00  0.83           C  
ATOM    643  C   ALA A  42       3.820   1.825 -13.660  1.00  0.79           C  
ATOM    644  O   ALA A  42       2.654   2.193 -13.657  1.00  0.81           O  
ATOM    645  CB  ALA A  42       4.408  -0.556 -13.771  1.00  1.20           C  
ATOM    646  H   ALA A  42       6.324   0.442 -15.080  1.00  1.10           H  
ATOM    647  HA  ALA A  42       3.545   0.631 -15.335  1.00  1.00           H  
ATOM    648 1HB  ALA A  42       3.457  -0.811 -13.325  1.00  1.44           H  
ATOM    649 2HB  ALA A  42       4.723  -1.352 -14.423  1.00  1.44           H  
ATOM    650 3HB  ALA A  42       5.146  -0.422 -13.000  1.00  1.44           H  
ATOM    651  N   LEU A  43       4.752   2.496 -13.019  1.00  0.82           N  
ATOM    652  CA  LEU A  43       4.378   3.549 -12.113  1.00  0.83           C  
ATOM    653  C   LEU A  43       3.544   4.643 -12.729  1.00  0.80           C  
ATOM    654  O   LEU A  43       2.742   5.249 -12.022  1.00  0.81           O  
ATOM    655  CB  LEU A  43       5.619   4.225 -11.565  1.00  1.16           C  
ATOM    656  CG  LEU A  43       6.447   3.447 -10.641  1.00  1.16           C  
ATOM    657  CD1 LEU A  43       7.680   4.218 -10.335  1.00  1.16           C  
ATOM    658  CD2 LEU A  43       5.691   3.226  -9.414  1.00  1.16           C  
ATOM    659  H   LEU A  43       5.711   2.183 -13.080  1.00  0.98           H  
ATOM    660  HA  LEU A  43       3.789   3.113 -11.325  1.00  1.00           H  
ATOM    661 1HB  LEU A  43       6.248   4.524 -12.406  1.00  1.39           H  
ATOM    662 2HB  LEU A  43       5.311   5.118 -11.042  1.00  1.39           H  
ATOM    663  HG  LEU A  43       6.743   2.499 -11.086  1.00  1.39           H  
ATOM    664 1HD1 LEU A  43       8.296   3.641  -9.645  1.00  1.39           H  
ATOM    665 2HD1 LEU A  43       8.247   4.403 -11.248  1.00  1.39           H  
ATOM    666 3HD1 LEU A  43       7.413   5.159  -9.875  1.00  1.39           H  
ATOM    667 1HD2 LEU A  43       6.321   2.713  -8.748  1.00  1.39           H  
ATOM    668 2HD2 LEU A  43       5.426   4.174  -9.016  1.00  1.39           H  
ATOM    669 3HD2 LEU A  43       4.804   2.650  -9.565  1.00  1.39           H  
ATOM    670  N   ASN A  44       3.723   4.941 -14.012  1.00  0.84           N  
ATOM    671  CA  ASN A  44       2.953   6.022 -14.582  1.00  0.89           C  
ATOM    672  C   ASN A  44       1.540   5.573 -14.910  1.00  0.89           C  
ATOM    673  O   ASN A  44       0.581   6.317 -14.668  1.00  0.94           O  
ATOM    674  CB  ASN A  44       3.645   6.573 -15.809  1.00  1.22           C  
ATOM    675  CG  ASN A  44       3.005   7.827 -16.313  1.00  1.22           C  
ATOM    676  OD1 ASN A  44       2.948   8.838 -15.599  1.00  1.22           O  
ATOM    677  ND2 ASN A  44       2.521   7.788 -17.529  1.00  1.22           N  
ATOM    678  H   ASN A  44       4.358   4.406 -14.611  1.00  1.01           H  
ATOM    679  HA  ASN A  44       2.858   6.809 -13.846  1.00  1.07           H  
ATOM    680 1HB  ASN A  44       4.688   6.777 -15.572  1.00  1.46           H  
ATOM    681 2HB  ASN A  44       3.628   5.819 -16.599  1.00  1.46           H  
ATOM    682 1HD2 ASN A  44       2.081   8.597 -17.920  1.00  1.46           H  
ATOM    683 2HD2 ASN A  44       2.589   6.946 -18.067  1.00  1.46           H  
ATOM    684  N   GLU A  45       1.398   4.364 -15.461  1.00  0.90           N  
ATOM    685  CA  GLU A  45       0.056   3.914 -15.843  1.00  1.00           C  
ATOM    686  C   GLU A  45      -0.759   3.240 -14.722  1.00  0.96           C  
ATOM    687  O   GLU A  45      -1.986   3.341 -14.716  1.00  1.05           O  
ATOM    688  CB  GLU A  45       0.109   3.030 -17.078  1.00  1.36           C  
ATOM    689  CG  GLU A  45       0.555   3.779 -18.347  1.00  1.36           C  
ATOM    690  CD  GLU A  45       0.526   2.931 -19.596  1.00  1.36           C  
ATOM    691  OE1 GLU A  45       0.012   1.845 -19.533  1.00  1.36           O  
ATOM    692  OE2 GLU A  45       1.041   3.361 -20.608  1.00  1.36           O  
ATOM    693  H   GLU A  45       2.240   3.796 -15.642  1.00  1.08           H  
ATOM    694  HA  GLU A  45      -0.506   4.800 -16.138  1.00  1.20           H  
ATOM    695 1HB  GLU A  45       0.817   2.248 -16.896  1.00  1.63           H  
ATOM    696 2HB  GLU A  45      -0.865   2.574 -17.255  1.00  1.63           H  
ATOM    697 1HG  GLU A  45      -0.096   4.642 -18.491  1.00  1.63           H  
ATOM    698 2HG  GLU A  45       1.568   4.150 -18.189  1.00  1.63           H  
ATOM    699  N   ILE A  46      -0.119   2.616 -13.721  1.00  0.88           N  
ATOM    700  CA  ILE A  46      -0.882   1.929 -12.657  1.00  0.95           C  
ATOM    701  C   ILE A  46      -1.726   2.894 -11.837  1.00  0.90           C  
ATOM    702  O   ILE A  46      -2.625   2.449 -11.108  1.00  0.97           O  
ATOM    703  CB  ILE A  46      -0.018   1.104 -11.672  1.00  1.30           C  
ATOM    704  CG1 ILE A  46       0.954   2.040 -10.880  1.00  1.30           C  
ATOM    705  CG2 ILE A  46       0.682  -0.074 -12.416  1.00  1.30           C  
ATOM    706  CD1 ILE A  46       1.728   1.361  -9.766  1.00  1.30           C  
ATOM    707  H   ILE A  46       0.899   2.562 -13.738  1.00  1.06           H  
ATOM    708  HA  ILE A  46      -1.562   1.227 -13.139  1.00  1.14           H  
ATOM    709  HB  ILE A  46      -0.681   0.699 -10.924  1.00  1.56           H  
ATOM    710 1HG1 ILE A  46       1.629   2.488 -11.556  1.00  1.56           H  
ATOM    711 2HG1 ILE A  46       0.377   2.830 -10.411  1.00  1.56           H  
ATOM    712 1HG2 ILE A  46       1.256  -0.684 -11.733  1.00  1.56           H  
ATOM    713 2HG2 ILE A  46      -0.080  -0.695 -12.888  1.00  1.56           H  
ATOM    714 3HG2 ILE A  46       1.328   0.304 -13.171  1.00  1.56           H  
ATOM    715 1HD1 ILE A  46       2.359   2.090  -9.263  1.00  1.56           H  
ATOM    716 2HD1 ILE A  46       1.029   0.938  -9.046  1.00  1.56           H  
ATOM    717 3HD1 ILE A  46       2.346   0.582 -10.177  1.00  1.56           H  
ATOM    718  N   GLN A  47      -1.461   4.198 -12.007  1.00  0.82           N  
ATOM    719  CA  GLN A  47      -2.135   5.303 -11.352  1.00  0.81           C  
ATOM    720  C   GLN A  47      -3.618   5.322 -11.665  1.00  0.84           C  
ATOM    721  O   GLN A  47      -4.402   5.841 -10.866  1.00  0.87           O  
ATOM    722  CB  GLN A  47      -1.464   6.640 -11.695  1.00  1.14           C  
ATOM    723  CG  GLN A  47      -0.101   6.780 -11.028  1.00  1.14           C  
ATOM    724  CD  GLN A  47       0.588   8.130 -11.207  1.00  1.14           C  
ATOM    725  OE1 GLN A  47       0.858   8.829 -10.186  1.00  1.14           O  
ATOM    726  NE2 GLN A  47       0.872   8.502 -12.469  1.00  1.14           N  
ATOM    727  H   GLN A  47      -0.718   4.411 -12.662  1.00  0.98           H  
ATOM    728  HA  GLN A  47      -2.032   5.176 -10.288  1.00  0.97           H  
ATOM    729 1HB  GLN A  47      -1.300   6.685 -12.773  1.00  1.37           H  
ATOM    730 2HB  GLN A  47      -2.099   7.473 -11.436  1.00  1.37           H  
ATOM    731 1HG  GLN A  47      -0.242   6.617  -9.966  1.00  1.37           H  
ATOM    732 2HG  GLN A  47       0.537   6.018 -11.444  1.00  1.37           H  
ATOM    733 1HE2 GLN A  47       1.306   9.383 -12.667  1.00  1.37           H  
ATOM    734 2HE2 GLN A  47       0.659   7.870 -13.255  1.00  1.37           H  
ATOM    735  N   GLU A  48      -4.032   4.641 -12.747  1.00  0.89           N  
ATOM    736  CA  GLU A  48      -5.449   4.567 -13.095  1.00  0.98           C  
ATOM    737  C   GLU A  48      -6.236   3.961 -11.929  1.00  1.06           C  
ATOM    738  O   GLU A  48      -7.407   4.294 -11.730  1.00  1.19           O  
ATOM    739  CB  GLU A  48      -5.669   3.725 -14.358  1.00  1.34           C  
ATOM    740  CG  GLU A  48      -5.204   4.378 -15.661  1.00  1.34           C  
ATOM    741  CD  GLU A  48      -5.398   3.486 -16.872  1.00  1.34           C  
ATOM    742  OE1 GLU A  48      -5.648   2.309 -16.696  1.00  1.34           O  
ATOM    743  OE2 GLU A  48      -5.296   3.967 -17.971  1.00  1.34           O  
ATOM    744  H   GLU A  48      -3.336   4.200 -13.363  1.00  1.07           H  
ATOM    745  HA  GLU A  48      -5.819   5.575 -13.278  1.00  1.18           H  
ATOM    746 1HB  GLU A  48      -5.130   2.782 -14.253  1.00  1.61           H  
ATOM    747 2HB  GLU A  48      -6.727   3.488 -14.455  1.00  1.61           H  
ATOM    748 1HG  GLU A  48      -5.759   5.302 -15.808  1.00  1.61           H  
ATOM    749 2HG  GLU A  48      -4.148   4.632 -15.566  1.00  1.61           H  
ATOM    750  N   VAL A  49      -5.606   3.051 -11.178  1.00  1.02           N  
ATOM    751  CA  VAL A  49      -6.231   2.445 -10.020  1.00  1.12           C  
ATOM    752  C   VAL A  49      -5.545   2.972  -8.758  1.00  1.07           C  
ATOM    753  O   VAL A  49      -6.195   3.329  -7.783  1.00  1.18           O  
ATOM    754  CB  VAL A  49      -6.172   0.913 -10.077  1.00  1.53           C  
ATOM    755  CG1 VAL A  49      -6.776   0.308  -8.794  1.00  1.53           C  
ATOM    756  CG2 VAL A  49      -6.940   0.440 -11.300  1.00  1.53           C  
ATOM    757  H   VAL A  49      -4.642   2.792 -11.401  1.00  1.22           H  
ATOM    758  HA  VAL A  49      -7.278   2.742  -9.995  1.00  1.34           H  
ATOM    759  HB  VAL A  49      -5.131   0.594 -10.145  1.00  1.84           H  
ATOM    760 1HG1 VAL A  49      -6.721  -0.780  -8.851  1.00  1.84           H  
ATOM    761 2HG1 VAL A  49      -6.239   0.645  -7.913  1.00  1.84           H  
ATOM    762 3HG1 VAL A  49      -7.816   0.611  -8.710  1.00  1.84           H  
ATOM    763 1HG2 VAL A  49      -6.900  -0.649 -11.357  1.00  1.84           H  
ATOM    764 2HG2 VAL A  49      -7.979   0.765 -11.223  1.00  1.84           H  
ATOM    765 3HG2 VAL A  49      -6.497   0.864 -12.202  1.00  1.84           H  
ATOM    766  N   PHE A  50      -4.214   2.988  -8.738  1.00  0.95           N  
ATOM    767  CA  PHE A  50      -3.488   3.386  -7.533  1.00  0.97           C  
ATOM    768  C   PHE A  50      -3.945   4.725  -6.938  1.00  0.93           C  
ATOM    769  O   PHE A  50      -4.086   4.843  -5.716  1.00  1.00           O  
ATOM    770  CB  PHE A  50      -1.968   3.385  -7.736  1.00  1.35           C  
ATOM    771  CG  PHE A  50      -1.259   3.838  -6.517  1.00  1.35           C  
ATOM    772  CD1 PHE A  50      -1.125   2.988  -5.436  1.00  1.35           C  
ATOM    773  CD2 PHE A  50      -0.736   5.114  -6.423  1.00  1.35           C  
ATOM    774  CE1 PHE A  50      -0.510   3.388  -4.292  1.00  1.35           C  
ATOM    775  CE2 PHE A  50      -0.115   5.504  -5.275  1.00  1.35           C  
ATOM    776  CZ  PHE A  50      -0.009   4.646  -4.210  1.00  1.35           C  
ATOM    777  H   PHE A  50      -3.691   2.707  -9.567  1.00  1.14           H  
ATOM    778  HA  PHE A  50      -3.686   2.627  -6.780  1.00  1.16           H  
ATOM    779 1HB  PHE A  50      -1.628   2.378  -7.982  1.00  1.62           H  
ATOM    780 2HB  PHE A  50      -1.692   4.019  -8.535  1.00  1.62           H  
ATOM    781  HD1 PHE A  50      -1.526   2.001  -5.495  1.00  1.62           H  
ATOM    782  HD2 PHE A  50      -0.828   5.809  -7.262  1.00  1.62           H  
ATOM    783  HE1 PHE A  50      -0.423   2.702  -3.452  1.00  1.62           H  
ATOM    784  HE2 PHE A  50       0.287   6.486  -5.188  1.00  1.62           H  
ATOM    785  HZ  PHE A  50       0.483   4.974  -3.310  1.00  1.62           H  
ATOM    786  N   THR A  51      -4.196   5.744  -7.770  1.00  0.90           N  
ATOM    787  CA  THR A  51      -4.526   7.069  -7.261  1.00  0.99           C  
ATOM    788  C   THR A  51      -5.923   7.163  -6.655  1.00  1.07           C  
ATOM    789  O   THR A  51      -6.295   8.199  -6.094  1.00  1.16           O  
ATOM    790  CB  THR A  51      -4.346   8.170  -8.330  1.00  1.35           C  
ATOM    791  OG1 THR A  51      -5.207   7.938  -9.461  1.00  1.35           O  
ATOM    792  CG2 THR A  51      -2.899   8.231  -8.785  1.00  1.35           C  
ATOM    793  H   THR A  51      -4.140   5.628  -8.779  1.00  1.08           H  
ATOM    794  HA  THR A  51      -3.828   7.283  -6.464  1.00  1.19           H  
ATOM    795  HB  THR A  51      -4.608   9.131  -7.892  1.00  1.62           H  
ATOM    796  HG1 THR A  51      -4.975   7.100  -9.903  1.00  1.62           H  
ATOM    797 1HG2 THR A  51      -2.775   9.019  -9.526  1.00  1.62           H  
ATOM    798 2HG2 THR A  51      -2.265   8.428  -7.950  1.00  1.62           H  
ATOM    799 3HG2 THR A  51      -2.636   7.287  -9.205  1.00  1.62           H  
ATOM    800  N   LEU A  52      -6.684   6.064  -6.672  1.00  1.12           N  
ATOM    801  CA  LEU A  52      -8.012   6.046  -6.086  1.00  1.28           C  
ATOM    802  C   LEU A  52      -7.885   6.031  -4.567  1.00  1.31           C  
ATOM    803  O   LEU A  52      -8.859   6.247  -3.849  1.00  1.44           O  
ATOM    804  CB  LEU A  52      -8.787   4.808  -6.560  1.00  1.72           C  
ATOM    805  CG  LEU A  52      -9.111   4.724  -8.091  1.00  1.72           C  
ATOM    806  CD1 LEU A  52      -9.719   3.360  -8.387  1.00  1.72           C  
ATOM    807  CD2 LEU A  52     -10.071   5.838  -8.507  1.00  1.72           C  
ATOM    808  H   LEU A  52      -6.340   5.208  -7.119  1.00  1.34           H  
ATOM    809  HA  LEU A  52      -8.538   6.952  -6.370  1.00  1.54           H  
ATOM    810 1HB  LEU A  52      -8.202   3.924  -6.296  1.00  2.06           H  
ATOM    811 2HB  LEU A  52      -9.729   4.765  -6.017  1.00  2.06           H  
ATOM    812  HG  LEU A  52      -8.185   4.816  -8.664  1.00  2.06           H  
ATOM    813 1HD1 LEU A  52      -9.926   3.280  -9.456  1.00  2.06           H  
ATOM    814 2HD1 LEU A  52      -9.012   2.586  -8.096  1.00  2.06           H  
ATOM    815 3HD1 LEU A  52     -10.643   3.239  -7.826  1.00  2.06           H  
ATOM    816 1HD2 LEU A  52     -10.277   5.747  -9.574  1.00  2.06           H  
ATOM    817 2HD2 LEU A  52     -11.002   5.748  -7.947  1.00  2.06           H  
ATOM    818 3HD2 LEU A  52      -9.626   6.808  -8.317  1.00  2.06           H  
ATOM    819  N   HIS A  53      -6.655   5.836  -4.076  1.00  1.25           N  
ATOM    820  CA  HIS A  53      -6.369   5.831  -2.656  1.00  1.36           C  
ATOM    821  C   HIS A  53      -5.924   7.219  -2.164  1.00  1.34           C  
ATOM    822  O   HIS A  53      -5.554   7.378  -1.001  1.00  1.47           O  
ATOM    823  CB  HIS A  53      -5.258   4.814  -2.361  1.00  1.86           C  
ATOM    824  CG  HIS A  53      -5.638   3.388  -2.654  1.00  1.86           C  
ATOM    825  ND1 HIS A  53      -6.536   2.680  -1.877  1.00  1.86           N  
ATOM    826  CD2 HIS A  53      -5.241   2.541  -3.639  1.00  1.86           C  
ATOM    827  CE1 HIS A  53      -6.674   1.461  -2.372  1.00  1.86           C  
ATOM    828  NE2 HIS A  53      -5.902   1.349  -3.440  1.00  1.86           N  
ATOM    829  H   HIS A  53      -5.890   5.624  -4.726  1.00  1.50           H  
ATOM    830  HA  HIS A  53      -7.262   5.543  -2.104  1.00  1.63           H  
ATOM    831 1HB  HIS A  53      -4.380   5.059  -2.967  1.00  2.23           H  
ATOM    832 2HB  HIS A  53      -4.964   4.887  -1.316  1.00  2.23           H  
ATOM    833  HD1 HIS A  53      -6.889   2.960  -0.984  1.00  2.23           H  
ATOM    834  HD2 HIS A  53      -4.553   2.649  -4.474  1.00  2.23           H  
ATOM    835  HE1 HIS A  53      -7.343   0.745  -1.897  1.00  2.23           H  
ATOM    836  N   GLY A  54      -5.929   8.229  -3.054  1.00  1.27           N  
ATOM    837  CA  GLY A  54      -5.526   9.599  -2.710  1.00  1.37           C  
ATOM    838  C   GLY A  54      -4.011   9.803  -2.764  1.00  1.34           C  
ATOM    839  O   GLY A  54      -3.497  10.895  -2.507  1.00  1.54           O  
ATOM    840  H   GLY A  54      -6.234   8.058  -4.019  1.00  1.52           H  
ATOM    841 1HA  GLY A  54      -6.010  10.292  -3.399  1.00  1.64           H  
ATOM    842 2HA  GLY A  54      -5.891   9.840  -1.713  1.00  1.64           H  
ATOM    843  N   MET A  55      -3.318   8.744  -3.124  1.00  1.17           N  
ATOM    844  CA  MET A  55      -1.872   8.669  -3.206  1.00  1.20           C  
ATOM    845  C   MET A  55      -1.400   8.840  -4.631  1.00  1.12           C  
ATOM    846  O   MET A  55      -2.150   8.581  -5.557  1.00  1.16           O  
ATOM    847  CB  MET A  55      -1.449   7.310  -2.704  1.00  1.68           C  
ATOM    848  CG  MET A  55      -1.802   6.994  -1.287  1.00  1.68           C  
ATOM    849  SD  MET A  55      -0.861   7.938  -0.095  1.00  1.68           S  
ATOM    850  CE  MET A  55      -2.039   9.154   0.441  1.00  1.68           C  
ATOM    851  H   MET A  55      -3.857   7.916  -3.323  1.00  1.40           H  
ATOM    852  HA  MET A  55      -1.430   9.460  -2.603  1.00  1.44           H  
ATOM    853 1HB  MET A  55      -1.925   6.550  -3.319  1.00  2.02           H  
ATOM    854 2HB  MET A  55      -0.372   7.210  -2.811  1.00  2.02           H  
ATOM    855 1HG  MET A  55      -2.860   7.202  -1.125  1.00  2.02           H  
ATOM    856 2HG  MET A  55      -1.647   5.942  -1.119  1.00  2.02           H  
ATOM    857 1HE  MET A  55      -1.581   9.796   1.191  1.00  2.02           H  
ATOM    858 2HE  MET A  55      -2.357   9.760  -0.397  1.00  2.02           H  
ATOM    859 3HE  MET A  55      -2.909   8.653   0.872  1.00  2.02           H  
ATOM    860  N   LYS A  56      -0.166   9.292  -4.816  1.00  1.22           N  
ATOM    861  CA  LYS A  56       0.413   9.415  -6.154  1.00  1.27           C  
ATOM    862  C   LYS A  56       1.623   8.499  -6.254  1.00  1.17           C  
ATOM    863  O   LYS A  56       2.254   8.208  -5.231  1.00  1.20           O  
ATOM    864  CB  LYS A  56       0.824  10.864  -6.420  1.00  1.76           C  
ATOM    865  CG  LYS A  56      -0.305  11.910  -6.260  1.00  1.76           C  
ATOM    866  CD  LYS A  56      -1.411  11.764  -7.307  1.00  1.76           C  
ATOM    867  CE  LYS A  56      -2.413  12.922  -7.235  1.00  1.76           C  
ATOM    868  NZ  LYS A  56      -3.249  12.887  -5.988  1.00  1.76           N  
ATOM    869  H   LYS A  56       0.397   9.533  -4.010  1.00  1.46           H  
ATOM    870  HA  LYS A  56      -0.308   9.090  -6.900  1.00  1.52           H  
ATOM    871 1HB  LYS A  56       1.634  11.140  -5.741  1.00  2.11           H  
ATOM    872 2HB  LYS A  56       1.210  10.947  -7.438  1.00  2.11           H  
ATOM    873 1HG  LYS A  56      -0.745  11.799  -5.269  1.00  2.11           H  
ATOM    874 2HG  LYS A  56       0.122  12.909  -6.334  1.00  2.11           H  
ATOM    875 1HD  LYS A  56      -0.972  11.726  -8.306  1.00  2.11           H  
ATOM    876 2HD  LYS A  56      -1.956  10.835  -7.134  1.00  2.11           H  
ATOM    877 1HE  LYS A  56      -1.866  13.862  -7.264  1.00  2.11           H  
ATOM    878 2HE  LYS A  56      -3.073  12.870  -8.100  1.00  2.11           H  
ATOM    879 1HZ  LYS A  56      -3.890  13.668  -5.992  1.00  2.11           H  
ATOM    880 2HZ  LYS A  56      -3.774  12.023  -5.960  1.00  2.11           H  
ATOM    881 3HZ  LYS A  56      -2.662  12.944  -5.167  1.00  2.11           H  
ATOM    882  N   CYS A  57       2.019   8.093  -7.465  1.00  1.24           N  
ATOM    883  CA  CYS A  57       3.197   7.224  -7.568  1.00  1.30           C  
ATOM    884  C   CYS A  57       4.548   7.904  -7.325  1.00  1.42           C  
ATOM    885  O   CYS A  57       5.604   7.272  -7.448  1.00  1.54           O  
ATOM    886  CB  CYS A  57       3.222   6.451  -8.878  1.00  1.80           C  
ATOM    887  SG  CYS A  57       2.032   5.116  -8.975  1.00  1.80           S  
ATOM    888  H   CYS A  57       1.499   8.355  -8.319  1.00  1.49           H  
ATOM    889  HA  CYS A  57       3.083   6.468  -6.795  1.00  1.56           H  
ATOM    890 1HB  CYS A  57       2.983   7.120  -9.680  1.00  2.16           H  
ATOM    891 2HB  CYS A  57       4.205   6.060  -9.067  1.00  2.16           H  
ATOM    892  HG  CYS A  57       2.111   4.996 -10.334  1.00  2.16           H  
ATOM    893  N   SER A  58       4.547   9.175  -6.929  1.00  1.56           N  
ATOM    894  CA  SER A  58       5.792   9.838  -6.561  1.00  1.84           C  
ATOM    895  C   SER A  58       6.407   9.112  -5.350  1.00  1.94           C  
ATOM    896  O   SER A  58       7.632   9.066  -5.188  1.00  2.24           O  
ATOM    897  CB  SER A  58       5.545  11.295  -6.230  1.00  2.47           C  
ATOM    898  OG  SER A  58       4.782  11.427  -5.066  1.00  2.47           O  
ATOM    899  H   SER A  58       3.679   9.687  -6.866  1.00  1.87           H  
ATOM    900  HA  SER A  58       6.492   9.784  -7.390  1.00  2.21           H  
ATOM    901 1HB  SER A  58       6.507  11.800  -6.094  1.00  2.96           H  
ATOM    902 2HB  SER A  58       5.032  11.775  -7.063  1.00  2.96           H  
ATOM    903  HG  SER A  58       4.697  12.373  -4.912  1.00  2.96           H  
ATOM    904  N   HIS A  59       5.571   8.379  -4.592  1.00  1.83           N  
ATOM    905  CA  HIS A  59       6.012   7.633  -3.416  1.00  2.13           C  
ATOM    906  C   HIS A  59       6.810   6.393  -3.804  1.00  2.15           C  
ATOM    907  O   HIS A  59       7.408   5.741  -2.951  1.00  2.50           O  
ATOM    908  CB  HIS A  59       4.805   7.159  -2.580  1.00  2.86           C  
ATOM    909  CG  HIS A  59       4.036   8.249  -1.869  1.00  2.86           C  
ATOM    910  ND1 HIS A  59       4.581   8.996  -0.845  1.00  2.86           N  
ATOM    911  CD2 HIS A  59       2.765   8.697  -2.025  1.00  2.86           C  
ATOM    912  CE1 HIS A  59       3.680   9.866  -0.415  1.00  2.86           C  
ATOM    913  NE2 HIS A  59       2.574   9.707  -1.113  1.00  2.86           N  
ATOM    914  H   HIS A  59       4.565   8.405  -4.799  1.00  2.20           H  
ATOM    915  HA  HIS A  59       6.643   8.266  -2.796  1.00  2.56           H  
ATOM    916 1HB  HIS A  59       4.106   6.637  -3.241  1.00  3.43           H  
ATOM    917 2HB  HIS A  59       5.139   6.437  -1.837  1.00  3.43           H  
ATOM    918  HD1 HIS A  59       5.358   8.705  -0.286  1.00  3.43           H  
ATOM    919  HD2 HIS A  59       1.958   8.408  -2.697  1.00  3.43           H  
ATOM    920  HE1 HIS A  59       3.919  10.556   0.393  1.00  3.43           H  
ATOM    921  N   PHE A  60       6.790   6.047  -5.086  1.00  1.92           N  
ATOM    922  CA  PHE A  60       7.462   4.875  -5.590  1.00  2.11           C  
ATOM    923  C   PHE A  60       8.521   5.221  -6.631  1.00  2.20           C  
ATOM    924  O   PHE A  60       8.956   4.349  -7.377  1.00  2.70           O  
ATOM    925  CB  PHE A  60       6.449   3.986  -6.237  1.00  2.88           C  
ATOM    926  CG  PHE A  60       5.337   3.617  -5.407  1.00  2.88           C  
ATOM    927  CD1 PHE A  60       4.099   3.886  -5.854  1.00  2.88           C  
ATOM    928  CD2 PHE A  60       5.495   3.052  -4.178  1.00  2.88           C  
ATOM    929  CE1 PHE A  60       3.033   3.602  -5.124  1.00  2.88           C  
ATOM    930  CE2 PHE A  60       4.413   2.754  -3.411  1.00  2.88           C  
ATOM    931  CZ  PHE A  60       3.171   3.032  -3.884  1.00  2.88           C  
ATOM    932  H   PHE A  60       6.299   6.633  -5.759  1.00  2.30           H  
ATOM    933  HA  PHE A  60       7.955   4.361  -4.763  1.00  2.53           H  
ATOM    934 1HB  PHE A  60       6.059   4.557  -7.040  1.00  3.46           H  
ATOM    935 2HB  PHE A  60       6.898   3.109  -6.634  1.00  3.46           H  
ATOM    936  HD1 PHE A  60       3.978   4.334  -6.833  1.00  3.46           H  
ATOM    937  HD2 PHE A  60       6.488   2.853  -3.819  1.00  3.46           H  
ATOM    938  HE1 PHE A  60       2.067   3.818  -5.533  1.00  3.46           H  
ATOM    939  HE2 PHE A  60       4.540   2.293  -2.436  1.00  3.46           H  
ATOM    940  HZ  PHE A  60       2.295   2.793  -3.291  1.00  3.46           H  
ATOM    941  N   LYS A  61       8.975   6.475  -6.641  1.00  2.07           N  
ATOM    942  CA  LYS A  61       9.973   6.998  -7.588  1.00  2.18           C  
ATOM    943  C   LYS A  61       9.468   7.239  -9.019  1.00  2.08           C  
ATOM    944  O   LYS A  61      10.216   7.039  -9.978  1.00  2.32           O  
ATOM    945  CB  LYS A  61      11.171   6.044  -7.759  1.00  3.01           C  
ATOM    946  CG  LYS A  61      11.866   5.617  -6.511  1.00  3.01           C  
ATOM    947  CD  LYS A  61      13.040   4.745  -6.806  1.00  3.01           C  
ATOM    948  CE  LYS A  61      14.316   5.527  -7.122  1.00  3.01           C  
ATOM    949  NZ  LYS A  61      15.452   4.603  -7.348  1.00  3.01           N  
ATOM    950  H   LYS A  61       8.572   7.143  -5.977  1.00  2.48           H  
ATOM    951  HA  LYS A  61      10.315   7.951  -7.204  1.00  2.62           H  
ATOM    952 1HB  LYS A  61      10.900   5.170  -8.341  1.00  3.61           H  
ATOM    953 2HB  LYS A  61      11.915   6.563  -8.350  1.00  3.61           H  
ATOM    954 1HG  LYS A  61      12.152   6.460  -5.928  1.00  3.61           H  
ATOM    955 2HG  LYS A  61      11.194   5.007  -5.926  1.00  3.61           H  
ATOM    956 1HD  LYS A  61      13.211   4.124  -5.940  1.00  3.61           H  
ATOM    957 2HD  LYS A  61      12.804   4.094  -7.644  1.00  3.61           H  
ATOM    958 1HE  LYS A  61      14.183   6.148  -8.001  1.00  3.61           H  
ATOM    959 2HE  LYS A  61      14.558   6.159  -6.267  1.00  3.61           H  
ATOM    960 1HZ  LYS A  61      16.298   5.116  -7.520  1.00  3.61           H  
ATOM    961 2HZ  LYS A  61      15.553   4.031  -6.499  1.00  3.61           H  
ATOM    962 3HZ  LYS A  61      15.259   4.000  -8.127  1.00  3.61           H  
ATOM    963  N   LEU A  62       8.256   7.770  -9.173  1.00  1.99           N  
ATOM    964  CA  LEU A  62       7.735   8.144 -10.483  1.00  2.13           C  
ATOM    965  C   LEU A  62       8.793   9.104 -11.107  1.00  2.15           C  
ATOM    966  O   LEU A  62       9.226  10.042 -10.424  1.00  2.15           O  
ATOM    967  CB  LEU A  62       6.346   8.764 -10.254  1.00  2.93           C  
ATOM    968  CG  LEU A  62       5.411   9.116 -11.393  1.00  2.93           C  
ATOM    969  CD1 LEU A  62       4.915   7.885 -12.115  1.00  2.93           C  
ATOM    970  CD2 LEU A  62       4.188   9.846 -10.769  1.00  2.93           C  
ATOM    971  H   LEU A  62       7.627   7.852  -8.372  1.00  2.39           H  
ATOM    972  HA  LEU A  62       7.614   7.237 -11.049  1.00  2.56           H  
ATOM    973 1HB  LEU A  62       5.807   8.060  -9.685  1.00  3.52           H  
ATOM    974 2HB  LEU A  62       6.473   9.661  -9.664  1.00  3.52           H  
ATOM    975  HG  LEU A  62       5.921   9.744 -12.103  1.00  3.52           H  
ATOM    976 1HD1 LEU A  62       4.244   8.216 -12.896  1.00  3.52           H  
ATOM    977 2HD1 LEU A  62       5.716   7.322 -12.551  1.00  3.52           H  
ATOM    978 3HD1 LEU A  62       4.385   7.252 -11.433  1.00  3.52           H  
ATOM    979 1HD2 LEU A  62       3.489  10.126 -11.557  1.00  3.52           H  
ATOM    980 2HD2 LEU A  62       3.689   9.198 -10.075  1.00  3.52           H  
ATOM    981 3HD2 LEU A  62       4.497  10.728 -10.236  1.00  3.52           H  
ATOM    982  N   PRO A  63       9.187   8.914 -12.406  1.00  2.34           N  
ATOM    983  CA  PRO A  63      10.292   9.563 -13.136  1.00  2.49           C  
ATOM    984  C   PRO A  63      10.570  11.059 -13.037  1.00  2.59           C  
ATOM    985  O   PRO A  63      11.735  11.437 -13.126  1.00  2.96           O  
ATOM    986  CB  PRO A  63       9.936   9.243 -14.594  1.00  3.74           C  
ATOM    987  CG  PRO A  63       9.231   7.937 -14.535  1.00  3.74           C  
ATOM    988  CD  PRO A  63       8.412   7.986 -13.287  1.00  3.74           C  
ATOM    989  HA  PRO A  63      11.212   9.019 -12.867  1.00  2.99           H  
ATOM    990 1HB  PRO A  63       9.316  10.050 -15.015  1.00  4.49           H  
ATOM    991 2HB  PRO A  63      10.854   9.204 -15.198  1.00  4.49           H  
ATOM    992 1HG  PRO A  63       8.617   7.791 -15.440  1.00  4.49           H  
ATOM    993 2HG  PRO A  63       9.965   7.114 -14.519  1.00  4.49           H  
ATOM    994 1HD  PRO A  63       7.427   8.388 -13.515  1.00  4.49           H  
ATOM    995 2HD  PRO A  63       8.396   6.952 -12.921  1.00  4.49           H  
ATOM    996  N   ASP A  64       9.575  11.924 -12.878  1.00  2.69           N  
ATOM    997  CA  ASP A  64       9.926  13.344 -12.807  1.00  2.99           C  
ATOM    998  C   ASP A  64       9.187  13.993 -11.655  1.00  2.84           C  
ATOM    999  O   ASP A  64       8.604  15.072 -11.774  1.00  3.21           O  
ATOM   1000  CB  ASP A  64       9.575  14.044 -14.132  1.00  4.07           C  
ATOM   1001  CG  ASP A  64      10.206  15.452 -14.306  1.00  4.07           C  
ATOM   1002  OD1 ASP A  64      11.248  15.691 -13.737  1.00  4.07           O  
ATOM   1003  OD2 ASP A  64       9.655  16.249 -15.042  1.00  4.07           O  
ATOM   1004  H   ASP A  64       8.611  11.638 -12.814  1.00  3.23           H  
ATOM   1005  HA  ASP A  64      10.994  13.448 -12.621  1.00  3.59           H  
ATOM   1006 1HB  ASP A  64       9.900  13.418 -14.963  1.00  4.88           H  
ATOM   1007 2HB  ASP A  64       8.490  14.144 -14.206  1.00  4.88           H  
ATOM   1008  N   TYR A  65       9.271  13.326 -10.512  1.00  2.57           N  
ATOM   1009  CA  TYR A  65       8.665  13.773  -9.276  1.00  2.66           C  
ATOM   1010  C   TYR A  65       9.709  13.720  -8.167  1.00  2.61           C  
ATOM   1011  O   TYR A  65      10.719  13.038  -8.322  1.00  2.78           O  
ATOM   1012  CB  TYR A  65       7.446  12.893  -8.993  1.00  3.69           C  
ATOM   1013  CG  TYR A  65       6.374  13.077 -10.034  1.00  3.69           C  
ATOM   1014  CD1 TYR A  65       6.436  12.394 -11.230  1.00  3.69           C  
ATOM   1015  CD2 TYR A  65       5.330  13.942  -9.794  1.00  3.69           C  
ATOM   1016  CE1 TYR A  65       5.471  12.583 -12.193  1.00  3.69           C  
ATOM   1017  CE2 TYR A  65       4.354  14.127 -10.751  1.00  3.69           C  
ATOM   1018  CZ  TYR A  65       4.426  13.450 -11.948  1.00  3.69           C  
ATOM   1019  OH  TYR A  65       3.455  13.632 -12.905  1.00  3.69           O  
ATOM   1020  H   TYR A  65       9.727  12.405 -10.523  1.00  3.08           H  
ATOM   1021  HA  TYR A  65       8.342  14.802  -9.414  1.00  3.19           H  
ATOM   1022 1HB  TYR A  65       7.748  11.842  -8.991  1.00  4.43           H  
ATOM   1023 2HB  TYR A  65       7.031  13.111  -8.026  1.00  4.43           H  
ATOM   1024  HD1 TYR A  65       7.251  11.708 -11.411  1.00  4.43           H  
ATOM   1025  HD2 TYR A  65       5.276  14.483  -8.850  1.00  4.43           H  
ATOM   1026  HE1 TYR A  65       5.528  12.044 -13.137  1.00  4.43           H  
ATOM   1027  HE2 TYR A  65       3.529  14.811 -10.561  1.00  4.43           H  
ATOM   1028  HH  TYR A  65       2.806  14.264 -12.587  1.00  4.43           H  
ATOM   1029  N   PRO A  66       9.580  14.512  -7.092  1.00  2.96           N  
ATOM   1030  CA  PRO A  66      10.443  14.412  -5.937  1.00  3.42           C  
ATOM   1031  C   PRO A  66      10.224  13.028  -5.373  1.00  3.53           C  
ATOM   1032  O   PRO A  66       9.081  12.578  -5.299  1.00  3.87           O  
ATOM   1033  CB  PRO A  66       9.934  15.536  -5.024  1.00  5.13           C  
ATOM   1034  CG  PRO A  66       8.507  15.811  -5.500  1.00  5.13           C  
ATOM   1035  CD  PRO A  66       8.532  15.540  -6.997  1.00  5.13           C  
ATOM   1036  HA  PRO A  66      11.490  14.560  -6.237  1.00  4.10           H  
ATOM   1037 1HB  PRO A  66       9.977  15.212  -3.973  1.00  6.16           H  
ATOM   1038 2HB  PRO A  66      10.590  16.415  -5.113  1.00  6.16           H  
ATOM   1039 1HG  PRO A  66       7.805  15.146  -4.968  1.00  6.16           H  
ATOM   1040 2HG  PRO A  66       8.214  16.844  -5.255  1.00  6.16           H  
ATOM   1041 1HD  PRO A  66       7.554  15.169  -7.294  1.00  6.16           H  
ATOM   1042 2HD  PRO A  66       8.823  16.442  -7.558  1.00  6.16           H  
ATOM   1043  N   LEU A  67      11.289  12.371  -4.945  1.00  3.72           N  
ATOM   1044  CA  LEU A  67      11.145  11.026  -4.414  1.00  4.23           C  
ATOM   1045  C   LEU A  67      11.998  10.741  -3.188  1.00  4.16           C  
ATOM   1046  O   LEU A  67      13.117  11.245  -3.040  1.00  4.46           O  
ATOM   1047  CB  LEU A  67      11.408  10.044  -5.568  1.00  5.72           C  
ATOM   1048  CG  LEU A  67      12.797  10.147  -6.276  1.00  5.72           C  
ATOM   1049  CD1 LEU A  67      13.776   9.185  -5.657  1.00  5.72           C  
ATOM   1050  CD2 LEU A  67      12.621   9.889  -7.780  1.00  5.72           C  
ATOM   1051  H   LEU A  67      12.203  12.795  -5.010  1.00  4.46           H  
ATOM   1052  HA  LEU A  67      10.104  10.895  -4.119  1.00  5.08           H  
ATOM   1053 1HB  LEU A  67      11.303   9.032  -5.183  1.00  6.86           H  
ATOM   1054 2HB  LEU A  67      10.637  10.206  -6.324  1.00  6.86           H  
ATOM   1055  HG  LEU A  67      13.194  11.148  -6.138  1.00  6.86           H  
ATOM   1056 1HD1 LEU A  67      14.734   9.282  -6.151  1.00  6.86           H  
ATOM   1057 2HD1 LEU A  67      13.889   9.403  -4.628  1.00  6.86           H  
ATOM   1058 3HD1 LEU A  67      13.426   8.193  -5.764  1.00  6.86           H  
ATOM   1059 1HD2 LEU A  67      13.583   9.988  -8.279  1.00  6.86           H  
ATOM   1060 2HD2 LEU A  67      12.241   8.901  -7.951  1.00  6.86           H  
ATOM   1061 3HD2 LEU A  67      11.920  10.625  -8.199  1.00  6.86           H  
ATOM   1062  N   LEU A  68      11.507   9.845  -2.345  1.00  4.21           N  
ATOM   1063  CA  LEU A  68      12.217   9.426  -1.143  1.00  4.52           C  
ATOM   1064  C   LEU A  68      13.309   8.427  -1.461  1.00  4.45           C  
ATOM   1065  O   LEU A  68      13.182   7.239  -1.174  1.00  4.62           O  
ATOM   1066  CB  LEU A  68      11.251   8.753  -0.164  1.00  6.21           C  
ATOM   1067  CG  LEU A  68      10.049   9.549   0.326  1.00  6.21           C  
ATOM   1068  CD1 LEU A  68       9.216   8.611   1.187  1.00  6.21           C  
ATOM   1069  CD2 LEU A  68      10.497  10.781   1.119  1.00  6.21           C  
ATOM   1070  H   LEU A  68      10.585   9.475  -2.526  1.00  5.05           H  
ATOM   1071  HA  LEU A  68      12.684  10.299  -0.687  1.00  5.42           H  
ATOM   1072 1HB  LEU A  68      10.855   7.867  -0.620  1.00  7.45           H  
ATOM   1073 2HB  LEU A  68      11.821   8.446   0.718  1.00  7.45           H  
ATOM   1074  HG  LEU A  68       9.443   9.865  -0.520  1.00  7.45           H  
ATOM   1075 1HD1 LEU A  68       8.333   9.132   1.553  1.00  7.45           H  
ATOM   1076 2HD1 LEU A  68       8.906   7.743   0.602  1.00  7.45           H  
ATOM   1077 3HD1 LEU A  68       9.815   8.280   2.032  1.00  7.45           H  
ATOM   1078 1HD2 LEU A  68       9.617  11.320   1.473  1.00  7.45           H  
ATOM   1079 2HD2 LEU A  68      11.095  10.465   1.976  1.00  7.45           H  
ATOM   1080 3HD2 LEU A  68      11.086  11.442   0.490  1.00  7.45           H  
ATOM   1081  N   MET A  69      14.385   8.889  -2.054  1.00  4.66           N  
ATOM   1082  CA  MET A  69      15.444   7.972  -2.464  1.00  5.05           C  
ATOM   1083  C   MET A  69      16.010   7.267  -1.239  1.00  5.05           C  
ATOM   1084  O   MET A  69      16.230   7.911  -0.212  1.00  5.42           O  
ATOM   1085  CB  MET A  69      16.543   8.753  -3.182  1.00  6.92           C  
ATOM   1086  CG  MET A  69      17.638   7.903  -3.798  1.00  6.92           C  
ATOM   1087  SD  MET A  69      18.843   8.871  -4.739  1.00  6.92           S  
ATOM   1088  CE  MET A  69      17.908   9.348  -6.207  1.00  6.92           C  
ATOM   1089  H   MET A  69      14.402   9.890  -2.272  1.00  5.59           H  
ATOM   1090  HA  MET A  69      15.028   7.213  -3.130  1.00  6.06           H  
ATOM   1091 1HB  MET A  69      16.108   9.376  -3.934  1.00  8.30           H  
ATOM   1092 2HB  MET A  69      17.027   9.415  -2.461  1.00  8.30           H  
ATOM   1093 1HG  MET A  69      18.175   7.369  -3.006  1.00  8.30           H  
ATOM   1094 2HG  MET A  69      17.191   7.162  -4.461  1.00  8.30           H  
ATOM   1095 1HE  MET A  69      18.550   9.932  -6.868  1.00  8.30           H  
ATOM   1096 2HE  MET A  69      17.568   8.455  -6.732  1.00  8.30           H  
ATOM   1097 3HE  MET A  69      17.052   9.952  -5.925  1.00  8.30           H  
ATOM   1098  N   ASN A  70      16.255   5.950  -1.335  1.00  5.06           N  
ATOM   1099  CA  ASN A  70      16.878   5.232  -0.229  1.00  5.47           C  
ATOM   1100  C   ASN A  70      18.270   5.785   0.028  1.00  5.67           C  
ATOM   1101  O   ASN A  70      19.116   5.780  -0.871  1.00  6.12           O  
ATOM   1102  CB  ASN A  70      16.967   3.745  -0.529  1.00  7.49           C  
ATOM   1103  CG  ASN A  70      17.438   2.928   0.639  1.00  7.49           C  
ATOM   1104  OD1 ASN A  70      16.973   3.100   1.771  1.00  7.49           O  
ATOM   1105  ND2 ASN A  70      18.361   2.037   0.386  1.00  7.49           N  
ATOM   1106  H   ASN A  70      16.004   5.420  -2.185  1.00  6.07           H  
ATOM   1107  HA  ASN A  70      16.290   5.393   0.675  1.00  6.56           H  
ATOM   1108 1HB  ASN A  70      16.004   3.381  -0.849  1.00  8.99           H  
ATOM   1109 2HB  ASN A  70      17.653   3.592  -1.362  1.00  8.99           H  
ATOM   1110 1HD2 ASN A  70      18.723   1.463   1.121  1.00  8.99           H  
ATOM   1111 2HD2 ASN A  70      18.713   1.934  -0.545  1.00  8.99           H  
ATOM   1112  N   ALA A  71      18.526   6.217   1.255  1.00  5.72           N  
ATOM   1113  CA  ALA A  71      19.822   6.778   1.604  1.00  6.33           C  
ATOM   1114  C   ALA A  71      19.953   6.902   3.116  1.00  6.96           C  
ATOM   1115  O   ALA A  71      21.055   7.062   3.638  1.00  7.41           O  
ATOM   1116  OXT ALA A  71      18.933   7.072   3.780  1.00  9.50           O  
ATOM   1117  CB  ALA A  71      20.007   8.141   0.943  1.00  8.18           C  
ATOM   1118  H   ALA A  71      17.790   6.186   1.951  1.00  6.86           H  
ATOM   1119  HA  ALA A  71      20.597   6.099   1.250  1.00  7.60           H  
ATOM   1120 1HB  ALA A  71      20.985   8.538   1.202  1.00  9.82           H  
ATOM   1121 2HB  ALA A  71      19.933   8.044  -0.141  1.00  9.82           H  
ATOM   1122 3HB  ALA A  71      19.232   8.819   1.295  1.00  9.82           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 -391.296 50.8357 268.736 -25.402 6.52354 18.0772 138.153 -150.798 -0.72885 -4.34332 -132.283 -12.5987 -53.5295 -4.20204 -6.71232 -6.88406 0 0.43413 3.99552 33.7781 72.2313 -8.7813 7.14872 0.75494 -3.31768 45.1645 -155.044
CYS:NtermProteinFull_1 -4.73525 0.39587 3.53296 -0.05651 1e-05 0.0166 1.0865 -1.66994 -0.06428 -0.25615 -1.33022 0.7755 0 0 0 0 0 0.11811 0.00692 0.30405 0 0 0 3.6196 0 0.20276 1.94651
VAL_2 -6.30022 1.20733 0.14824 -0.37771 0.38037 0.0906 0.78453 -1.22585 -0 -0 0.30857 -0.17031 0 0 0 0 0 0.14271 0.00813 0.66194 0 0.30282 0 1.9342 -0.09422 0.5767 -1.62216
PHE_3 -5.8779 0.82005 0.99051 -0.62337 0.1489 0.3671 0.33576 -1.40354 -0.04845 -0.16259 0.60176 0.13188 0 0 0 0 0 -0.05028 0.00337 0 2.39567 -0.17035 0 1.0402 -0.03596 0.56302 -0.97421
GLY_4 -2.38586 0.09684 2.04918 -4e-05 0 0 0.86586 -1.08101 -0 -0 -1.08203 -0.40034 0 0 0 0 0 -0.02328 0 0 0 0.49048 0 0.83697 0.21015 0.32082 -0.10227
CYS_5 -4.4711 0.9538 3.82436 -0.06605 0.02511 0.02538 1.59998 -1.86969 -0.0297 -0.22512 -0.13257 -1.10888 0 0 0 0 0 0.55948 0.00505 0.78325 0 -0.31439 0 3.6196 0.52157 0.9236 4.62369
PRO_6 -3.87605 0.69988 1.65255 -0.09327 0.00082 0.05867 0.56923 -0.92956 -0 -0 -0.10946 0.68434 0 0 0 0 0 -0.14068 0.02788 0.55333 0 -0.44673 0 -2.4119 0.16937 0.96284 -2.62873
SER_7 -1.7443 0.19893 1.81306 -0.03065 0.00097 0.0498 0.66942 -0.89822 -0.01017 -0.08272 0.15054 -1.09257 0 0 0 0 0 -0.04172 0.00839 0.17401 0 -0.26644 0.67813 -0.77834 -0.54279 0.36847 -1.37622
ALA_8 -5.72367 0.53819 3.79264 -0.02565 0.00179 0 3.47279 -2.53984 -0 -0 -2.22065 -0.41279 0 0 0 0 0 -0.02612 0 0 0 -0.1527 0 1.8394 -0.07256 0.7559 -0.77328
ALA_9 -6.61981 0.5233 4.25078 -0.02334 0 0 2.55422 -2.89823 -0 -0 -2.40462 -0.37247 0 0 0 0 0 -0.10426 0 0 0 -0.2017 0 1.8394 -0.11805 0.72246 -2.85233
ASP_10 -4.90278 0.38427 7.06862 -0.10913 0 0.31936 3.34888 -2.95239 -0.05235 -0.29389 -5.97809 -0.90105 0 0 -0.60609 -0.6646 0 -0.02518 0.00574 0 3.1954 -0.20138 0 -2.3716 -0.53586 0.42374 -4.84839
LYS_11 -5.13922 0.17264 4.86982 -0.28758 0.03058 0.12941 2.17484 -2.2437 -0.01017 -0.08272 -1.45737 -0.14349 0 0 0 0 0 -0.00412 0.05138 1.99367 0 -0.13923 0 -1.5107 -0.20169 0.44678 -1.35087
LEU_12 -10.4019 1.3987 5.67541 -0.52178 0.3886 0.12212 3.57851 -3.89323 -0 -0 -2.46479 0.27791 0 0 0 0 0 0.05388 0.03305 0.36072 0 -0.27388 0 0.18072 -0.20448 0.47903 -5.2114
TRP_13 -12.4799 1.31877 5.65035 -1.31955 0.34839 0.62034 3.79077 -3.8508 -0 -0 -3.20236 -0.23585 0 0 -0.83236 0 0 -0.0379 0.00192 0 3.48599 -0.04857 0 1.6906 -0.15378 0.82097 -4.43291
ASP_14 -4.12696 0.33459 5.92285 -0.2156 0.00145 0.7067 1.94934 -2.51032 -0 -0 -2.68324 -0.03445 0 0 0 0 0 0.25065 0.16447 0 3.31576 0.05589 0 -2.3716 -0.17881 0.76349 1.34421
GLU_15 -5.22944 0.39471 6.23713 -0.33665 0.10948 0.39717 2.41736 -2.7322 -0.02317 -0.173 -3.21573 -0.56138 0 0 0 0 0 0.03516 0.05169 0 3.241 -0.05451 0 -2.7348 0.00316 0.43188 -1.74214
ASN_16 -8.56905 0.97921 5.98092 -0.32482 0.00546 0.64637 3.56177 -3.2994 -0.00596 -0.04541 -3.4972 -0.1875 0 0 0 0 0 -0.08569 0.05256 0 2.8648 0.21258 0 -0.93687 0.18158 0.44524 -2.02141
LYS_17 -8.53253 1.11672 9.19951 -0.40323 0.0754 0.19561 4.20087 -3.99149 -0.01668 -0.08807 -6.71224 0.0846 0 0 0 -0.43309 0 -0.10321 0.16965 1.62751 0 -0.0435 0 -1.5107 -0.30444 0.62667 -4.84266
SER_18 -2.56144 0.31945 3.58456 -0.03776 0.00021 0.04898 1.6135 -1.62411 -0 -0 -1.8857 -0.47045 0 0 0 0 0 -0.08227 0.00393 0.16843 0 -0.18583 1.75488 -0.77834 -0.66947 0.50378 -0.29766
HIS_D_19 -3.25919 0.40142 2.62534 -0.72275 0.0174 0.78276 1.19991 -1.42285 -0.0093 -0.04144 -0.46188 -0.2548 0 0 0 0 0 0.09975 0.10983 0 2.2333 -0.13963 0 -0.45461 0.01965 0.2184 0.94131
PHE_20 -8.64921 0.99862 3.3411 -0.62165 0.05493 0.33985 2.18416 -2.52428 -0 -0 -1.94757 0.14396 0 0 0 0 0 0.04532 0.00165 0 2.19037 -0.11306 0 1.0402 0.39771 0.66054 -2.45736
ILE_21 -8.07053 0.97703 3.89046 -0.57303 0.28023 0.16466 2.87615 -2.49059 -0.00596 -0.04541 -3.23969 0.15787 0 0 0 0 0 -0.0614 0.27809 1.45602 0 0.11151 0 0.73287 -0.11948 0.83044 -2.85077
GLU_22 -3.68332 0.38774 3.75598 -0.2231 0.02628 0.30649 1.14529 -1.85949 -0.01668 -0.08807 -0.69325 -0.5828 0 0 0 0 0 -0.06093 0.05069 0 3.07633 -0.35773 0 -2.7348 -0.49239 0.50484 -1.53893
ASP_23 -3.4991 0.16764 4.63088 -0.1025 0.0051 0.30609 2.03298 -2.11889 -0 -0 -1.62016 -0.27735 0 0 0 0 0 0.09465 0.0086 0 1.86627 0.092 0 -2.3716 -0.45005 0.47229 -0.76314
PHE_24 -10.3863 1.75185 4.91887 -1.02481 0.10021 0.41321 2.61257 -3.39649 -0.00027 -0.00158 -2.30162 0.07976 0 0 0 0 0 -0.03064 0.03169 0 2.10201 -0.15504 0 1.0402 -0.14567 0.54129 -3.85075
CYS_25 -7.16336 0.6373 5.20406 -0.04885 0 0.01613 2.62881 -2.58022 -0 -0 -3.33606 0.00446 0 0 0 0 0 0.07128 0.02542 0.3042 0 0.2692 0 3.6196 0.09738 0.4834 0.23276
TRP_26 -6.2435 0.5041 5.50197 -1.12035 0.03612 0.33511 2.38139 -2.64688 -0 -0 -2.23449 -0.38795 0 0 0 0 0 -0.00774 0.00986 0 1.67853 -0.32341 0 1.6906 0.20026 0.34545 -0.28095
LYS_27 -5.68698 0.44527 7.22933 -0.29695 0.02513 0.12817 2.92542 -3.15445 -0 -0 -4.69747 -0.00194 0 0 0 0 0 -0.02432 0.03507 1.77002 0 0.01881 0 -1.5107 -0.11883 0.2856 -2.62881
LEU_28 -10.2905 1.51179 5.75633 -0.66326 0.74184 0.30639 3.31943 -3.79001 -0 -0 -4.09825 -0.17452 0 0 0 0 0 -0.01596 0.08779 1.50576 0 -0.22116 0 0.18072 -0.20742 0.64231 -5.40876
HIS_29 -5.04434 0.31321 4.96912 -0.75527 0.02005 0.80854 2.07423 -2.51645 -0.04053 -0.29564 -1.54427 -0.27577 0 0 0 0 0 0.03288 0.02346 0 1.57556 -0.21935 0 -0.45461 0.13176 0.59525 -0.60218
ARG_30 -4.6266 0.32863 4.10714 -0.79477 0.14472 0.46089 1.22173 -1.90589 -0 -0 -0.85653 0.31717 0 0 0 0 0 -0.0418 0.12373 2.9894 0 -0.08442 0 -1.2888 -0.0313 0.32196 0.38526
ARG_31 -4.05636 0.10501 5.55646 -0.74409 0.11711 0.50667 2.93246 -2.23896 -0 -0 -3.52258 0.37947 0 0 0 -2.34433 0 0.04357 0.22448 2.10239 0 -0.03673 0 -1.2888 0.07588 0.91808 -1.27027
GLU_32 -4.46854 0.4815 4.46125 -0.22431 0.0701 0.36986 2.34321 -1.92457 -0.00024 -0.00453 -3.21044 -0.48316 0 0 0 -1.07249 0 0.01536 0.1645 0 3.33787 -0.11052 0 -2.7348 0.41813 0.95675 -1.61507
GLY_33 -3.04209 0.23415 2.90109 -7e-05 0 0 1.84965 -1.61357 -0.02167 -0.14835 -2.25425 -0.38646 0 0 0 0 0 -0.04882 0 0 0 -0.98904 0 0.83697 0.84126 0.58816 -1.25304
ALA_34 -3.63826 0.67182 2.41663 -0.03082 0.01661 0 1.73632 -1.78184 -0 -0 -1.64073 -0.49208 0 0 0 0 0 -0.03485 0 0 0 -0.0965 0 1.8394 1.12155 0.63874 0.726
CYS_35 -5.90374 0.97433 2.9682 -0.05358 0.00497 0.02099 2.0006 -1.77964 -0.03338 -0.25842 -2.3453 -0.14918 0 0 0 0 0 0.12719 0.01135 0.49242 0 0.17483 0 3.6196 0.33848 0.60649 0.81622
VAL_36 -2.93224 0.47062 1.74544 -0.28237 0.17445 0.04785 0.71113 -1.31344 -0 -0 -0.08754 0.35258 0 0 0 0 0 -0.10623 0.00128 0.5334 0 0.44496 0 1.9342 -0.19927 0.3653 1.86011
ASN_37 -5.59814 0.73731 4.06627 -0.19523 0.01925 0.30422 2.61042 -2.47677 -0.01207 -0.08315 -2.9254 -0.40445 0 0 0 0 0 -0.03631 0.09267 0 1.92065 -0.40798 0 -0.93687 -0.51816 0.37065 -3.47309
CYS_38 -7.88803 1.35736 3.69912 -0.04209 0 0.01848 2.79002 -2.26899 -0.01105 -0.06925 -2.62645 -0.27659 0 0 0 0 0 -0.04311 0.0145 0.31476 0 0.28482 0 3.6196 -0.3895 0.48015 -1.03625
GLU_39 -3.79431 0.1832 4.14615 -0.23024 0.03277 0.33368 1.53297 -1.86587 -0.01479 -0.11271 -2.89958 -0.60528 0 0 -0.83236 -0.43309 0 -0.08759 0.03228 0 3.23911 -0.24274 0 -2.7348 -0.29147 0.42202 -4.22265
MET_40 -3.94388 0.37225 3.03659 -0.34325 0.08955 0.10576 1.19196 -1.65851 -0 -0 -0.63463 -0.1425 0 0 0 0 0 -0.03361 0.00673 1.85658 0 0.17047 0 0.60916 0.0663 0.37705 1.12601
HIS_D_41 -4.63871 0.36242 3.98019 -0.4271 0.0164 0.56101 1.97001 -2.11822 -0 -0 -1.6236 -0.33899 0 0 0 0 0 0.00835 0.00679 0 1.62055 -0.31004 0 -0.45461 0.35483 0.51116 -0.51955
ALA_42 -6.45532 1.3383 2.90846 -0.02216 0 0 2.88581 -2.5873 -0.01183 -0.07862 -2.78979 -0.36845 0 0 0 0 0 -0.07843 0 0 0 -0.38951 0 1.8394 -0.35094 0.74081 -3.41957
LEU_43 -9.60768 1.69251 2.78218 -0.58974 0.51135 0.1609 1.25382 -2.57234 -0.01105 -0.06925 -0.61714 0.32044 0 0 0 0 0 -0.10673 0.00596 0.3329 0 -0.2125 0 0.18072 -0.44607 1.01734 -5.9744
ASN_44 -4.125 0.34148 4.00499 -0.33554 0.00947 0.65271 1.6953 -2.02137 -0 -0 -1.56694 -0.12227 0 0 -0.98411 0 0 -0.04283 0.01598 0 2.76969 0.30264 0 -0.93687 0.07942 0.70703 0.44377
GLU_45 -4.76649 0.71668 6.19343 -0.21659 0.03412 0.31011 3.01945 -2.66612 -0.00041 -0.00418 -3.00977 -0.55956 0 0 0 -1.27185 0 -0.03605 0.05706 0 3.08938 -0.20152 0 -2.7348 0.09459 0.54609 -1.40643
ILE_46 -8.68145 1.17312 3.61737 -0.54081 0.26412 0.13509 3.01737 -2.70426 -0 -0 -3.41652 0.32427 0 0 0 0 0 -0.15586 0.02225 0.47156 0 0.51762 0 0.73287 -0.08839 1.03018 -4.28146
GLN_47 -8.50766 1.37406 6.76516 -0.29351 0.03725 0.21395 3.57522 -3.44985 -0 -0 -4.1067 -0.24308 0 0 -1.91771 0 0 -0.03114 0.17086 0 4.51137 -0.07276 0 -0.18838 -0.15746 0.96374 -1.35666
GLU_48 -3.00702 0.52471 4.72025 -0.21174 0.02109 0.2866 2.01904 -2.03094 -0 -0 -3.06048 -0.58592 0 0 0 0 0 0.06546 0.02002 0 3.1501 -0.32815 0 -2.7348 -0.48597 0.47243 -1.16532
VAL_49 -4.63866 0.58675 3.488 -0.29345 0.17971 0.06814 2.17598 -2.06422 -0.01077 -0.05491 -1.22792 -0.45471 0 0 0 0 0 0.00411 0.00669 0.28513 0 -0.49215 0 1.9342 -0.26239 0.23347 -0.537
PHE_50 -10.4412 1.54792 3.46837 -1.08025 0.0917 0.47015 2.31874 -2.81489 -0.02465 -0.15626 -1.41143 0.08438 0 0 0 0 0 0.03967 0.00846 0 1.94674 -0.19177 0 1.0402 0.10303 0.54758 -4.45351
THR_51 -5.61501 0.94101 4.53684 -0.13508 0.05107 0.06857 2.59002 -2.56636 -0 -0 -2.73512 -0.13489 0 0 0 0 0 -0.04087 0.00972 0.02549 0 0.00494 4.11364 -1.0874 0.17118 0.63246 0.83021
LEU_52 -3.44763 0.42558 3.07127 -0.49035 0.19174 0.12721 1.86479 -1.64344 -0 -0 -0.9401 0.1408 0 0 0 0 0 0.01774 0.02994 0.17163 0 -0.07629 0 0.18072 -0.03803 0.38592 -0.02851
HIS_D_53 -3.62459 0.53074 3.11909 -0.39765 0.01493 0.51557 1.65437 -1.58597 -0.01036 -0.05073 -0.47038 -0.36933 0 0 0 0 0 -0.06035 0.00594 0 1.66316 -0.20392 0 -0.45461 -0.45906 0.24722 0.06406
GLY_54 -1.90501 0.12527 2.22709 -5e-05 0 0 0.71361 -1.12761 -0 -0 -1.225 -0.39939 0 0 0 0 0 -0.17536 0 0 0 -1.44922 0 0.83697 -0.85688 0.2683 -2.96728
MET_55 -6.72166 1.06324 3.6279 -0.64707 0.15094 0.23265 1.05254 -1.88545 -0.02465 -0.15626 -0.56904 -0.11647 0 0 0 0 0 -0.00472 0.07054 2.66195 0 -0.02219 0 0.60916 -0.63264 0.36184 -0.94939
LYS_56 -4.37263 0.48469 3.75519 -0.57948 0.11915 0.56839 1.47648 -1.87516 -0 -0 -1.29959 0.05019 0 0 0 0 0 0.02786 0.05155 2.01113 0 0.00836 0 -1.5107 -0.12642 0.4105 -0.80046
CYS_57 -8.76913 1.3845 3.85576 -0.0502 0.02582 0.02492 2.52433 -2.25633 -0 -0 -3.33375 -0.36913 0 0 -0.9336 0 0 0.12064 0.28467 0.34093 0 0.21943 0 3.6196 0.01919 0.64866 -2.64369
SER_58 -4.49362 0.53386 4.42388 -0.02672 0 0.04313 1.8963 -2.12734 -0.01593 -0.11849 -0.71324 -1.08416 0 0 0 0 0 -0.08174 0 0.16953 0 -0.1601 0.60194 -0.77834 -0.27564 0.70065 -1.50603
HIS_D_59 -6.42179 0.65344 3.80939 -0.37133 0.01096 0.46324 2.17218 -2.35898 -0 -0 -0.60417 -0.44704 0 0 0 0 0 -0.04723 0.00557 0 2.37424 -0.09359 0 -0.45461 -0.54668 0.38701 -1.46939
PHE_60 -12.1494 2.46503 2.34071 -0.71805 0.15395 0.45055 1.64652 -2.80458 -0.03291 -0.13549 -1.29998 0.18155 0 0 0 0 0 -0.03858 0.18951 0 2.55816 -0.14809 0 1.0402 -0.25543 0.67231 -5.88402
LYS_61 -6.32556 1.04091 4.72732 -0.47683 0.1687 0.29541 1.98147 -2.25824 -0 -0 -3.21592 -0.34011 0 0 0 -0.6646 0 -0.00291 0.50025 2.51878 0 0.01566 0 -1.5107 0.28856 1.23792 -2.01989
LEU_62 -9.03892 1.83455 3.32891 -0.45467 0.08335 0.09433 1.78511 -2.52567 -0.03813 -0.15749 -0.79496 0.21749 0 0 0 0 0 0.8985 0.04329 0.49335 0 -0.02433 0 0.18072 0.31176 2.24557 -1.51724
PRO_63 -2.23832 0.56366 1.21982 -0.07333 1e-05 0.04489 0.49832 -0.4936 -0.01781 -0.11271 0.51321 0.56513 0 0 0 0 0 -0.18533 0.04052 0.17787 0 -0.95304 0 -2.4119 0.40177 2.65244 0.19159
ASP_64 -1.96831 0.33105 1.66217 -0.26734 0.04286 0.87694 0.54877 -0.87785 -0.01781 -0.11271 0.0724 -0.03139 0 0 0 0 0 0.03058 0.0318 0 2.11945 -0.46227 0 -2.3716 0.96061 1.28976 1.85712
TYR_65 -5.50464 1.04052 2.40927 -0.62264 0.15187 0.33523 1.3327 -1.51379 -0.00522 -0.02199 -0.29734 -0.18435 0 0 0 0 0 0.10152 0.05724 0 1.96219 -0.38768 0.00013 1.2797 0.60991 1.06711 1.80972
PRO_66 -1.66139 0.31708 1.16438 -0.19395 0.00498 0.1441 0.24762 -0.49801 -0 -0 -0.27158 -0.05557 0 0 0 0 0 -0.04809 0.00723 0.95114 0 -0.76418 0 -2.4119 -0.24032 1.20135 -2.1071
LEU_67 -5.04959 0.64073 1.43078 -0.74838 0.34972 0.33451 1.02617 -1.28234 -0 -0 -0.7297 -0.13028 0 0 0 0 0 0.00738 0.33391 1.3271 0 0.33292 0 0.18072 -0.17389 0.65568 -1.49456
LEU_68 -4.12461 0.28783 2.62348 -0.54247 0.19568 0.16678 1.76839 -1.81246 -0.06828 -0.41238 -1.55541 0.11203 0 0 0 0 0 -0.01741 0.05113 0.5815 0 0.0231 0 0.18072 0.37316 0.54073 -1.62849
MET_69 -3.35447 0.35298 2.47513 -0.36506 0.13545 0.09508 1.15975 -1.41496 -0.00608 -0.0718 -1.30737 0.2324 0 0 0 0 0 0.00512 0.03892 1.30621 0 0.26245 0 0.60916 -0.09119 0.41391 0.47563
ASN_70 -3.15291 0.22903 2.79823 -0.24911 0.01268 0.46698 1.12491 -1.36827 -0 -0 -1.91842 -0.50422 0 0 -0.60609 0 0 -0.07114 0.00191 0 2.74768 -0.15692 0 -0.93687 -0.31289 0.28034 -1.61509
ALA:CtermProteinFull_71 -0.94185 0.06665 1.03006 -0.03531 0.00011 0 0.28282 -0.54988 -0.00608 -0.0718 -0.26404 -0.39121 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.00392 0.13164 1.0866
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

REMARK ID 114278 DOMAINID 110960 MODEL 4 2021-08-21_00000149_1_19
MODEL     4
REMARK    Rerank model03.pdb to model04.pdb score: 44.163
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 8 cluster_threshold: 2.937218
REMARK    SCORE fa_intra_sol_xover4:          15.736
REMARK    SCORE           omega:           1.763
REMARK    SCORE        hbond_sc:          -5.407
REMARK    SCORE    fa_intra_rep:           0.668
REMARK    SCORE     total_score:        -345.934
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE atom_pair_constraint:        -208.788
REMARK    SCORE             ref:          27.225
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE          fa_atr:        -413.503
REMARK    SCORE     lk_ball_wtd:         -11.192
REMARK    SCORE     cart_bonded:          44.328
REMARK    SCORE         p_aa_pp:          -9.005
REMARK    SCORE          fa_sol:         242.704
REMARK    SCORE         fa_elec:        -114.441
REMARK    SCORE          fa_rep:          48.418
REMARK    SCORE     hbond_sr_bb:         -49.429
REMARK    SCORE     hbond_bb_sc:          -7.109
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     hbond_lr_bb:          -2.067
REMARK    SCORE          fa_dun:          94.771
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:        -345.934
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE     rama_prepro:          -0.605
ATOM      1  N   CYS A   1       0.450   0.103   0.724  1.00  3.980          N  
ATOM      2  CA  CYS A   1       1.905  -0.020   0.743  1.00  3.020          C  
ATOM      3  C   CYS A   1       2.616   1.317   0.801  1.00  2.530          C  
ATOM      4  O   CYS A   1       3.778   1.391   1.200  1.00  2.700          O  
ATOM      5  CB  CYS A   1       2.422  -0.678  -0.522  1.00  4.610          C  
ATOM      6  SG  CYS A   1       2.189   0.362  -2.002  1.00  4.610          S  
ATOM      7 1H   CYS A   1       0.027  -0.810   0.828  1.00  4.780          H  
ATOM      8 2H   CYS A   1       0.154   0.699   1.483  1.00  4.780          H  
ATOM      9 3H   CYS A   1       0.151   0.493  -0.156  1.00  4.780          H  
ATOM     10  HA  CYS A   1       2.181  -0.614   1.614  1.00  3.620          H  
ATOM     11 1HB  CYS A   1       3.478  -0.852  -0.414  1.00  5.530          H  
ATOM     12 2HB  CYS A   1       1.941  -1.644  -0.674  1.00  5.530          H  
ATOM     13  HG  CYS A   1       1.043  -0.251  -2.393  1.00  5.530          H  
ATOM     14  N   VAL A   2       1.933   2.390   0.414  1.00  2.420          N  
ATOM     15  CA  VAL A   2       2.596   3.684   0.306  1.00  2.600          C  
ATOM     16  C   VAL A   2       3.260   4.164   1.596  1.00  2.430          C  
ATOM     17  O   VAL A   2       4.314   4.795   1.540  1.00  3.040          O  
ATOM     18  CB  VAL A   2       1.592   4.719  -0.257  1.00  3.570          C  
ATOM     19  CG1 VAL A   2       0.480   5.005   0.704  1.00  3.570          C  
ATOM     20  CG2 VAL A   2       2.327   5.987  -0.581  1.00  3.570          C  
ATOM     21  H   VAL A   2       0.975   2.312   0.121  1.00  2.900          H  
ATOM     22  HA  VAL A   2       3.384   3.581  -0.442  1.00  3.120          H  
ATOM     23  HB  VAL A   2       1.142   4.311  -1.153  1.00  4.280          H  
ATOM     24 1HG1 VAL A   2      -0.204   5.727   0.259  1.00  4.280          H  
ATOM     25 2HG1 VAL A   2      -0.062   4.097   0.937  1.00  4.280          H  
ATOM     26 3HG1 VAL A   2       0.880   5.416   1.590  1.00  4.280          H  
ATOM     27 1HG2 VAL A   2       1.640   6.712  -1.006  1.00  4.280          H  
ATOM     28 2HG2 VAL A   2       2.773   6.406   0.318  1.00  4.280          H  
ATOM     29 3HG2 VAL A   2       3.112   5.765  -1.296  1.00  4.280          H  
ATOM     30  N   PHE A   3       2.674   3.853   2.751  1.00  2.000          N  
ATOM     31  CA  PHE A   3       3.270   4.260   4.011  1.00  2.200          C  
ATOM     32  C   PHE A   3       3.600   3.036   4.863  1.00  1.760          C  
ATOM     33  O   PHE A   3       3.536   3.097   6.092  1.00  2.170          O  
ATOM     34  CB  PHE A   3       2.351   5.211   4.785  1.00  3.000          C  
ATOM     35  CG  PHE A   3       1.960   6.448   4.002  1.00  3.000          C  
ATOM     36  CD1 PHE A   3       0.620   6.800   3.876  1.00  3.000          C  
ATOM     37  CD2 PHE A   3       2.909   7.225   3.339  1.00  3.000          C  
ATOM     38  CE1 PHE A   3       0.248   7.896   3.126  1.00  3.000          C  
ATOM     39  CE2 PHE A   3       2.533   8.310   2.591  1.00  3.000          C  
ATOM     40  CZ  PHE A   3       1.203   8.648   2.484  1.00  3.000          C  
ATOM     41  H   PHE A   3       1.806   3.344   2.757  1.00  2.400          H  
ATOM     42  HA  PHE A   3       4.209   4.769   3.808  1.00  2.640          H  
ATOM     43 1HB  PHE A   3       1.443   4.683   5.070  1.00  3.600          H  
ATOM     44 2HB  PHE A   3       2.846   5.529   5.701  1.00  3.600          H  
ATOM     45  HD1 PHE A   3      -0.142   6.200   4.376  1.00  3.600          H  
ATOM     46  HD2 PHE A   3       3.965   6.966   3.400  1.00  3.600          H  
ATOM     47  HE1 PHE A   3      -0.805   8.162   3.036  1.00  3.600          H  
ATOM     48  HE2 PHE A   3       3.294   8.900   2.072  1.00  3.600          H  
ATOM     49  HZ  PHE A   3       0.910   9.507   1.886  1.00  3.600          H  
ATOM     50  N   GLY A   4       3.904   1.914   4.208  1.00  1.630          N  
ATOM     51  CA  GLY A   4       4.227   0.672   4.903  1.00  1.920          C  
ATOM     52  C   GLY A   4       5.733   0.512   5.068  1.00  1.930          C  
ATOM     53  O   GLY A   4       6.470   1.494   5.170  1.00  2.130          O  
ATOM     54  H   GLY A   4       3.936   1.917   3.183  1.00  1.960          H  
ATOM     55 1HA  GLY A   4       3.741   0.657   5.878  1.00  2.300          H  
ATOM     56 2HA  GLY A   4       3.832  -0.170   4.333  1.00  2.300          H  
ATOM     57  N   CYS A   5       6.184  -0.737   5.140  1.00  1.970          N  
ATOM     58  CA  CYS A   5       7.598  -1.063   5.306  1.00  2.020          C  
ATOM     59  C   CYS A   5       8.185  -1.693   4.039  1.00  1.630          C  
ATOM     60  O   CYS A   5       8.072  -2.909   3.887  1.00  1.570          O  
ATOM     61  CB  CYS A   5       7.792  -2.069   6.428  1.00  2.810          C  
ATOM     62  SG  CYS A   5       9.515  -2.528   6.655  1.00  2.810          S  
ATOM     63  H   CYS A   5       5.504  -1.484   5.075  1.00  2.360          H  
ATOM     64  HA  CYS A   5       8.128  -0.160   5.589  1.00  2.420          H  
ATOM     65 1HB  CYS A   5       7.423  -1.650   7.366  1.00  3.370          H  
ATOM     66 2HB  CYS A   5       7.221  -2.974   6.218  1.00  3.370          H  
ATOM     67  HG  CYS A   5       9.296  -3.377   7.653  1.00  3.370          H  
ATOM     68  N   PRO A   6       8.892  -0.923   3.175  1.00  1.570          N  
ATOM     69  CA  PRO A   6       9.448  -1.316   1.880  1.00  1.430          C  
ATOM     70  C   PRO A   6      10.263  -2.603   1.903  1.00  1.470          C  
ATOM     71  O   PRO A   6      10.230  -3.382   0.952  1.00  1.600          O  
ATOM     72  CB  PRO A   6      10.353  -0.121   1.561  1.00  2.150          C  
ATOM     73  CG  PRO A   6       9.697   1.039   2.223  1.00  2.150          C  
ATOM     74  CD  PRO A   6       9.171   0.493   3.514  1.00  2.150          C  
ATOM     75  HA  PRO A   6       8.650  -1.379   1.136  1.00  1.720          H  
ATOM     76 1HB  PRO A   6      11.378  -0.310   1.911  1.00  2.570          H  
ATOM     77 2HB  PRO A   6      10.409   0.022   0.496  1.00  2.570          H  
ATOM     78 1HG  PRO A   6      10.421   1.859   2.366  1.00  2.570          H  
ATOM     79 2HG  PRO A   6       8.898   1.437   1.578  1.00  2.570          H  
ATOM     80 1HD  PRO A   6       9.921   0.577   4.316  1.00  2.570          H  
ATOM     81 2HD  PRO A   6       8.262   1.039   3.727  1.00  2.570          H  
ATOM     82  N   SER A   7      10.950  -2.867   3.016  1.00  1.660          N  
ATOM     83  CA  SER A   7      11.751  -4.072   3.131  1.00  1.910          C  
ATOM     84  C   SER A   7      10.886  -5.318   2.975  1.00  1.990          C  
ATOM     85  O   SER A   7      11.284  -6.301   2.337  1.00  2.290          O  
ATOM     86  CB  SER A   7      12.447  -4.115   4.480  1.00  2.570          C  
ATOM     87  OG  SER A   7      13.383  -3.075   4.608  1.00  2.570          O  
ATOM     88  H   SER A   7      10.983  -2.219   3.792  1.00  1.990          H  
ATOM     89  HA  SER A   7      12.501  -4.066   2.340  1.00  2.290          H  
ATOM     90 1HB  SER A   7      11.709  -4.044   5.270  1.00  3.090          H  
ATOM     91 2HB  SER A   7      12.949  -5.073   4.592  1.00  3.090          H  
ATOM     92  HG  SER A   7      13.797  -3.198   5.468  1.00  3.090          H  
ATOM     93  N   ALA A   8       9.688  -5.301   3.563  1.00  1.870          N  
ATOM     94  CA  ALA A   8       8.789  -6.440   3.527  1.00  2.090          C  
ATOM     95  C   ALA A   8       7.963  -6.367   2.264  1.00  1.830          C  
ATOM     96  O   ALA A   8       6.731  -6.369   2.317  1.00  1.620          O  
ATOM     97  CB  ALA A   8       7.894  -6.436   4.754  1.00  2.840          C  
ATOM     98  H   ALA A   8       9.355  -4.438   3.999  1.00  2.240          H  
ATOM     99  HA  ALA A   8       9.383  -7.354   3.502  1.00  2.510          H  
ATOM    100 1HB  ALA A   8       7.227  -7.291   4.725  1.00  3.410          H  
ATOM    101 2HB  ALA A   8       8.508  -6.485   5.652  1.00  3.410          H  
ATOM    102 3HB  ALA A   8       7.308  -5.512   4.764  1.00  3.410          H  
ATOM    103  N   ALA A   9       8.637  -6.432   1.131  1.00  1.940          N  
ATOM    104  CA  ALA A   9       8.014  -6.211  -0.161  1.00  1.780          C  
ATOM    105  C   ALA A   9       6.856  -7.161  -0.428  1.00  1.640          C  
ATOM    106  O   ALA A   9       5.825  -6.755  -0.964  1.00  1.390          O  
ATOM    107  CB  ALA A   9       9.061  -6.348  -1.244  1.00  2.560          C  
ATOM    108  H   ALA A   9       9.655  -6.524   1.216  1.00  2.330          H  
ATOM    109  HA  ALA A   9       7.633  -5.193  -0.169  1.00  2.140          H  
ATOM    110 1HB  ALA A   9       8.626  -6.143  -2.208  1.00  3.070          H  
ATOM    111 2HB  ALA A   9       9.865  -5.643  -1.053  1.00  3.070          H  
ATOM    112 3HB  ALA A   9       9.457  -7.359  -1.240  1.00  3.070          H  
ATOM    113  N   ASP A  10       6.957  -8.401   0.016  1.00  1.850          N  
ATOM    114  CA  ASP A  10       5.878  -9.331  -0.271  1.00  1.780          C  
ATOM    115  C   ASP A  10       4.655  -9.041   0.604  1.00  1.480          C  
ATOM    116  O   ASP A  10       3.530  -9.393   0.235  1.00  1.340          O  
ATOM    117  CB  ASP A  10       6.357 -10.761  -0.100  1.00  2.520          C  
ATOM    118  CG  ASP A  10       7.416 -11.170  -1.168  1.00  2.520          C  
ATOM    119  OD1 ASP A  10       7.539 -10.550  -2.234  1.00  2.520          O  
ATOM    120  OD2 ASP A  10       8.108 -12.112  -0.882  1.00  2.520          O  
ATOM    121  H   ASP A  10       7.801  -8.700   0.485  1.00  2.220          H  
ATOM    122  HA  ASP A  10       5.586  -9.202  -1.314  1.00  2.140          H  
ATOM    123 1HB  ASP A  10       6.785 -10.886   0.895  1.00  3.020          H  
ATOM    124 2HB  ASP A  10       5.504 -11.438  -0.178  1.00  3.020          H  
ATOM    125  N   LYS A  11       4.863  -8.412   1.772  1.00  1.500          N  
ATOM    126  CA  LYS A  11       3.762  -8.089   2.662  1.00  1.380          C  
ATOM    127  C   LYS A  11       3.023  -6.939   2.038  1.00  1.020          C  
ATOM    128  O   LYS A  11       1.790  -6.918   2.012  1.00  0.940          O  
ATOM    129  CB  LYS A  11       4.245  -7.698   4.058  1.00  1.980          C  
ATOM    130  CG  LYS A  11       3.123  -7.390   5.045  1.00  1.980          C  
ATOM    131  CD  LYS A  11       3.669  -7.100   6.440  1.00  1.980          C  
ATOM    132  CE  LYS A  11       2.541  -6.773   7.413  1.00  1.980          C  
ATOM    133  NZ  LYS A  11       3.050  -6.472   8.781  1.00  1.980          N  
ATOM    134  H   LYS A  11       5.792  -8.094   2.043  1.00  1.800          H  
ATOM    135  HA  LYS A  11       3.086  -8.943   2.731  1.00  1.660          H  
ATOM    136 1HB  LYS A  11       4.861  -8.494   4.468  1.00  2.380          H  
ATOM    137 2HB  LYS A  11       4.863  -6.805   3.986  1.00  2.380          H  
ATOM    138 1HG  LYS A  11       2.564  -6.511   4.698  1.00  2.380          H  
ATOM    139 2HG  LYS A  11       2.436  -8.236   5.091  1.00  2.380          H  
ATOM    140 1HD  LYS A  11       4.220  -7.968   6.807  1.00  2.380          H  
ATOM    141 2HD  LYS A  11       4.352  -6.251   6.387  1.00  2.380          H  
ATOM    142 1HE  LYS A  11       1.991  -5.906   7.039  1.00  2.380          H  
ATOM    143 2HE  LYS A  11       1.862  -7.623   7.468  1.00  2.380          H  
ATOM    144 1HZ  LYS A  11       2.271  -6.260   9.389  1.00  2.380          H  
ATOM    145 2HZ  LYS A  11       3.551  -7.271   9.143  1.00  2.380          H  
ATOM    146 3HZ  LYS A  11       3.669  -5.675   8.741  1.00  2.380          H  
ATOM    147  N   LEU A  12       3.798  -5.977   1.546  1.00  0.920          N  
ATOM    148  CA  LEU A  12       3.249  -4.799   0.915  1.00  0.710          C  
ATOM    149  C   LEU A  12       2.483  -5.213  -0.326  1.00  0.640          C  
ATOM    150  O   LEU A  12       1.440  -4.637  -0.631  1.00  0.690          O  
ATOM    151  CB  LEU A  12       4.361  -3.824   0.577  1.00  1.080          C  
ATOM    152  CG  LEU A  12       4.730  -2.787   1.643  1.00  1.080          C  
ATOM    153  CD1 LEU A  12       5.109  -3.479   2.940  1.00  1.080          C  
ATOM    154  CD2 LEU A  12       5.899  -1.961   1.131  1.00  1.080          C  
ATOM    155  H   LEU A  12       4.815  -6.075   1.640  1.00  1.100          H  
ATOM    156  HA  LEU A  12       2.553  -4.320   1.606  1.00  0.850          H  
ATOM    157 1HB  LEU A  12       5.254  -4.416   0.402  1.00  1.290          H  
ATOM    158 2HB  LEU A  12       4.090  -3.298  -0.331  1.00  1.290          H  
ATOM    159  HG  LEU A  12       3.879  -2.150   1.842  1.00  1.290          H  
ATOM    160 1HD1 LEU A  12       5.364  -2.751   3.660  1.00  1.290          H  
ATOM    161 2HD1 LEU A  12       4.277  -4.067   3.321  1.00  1.290          H  
ATOM    162 3HD1 LEU A  12       5.962  -4.120   2.774  1.00  1.290          H  
ATOM    163 1HD2 LEU A  12       6.171  -1.215   1.879  1.00  1.290          H  
ATOM    164 2HD2 LEU A  12       6.744  -2.629   0.952  1.00  1.290          H  
ATOM    165 3HD2 LEU A  12       5.637  -1.457   0.205  1.00  1.290          H  
ATOM    166  N   TRP A  13       2.987  -6.218  -1.057  1.00  0.790          N  
ATOM    167  CA  TRP A  13       2.253  -6.661  -2.221  1.00  0.970          C  
ATOM    168  C   TRP A  13       0.897  -7.209  -1.784  1.00  0.990          C  
ATOM    169  O   TRP A  13      -0.119  -6.882  -2.399  1.00  1.230          O  
ATOM    170  CB  TRP A  13       2.967  -7.706  -3.065  1.00  1.290          C  
ATOM    171  CG  TRP A  13       2.208  -7.875  -4.333  1.00  1.290          C  
ATOM    172  CD1 TRP A  13       1.458  -8.930  -4.761  1.00  1.290          C  
ATOM    173  CD2 TRP A  13       2.091  -6.859  -5.354  1.00  1.290          C  
ATOM    174  NE1 TRP A  13       0.888  -8.629  -5.985  1.00  1.290          N  
ATOM    175  CE2 TRP A  13       1.269  -7.370  -6.346  1.00  1.290          C  
ATOM    176  CE3 TRP A  13       2.606  -5.555  -5.494  1.00  1.290          C  
ATOM    177  CZ2 TRP A  13       0.957  -6.647  -7.455  1.00  1.290          C  
ATOM    178  CZ3 TRP A  13       2.270  -4.839  -6.602  1.00  1.290          C  
ATOM    179  CH2 TRP A  13       1.466  -5.382  -7.559  1.00  1.290          C  
ATOM    180  H   TRP A  13       3.891  -6.626  -0.810  1.00  0.950          H  
ATOM    181  HA  TRP A  13       2.070  -5.797  -2.843  1.00  1.160          H  
ATOM    182 1HB  TRP A  13       3.982  -7.426  -3.275  1.00  1.540          H  
ATOM    183 2HB  TRP A  13       2.989  -8.662  -2.535  1.00  1.540          H  
ATOM    184  HD1 TRP A  13       1.326  -9.861  -4.214  1.00  1.540          H  
ATOM    185  HE1 TRP A  13       0.259  -9.228  -6.574  1.00  1.540          H  
ATOM    186  HE3 TRP A  13       3.255  -5.124  -4.737  1.00  1.540          H  
ATOM    187  HZ2 TRP A  13       0.317  -7.041  -8.237  1.00  1.540          H  
ATOM    188  HZ3 TRP A  13       2.664  -3.829  -6.708  1.00  1.540          H  
ATOM    189  HH2 TRP A  13       1.212  -4.810  -8.432  1.00  1.540          H  
ATOM    190  N   ASP A  14       0.843  -8.037  -0.726  1.00  0.960          N  
ATOM    191  CA  ASP A  14      -0.468  -8.516  -0.285  1.00  1.150          C  
ATOM    192  C   ASP A  14      -1.385  -7.341   0.098  1.00  1.200          C  
ATOM    193  O   ASP A  14      -2.594  -7.384  -0.167  1.00  1.480          O  
ATOM    194  CB  ASP A  14      -0.364  -9.481   0.901  1.00  1.530          C  
ATOM    195  CG  ASP A  14       0.158 -10.897   0.557  1.00  1.530          C  
ATOM    196  OD1 ASP A  14       0.214 -11.262  -0.600  1.00  1.530          O  
ATOM    197  OD2 ASP A  14       0.475 -11.609   1.482  1.00  1.530          O  
ATOM    198  H   ASP A  14       1.704  -8.358  -0.264  1.00  1.150          H  
ATOM    199  HA  ASP A  14      -0.929  -9.053  -1.114  1.00  1.380          H  
ATOM    200 1HB  ASP A  14       0.311  -9.046   1.643  1.00  1.840          H  
ATOM    201 2HB  ASP A  14      -1.340  -9.577   1.372  1.00  1.840          H  
ATOM    202  N   GLU A  15      -0.823  -6.289   0.721  1.00  1.070          N  
ATOM    203  CA  GLU A  15      -1.631  -5.115   1.065  1.00  1.340          C  
ATOM    204  C   GLU A  15      -2.167  -4.458  -0.221  1.00  1.530          C  
ATOM    205  O   GLU A  15      -3.341  -4.057  -0.302  1.00  1.910          O  
ATOM    206  CB  GLU A  15      -0.795  -4.073   1.837  1.00  1.770          C  
ATOM    207  CG  GLU A  15      -0.357  -4.459   3.264  1.00  1.770          C  
ATOM    208  CD  GLU A  15       0.604  -3.427   3.881  1.00  1.770          C  
ATOM    209  OE1 GLU A  15       1.019  -2.531   3.172  1.00  1.770          O  
ATOM    210  OE2 GLU A  15       0.915  -3.543   5.045  1.00  1.770          O  
ATOM    211  H   GLU A  15       0.166  -6.344   0.992  1.00  1.280          H  
ATOM    212  HA  GLU A  15      -2.473  -5.433   1.676  1.00  1.610          H  
ATOM    213 1HB  GLU A  15       0.097  -3.840   1.275  1.00  2.120          H  
ATOM    214 2HB  GLU A  15      -1.367  -3.150   1.914  1.00  2.120          H  
ATOM    215 1HG  GLU A  15      -1.241  -4.542   3.893  1.00  2.120          H  
ATOM    216 2HG  GLU A  15       0.127  -5.431   3.236  1.00  2.120          H  
ATOM    217  N   ASN A  16      -1.318  -4.393  -1.256  1.00  1.420          N  
ATOM    218  CA  ASN A  16      -1.726  -3.818  -2.524  1.00  1.870          C  
ATOM    219  C   ASN A  16      -2.812  -4.658  -3.155  1.00  1.750          C  
ATOM    220  O   ASN A  16      -3.782  -4.103  -3.683  1.00  1.780          O  
ATOM    221  CB  ASN A  16      -0.555  -3.708  -3.480  1.00  2.440          C  
ATOM    222  CG  ASN A  16       0.374  -2.655  -3.092  1.00  2.440          C  
ATOM    223  OD1 ASN A  16       0.005  -1.721  -2.369  1.00  2.440          O  
ATOM    224  ND2 ASN A  16       1.584  -2.765  -3.540  1.00  2.440          N  
ATOM    225  H   ASN A  16      -0.346  -4.682  -1.106  1.00  1.700          H  
ATOM    226  HA  ASN A  16      -2.134  -2.825  -2.340  1.00  2.240          H  
ATOM    227 1HB  ASN A  16      -0.020  -4.649  -3.520  1.00  2.930          H  
ATOM    228 2HB  ASN A  16      -0.926  -3.507  -4.482  1.00  2.930          H  
ATOM    229 1HD2 ASN A  16       2.272  -2.078  -3.310  1.00  2.930          H  
ATOM    230 2HD2 ASN A  16       1.829  -3.538  -4.119  1.00  2.930          H  
ATOM    231  N   LYS A  17      -2.693  -5.988  -3.046  1.00  1.750          N  
ATOM    232  CA  LYS A  17      -3.671  -6.905  -3.608  1.00  1.890          C  
ATOM    233  C   LYS A  17      -5.051  -6.649  -3.028  1.00  1.820          C  
ATOM    234  O   LYS A  17      -6.043  -6.655  -3.762  1.00  2.030          O  
ATOM    235  CB  LYS A  17      -3.243  -8.358  -3.423  1.00  2.590          C  
ATOM    236  CG  LYS A  17      -4.178  -9.377  -4.081  1.00  2.590          C  
ATOM    237  CD  LYS A  17      -3.613 -10.789  -3.984  1.00  2.590          C  
ATOM    238  CE  LYS A  17      -4.536 -11.813  -4.648  1.00  2.590          C  
ATOM    239  NZ  LYS A  17      -3.948 -13.183  -4.630  1.00  2.590          N  
ATOM    240  H   LYS A  17      -1.844  -6.360  -2.614  1.00  2.100          H  
ATOM    241  HA  LYS A  17      -3.734  -6.738  -4.662  1.00  2.270          H  
ATOM    242 1HB  LYS A  17      -2.234  -8.493  -3.823  1.00  3.110          H  
ATOM    243 2HB  LYS A  17      -3.202  -8.587  -2.361  1.00  3.110          H  
ATOM    244 1HG  LYS A  17      -5.151  -9.350  -3.585  1.00  3.110          H  
ATOM    245 2HG  LYS A  17      -4.318  -9.113  -5.131  1.00  3.110          H  
ATOM    246 1HD  LYS A  17      -2.635 -10.825  -4.473  1.00  3.110          H  
ATOM    247 2HD  LYS A  17      -3.483 -11.056  -2.935  1.00  3.110          H  
ATOM    248 1HE  LYS A  17      -5.490 -11.831  -4.125  1.00  3.110          H  
ATOM    249 2HE  LYS A  17      -4.705 -11.519  -5.685  1.00  3.110          H  
ATOM    250 1HZ  LYS A  17      -4.554 -13.854  -5.089  1.00  3.110          H  
ATOM    251 2HZ  LYS A  17      -3.056 -13.181  -5.140  1.00  3.110          H  
ATOM    252 3HZ  LYS A  17      -3.783 -13.492  -3.693  1.00  3.110          H  
ATOM    253  N   SER A  18      -5.121  -6.434  -1.710  1.00  1.730          N  
ATOM    254  CA  SER A  18      -6.394  -6.156  -1.059  1.00  1.920          C  
ATOM    255  C   SER A  18      -7.048  -4.861  -1.540  1.00  1.900          C  
ATOM    256  O   SER A  18      -8.265  -4.828  -1.747  1.00  2.210          O  
ATOM    257  CB  SER A  18      -6.220  -6.070   0.450  1.00  2.610          C  
ATOM    258  OG  SER A  18      -5.874  -7.311   1.005  1.00  2.610          O  
ATOM    259  H   SER A  18      -4.271  -6.537  -1.143  1.00  2.080          H  
ATOM    260  HA  SER A  18      -7.069  -6.979  -1.281  1.00  2.300          H  
ATOM    261 1HB  SER A  18      -5.440  -5.342   0.676  1.00  3.130          H  
ATOM    262 2HB  SER A  18      -7.142  -5.706   0.900  1.00  3.130          H  
ATOM    263  HG  SER A  18      -5.802  -7.164   1.951  1.00  3.130          H  
ATOM    264  N   HIS A  19      -6.260  -3.790  -1.736  1.00  1.650          N  
ATOM    265  CA  HIS A  19      -6.882  -2.529  -2.155  1.00  1.690          C  
ATOM    266  C   HIS A  19      -6.529  -1.966  -3.553  1.00  1.490          C  
ATOM    267  O   HIS A  19      -7.434  -1.610  -4.315  1.00  1.640          O  
ATOM    268  CB  HIS A  19      -6.569  -1.473  -1.098  1.00  2.350          C  
ATOM    269  CG  HIS A  19      -7.154  -1.826   0.240  1.00  2.350          C  
ATOM    270  ND1 HIS A  19      -8.508  -1.766   0.503  1.00  2.350          N  
ATOM    271  CD2 HIS A  19      -6.566  -2.267   1.377  1.00  2.350          C  
ATOM    272  CE1 HIS A  19      -8.724  -2.149   1.751  1.00  2.350          C  
ATOM    273  NE2 HIS A  19      -7.564  -2.457   2.301  1.00  2.350          N  
ATOM    274  H   HIS A  19      -5.262  -3.859  -1.498  1.00  1.980          H  
ATOM    275  HA  HIS A  19      -7.960  -2.665  -2.154  1.00  2.030          H  
ATOM    276 1HB  HIS A  19      -5.488  -1.374  -0.988  1.00  2.820          H  
ATOM    277 2HB  HIS A  19      -6.964  -0.509  -1.413  1.00  2.820          H  
ATOM    278  HD1 HIS A  19      -9.230  -1.748  -0.190  1.00  2.820          H  
ATOM    279  HD2 HIS A  19      -5.528  -2.476   1.638  1.00  2.820          H  
ATOM    280  HE1 HIS A  19      -9.735  -2.171   2.155  1.00  2.820          H  
ATOM    281  N   PHE A  20      -5.241  -1.859  -3.893  1.00  1.340          N  
ATOM    282  CA  PHE A  20      -4.847  -1.240  -5.157  1.00  1.350          C  
ATOM    283  C   PHE A  20      -5.187  -2.082  -6.334  1.00  1.200          C  
ATOM    284  O   PHE A  20      -5.653  -1.584  -7.353  1.00  1.210          O  
ATOM    285  CB  PHE A  20      -3.342  -0.992  -5.265  1.00  1.890          C  
ATOM    286  CG  PHE A  20      -2.741   0.229  -4.627  1.00  1.890          C  
ATOM    287  CD1 PHE A  20      -3.465   1.372  -4.271  1.00  1.890          C  
ATOM    288  CD2 PHE A  20      -1.385   0.252  -4.453  1.00  1.890          C  
ATOM    289  CE1 PHE A  20      -2.812   2.472  -3.750  1.00  1.890          C  
ATOM    290  CE2 PHE A  20      -0.745   1.336  -3.953  1.00  1.890          C  
ATOM    291  CZ  PHE A  20      -1.450   2.452  -3.595  1.00  1.890          C  
ATOM    292  H   PHE A  20      -4.542  -2.260  -3.285  1.00  1.610          H  
ATOM    293  HA  PHE A  20      -5.390  -0.307  -5.272  1.00  1.620          H  
ATOM    294 1HB  PHE A  20      -2.833  -1.856  -4.851  1.00  2.260          H  
ATOM    295 2HB  PHE A  20      -3.087  -0.968  -6.315  1.00  2.260          H  
ATOM    296  HD1 PHE A  20      -4.540   1.419  -4.401  1.00  2.260          H  
ATOM    297  HD2 PHE A  20      -0.809  -0.621  -4.737  1.00  2.260          H  
ATOM    298  HE1 PHE A  20      -3.380   3.361  -3.473  1.00  2.260          H  
ATOM    299  HE2 PHE A  20       0.326   1.320  -3.849  1.00  2.260          H  
ATOM    300  HZ  PHE A  20      -0.931   3.323  -3.193  1.00  2.260          H  
ATOM    301  N   ILE A  21      -4.959  -3.374  -6.222  1.00  1.170          N  
ATOM    302  CA  ILE A  21      -5.177  -4.197  -7.385  1.00  1.140          C  
ATOM    303  C   ILE A  21      -6.647  -4.187  -7.729  1.00  1.070          C  
ATOM    304  O   ILE A  21      -6.986  -4.103  -8.900  1.00  1.020          O  
ATOM    305  CB  ILE A  21      -4.654  -5.634  -7.212  1.00  1.610          C  
ATOM    306  CG1 ILE A  21      -3.085  -5.609  -6.950  1.00  1.610          C  
ATOM    307  CG2 ILE A  21      -4.980  -6.479  -8.477  1.00  1.610          C  
ATOM    308  CD1 ILE A  21      -2.239  -4.979  -7.971  1.00  1.610          C  
ATOM    309  H   ILE A  21      -4.604  -3.749  -5.339  1.00  1.400          H  
ATOM    310  HA  ILE A  21      -4.664  -3.752  -8.228  1.00  1.370          H  
ATOM    311  HB  ILE A  21      -5.131  -6.091  -6.348  1.00  1.930          H  
ATOM    312 1HG1 ILE A  21      -2.904  -5.071  -6.031  1.00  1.930          H  
ATOM    313 2HG1 ILE A  21      -2.736  -6.641  -6.832  1.00  1.930          H  
ATOM    314 1HG2 ILE A  21      -4.605  -7.495  -8.340  1.00  1.930          H  
ATOM    315 2HG2 ILE A  21      -6.058  -6.520  -8.634  1.00  1.930          H  
ATOM    316 3HG2 ILE A  21      -4.518  -6.038  -9.355  1.00  1.930          H  
ATOM    317 1HD1 ILE A  21      -1.231  -5.025  -7.649  1.00  1.930          H  
ATOM    318 2HD1 ILE A  21      -2.336  -5.494  -8.913  1.00  1.930          H  
ATOM    319 3HD1 ILE A  21      -2.510  -3.952  -8.079  1.00  1.930          H  
ATOM    320  N   GLU A  22      -7.534  -4.261  -6.743  1.00  1.230          N  
ATOM    321  CA  GLU A  22      -8.956  -4.267  -7.045  1.00  1.350          C  
ATOM    322  C   GLU A  22      -9.403  -2.998  -7.789  1.00  1.280          C  
ATOM    323  O   GLU A  22     -10.122  -3.098  -8.791  1.00  1.360          O  
ATOM    324  CB  GLU A  22      -9.761  -4.413  -5.750  1.00  1.840          C  
ATOM    325  CG  GLU A  22     -11.284  -4.524  -5.930  1.00  1.840          C  
ATOM    326  CD  GLU A  22     -11.712  -5.801  -6.611  1.00  1.840          C  
ATOM    327  OE1 GLU A  22     -10.941  -6.734  -6.620  1.00  1.840          O  
ATOM    328  OE2 GLU A  22     -12.808  -5.846  -7.114  1.00  1.840          O  
ATOM    329  H   GLU A  22      -7.210  -4.338  -5.788  1.00  1.480          H  
ATOM    330  HA  GLU A  22      -9.166  -5.128  -7.682  1.00  1.620          H  
ATOM    331 1HB  GLU A  22      -9.419  -5.297  -5.209  1.00  2.210          H  
ATOM    332 2HB  GLU A  22      -9.562  -3.549  -5.109  1.00  2.210          H  
ATOM    333 1HG  GLU A  22     -11.750  -4.480  -4.948  1.00  2.210          H  
ATOM    334 2HG  GLU A  22     -11.642  -3.670  -6.506  1.00  2.210          H  
ATOM    335  N   ASP A  23      -8.911  -1.811  -7.397  1.00  1.300          N  
ATOM    336  CA  ASP A  23      -9.365  -0.628  -8.130  1.00  1.450          C  
ATOM    337  C   ASP A  23      -8.613  -0.427  -9.438  1.00  1.350          C  
ATOM    338  O   ASP A  23      -9.214  -0.026 -10.445  1.00  1.460          O  
ATOM    339  CB  ASP A  23      -9.228   0.642  -7.293  1.00  1.970          C  
ATOM    340  CG  ASP A  23     -10.201   0.726  -6.127  1.00  1.970          C  
ATOM    341  OD1 ASP A  23     -11.393   0.622  -6.342  1.00  1.970          O  
ATOM    342  OD2 ASP A  23      -9.747   0.920  -5.032  1.00  1.970          O  
ATOM    343  H   ASP A  23      -8.327  -1.732  -6.553  1.00  1.560          H  
ATOM    344  HA  ASP A  23     -10.420  -0.760  -8.362  1.00  1.740          H  
ATOM    345 1HB  ASP A  23      -8.210   0.690  -6.894  1.00  2.360          H  
ATOM    346 2HB  ASP A  23      -9.367   1.513  -7.929  1.00  2.360          H  
ATOM    347  N   PHE A  24      -7.317  -0.736  -9.464  1.00  1.260          N  
ATOM    348  CA  PHE A  24      -6.551  -0.544 -10.680  1.00  1.400          C  
ATOM    349  C   PHE A  24      -7.081  -1.539 -11.709  1.00  1.320          C  
ATOM    350  O   PHE A  24      -7.272  -1.190 -12.878  1.00  1.530          O  
ATOM    351  CB  PHE A  24      -5.042  -0.718 -10.416  1.00  1.900          C  
ATOM    352  CG  PHE A  24      -4.410   0.375  -9.463  1.00  1.900          C  
ATOM    353  CD1 PHE A  24      -5.127   1.514  -9.046  1.00  1.900          C  
ATOM    354  CD2 PHE A  24      -3.091   0.262  -8.998  1.00  1.900          C  
ATOM    355  CE1 PHE A  24      -4.554   2.449  -8.207  1.00  1.900          C  
ATOM    356  CE2 PHE A  24      -2.541   1.224  -8.164  1.00  1.900          C  
ATOM    357  CZ  PHE A  24      -3.267   2.299  -7.772  1.00  1.900          C  
ATOM    358  H   PHE A  24      -6.839  -1.072  -8.626  1.00  1.510          H  
ATOM    359  HA  PHE A  24      -6.731   0.454 -11.074  1.00  1.680          H  
ATOM    360 1HB  PHE A  24      -4.881  -1.694  -9.958  1.00  2.280          H  
ATOM    361 2HB  PHE A  24      -4.502  -0.705 -11.361  1.00  2.280          H  
ATOM    362  HD1 PHE A  24      -6.147   1.673  -9.368  1.00  2.280          H  
ATOM    363  HD2 PHE A  24      -2.489  -0.577  -9.289  1.00  2.280          H  
ATOM    364  HE1 PHE A  24      -5.130   3.314  -7.891  1.00  2.280          H  
ATOM    365  HE2 PHE A  24      -1.531   1.136  -7.811  1.00  2.280          H  
ATOM    366  HZ  PHE A  24      -2.821   3.042  -7.112  1.00  2.280          H  
ATOM    367  N   CYS A  25      -7.367  -2.771 -11.263  1.00  1.180          N  
ATOM    368  CA  CYS A  25      -7.922  -3.795 -12.115  1.00  1.320          C  
ATOM    369  C   CYS A  25      -9.259  -3.381 -12.635  1.00  1.390          C  
ATOM    370  O   CYS A  25      -9.516  -3.548 -13.812  1.00  1.500          O  
ATOM    371  CB  CYS A  25      -8.083  -5.142 -11.411  1.00  1.790          C  
ATOM    372  SG  CYS A  25      -8.771  -6.459 -12.479  1.00  1.790          S  
ATOM    373  H   CYS A  25      -7.173  -3.024 -10.302  1.00  1.420          H  
ATOM    374  HA  CYS A  25      -7.264  -3.913 -12.961  1.00  1.580          H  
ATOM    375 1HB  CYS A  25      -7.115  -5.476 -11.040  1.00  2.150          H  
ATOM    376 2HB  CYS A  25      -8.744  -5.022 -10.548  1.00  2.150          H  
ATOM    377  HG  CYS A  25      -9.882  -5.789 -12.808  1.00  2.150          H  
ATOM    378  N   TRP A  26     -10.152  -2.842 -11.811  1.00  1.410          N  
ATOM    379  CA  TRP A  26     -11.433  -2.455 -12.378  1.00  1.620          C  
ATOM    380  C   TRP A  26     -11.248  -1.465 -13.524  1.00  1.700          C  
ATOM    381  O   TRP A  26     -11.835  -1.634 -14.603  1.00  1.880          O  
ATOM    382  CB  TRP A  26     -12.344  -1.836 -11.320  1.00  2.180          C  
ATOM    383  CG  TRP A  26     -13.658  -1.364 -11.884  1.00  2.180          C  
ATOM    384  CD1 TRP A  26     -14.776  -2.113 -12.060  1.00  2.180          C  
ATOM    385  CD2 TRP A  26     -13.998  -0.026 -12.341  1.00  2.180          C  
ATOM    386  NE1 TRP A  26     -15.777  -1.347 -12.596  1.00  2.180          N  
ATOM    387  CE2 TRP A  26     -15.316  -0.069 -12.774  1.00  2.180          C  
ATOM    388  CE3 TRP A  26     -13.299   1.178 -12.412  1.00  2.180          C  
ATOM    389  CZ2 TRP A  26     -15.957   1.049 -13.276  1.00  2.180          C  
ATOM    390  CZ3 TRP A  26     -13.930   2.294 -12.916  1.00  2.180          C  
ATOM    391  CH2 TRP A  26     -15.227   2.234 -13.338  1.00  2.180          C  
ATOM    392  H   TRP A  26      -9.976  -2.740 -10.804  1.00  1.690          H  
ATOM    393  HA  TRP A  26     -11.919  -3.347 -12.768  1.00  1.940          H  
ATOM    394 1HB  TRP A  26     -12.540  -2.568 -10.536  1.00  2.620          H  
ATOM    395 2HB  TRP A  26     -11.836  -0.991 -10.853  1.00  2.620          H  
ATOM    396  HD1 TRP A  26     -14.862  -3.169 -11.814  1.00  2.620          H  
ATOM    397  HE1 TRP A  26     -16.706  -1.672 -12.822  1.00  2.620          H  
ATOM    398  HE3 TRP A  26     -12.279   1.230 -12.074  1.00  2.620          H  
ATOM    399  HZ2 TRP A  26     -16.992   1.020 -13.614  1.00  2.620          H  
ATOM    400  HZ3 TRP A  26     -13.370   3.226 -12.965  1.00  2.620          H  
ATOM    401  HH2 TRP A  26     -15.700   3.134 -13.727  1.00  2.620          H  
ATOM    402  N   LYS A  27     -10.422  -0.432 -13.308  1.00  1.660          N  
ATOM    403  CA  LYS A  27     -10.248   0.590 -14.335  1.00  1.840          C  
ATOM    404  C   LYS A  27      -9.739   0.017 -15.658  1.00  1.760          C  
ATOM    405  O   LYS A  27     -10.214   0.421 -16.730  1.00  1.870          O  
ATOM    406  CB  LYS A  27      -9.290   1.687 -13.854  1.00  2.500          C  
ATOM    407  CG  LYS A  27      -9.852   2.603 -12.772  1.00  2.500          C  
ATOM    408  CD  LYS A  27      -8.844   3.673 -12.353  1.00  2.500          C  
ATOM    409  CE  LYS A  27      -9.419   4.588 -11.276  1.00  2.500          C  
ATOM    410  NZ  LYS A  27      -8.448   5.650 -10.865  1.00  2.500          N  
ATOM    411  H   LYS A  27      -9.942  -0.349 -12.403  1.00  1.990          H  
ATOM    412  HA  LYS A  27     -11.218   1.041 -14.520  1.00  2.210          H  
ATOM    413 1HB  LYS A  27      -8.388   1.217 -13.451  1.00  3.000          H  
ATOM    414 2HB  LYS A  27      -8.989   2.301 -14.700  1.00  3.000          H  
ATOM    415 1HG  LYS A  27     -10.759   3.082 -13.138  1.00  3.000          H  
ATOM    416 2HG  LYS A  27     -10.102   2.004 -11.898  1.00  3.000          H  
ATOM    417 1HD  LYS A  27      -7.948   3.185 -11.960  1.00  3.000          H  
ATOM    418 2HD  LYS A  27      -8.562   4.272 -13.218  1.00  3.000          H  
ATOM    419 1HE  LYS A  27     -10.322   5.062 -11.656  1.00  3.000          H  
ATOM    420 2HE  LYS A  27      -9.675   3.987 -10.402  1.00  3.000          H  
ATOM    421 1HZ  LYS A  27      -8.867   6.232 -10.152  1.00  3.000          H  
ATOM    422 2HZ  LYS A  27      -7.608   5.227 -10.500  1.00  3.000          H  
ATOM    423 3HZ  LYS A  27      -8.214   6.220 -11.666  1.00  3.000          H  
ATOM    424  N   LEU A  28      -8.797  -0.933 -15.568  1.00  1.610          N  
ATOM    425  CA  LEU A  28      -8.184  -1.599 -16.711  1.00  1.590          C  
ATOM    426  C   LEU A  28      -9.058  -2.680 -17.339  1.00  1.590          C  
ATOM    427  O   LEU A  28      -9.185  -2.759 -18.568  1.00  1.770          O  
ATOM    428  CB  LEU A  28      -6.919  -2.291 -16.210  1.00  2.230          C  
ATOM    429  CG  LEU A  28      -5.769  -1.417 -15.739  1.00  2.230          C  
ATOM    430  CD1 LEU A  28      -4.804  -2.303 -15.011  1.00  2.230          C  
ATOM    431  CD2 LEU A  28      -5.075  -0.774 -16.933  1.00  2.230          C  
ATOM    432  H   LEU A  28      -8.437  -1.153 -14.630  1.00  1.930          H  
ATOM    433  HA  LEU A  28      -7.960  -0.852 -17.466  1.00  1.910          H  
ATOM    434 1HB  LEU A  28      -7.203  -2.907 -15.361  1.00  2.680          H  
ATOM    435 2HB  LEU A  28      -6.545  -2.948 -16.997  1.00  2.680          H  
ATOM    436  HG  LEU A  28      -6.131  -0.645 -15.060  1.00  2.680          H  
ATOM    437 1HD1 LEU A  28      -3.954  -1.722 -14.654  1.00  2.680          H  
ATOM    438 2HD1 LEU A  28      -5.298  -2.774 -14.159  1.00  2.680          H  
ATOM    439 3HD1 LEU A  28      -4.479  -3.055 -15.698  1.00  2.680          H  
ATOM    440 1HD2 LEU A  28      -4.238  -0.171 -16.582  1.00  2.680          H  
ATOM    441 2HD2 LEU A  28      -4.706  -1.553 -17.604  1.00  2.680          H  
ATOM    442 3HD2 LEU A  28      -5.771  -0.135 -17.470  1.00  2.680          H  
ATOM    443  N   HIS A  29      -9.676  -3.493 -16.489  1.00  1.540          N  
ATOM    444  CA  HIS A  29     -10.443  -4.681 -16.837  1.00  1.770          C  
ATOM    445  C   HIS A  29     -11.532  -4.400 -17.822  1.00  2.190          C  
ATOM    446  O   HIS A  29     -11.716  -5.169 -18.775  1.00  2.420          O  
ATOM    447  CB  HIS A  29     -11.011  -5.352 -15.595  1.00  2.390          C  
ATOM    448  CG  HIS A  29     -11.755  -6.554 -15.904  1.00  2.390          C  
ATOM    449  ND1 HIS A  29     -13.133  -6.603 -15.917  1.00  2.390          N  
ATOM    450  CD2 HIS A  29     -11.328  -7.771 -16.266  1.00  2.390          C  
ATOM    451  CE1 HIS A  29     -13.518  -7.816 -16.256  1.00  2.390          C  
ATOM    452  NE2 HIS A  29     -12.441  -8.547 -16.472  1.00  2.390          N  
ATOM    453  H   HIS A  29      -9.562  -3.316 -15.503  1.00  1.850          H  
ATOM    454  HA  HIS A  29      -9.778  -5.405 -17.296  1.00  2.120          H  
ATOM    455 1HB  HIS A  29     -10.202  -5.630 -14.944  1.00  2.860          H  
ATOM    456 2HB  HIS A  29     -11.654  -4.654 -15.056  1.00  2.860          H  
ATOM    457  HD2 HIS A  29     -10.287  -8.083 -16.378  1.00  2.860          H  
ATOM    458  HE1 HIS A  29     -14.548  -8.158 -16.345  1.00  2.860          H  
ATOM    459  HE2 HIS A  29     -12.434  -9.524 -16.750  1.00  2.860          H  
ATOM    460  N   ARG A  30     -12.161  -3.230 -17.688  1.00  2.370          N  
ATOM    461  CA  ARG A  30     -13.243  -2.794 -18.572  1.00  2.860          C  
ATOM    462  C   ARG A  30     -12.869  -2.903 -20.063  1.00  2.960          C  
ATOM    463  O   ARG A  30     -13.758  -2.937 -20.922  1.00  3.220          O  
ATOM    464  CB  ARG A  30     -13.581  -1.335 -18.304  1.00  3.810          C  
ATOM    465  CG  ARG A  30     -14.234  -1.033 -16.969  1.00  3.810          C  
ATOM    466  CD  ARG A  30     -14.479   0.415 -16.805  1.00  3.810          C  
ATOM    467  NE  ARG A  30     -13.225   1.185 -16.763  1.00  3.810          N  
ATOM    468  CZ  ARG A  30     -13.121   2.517 -16.698  1.00  3.810          C  
ATOM    469  NH1 ARG A  30     -14.185   3.299 -16.630  1.00  3.810          N  
ATOM    470  NH2 ARG A  30     -11.906   3.011 -16.714  1.00  3.810          N  
ATOM    471  H   ARG A  30     -11.936  -2.684 -16.849  1.00  2.840          H  
ATOM    472  HA  ARG A  30     -14.117  -3.415 -18.376  1.00  3.430          H  
ATOM    473 1HB  ARG A  30     -12.660  -0.752 -18.360  1.00  4.570          H  
ATOM    474 2HB  ARG A  30     -14.240  -0.967 -19.084  1.00  4.570          H  
ATOM    475 1HG  ARG A  30     -15.189  -1.549 -16.905  1.00  4.570          H  
ATOM    476 2HG  ARG A  30     -13.602  -1.360 -16.166  1.00  4.570          H  
ATOM    477 1HD  ARG A  30     -15.078   0.777 -17.637  1.00  4.570          H  
ATOM    478 2HD  ARG A  30     -15.007   0.575 -15.880  1.00  4.570          H  
ATOM    479  HE  ARG A  30     -12.320   0.681 -16.806  1.00  4.570          H  
ATOM    480 1HH1 ARG A  30     -15.111   2.898 -16.623  1.00  4.570          H  
ATOM    481 2HH1 ARG A  30     -14.075   4.302 -16.587  1.00  4.570          H  
ATOM    482 1HH2 ARG A  30     -11.129   2.330 -16.794  1.00  4.570          H  
ATOM    483 2HH2 ARG A  30     -11.742   4.005 -16.675  1.00  4.570          H  
ATOM    484  N   ARG A  31     -11.569  -2.896 -20.376  1.00  2.750          N  
ATOM    485  CA  ARG A  31     -11.096  -3.009 -21.740  1.00  2.870          C  
ATOM    486  C   ARG A  31     -10.088  -4.158 -21.884  1.00  2.710          C  
ATOM    487  O   ARG A  31      -9.975  -4.746 -22.963  1.00  2.810          O  
ATOM    488  CB  ARG A  31     -10.470  -1.701 -22.196  1.00  3.970          C  
ATOM    489  CG  ARG A  31     -11.441  -0.509 -22.261  1.00  3.970          C  
ATOM    490  CD  ARG A  31     -12.453  -0.653 -23.355  1.00  3.970          C  
ATOM    491  NE  ARG A  31     -13.358   0.477 -23.403  1.00  3.970          N  
ATOM    492  CZ  ARG A  31     -14.522   0.586 -22.715  1.00  3.970          C  
ATOM    493  NH1 ARG A  31     -14.947  -0.372 -21.897  1.00  3.970          N  
ATOM    494  NH2 ARG A  31     -15.254   1.682 -22.868  1.00  3.970          N  
ATOM    495  H   ARG A  31     -10.882  -2.847 -19.624  1.00  3.300          H  
ATOM    496  HA  ARG A  31     -11.940  -3.247 -22.380  1.00  3.440          H  
ATOM    497 1HB  ARG A  31      -9.667  -1.437 -21.506  1.00  4.760          H  
ATOM    498 2HB  ARG A  31     -10.027  -1.832 -23.181  1.00  4.760          H  
ATOM    499 1HG  ARG A  31     -11.967  -0.414 -21.312  1.00  4.760          H  
ATOM    500 2HG  ARG A  31     -10.874   0.402 -22.445  1.00  4.760          H  
ATOM    501 1HD  ARG A  31     -11.933  -0.710 -24.311  1.00  4.760          H  
ATOM    502 2HD  ARG A  31     -13.046  -1.546 -23.222  1.00  4.760          H  
ATOM    503  HE  ARG A  31     -13.101   1.247 -24.008  1.00  4.760          H  
ATOM    504 1HH1 ARG A  31     -14.412  -1.243 -21.741  1.00  4.760          H  
ATOM    505 2HH1 ARG A  31     -15.820  -0.257 -21.407  1.00  4.760          H  
ATOM    506 1HH2 ARG A  31     -14.942   2.417 -23.488  1.00  4.760          H  
ATOM    507 2HH2 ARG A  31     -16.126   1.785 -22.367  1.00  4.760          H  
ATOM    508  N   GLU A  32      -9.350  -4.452 -20.806  1.00  2.630          N  
ATOM    509  CA  GLU A  32      -8.276  -5.441 -20.808  1.00  2.710          C  
ATOM    510  C   GLU A  32      -8.774  -6.894 -20.831  1.00  2.120          C  
ATOM    511  O   GLU A  32      -8.136  -7.758 -21.438  1.00  2.170          O  
ATOM    512  CB  GLU A  32      -7.398  -5.248 -19.557  1.00  3.760          C  
ATOM    513  CG  GLU A  32      -6.100  -6.067 -19.491  1.00  3.760          C  
ATOM    514  CD  GLU A  32      -5.096  -5.624 -20.531  1.00  3.760          C  
ATOM    515  OE1 GLU A  32      -5.288  -4.561 -21.069  1.00  3.760          O  
ATOM    516  OE2 GLU A  32      -4.111  -6.301 -20.761  1.00  3.760          O  
ATOM    517  H   GLU A  32      -9.501  -3.921 -19.954  1.00  3.160          H  
ATOM    518  HA  GLU A  32      -7.666  -5.274 -21.697  1.00  3.250          H  
ATOM    519 1HB  GLU A  32      -7.131  -4.195 -19.462  1.00  4.510          H  
ATOM    520 2HB  GLU A  32      -7.976  -5.507 -18.685  1.00  4.510          H  
ATOM    521 1HG  GLU A  32      -5.653  -5.940 -18.505  1.00  4.510          H  
ATOM    522 2HG  GLU A  32      -6.322  -7.123 -19.617  1.00  4.510          H  
ATOM    523  N   GLY A  33      -9.844  -7.218 -20.073  1.00  1.990          N  
ATOM    524  CA  GLY A  33     -10.369  -8.595 -19.977  1.00  2.020          C  
ATOM    525  C   GLY A  33      -9.522  -9.527 -19.078  1.00  1.690          C  
ATOM    526  O   GLY A  33     -10.004 -10.228 -18.178  1.00  1.940          O  
ATOM    527  H   GLY A  33     -10.362  -6.476 -19.597  1.00  2.390          H  
ATOM    528 1HA  GLY A  33     -11.388  -8.551 -19.590  1.00  2.420          H  
ATOM    529 2HA  GLY A  33     -10.435  -9.019 -20.977  1.00  2.420          H  
ATOM    530  N   ALA A  34      -8.240  -9.564 -19.372  1.00  1.460          N  
ATOM    531  CA  ALA A  34      -7.260 -10.390 -18.704  1.00  1.510          C  
ATOM    532  C   ALA A  34      -6.887  -9.877 -17.329  1.00  1.240          C  
ATOM    533  O   ALA A  34      -5.851  -9.233 -17.177  1.00  1.070          O  
ATOM    534  CB  ALA A  34      -6.001 -10.465 -19.549  1.00  2.090          C  
ATOM    535  H   ALA A  34      -7.960  -8.994 -20.167  1.00  1.750          H  
ATOM    536  HA  ALA A  34      -7.682 -11.387 -18.590  1.00  1.810          H  
ATOM    537 1HB  ALA A  34      -5.266 -11.107 -19.074  1.00  2.510          H  
ATOM    538 2HB  ALA A  34      -6.247 -10.865 -20.531  1.00  2.510          H  
ATOM    539 3HB  ALA A  34      -5.594  -9.468 -19.664  1.00  2.510          H  
ATOM    540  N   CYS A  35      -7.645 -10.269 -16.302  1.00  1.440          N  
ATOM    541  CA  CYS A  35      -7.355  -9.799 -14.933  1.00  1.370          C  
ATOM    542  C   CYS A  35      -5.897 -10.073 -14.509  1.00  1.390          C  
ATOM    543  O   CYS A  35      -5.362  -9.381 -13.636  1.00  1.390          O  
ATOM    544  CB  CYS A  35      -8.267 -10.456 -13.899  1.00  1.950          C  
ATOM    545  SG  CYS A  35      -9.978  -9.954 -13.996  1.00  1.950          S  
ATOM    546  H   CYS A  35      -8.497 -10.796 -16.518  1.00  1.730          H  
ATOM    547  HA  CYS A  35      -7.542  -8.730 -14.900  1.00  1.640          H  
ATOM    548 1HB  CYS A  35      -8.224 -11.538 -14.006  1.00  2.340          H  
ATOM    549 2HB  CYS A  35      -7.906 -10.211 -12.900  1.00  2.340          H  
ATOM    550  HG  CYS A  35      -9.746  -8.643 -13.922  1.00  2.340          H  
ATOM    551  N   VAL A  36      -5.256 -11.072 -15.116  1.00  1.580          N  
ATOM    552  CA  VAL A  36      -3.865 -11.362 -14.790  1.00  1.850          C  
ATOM    553  C   VAL A  36      -2.969 -10.241 -15.331  1.00  1.790          C  
ATOM    554  O   VAL A  36      -1.975  -9.874 -14.703  1.00  2.140          O  
ATOM    555  CB  VAL A  36      -3.434 -12.741 -15.341  1.00  2.480          C  
ATOM    556  CG1 VAL A  36      -4.316 -13.800 -14.731  1.00  2.480          C  
ATOM    557  CG2 VAL A  36      -3.517 -12.785 -16.885  1.00  2.480          C  
ATOM    558  H   VAL A  36      -5.763 -11.612 -15.802  1.00  1.900          H  
ATOM    559  HA  VAL A  36      -3.761 -11.392 -13.703  1.00  2.220          H  
ATOM    560  HB  VAL A  36      -2.412 -12.948 -15.029  1.00  2.980          H  
ATOM    561 1HG1 VAL A  36      -4.005 -14.786 -15.079  1.00  2.980          H  
ATOM    562 2HG1 VAL A  36      -4.221 -13.748 -13.655  1.00  2.980          H  
ATOM    563 3HG1 VAL A  36      -5.350 -13.632 -15.006  1.00  2.980          H  
ATOM    564 1HG2 VAL A  36      -3.213 -13.772 -17.225  1.00  2.980          H  
ATOM    565 2HG2 VAL A  36      -4.534 -12.594 -17.209  1.00  2.980          H  
ATOM    566 3HG2 VAL A  36      -2.853 -12.053 -17.330  1.00  2.980          H  
ATOM    567  N   ASN A  37      -3.331  -9.666 -16.481  1.00  1.560          N  
ATOM    568  CA  ASN A  37      -2.537  -8.594 -17.017  1.00  1.750          C  
ATOM    569  C   ASN A  37      -2.849  -7.392 -16.178  1.00  1.550          C  
ATOM    570  O   ASN A  37      -1.992  -6.558 -15.937  1.00  1.610          O  
ATOM    571  CB  ASN A  37      -2.840  -8.292 -18.456  1.00  2.370          C  
ATOM    572  CG  ASN A  37      -2.423  -9.327 -19.409  1.00  2.370          C  
ATOM    573  OD1 ASN A  37      -1.658 -10.267 -19.139  1.00  2.370          O  
ATOM    574  ND2 ASN A  37      -2.913  -9.140 -20.596  1.00  2.370          N  
ATOM    575  H   ASN A  37      -4.185  -9.938 -16.951  1.00  1.870          H  
ATOM    576  HA  ASN A  37      -1.478  -8.831 -16.907  1.00  2.100          H  
ATOM    577 1HB  ASN A  37      -3.909  -8.115 -18.568  1.00  2.850          H  
ATOM    578 2HB  ASN A  37      -2.343  -7.375 -18.730  1.00  2.850          H  
ATOM    579 1HD2 ASN A  37      -2.694  -9.769 -21.343  1.00  2.850          H  
ATOM    580 2HD2 ASN A  37      -3.489  -8.305 -20.757  1.00  2.850          H  
ATOM    581  N   CYS A  38      -4.078  -7.312 -15.678  1.00  1.370          N  
ATOM    582  CA  CYS A  38      -4.426  -6.170 -14.863  1.00  1.250          C  
ATOM    583  C   CYS A  38      -3.539  -6.104 -13.621  1.00  1.160          C  
ATOM    584  O   CYS A  38      -3.081  -5.016 -13.273  1.00  1.150          O  
ATOM    585  CB  CYS A  38      -5.873  -6.197 -14.434  1.00  1.800          C  
ATOM    586  SG  CYS A  38      -7.075  -5.920 -15.760  1.00  1.800          S  
ATOM    587  H   CYS A  38      -4.761  -8.027 -15.943  1.00  1.640          H  
ATOM    588  HA  CYS A  38      -4.268  -5.277 -15.452  1.00  1.500          H  
ATOM    589 1HB  CYS A  38      -6.098  -7.120 -13.950  1.00  2.160          H  
ATOM    590 2HB  CYS A  38      -5.997  -5.440 -13.708  1.00  2.160          H  
ATOM    591  HG  CYS A  38      -8.090  -5.580 -14.959  1.00  2.160          H  
ATOM    592  N   GLU A  39      -3.267  -7.248 -12.963  1.00  1.190          N  
ATOM    593  CA  GLU A  39      -2.370  -7.230 -11.799  1.00  1.170          C  
ATOM    594  C   GLU A  39      -0.976  -6.733 -12.217  1.00  1.180          C  
ATOM    595  O   GLU A  39      -0.372  -5.915 -11.518  1.00  1.100          O  
ATOM    596  CB  GLU A  39      -2.275  -8.607 -11.123  1.00  1.650          C  
ATOM    597  CG  GLU A  39      -1.433  -8.621  -9.807  1.00  1.650          C  
ATOM    598  CD  GLU A  39      -1.444  -9.970  -9.095  1.00  1.650          C  
ATOM    599  OE1 GLU A  39      -2.063 -10.860  -9.613  1.00  1.650          O  
ATOM    600  OE2 GLU A  39      -0.852 -10.111  -8.028  1.00  1.650          O  
ATOM    601  H   GLU A  39      -3.746  -8.110 -13.253  1.00  1.430          H  
ATOM    602  HA  GLU A  39      -2.774  -6.532 -11.072  1.00  1.400          H  
ATOM    603 1HB  GLU A  39      -3.278  -8.967 -10.893  1.00  1.980          H  
ATOM    604 2HB  GLU A  39      -1.822  -9.318 -11.818  1.00  1.980          H  
ATOM    605 1HG  GLU A  39      -0.410  -8.358 -10.047  1.00  1.980          H  
ATOM    606 2HG  GLU A  39      -1.824  -7.864  -9.134  1.00  1.980          H  
ATOM    607  N   MET A  40      -0.485  -7.204 -13.370  1.00  1.340          N  
ATOM    608  CA  MET A  40       0.803  -6.773 -13.932  1.00  1.450          C  
ATOM    609  C   MET A  40       0.833  -5.264 -14.242  1.00  1.370          C  
ATOM    610  O   MET A  40       1.807  -4.566 -13.939  1.00  1.370          O  
ATOM    611  CB  MET A  40       1.057  -7.542 -15.205  1.00  1.990          C  
ATOM    612  CG  MET A  40       2.324  -7.221 -15.963  1.00  1.990          C  
ATOM    613  SD  MET A  40       2.347  -8.058 -17.572  1.00  1.990          S  
ATOM    614  CE  MET A  40       1.087  -7.121 -18.499  1.00  1.990          C  
ATOM    615  H   MET A  40      -1.028  -7.920 -13.871  1.00  1.610          H  
ATOM    616  HA  MET A  40       1.587  -6.992 -13.208  1.00  1.740          H  
ATOM    617 1HB  MET A  40       1.069  -8.566 -14.963  1.00  2.380          H  
ATOM    618 2HB  MET A  40       0.241  -7.395 -15.854  1.00  2.380          H  
ATOM    619 1HG  MET A  40       2.414  -6.149 -16.131  1.00  2.380          H  
ATOM    620 2HG  MET A  40       3.191  -7.555 -15.380  1.00  2.380          H  
ATOM    621 1HE  MET A  40       1.010  -7.521 -19.510  1.00  2.380          H  
ATOM    622 2HE  MET A  40       0.118  -7.193 -18.022  1.00  2.380          H  
ATOM    623 3HE  MET A  40       1.380  -6.069 -18.549  1.00  2.380          H  
ATOM    624  N   HIS A  41      -0.227  -4.764 -14.868  1.00  1.350          N  
ATOM    625  CA  HIS A  41      -0.307  -3.364 -15.231  1.00  1.390          C  
ATOM    626  C   HIS A  41      -0.379  -2.544 -13.951  1.00  1.180          C  
ATOM    627  O   HIS A  41       0.220  -1.464 -13.854  1.00  1.200          O  
ATOM    628  CB  HIS A  41      -1.550  -3.086 -16.073  1.00  1.930          C  
ATOM    629  CG  HIS A  41      -1.585  -3.686 -17.473  1.00  1.930          C  
ATOM    630  ND1 HIS A  41      -0.606  -3.466 -18.416  1.00  1.930          N  
ATOM    631  CD2 HIS A  41      -2.523  -4.455 -18.078  1.00  1.930          C  
ATOM    632  CE1 HIS A  41      -0.933  -4.101 -19.539  1.00  1.930          C  
ATOM    633  NE2 HIS A  41      -2.090  -4.702 -19.356  1.00  1.930          N  
ATOM    634  H   HIS A  41      -0.980  -5.387 -15.136  1.00  1.620          H  
ATOM    635  HA  HIS A  41       0.576  -3.069 -15.792  1.00  1.670          H  
ATOM    636 1HB  HIS A  41      -2.368  -3.523 -15.538  1.00  2.320          H  
ATOM    637 2HB  HIS A  41      -1.727  -2.014 -16.140  1.00  2.320          H  
ATOM    638  HD2 HIS A  41      -3.452  -4.815 -17.647  1.00  2.320          H  
ATOM    639  HE1 HIS A  41      -0.350  -4.118 -20.461  1.00  2.320          H  
ATOM    640  HE2 HIS A  41      -2.623  -5.274 -20.046  1.00  2.320          H  
ATOM    641  N   ALA A  42      -1.126  -3.048 -12.963  1.00  1.040          N  
ATOM    642  CA  ALA A  42      -1.232  -2.387 -11.688  1.00  0.890          C  
ATOM    643  C   ALA A  42       0.151  -2.313 -11.059  1.00  0.820          C  
ATOM    644  O   ALA A  42       0.534  -1.255 -10.582  1.00  0.820          O  
ATOM    645  CB  ALA A  42      -2.207  -3.116 -10.803  1.00  1.310          C  
ATOM    646  H   ALA A  42      -1.650  -3.911 -13.107  1.00  1.250          H  
ATOM    647  HA  ALA A  42      -1.592  -1.373 -11.852  1.00  1.070          H  
ATOM    648 1HB  ALA A  42      -2.285  -2.621  -9.861  1.00  1.570          H  
ATOM    649 2HB  ALA A  42      -3.183  -3.152 -11.284  1.00  1.570          H  
ATOM    650 3HB  ALA A  42      -1.846  -4.115 -10.660  1.00  1.570          H  
ATOM    651  N   LEU A  43       0.967  -3.376 -11.162  1.00  0.870          N  
ATOM    652  CA  LEU A  43       2.324  -3.341 -10.612  1.00  0.860          C  
ATOM    653  C   LEU A  43       3.075  -2.145 -11.183  1.00  0.830          C  
ATOM    654  O   LEU A  43       3.767  -1.440 -10.446  1.00  0.780          O  
ATOM    655  CB  LEU A  43       3.088  -4.650 -10.938  1.00  1.210          C  
ATOM    656  CG  LEU A  43       4.573  -4.801 -10.433  1.00  1.210          C  
ATOM    657  CD1 LEU A  43       4.639  -4.785  -8.906  1.00  1.210          C  
ATOM    658  CD2 LEU A  43       5.160  -6.107 -10.969  1.00  1.210          C  
ATOM    659  H   LEU A  43       0.593  -4.255 -11.535  1.00  1.040          H  
ATOM    660  HA  LEU A  43       2.257  -3.217  -9.540  1.00  1.030          H  
ATOM    661 1HB  LEU A  43       2.509  -5.491 -10.556  1.00  1.450          H  
ATOM    662 2HB  LEU A  43       3.137  -4.751 -12.006  1.00  1.450          H  
ATOM    663  HG  LEU A  43       5.158  -3.974 -10.814  1.00  1.450          H  
ATOM    664 1HD1 LEU A  43       5.662  -4.896  -8.566  1.00  1.450          H  
ATOM    665 2HD1 LEU A  43       4.241  -3.851  -8.527  1.00  1.450          H  
ATOM    666 3HD1 LEU A  43       4.073  -5.603  -8.528  1.00  1.450          H  
ATOM    667 1HD2 LEU A  43       6.187  -6.197 -10.630  1.00  1.450          H  
ATOM    668 2HD2 LEU A  43       4.584  -6.948 -10.602  1.00  1.450          H  
ATOM    669 3HD2 LEU A  43       5.134  -6.108 -12.064  1.00  1.450          H  
ATOM    670  N   ASN A  44       2.944  -1.917 -12.490  1.00  0.960          N  
ATOM    671  CA  ASN A  44       3.610  -0.785 -13.128  1.00  1.040          C  
ATOM    672  C   ASN A  44       3.080   0.587 -12.653  1.00  1.010          C  
ATOM    673  O   ASN A  44       3.834   1.563 -12.634  1.00  1.060          O  
ATOM    674  CB  ASN A  44       3.540  -0.934 -14.632  1.00  1.420          C  
ATOM    675  CG  ASN A  44       4.454  -2.040 -15.088  1.00  1.420          C  
ATOM    676  OD1 ASN A  44       5.381  -2.405 -14.350  1.00  1.420          O  
ATOM    677  ND2 ASN A  44       4.221  -2.574 -16.258  1.00  1.420          N  
ATOM    678  H   ASN A  44       2.411  -2.602 -13.041  1.00  1.150          H  
ATOM    679  HA  ASN A  44       4.661  -0.817 -12.843  1.00  1.250          H  
ATOM    680 1HB  ASN A  44       2.521  -1.166 -14.935  1.00  1.710          H  
ATOM    681 2HB  ASN A  44       3.829  -0.001 -15.113  1.00  1.710          H  
ATOM    682 1HD2 ASN A  44       4.805  -3.317 -16.590  1.00  1.710          H  
ATOM    683 2HD2 ASN A  44       3.458  -2.248 -16.819  1.00  1.710          H  
ATOM    684  N   GLU A  45       1.804   0.663 -12.252  1.00  1.010          N  
ATOM    685  CA  GLU A  45       1.230   1.902 -11.685  1.00  1.090          C  
ATOM    686  C   GLU A  45       1.764   2.098 -10.248  1.00  0.990          C  
ATOM    687  O   GLU A  45       2.156   3.198  -9.816  1.00  1.110          O  
ATOM    688  CB  GLU A  45      -0.308   1.821 -11.655  1.00  1.490          C  
ATOM    689  CG  GLU A  45      -1.037   3.077 -11.151  1.00  1.490          C  
ATOM    690  CD  GLU A  45      -0.873   4.270 -12.053  1.00  1.490          C  
ATOM    691  OE1 GLU A  45      -0.544   4.082 -13.201  1.00  1.490          O  
ATOM    692  OE2 GLU A  45      -1.083   5.368 -11.598  1.00  1.490          O  
ATOM    693  H   GLU A  45       1.210  -0.167 -12.375  1.00  1.210          H  
ATOM    694  HA  GLU A  45       1.537   2.749 -12.298  1.00  1.310          H  
ATOM    695 1HB  GLU A  45      -0.676   1.588 -12.654  1.00  1.790          H  
ATOM    696 2HB  GLU A  45      -0.609   1.001 -11.006  1.00  1.790          H  
ATOM    697 1HG  GLU A  45      -2.099   2.846 -11.062  1.00  1.790          H  
ATOM    698 2HG  GLU A  45      -0.670   3.325 -10.156  1.00  1.790          H  
ATOM    699  N   ILE A  46       1.820   0.983  -9.534  1.00  0.850          N  
ATOM    700  CA  ILE A  46       2.276   0.886  -8.163  1.00  0.940          C  
ATOM    701  C   ILE A  46       3.741   1.330  -8.128  1.00  0.890          C  
ATOM    702  O   ILE A  46       4.187   1.926  -7.156  1.00  1.000          O  
ATOM    703  CB  ILE A  46       2.007  -0.498  -7.578  1.00  1.280          C  
ATOM    704  CG1 ILE A  46       0.472  -0.695  -7.482  1.00  1.280          C  
ATOM    705  CG2 ILE A  46       2.582  -0.540  -6.212  1.00  1.280          C  
ATOM    706  CD1 ILE A  46      -0.020  -2.094  -7.215  1.00  1.280          C  
ATOM    707  H   ILE A  46       1.481   0.135  -9.984  1.00  1.020          H  
ATOM    708  HA  ILE A  46       1.701   1.591  -7.562  1.00  1.130          H  
ATOM    709  HB  ILE A  46       2.442  -1.268  -8.204  1.00  1.540          H  
ATOM    710 1HG1 ILE A  46       0.124  -0.049  -6.707  1.00  1.540          H  
ATOM    711 2HG1 ILE A  46       0.035  -0.368  -8.407  1.00  1.540          H  
ATOM    712 1HG2 ILE A  46       2.403  -1.496  -5.771  1.00  1.540          H  
ATOM    713 2HG2 ILE A  46       3.628  -0.370  -6.282  1.00  1.540          H  
ATOM    714 3HG2 ILE A  46       2.137   0.240  -5.591  1.00  1.540          H  
ATOM    715 1HD1 ILE A  46      -1.104  -2.090  -7.174  1.00  1.540          H  
ATOM    716 2HD1 ILE A  46       0.303  -2.737  -8.022  1.00  1.540          H  
ATOM    717 3HD1 ILE A  46       0.367  -2.461  -6.281  1.00  1.540          H  
ATOM    718  N   GLN A  47       4.488   1.054  -9.200  1.00  0.810          N  
ATOM    719  CA  GLN A  47       5.862   1.523  -9.309  1.00  0.810          C  
ATOM    720  C   GLN A  47       5.966   3.010  -9.035  1.00  0.830          C  
ATOM    721  O   GLN A  47       7.006   3.429  -8.533  1.00  0.860          O  
ATOM    722  CB  GLN A  47       6.460   1.256 -10.700  1.00  1.130          C  
ATOM    723  CG  GLN A  47       7.942   1.715 -10.910  1.00  1.130          C  
ATOM    724  CD  GLN A  47       9.010   1.057 -10.007  1.00  1.130          C  
ATOM    725  OE1 GLN A  47       9.075  -0.170  -9.829  1.00  1.130          O  
ATOM    726  NE2 GLN A  47       9.882   1.898  -9.468  1.00  1.130          N  
ATOM    727  H   GLN A  47       4.093   0.450  -9.923  1.00  0.970          H  
ATOM    728  HA  GLN A  47       6.459   1.002  -8.567  1.00  0.970          H  
ATOM    729 1HB  GLN A  47       6.357   0.219 -10.977  1.00  1.360          H  
ATOM    730 2HB  GLN A  47       5.890   1.823 -11.419  1.00  1.360          H  
ATOM    731 1HG  GLN A  47       8.204   1.474 -11.937  1.00  1.360          H  
ATOM    732 2HG  GLN A  47       8.004   2.793 -10.777  1.00  1.360          H  
ATOM    733 1HE2 GLN A  47      10.634   1.568  -8.902  1.00  1.360          H  
ATOM    734 2HE2 GLN A  47       9.810   2.896  -9.647  1.00  1.360          H  
ATOM    735  N   GLU A  48       4.983   3.845  -9.413  1.00  0.860          N  
ATOM    736  CA  GLU A  48       5.106   5.271  -9.131  1.00  0.950          C  
ATOM    737  C   GLU A  48       4.958   5.451  -7.629  1.00  1.050          C  
ATOM    738  O   GLU A  48       5.743   6.139  -6.978  1.00  1.310          O  
ATOM    739  CB  GLU A  48       4.034   6.074  -9.876  1.00  1.290          C  
ATOM    740  CG  GLU A  48       4.088   7.609  -9.699  1.00  1.290          C  
ATOM    741  CD  GLU A  48       5.336   8.252 -10.252  1.00  1.290          C  
ATOM    742  OE1 GLU A  48       6.063   7.588 -10.950  1.00  1.290          O  
ATOM    743  OE2 GLU A  48       5.534   9.421 -10.019  1.00  1.290          O  
ATOM    744  H   GLU A  48       4.109   3.514  -9.835  1.00  1.030          H  
ATOM    745  HA  GLU A  48       6.096   5.614  -9.437  1.00  1.140          H  
ATOM    746 1HB  GLU A  48       4.102   5.858 -10.941  1.00  1.550          H  
ATOM    747 2HB  GLU A  48       3.049   5.741  -9.545  1.00  1.550          H  
ATOM    748 1HG  GLU A  48       3.222   8.046 -10.192  1.00  1.550          H  
ATOM    749 2HG  GLU A  48       4.015   7.837  -8.638  1.00  1.550          H  
ATOM    750  N   VAL A  49       4.012   4.713  -7.051  1.00  0.920          N  
ATOM    751  CA  VAL A  49       3.770   4.809  -5.606  1.00  1.020          C  
ATOM    752  C   VAL A  49       5.055   4.452  -4.845  1.00  1.020          C  
ATOM    753  O   VAL A  49       5.443   5.131  -3.884  1.00  1.110          O  
ATOM    754  CB  VAL A  49       2.628   3.845  -5.165  1.00  1.390          C  
ATOM    755  CG1 VAL A  49       2.507   3.808  -3.642  1.00  1.390          C  
ATOM    756  CG2 VAL A  49       1.319   4.266  -5.828  1.00  1.390          C  
ATOM    757  H   VAL A  49       3.413   4.152  -7.673  1.00  1.100          H  
ATOM    758  HA  VAL A  49       3.488   5.835  -5.366  1.00  1.220          H  
ATOM    759  HB  VAL A  49       2.869   2.846  -5.468  1.00  1.670          H  
ATOM    760 1HG1 VAL A  49       1.722   3.125  -3.360  1.00  1.670          H  
ATOM    761 2HG1 VAL A  49       3.439   3.478  -3.185  1.00  1.670          H  
ATOM    762 3HG1 VAL A  49       2.265   4.803  -3.296  1.00  1.670          H  
ATOM    763 1HG2 VAL A  49       0.526   3.583  -5.542  1.00  1.670          H  
ATOM    764 2HG2 VAL A  49       1.063   5.276  -5.513  1.00  1.670          H  
ATOM    765 3HG2 VAL A  49       1.434   4.244  -6.914  1.00  1.670          H  
ATOM    766  N   PHE A  50       5.713   3.383  -5.294  1.00  0.940          N  
ATOM    767  CA  PHE A  50       6.954   2.915  -4.702  1.00  0.980          C  
ATOM    768  C   PHE A  50       8.123   3.873  -4.977  1.00  0.910          C  
ATOM    769  O   PHE A  50       8.834   4.264  -4.043  1.00  0.880          O  
ATOM    770  CB  PHE A  50       7.344   1.555  -5.290  1.00  1.360          C  
ATOM    771  CG  PHE A  50       6.517   0.354  -4.966  1.00  1.360          C  
ATOM    772  CD1 PHE A  50       5.753   0.218  -3.817  1.00  1.360          C  
ATOM    773  CD2 PHE A  50       6.533  -0.680  -5.863  1.00  1.360          C  
ATOM    774  CE1 PHE A  50       5.031  -0.934  -3.613  1.00  1.360          C  
ATOM    775  CE2 PHE A  50       5.806  -1.822  -5.659  1.00  1.360          C  
ATOM    776  CZ  PHE A  50       5.052  -1.943  -4.537  1.00  1.360          C  
ATOM    777  H   PHE A  50       5.300   2.870  -6.074  1.00  1.130          H  
ATOM    778  HA  PHE A  50       6.822   2.845  -3.625  1.00  1.180          H  
ATOM    779 1HB  PHE A  50       7.380   1.650  -6.370  1.00  1.630          H  
ATOM    780 2HB  PHE A  50       8.321   1.334  -4.986  1.00  1.630          H  
ATOM    781  HD1 PHE A  50       5.719   1.010  -3.074  1.00  1.630          H  
ATOM    782  HD2 PHE A  50       7.140  -0.574  -6.753  1.00  1.630          H  
ATOM    783  HE1 PHE A  50       4.447  -1.050  -2.720  1.00  1.630          H  
ATOM    784  HE2 PHE A  50       5.826  -2.631  -6.382  1.00  1.630          H  
ATOM    785  HZ  PHE A  50       4.478  -2.848  -4.370  1.00  1.630          H  
ATOM    786  N   THR A  51       8.276   4.335  -6.229  1.00  0.920          N  
ATOM    787  CA  THR A  51       9.396   5.191  -6.642  1.00  0.940          C  
ATOM    788  C   THR A  51       9.453   6.447  -5.808  1.00  0.960          C  
ATOM    789  O   THR A  51      10.515   6.837  -5.313  1.00  1.020          O  
ATOM    790  CB  THR A  51       9.297   5.606  -8.133  1.00  1.310          C  
ATOM    791  OG1 THR A  51       9.340   4.444  -8.959  1.00  1.310          O  
ATOM    792  CG2 THR A  51      10.455   6.527  -8.512  1.00  1.310          C  
ATOM    793  H   THR A  51       7.639   4.028  -6.956  1.00  1.100          H  
ATOM    794  HA  THR A  51      10.321   4.632  -6.497  1.00  1.130          H  
ATOM    795  HB  THR A  51       8.349   6.125  -8.304  1.00  1.570          H  
ATOM    796  HG1 THR A  51       8.508   3.956  -8.814  1.00  1.570          H  
ATOM    797 1HG2 THR A  51      10.364   6.796  -9.562  1.00  1.570          H  
ATOM    798 2HG2 THR A  51      10.437   7.434  -7.910  1.00  1.570          H  
ATOM    799 3HG2 THR A  51      11.397   6.005  -8.350  1.00  1.570          H  
ATOM    800  N   LEU A  52       8.299   7.048  -5.579  1.00  1.000          N  
ATOM    801  CA  LEU A  52       8.177   8.273  -4.809  1.00  1.110          C  
ATOM    802  C   LEU A  52       8.691   8.134  -3.376  1.00  1.130          C  
ATOM    803  O   LEU A  52       8.943   9.139  -2.709  1.00  1.190          O  
ATOM    804  CB  LEU A  52       6.709   8.711  -4.795  1.00  1.510          C  
ATOM    805  CG  LEU A  52       6.109   9.201  -6.151  1.00  1.510          C  
ATOM    806  CD1 LEU A  52       4.607   9.348  -5.989  1.00  1.510          C  
ATOM    807  CD2 LEU A  52       6.729  10.534  -6.567  1.00  1.510          C  
ATOM    808  H   LEU A  52       7.453   6.659  -6.015  1.00  1.200          H  
ATOM    809  HA  LEU A  52       8.782   9.033  -5.294  1.00  1.330          H  
ATOM    810 1HB  LEU A  52       6.114   7.850  -4.477  1.00  1.810          H  
ATOM    811 2HB  LEU A  52       6.586   9.500  -4.057  1.00  1.810          H  
ATOM    812  HG  LEU A  52       6.304   8.472  -6.930  1.00  1.810          H  
ATOM    813 1HD1 LEU A  52       4.177   9.678  -6.937  1.00  1.810          H  
ATOM    814 2HD1 LEU A  52       4.180   8.382  -5.714  1.00  1.810          H  
ATOM    815 3HD1 LEU A  52       4.390  10.080  -5.216  1.00  1.810          H  
ATOM    816 1HD2 LEU A  52       6.280  10.845  -7.516  1.00  1.810          H  
ATOM    817 2HD2 LEU A  52       6.531  11.284  -5.804  1.00  1.810          H  
ATOM    818 3HD2 LEU A  52       7.798  10.431  -6.703  1.00  1.810          H  
ATOM    819  N   HIS A  53       8.792   6.898  -2.878  1.00  1.130          N  
ATOM    820  CA  HIS A  53       9.253   6.622  -1.538  1.00  1.260          C  
ATOM    821  C   HIS A  53      10.558   5.789  -1.552  1.00  1.230          C  
ATOM    822  O   HIS A  53      10.956   5.231  -0.527  1.00  1.360          O  
ATOM    823  CB  HIS A  53       8.122   5.935  -0.761  1.00  1.710          C  
ATOM    824  CG  HIS A  53       6.905   6.844  -0.623  1.00  1.710          C  
ATOM    825  ND1 HIS A  53       5.949   6.984  -1.621  1.00  1.710          N  
ATOM    826  CD2 HIS A  53       6.526   7.672   0.379  1.00  1.710          C  
ATOM    827  CE1 HIS A  53       5.046   7.868  -1.232  1.00  1.710          C  
ATOM    828  NE2 HIS A  53       5.372   8.301  -0.024  1.00  1.710          N  
ATOM    829  H   HIS A  53       8.601   6.085  -3.461  1.00  1.360          H  
ATOM    830  HA  HIS A  53       9.473   7.560  -1.031  1.00  1.510          H  
ATOM    831 1HB  HIS A  53       7.818   5.027  -1.290  1.00  2.050          H  
ATOM    832 2HB  HIS A  53       8.465   5.650   0.231  1.00  2.050          H  
ATOM    833  HD1 HIS A  53       5.794   6.344  -2.415  1.00  2.050          H  
ATOM    834  HD2 HIS A  53       6.962   7.904   1.349  1.00  2.050          H  
ATOM    835  HE1 HIS A  53       4.212   8.122  -1.882  1.00  2.050          H  
ATOM    836  N   GLY A  54      11.225   5.719  -2.723  1.00  1.160          N  
ATOM    837  CA  GLY A  54      12.504   5.017  -2.905  1.00  1.310          C  
ATOM    838  C   GLY A  54      12.473   3.488  -3.124  1.00  1.280          C  
ATOM    839  O   GLY A  54      13.528   2.850  -3.089  1.00  1.550          O  
ATOM    840  H   GLY A  54      10.845   6.200  -3.541  1.00  1.390          H  
ATOM    841 1HA  GLY A  54      13.010   5.472  -3.757  1.00  1.570          H  
ATOM    842 2HA  GLY A  54      13.131   5.228  -2.042  1.00  1.570          H  
ATOM    843  N   MET A  55      11.297   2.888  -3.295  1.00  1.030          N  
ATOM    844  CA  MET A  55      11.180   1.439  -3.449  1.00  1.050          C  
ATOM    845  C   MET A  55      10.986   1.010  -4.916  1.00  1.030          C  
ATOM    846  O   MET A  55      10.559   1.817  -5.736  1.00  1.070          O  
ATOM    847  CB  MET A  55      10.086   0.949  -2.504  1.00  1.460          C  
ATOM    848  CG  MET A  55       9.925  -0.524  -2.434  1.00  1.460          C  
ATOM    849  SD  MET A  55      11.431  -1.331  -1.784  1.00  1.460          S  
ATOM    850  CE  MET A  55      11.180  -3.028  -2.189  1.00  1.460          C  
ATOM    851  H   MET A  55      10.443   3.448  -3.363  1.00  1.240          H  
ATOM    852  HA  MET A  55      12.117   0.995  -3.117  1.00  1.260          H  
ATOM    853 1HB  MET A  55      10.304   1.313  -1.504  1.00  1.750          H  
ATOM    854 2HB  MET A  55       9.134   1.383  -2.792  1.00  1.750          H  
ATOM    855 1HG  MET A  55       9.113  -0.733  -1.749  1.00  1.750          H  
ATOM    856 2HG  MET A  55       9.664  -0.928  -3.387  1.00  1.750          H  
ATOM    857 1HE  MET A  55      12.026  -3.615  -1.836  1.00  1.750          H  
ATOM    858 2HE  MET A  55      10.272  -3.382  -1.705  1.00  1.750          H  
ATOM    859 3HE  MET A  55      11.093  -3.129  -3.265  1.00  1.750          H  
ATOM    860  N   LYS A  56      11.323  -0.248  -5.261  1.00  1.130          N  
ATOM    861  CA  LYS A  56      11.107  -0.739  -6.635  1.00  1.190          C  
ATOM    862  C   LYS A  56      10.285  -2.041  -6.745  1.00  1.190          C  
ATOM    863  O   LYS A  56      10.455  -2.970  -5.947  1.00  1.280          O  
ATOM    864  CB  LYS A  56      12.461  -0.963  -7.305  1.00  1.640          C  
ATOM    865  CG  LYS A  56      13.300   0.302  -7.464  1.00  1.640          C  
ATOM    866  CD  LYS A  56      14.617   0.013  -8.176  1.00  1.640          C  
ATOM    867  CE  LYS A  56      15.464   1.276  -8.314  1.00  1.640          C  
ATOM    868  NZ  LYS A  56      16.762   1.007  -8.998  1.00  1.640          N  
ATOM    869  H   LYS A  56      11.709  -0.859  -4.552  1.00  1.360          H  
ATOM    870  HA  LYS A  56      10.562   0.027  -7.188  1.00  1.430          H  
ATOM    871 1HB  LYS A  56      13.039  -1.687  -6.727  1.00  1.970          H  
ATOM    872 2HB  LYS A  56      12.307  -1.389  -8.297  1.00  1.970          H  
ATOM    873 1HG  LYS A  56      12.734   1.045  -8.026  1.00  1.970          H  
ATOM    874 2HG  LYS A  56      13.517   0.715  -6.479  1.00  1.970          H  
ATOM    875 1HD  LYS A  56      15.181  -0.734  -7.612  1.00  1.970          H  
ATOM    876 2HD  LYS A  56      14.412  -0.384  -9.169  1.00  1.970          H  
ATOM    877 1HE  LYS A  56      14.908   2.015  -8.889  1.00  1.970          H  
ATOM    878 2HE  LYS A  56      15.665   1.681  -7.321  1.00  1.970          H  
ATOM    879 1HZ  LYS A  56      17.290   1.866  -9.069  1.00  1.970          H  
ATOM    880 2HZ  LYS A  56      17.292   0.331  -8.466  1.00  1.970          H  
ATOM    881 3HZ  LYS A  56      16.588   0.643  -9.924  1.00  1.970          H  
ATOM    882  N   CYS A  57       9.505  -2.160  -7.839  1.00  1.210          N  
ATOM    883  CA  CYS A  57       8.643  -3.324  -8.133  1.00  1.250          C  
ATOM    884  C   CYS A  57       9.348  -4.653  -8.326  1.00  1.460          C  
ATOM    885  O   CYS A  57       8.716  -5.707  -8.241  1.00  1.440          O  
ATOM    886  CB  CYS A  57       7.803  -3.081  -9.376  1.00  1.730          C  
ATOM    887  SG  CYS A  57       6.506  -1.906  -9.121  1.00  1.730          S  
ATOM    888  H   CYS A  57       9.458  -1.366  -8.489  1.00  1.450          H  
ATOM    889  HA  CYS A  57       7.948  -3.423  -7.306  1.00  1.500          H  
ATOM    890 1HB  CYS A  57       8.437  -2.705 -10.177  1.00  2.080          H  
ATOM    891 2HB  CYS A  57       7.382  -4.009  -9.720  1.00  2.080          H  
ATOM    892  HG  CYS A  57       5.681  -2.291 -10.106  1.00  2.080          H  
ATOM    893  N   SER A  58      10.650  -4.595  -8.550  1.00  1.760          N  
ATOM    894  CA  SER A  58      11.514  -5.745  -8.780  1.00  2.120          C  
ATOM    895  C   SER A  58      11.591  -6.681  -7.582  1.00  2.120          C  
ATOM    896  O   SER A  58      12.085  -7.805  -7.694  1.00  2.410          O  
ATOM    897  CB  SER A  58      12.904  -5.277  -9.158  1.00  2.820          C  
ATOM    898  OG  SER A  58      13.510  -4.599  -8.096  1.00  2.820          O  
ATOM    899  H   SER A  58      11.068  -3.677  -8.569  1.00  2.110          H  
ATOM    900  HA  SER A  58      11.106  -6.302  -9.610  1.00  2.540          H  
ATOM    901 1HB  SER A  58      13.510  -6.139  -9.432  1.00  3.390          H  
ATOM    902 2HB  SER A  58      12.845  -4.627 -10.027  1.00  3.390          H  
ATOM    903  HG  SER A  58      14.414  -4.419  -8.370  1.00  3.390          H  
ATOM    904  N   HIS A  59      11.161  -6.197  -6.419  1.00  1.910          N  
ATOM    905  CA  HIS A  59      11.186  -6.998  -5.211  1.00  2.150          C  
ATOM    906  C   HIS A  59       9.813  -7.492  -4.743  1.00  1.950          C  
ATOM    907  O   HIS A  59       9.728  -8.081  -3.671  1.00  2.190          O  
ATOM    908  CB  HIS A  59      11.784  -6.167  -4.085  1.00  2.910          C  
ATOM    909  CG  HIS A  59      13.190  -5.745  -4.336  1.00  2.910          C  
ATOM    910  ND1 HIS A  59      14.259  -6.613  -4.247  1.00  2.910          N  
ATOM    911  CD2 HIS A  59      13.705  -4.546  -4.691  1.00  2.910          C  
ATOM    912  CE1 HIS A  59      15.374  -5.959  -4.526  1.00  2.910          C  
ATOM    913  NE2 HIS A  59      15.066  -4.704  -4.797  1.00  2.910          N  
ATOM    914  H   HIS A  59      10.835  -5.226  -6.393  1.00  2.290          H  
ATOM    915  HA  HIS A  59      11.815  -7.870  -5.372  1.00  2.580          H  
ATOM    916 1HB  HIS A  59      11.174  -5.285  -3.961  1.00  3.500          H  
ATOM    917 2HB  HIS A  59      11.749  -6.725  -3.153  1.00  3.500          H  
ATOM    918  HD1 HIS A  59      14.195  -7.612  -4.260  1.00  3.500          H  
ATOM    919  HD2 HIS A  59      13.245  -3.575  -4.885  1.00  3.500          H  
ATOM    920  HE1 HIS A  59      16.336  -6.471  -4.508  1.00  3.500          H  
ATOM    921  N   PHE A  60       8.749  -7.267  -5.521  1.00  1.670          N  
ATOM    922  CA  PHE A  60       7.396  -7.624  -5.061  1.00  1.680          C  
ATOM    923  C   PHE A  60       6.775  -8.830  -5.729  1.00  1.710          C  
ATOM    924  O   PHE A  60       6.270  -8.727  -6.841  1.00  2.050          O  
ATOM    925  CB  PHE A  60       6.474  -6.423  -5.283  1.00  2.350          C  
ATOM    926  CG  PHE A  60       6.811  -5.296  -4.397  1.00  2.350          C  
ATOM    927  CD1 PHE A  60       7.862  -4.480  -4.659  1.00  2.350          C  
ATOM    928  CD2 PHE A  60       6.076  -5.043  -3.289  1.00  2.350          C  
ATOM    929  CE1 PHE A  60       8.173  -3.466  -3.831  1.00  2.350          C  
ATOM    930  CE2 PHE A  60       6.396  -4.026  -2.460  1.00  2.350          C  
ATOM    931  CZ  PHE A  60       7.446  -3.239  -2.721  1.00  2.350          C  
ATOM    932  H   PHE A  60       8.868  -6.816  -6.434  1.00  2.000          H  
ATOM    933  HA  PHE A  60       7.447  -7.833  -3.989  1.00  2.020          H  
ATOM    934 1HB  PHE A  60       6.562  -6.083  -6.320  1.00  2.820          H  
ATOM    935 2HB  PHE A  60       5.442  -6.715  -5.113  1.00  2.820          H  
ATOM    936  HD1 PHE A  60       8.466  -4.648  -5.530  1.00  2.820          H  
ATOM    937  HD2 PHE A  60       5.233  -5.665  -3.056  1.00  2.820          H  
ATOM    938  HE1 PHE A  60       9.004  -2.847  -4.070  1.00  2.820          H  
ATOM    939  HE2 PHE A  60       5.818  -3.849  -1.604  1.00  2.820          H  
ATOM    940  HZ  PHE A  60       7.689  -2.430  -2.054  1.00  2.820          H  
ATOM    941  N   LYS A  61       6.785  -9.980  -5.059  1.00  1.750          N  
ATOM    942  CA  LYS A  61       6.255 -11.182  -5.689  1.00  1.800          C  
ATOM    943  C   LYS A  61       4.756 -11.100  -5.874  1.00  1.740          C  
ATOM    944  O   LYS A  61       4.039 -10.677  -4.971  1.00  1.860          O  
ATOM    945  CB  LYS A  61       6.615 -12.425  -4.872  1.00  2.500          C  
ATOM    946  CG  LYS A  61       6.231 -13.776  -5.503  1.00  2.500          C  
ATOM    947  CD  LYS A  61       6.759 -14.935  -4.649  1.00  2.500          C  
ATOM    948  CE  LYS A  61       6.435 -16.302  -5.250  1.00  2.500          C  
ATOM    949  NZ  LYS A  61       6.984 -17.419  -4.416  1.00  2.500          N  
ATOM    950  H   LYS A  61       7.183 -10.045  -4.103  1.00  2.100          H  
ATOM    951  HA  LYS A  61       6.695 -11.281  -6.677  1.00  2.160          H  
ATOM    952 1HB  LYS A  61       7.690 -12.428  -4.682  1.00  3.000          H  
ATOM    953 2HB  LYS A  61       6.124 -12.363  -3.898  1.00  3.000          H  
ATOM    954 1HG  LYS A  61       5.150 -13.853  -5.557  1.00  3.000          H  
ATOM    955 2HG  LYS A  61       6.638 -13.845  -6.513  1.00  3.000          H  
ATOM    956 1HD  LYS A  61       7.842 -14.841  -4.542  1.00  3.000          H  
ATOM    957 2HD  LYS A  61       6.310 -14.871  -3.657  1.00  3.000          H  
ATOM    958 1HE  LYS A  61       5.360 -16.418  -5.320  1.00  3.000          H  
ATOM    959 2HE  LYS A  61       6.863 -16.364  -6.251  1.00  3.000          H  
ATOM    960 1HZ  LYS A  61       6.753 -18.306  -4.842  1.00  3.000          H  
ATOM    961 2HZ  LYS A  61       7.990 -17.331  -4.352  1.00  3.000          H  
ATOM    962 3HZ  LYS A  61       6.586 -17.380  -3.488  1.00  3.000          H  
ATOM    963  N   LEU A  62       4.289 -11.545  -7.039  1.00  1.850          N  
ATOM    964  CA  LEU A  62       2.870 -11.649  -7.371  1.00  1.890          C  
ATOM    965  C   LEU A  62       2.522 -13.141  -7.301  1.00  1.730          C  
ATOM    966  O   LEU A  62       2.269 -13.728  -8.347  1.00  1.890          O  
ATOM    967  CB  LEU A  62       2.631 -11.113  -8.813  1.00  2.630          C  
ATOM    968  CG  LEU A  62       2.497  -9.552  -9.012  1.00  2.630          C  
ATOM    969  CD1 LEU A  62       3.686  -8.809  -8.430  1.00  2.630          C  
ATOM    970  CD2 LEU A  62       2.392  -9.225 -10.503  1.00  2.630          C  
ATOM    971  H   LEU A  62       4.972 -11.822  -7.729  1.00  2.220          H  
ATOM    972  HA  LEU A  62       2.288 -11.063  -6.668  1.00  2.270          H  
ATOM    973 1HB  LEU A  62       3.445 -11.459  -9.455  1.00  3.160          H  
ATOM    974 2HB  LEU A  62       1.699 -11.551  -9.187  1.00  3.160          H  
ATOM    975  HG  LEU A  62       1.604  -9.221  -8.525  1.00  3.160          H  
ATOM    976 1HD1 LEU A  62       3.543  -7.762  -8.587  1.00  3.160          H  
ATOM    977 2HD1 LEU A  62       3.755  -8.983  -7.368  1.00  3.160          H  
ATOM    978 3HD1 LEU A  62       4.608  -9.123  -8.911  1.00  3.160          H  
ATOM    979 1HD2 LEU A  62       2.272  -8.148 -10.636  1.00  3.160          H  
ATOM    980 2HD2 LEU A  62       3.295  -9.549 -11.002  1.00  3.160          H  
ATOM    981 3HD2 LEU A  62       1.528  -9.737 -10.929  1.00  3.160          H  
ATOM    982  N   PRO A  63       2.264 -13.715  -6.100  1.00  1.580          N  
ATOM    983  CA  PRO A  63       2.300 -15.149  -5.783  1.00  1.510          C  
ATOM    984  C   PRO A  63       1.387 -16.093  -6.551  1.00  1.690          C  
ATOM    985  O   PRO A  63       1.689 -17.281  -6.640  1.00  2.330          O  
ATOM    986  CB  PRO A  63       1.907 -15.167  -4.298  1.00  2.270          C  
ATOM    987  CG  PRO A  63       1.138 -13.890  -4.072  1.00  2.270          C  
ATOM    988  CD  PRO A  63       1.782 -12.881  -4.974  1.00  2.270          C  
ATOM    989  HA  PRO A  63       3.334 -15.488  -5.896  1.00  1.810          H  
ATOM    990 1HB  PRO A  63       1.299 -16.063  -4.088  1.00  2.720          H  
ATOM    991 2HB  PRO A  63       2.810 -15.236  -3.675  1.00  2.720          H  
ATOM    992 1HG  PRO A  63       0.068 -14.048  -4.291  1.00  2.720          H  
ATOM    993 2HG  PRO A  63       1.197 -13.595  -3.006  1.00  2.720          H  
ATOM    994 1HD  PRO A  63       1.021 -12.154  -5.289  1.00  2.720          H  
ATOM    995 2HD  PRO A  63       2.604 -12.424  -4.434  1.00  2.720          H  
ATOM    996  N   ASP A  64       0.308 -15.598  -7.138  1.00  1.610          N  
ATOM    997  CA  ASP A  64      -0.567 -16.494  -7.877  1.00  1.880          C  
ATOM    998  C   ASP A  64      -0.086 -16.593  -9.316  1.00  2.040          C  
ATOM    999  O   ASP A  64      -0.310 -17.595 -10.001  1.00  2.340          O  
ATOM   1000  CB  ASP A  64      -2.002 -15.979  -7.847  1.00  2.520          C  
ATOM   1001  CG  ASP A  64      -2.604 -15.944  -6.451  1.00  2.520          C  
ATOM   1002  OD1 ASP A  64      -2.725 -16.964  -5.824  1.00  2.520          O  
ATOM   1003  OD2 ASP A  64      -2.939 -14.847  -6.004  1.00  2.520          O  
ATOM   1004  H   ASP A  64       0.053 -14.622  -7.052  1.00  1.930          H  
ATOM   1005  HA  ASP A  64      -0.531 -17.485  -7.425  1.00  2.260          H  
ATOM   1006 1HB  ASP A  64      -2.023 -14.971  -8.249  1.00  3.030          H  
ATOM   1007 2HB  ASP A  64      -2.625 -16.603  -8.492  1.00  3.030          H  
ATOM   1008  N   TYR A  65       0.534 -15.510  -9.777  1.00  2.000          N  
ATOM   1009  CA  TYR A  65       0.988 -15.338 -11.137  1.00  2.330          C  
ATOM   1010  C   TYR A  65       2.393 -14.714 -11.143  1.00  1.990          C  
ATOM   1011  O   TYR A  65       2.572 -13.684 -11.793  1.00  1.990          O  
ATOM   1012  CB  TYR A  65       0.007 -14.441 -11.897  1.00  3.130          C  
ATOM   1013  CG  TYR A  65      -1.417 -14.932 -11.868  1.00  3.130          C  
ATOM   1014  CD1 TYR A  65      -2.324 -14.317 -11.026  1.00  3.130          C  
ATOM   1015  CD2 TYR A  65      -1.811 -16.003 -12.642  1.00  3.130          C  
ATOM   1016  CE1 TYR A  65      -3.620 -14.775 -10.954  1.00  3.130          C  
ATOM   1017  CE2 TYR A  65      -3.108 -16.467 -12.571  1.00  3.130          C  
ATOM   1018  CZ  TYR A  65      -4.011 -15.858 -11.728  1.00  3.130          C  
ATOM   1019  OH  TYR A  65      -5.305 -16.327 -11.649  1.00  3.130          O  
ATOM   1020  H   TYR A  65       0.747 -14.746  -9.136  1.00  2.400          H  
ATOM   1021  HA  TYR A  65       1.024 -16.308 -11.629  1.00  2.800          H  
ATOM   1022 1HB  TYR A  65       0.024 -13.457 -11.444  1.00  3.760          H  
ATOM   1023 2HB  TYR A  65       0.317 -14.347 -12.933  1.00  3.760          H  
ATOM   1024  HD1 TYR A  65      -2.010 -13.469 -10.409  1.00  3.760          H  
ATOM   1025  HD2 TYR A  65      -1.095 -16.492 -13.300  1.00  3.760          H  
ATOM   1026  HE1 TYR A  65      -4.329 -14.291 -10.284  1.00  3.760          H  
ATOM   1027  HE2 TYR A  65      -3.417 -17.319 -13.176  1.00  3.760          H  
ATOM   1028  HH  TYR A  65      -5.812 -15.770 -11.052  1.00  3.760          H  
ATOM   1029  N   PRO A  66       3.416 -15.316 -10.483  1.00  2.210          N  
ATOM   1030  CA  PRO A  66       4.751 -14.754 -10.238  1.00  2.310          C  
ATOM   1031  C   PRO A  66       5.492 -14.406 -11.527  1.00  2.320          C  
ATOM   1032  O   PRO A  66       6.425 -13.603 -11.526  1.00  2.970          O  
ATOM   1033  CB  PRO A  66       5.451 -15.878  -9.461  1.00  3.460          C  
ATOM   1034  CG  PRO A  66       4.696 -17.141  -9.819  1.00  3.460          C  
ATOM   1035  CD  PRO A  66       3.261 -16.699  -9.973  1.00  3.460          C  
ATOM   1036  HA  PRO A  66       4.643 -13.862  -9.607  1.00  2.770          H  
ATOM   1037 1HB  PRO A  66       6.516 -15.922  -9.736  1.00  4.160          H  
ATOM   1038 2HB  PRO A  66       5.405 -15.658  -8.385  1.00  4.160          H  
ATOM   1039 1HG  PRO A  66       5.109 -17.591 -10.734  1.00  4.160          H  
ATOM   1040 2HG  PRO A  66       4.812 -17.887  -9.018  1.00  4.160          H  
ATOM   1041 1HD  PRO A  66       2.738 -17.353 -10.678  1.00  4.160          H  
ATOM   1042 2HD  PRO A  66       2.791 -16.696  -8.986  1.00  4.160          H  
ATOM   1043  N   LEU A  67       5.056 -15.002 -12.626  1.00  2.380          N  
ATOM   1044  CA  LEU A  67       5.583 -14.778 -13.960  1.00  3.060          C  
ATOM   1045  C   LEU A  67       5.484 -13.296 -14.337  1.00  2.860          C  
ATOM   1046  O   LEU A  67       6.235 -12.804 -15.179  1.00  3.230          O  
ATOM   1047  CB  LEU A  67       4.795 -15.611 -14.976  1.00  4.010          C  
ATOM   1048  CG  LEU A  67       4.942 -17.159 -14.882  1.00  4.010          C  
ATOM   1049  CD1 LEU A  67       3.960 -17.800 -15.853  1.00  4.010          C  
ATOM   1050  CD2 LEU A  67       6.376 -17.587 -15.213  1.00  4.010          C  
ATOM   1051  H   LEU A  67       4.292 -15.650 -12.542  1.00  2.860          H  
ATOM   1052  HA  LEU A  67       6.634 -15.052 -13.972  1.00  3.670          H  
ATOM   1053 1HB  LEU A  67       3.738 -15.368 -14.860  1.00  4.810          H  
ATOM   1054 2HB  LEU A  67       5.102 -15.307 -15.975  1.00  4.810          H  
ATOM   1055  HG  LEU A  67       4.692 -17.490 -13.875  1.00  4.810          H  
ATOM   1056 1HD1 LEU A  67       4.041 -18.886 -15.789  1.00  4.810          H  
ATOM   1057 2HD1 LEU A  67       2.943 -17.500 -15.601  1.00  4.810          H  
ATOM   1058 3HD1 LEU A  67       4.190 -17.481 -16.869  1.00  4.810          H  
ATOM   1059 1HD2 LEU A  67       6.449 -18.673 -15.150  1.00  4.810          H  
ATOM   1060 2HD2 LEU A  67       6.627 -17.266 -16.225  1.00  4.810          H  
ATOM   1061 3HD2 LEU A  67       7.078 -17.149 -14.514  1.00  4.810          H  
ATOM   1062  N   LEU A  68       4.498 -12.608 -13.753  1.00  2.870          N  
ATOM   1063  CA  LEU A  68       4.186 -11.216 -14.037  1.00  3.250          C  
ATOM   1064  C   LEU A  68       5.046 -10.216 -13.249  1.00  3.100          C  
ATOM   1065  O   LEU A  68       4.864  -9.006 -13.395  1.00  3.240          O  
ATOM   1066  CB  LEU A  68       2.742 -10.947 -13.618  1.00  4.400          C  
ATOM   1067  CG  LEU A  68       1.595 -11.733 -14.280  1.00  4.400          C  
ATOM   1068  CD1 LEU A  68       0.323 -11.325 -13.542  1.00  4.400          C  
ATOM   1069  CD2 LEU A  68       1.486 -11.471 -15.793  1.00  4.400          C  
ATOM   1070  H   LEU A  68       3.927 -13.079 -13.045  1.00  3.440          H  
ATOM   1071  HA  LEU A  68       4.330 -11.035 -15.099  1.00  3.900          H  
ATOM   1072 1HB  LEU A  68       2.681 -11.190 -12.565  1.00  5.280          H  
ATOM   1073 2HB  LEU A  68       2.543  -9.891 -13.731  1.00  5.280          H  
ATOM   1074  HG  LEU A  68       1.752 -12.795 -14.125  1.00  5.280          H  
ATOM   1075 1HD1 LEU A  68      -0.528 -11.872 -13.933  1.00  5.280          H  
ATOM   1076 2HD1 LEU A  68       0.433 -11.536 -12.484  1.00  5.280          H  
ATOM   1077 3HD1 LEU A  68       0.160 -10.267 -13.665  1.00  5.280          H  
ATOM   1078 1HD2 LEU A  68       0.653 -12.048 -16.195  1.00  5.280          H  
ATOM   1079 2HD2 LEU A  68       1.313 -10.438 -15.991  1.00  5.280          H  
ATOM   1080 3HD2 LEU A  68       2.405 -11.779 -16.284  1.00  5.280          H  
ATOM   1081  N   MET A  69       5.930 -10.692 -12.369  1.00  3.510          N  
ATOM   1082  CA  MET A  69       6.753  -9.787 -11.570  1.00  4.110          C  
ATOM   1083  C   MET A  69       7.824  -9.118 -12.434  1.00  4.300          C  
ATOM   1084  O   MET A  69       8.405  -9.743 -13.321  1.00  4.770          O  
ATOM   1085  CB  MET A  69       7.442 -10.528 -10.421  1.00  5.510          C  
ATOM   1086  CG  MET A  69       8.138  -9.586  -9.387  1.00  5.510          C  
ATOM   1087  SD  MET A  69       9.044 -10.430  -8.085  1.00  5.510          S  
ATOM   1088  CE  MET A  69      10.544 -10.817  -8.957  1.00  5.510          C  
ATOM   1089  H   MET A  69       6.056 -11.704 -12.264  1.00  4.210          H  
ATOM   1090  HA  MET A  69       6.116  -9.007 -11.156  1.00  4.930          H  
ATOM   1091 1HB  MET A  69       6.706 -11.130  -9.891  1.00  6.620          H  
ATOM   1092 2HB  MET A  69       8.181 -11.211 -10.835  1.00  6.620          H  
ATOM   1093 1HG  MET A  69       8.836  -8.948  -9.870  1.00  6.620          H  
ATOM   1094 2HG  MET A  69       7.393  -8.951  -8.934  1.00  6.620          H  
ATOM   1095 1HE  MET A  69      11.228 -11.339  -8.291  1.00  6.620          H  
ATOM   1096 2HE  MET A  69      10.324 -11.442  -9.819  1.00  6.620          H  
ATOM   1097 3HE  MET A  69      11.013  -9.883  -9.296  1.00  6.620          H  
ATOM   1098  N   ASN A  70       8.114  -7.856 -12.144  1.00  4.400          N  
ATOM   1099  CA  ASN A  70       9.187  -7.140 -12.820  1.00  5.040          C  
ATOM   1100  C   ASN A  70      10.530  -7.543 -12.243  1.00  5.540          C  
ATOM   1101  O   ASN A  70      10.587  -7.999 -11.112  1.00  5.800          O  
ATOM   1102  CB  ASN A  70       9.003  -5.644 -12.709  1.00  6.800          C  
ATOM   1103  CG  ASN A  70       7.870  -5.136 -13.530  1.00  6.800          C  
ATOM   1104  OD1 ASN A  70       7.545  -5.687 -14.587  1.00  6.800          O  
ATOM   1105  ND2 ASN A  70       7.275  -4.077 -13.082  1.00  6.800          N  
ATOM   1106  H   ASN A  70       7.586  -7.395 -11.419  1.00  5.280          H  
ATOM   1107  HA  ASN A  70       9.188  -7.423 -13.874  1.00  6.050          H  
ATOM   1108 1HB  ASN A  70       8.826  -5.379 -11.663  1.00  8.160          H  
ATOM   1109 2HB  ASN A  70       9.918  -5.142 -13.021  1.00  8.160          H  
ATOM   1110 1HD2 ASN A  70       6.519  -3.658 -13.609  1.00  8.160          H  
ATOM   1111 2HD2 ASN A  70       7.574  -3.651 -12.232  1.00  8.160          H  
ATOM   1112  N   ALA A  71      11.597  -7.353 -13.019  1.00  6.020          N  
ATOM   1113  CA  ALA A  71      13.004  -7.595 -12.653  1.00  6.790          C  
ATOM   1114  C   ALA A  71      13.723  -8.122 -13.885  1.00  7.690          C  
ATOM   1115  O   ALA A  71      14.741  -8.805 -13.777  1.00  8.170          O  
ATOM   1116  OXT ALA A  71      13.227  -7.926 -14.994  1.00 10.190          O  
ATOM   1117  CB  ALA A  71      13.187  -8.585 -11.492  1.00  8.700          C  
ATOM   1118  H   ALA A  71      11.426  -7.004 -13.954  1.00  7.220          H  
ATOM   1119  HA  ALA A  71      13.462  -6.644 -12.375  1.00  8.150          H  
ATOM   1120 1HB  ALA A  71      14.252  -8.714 -11.315  1.00 10.450          H  
ATOM   1121 2HB  ALA A  71      12.746  -8.230 -10.568  1.00 10.450          H  
ATOM   1122 3HB  ALA A  71      12.748  -9.545 -11.757  1.00 10.450          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 -413.705 48.3873 296.928 -25.2366 6.92534 18.4594 155.702 -163.208 -0.47623 -3.25708 -131.401 -13.423 -56.0362 -2.34065 -7.61157 -5.13211 0 2.10193 3.93439 38.1105 69.3052 -9.16689 4.13032 0.75494 -0.67273 44.9806 -141.947
CYS:NtermProteinFull_1 -5.8205 0.89471 2.91972 -0.08631 0.0018 0.04838 1.60284 -1.60639 -0.04706 -0.22195 -1.54219 1.05234 0 0 0 0 0 0.28674 0.00051 0.58041 0 0 0 3.6196 0 0.40483 2.08751
VAL_2 -4.60873 0.76469 0.46286 -0.35976 0.23511 0.08469 0.70223 -1.13156 -0 -0 0.67049 0.01779 0 0 0 0 0 -0.06546 0.01337 0.81539 0 0.18067 0 1.9342 -0.11016 0.66001 0.26582
PHE_3 -2.94539 0.52188 0.40837 -0.62322 0.14082 0.38677 0.16396 -0.84064 -0.03638 -0.14141 0.02787 0.07387 0 0 0 0 0 -0.04252 0.14312 0 2.71341 -0.21381 0 1.0402 -0.08973 0.34795 1.03514
GLY_4 -1.91417 0.22324 1.59015 -0.00026 0 0 0.84201 -0.86615 -0 -0 -0.96808 -0.16541 0 0 0 0 0 -0.06324 0 0 0 -1.23007 0 0.83697 0.15505 0.13867 -1.42128
CYS_5 -3.75612 0.60493 2.46953 -0.07358 0.04729 0.0785 1.69928 -1.48173 -0 -0 -0.36308 -0.51502 0 0 0 0 0 -0.04518 0.04819 0.36033 0 -0.12394 0 3.6196 1.98658 0.73749 5.29308
PRO_6 -4.33832 0.84252 1.95893 -0.06927 0 0.0431 0.90201 -1.08932 -0 -0 -0.2509 0.62531 0 0 0 0 0 -0.1635 0.00689 0.19387 0 -0.47629 0 -2.4119 1.93604 0.94286 -1.34796
SER_7 -2.22924 0.35549 2.11128 -0.02395 0 0.02154 0.93922 -1.0707 -1e-05 -9e-05 -0.83919 -0.46284 0 0 0 0 0 -0.0515 0.00356 0.51978 0 0.29036 0.60291 -0.77834 0.03743 0.39387 -0.18043
ALA_8 -4.21249 0.39479 3.55685 -0.03043 0.01215 0 2.81473 -2.14653 -0.0014 -0.01366 -2.50666 -0.53043 0 0 0 0 0 0.25776 0 0 0 -0.08919 0 1.8394 0.16697 0.46466 -0.02349
ALA_9 -5.89763 0.84876 3.18244 -0.02192 0 0 2.57186 -2.58798 -0 -0 -2.38564 -0.37096 0 0 0 0 0 -0.07692 0 0 0 -0.40321 0 1.8394 -0.08493 0.5582 -2.82854
ASP_10 -3.95542 0.17678 5.58275 -0.11113 0.00829 0.34095 2.11237 -2.50406 -1e-05 -9e-05 -2.07366 -0.27247 0 0 -0.53388 0 0 0.01646 0.02617 0 1.95218 -0.226 0 -2.3716 -0.46072 0.44453 -1.84855
LYS_11 -4.77663 0.3478 5.08381 -0.41533 0.05309 0.22818 2.71516 -2.45792 -0 -0 -1.75887 -0.15039 0 0 0 0 0 0.0073 0.0098 2.26867 0 -0.08337 0 -1.5107 -0.20053 0.39275 -0.24719
LEU_12 -10.3184 1.03076 5.6841 -0.53493 0.31451 0.11797 3.00447 -3.73059 -0.02973 -0.20583 -2.12335 0.03184 0 0 0 0 0 0.08155 0.00984 3.31313 0 -0.29452 0 0.18072 -0.22312 0.43035 -3.26127
TRP_13 -13.0524 1.61079 6.33991 -1.40655 0.33107 0.68841 4.00568 -4.12296 -0.0014 -0.01366 -3.41144 -0.38093 0 0 0 -0.73059 0 0.10725 0.32527 0 2.15903 -0.20113 0 1.6906 -0.22816 0.97871 -5.31249
ASP_14 -4.3975 0.23273 5.85177 -0.1051 0.00851 0.31977 2.60806 -2.69788 -0 -0 -1.62185 -0.37117 0 0 0 0 0 0.09317 0.03364 0 1.68097 0.11658 0 -2.3716 -0.20718 0.95569 0.12861
GLU_15 -5.71028 0.34232 7.42528 -0.19898 0.0242 0.27071 3.1353 -3.28361 -0.02301 -0.14708 -3.2072 -0.58266 0 0 0 0 0 0.03476 0.03594 0 3.00571 -0.23397 0 -2.7348 -0.43082 0.45547 -1.82273
ASN_16 -9.5255 0.78382 7.86249 -0.18815 0.04439 0.28034 4.60754 -4.13128 -0.01444 -0.10386 -4.08209 -0.32262 0 0 0 0 0 -0.00914 0.00386 0 1.42501 0.43299 0 -0.93687 -0.20553 0.39178 -3.68729
LYS_17 -4.89413 0.79492 6.66843 -0.41711 0.04836 0.23387 2.75319 -2.84245 -0 -0 -4.89713 -0.17326 0 0 0 0 0 0.0245 0.10564 2.05956 0 0.01487 0 -1.5107 -0.11252 0.39384 -1.75014
SER_18 -3.09412 0.1646 3.66799 -0.02391 0 0.02273 1.21483 -1.71441 -2e-05 -9e-05 -0.8986 -0.34918 0 0 0 0 0 -0.04688 0.01055 0.49342 0 0.29909 0.60063 -0.77834 -0.20105 0.45102 -0.18176
HIS_D_19 -3.7345 0.13641 4.48721 -0.41769 0.0138 0.54577 1.73008 -2.15251 -2e-05 -9e-05 -1.02663 -0.22329 0 0 0 0 0 0.01716 0.02893 0 2.0407 -0.20641 0 -0.45461 0.76781 0.75383 2.30593
PHE_20 -8.39113 0.77841 3.05294 -0.49421 0.25582 0.16971 2.79424 -2.43474 -0.00898 -0.04493 -1.91774 -0.0153 0 0 0 0 0 0.00866 0.25131 0 3.06781 -0.03821 0 1.0402 0.7744 1.19412 0.04237
ILE_21 -7.99142 1.26253 4.14376 -0.68363 0.55664 0.1592 2.42036 -2.7077 -0 -0 -2.72261 0.14488 0 0 0 0 0 -0.07213 0.10608 0.61109 0 -0.32669 0 0.73287 -0.07773 1.11387 -3.33064
GLU_22 -3.4836 0.14291 4.39648 -0.59711 0.10642 1.07991 1.38699 -2.04218 -0.01444 -0.10386 -1.32033 -0.64476 0 0 0 0 0 -0.02291 0.01564 0 3.59909 -0.19295 0 -2.7348 -0.31226 0.78205 0.0403
ASP_23 -4.23403 0.19813 5.23511 -0.10789 0.00356 0.33163 2.0789 -2.43292 -0 -0 -1.251 -0.46635 0 0 0 0 0 -0.00982 0.04242 0 2.37271 -0.19661 0 -2.3716 -0.38055 0.47949 -0.70881
PHE_24 -8.58617 0.58323 3.97978 -0.5295 0.34066 0.25865 2.69507 -2.72319 -0 -0 -2.18071 -0.31615 0 0 0 0 0 0.12945 0.20191 0 3.33749 0.01785 0 1.0402 -0.19997 0.47443 -1.47697
CYS_25 -7.31849 1.00942 5.47091 -0.09875 0.00697 0.07151 2.82373 -2.71869 -0.02048 -0.11636 -3.62271 -0.4797 0 0 0 0 0 0.00573 0.02872 0.86817 0 0.26358 0 3.6196 0.18914 0.72685 0.70915
TRP_26 -6.47032 0.5747 5.62914 -1.32537 0.09386 0.52702 2.28644 -2.78795 -0.00042 -0.00258 -1.79597 -0.32593 0 0 0 0 0 -0.00896 0.01775 0 1.75155 -0.29498 0 1.6906 0.26466 0.49657 0.31982
LYS_27 -5.31665 0.28468 5.07802 -0.2991 0.02379 0.12987 2.12084 -2.38263 -0 -0 -1.67727 0.00239 0 0 -1.35873 0 0 -0.02857 0.02506 1.69205 0 -0.02344 0 -1.5107 -0.2193 0.2635 -3.19618
LEU_28 -7.32889 0.66396 4.985 -0.4924 0.16103 0.10859 2.88898 -2.77783 -0.00167 -0.02211 -3.10985 0.2561 0 0 0 0 0 0.09436 0.25825 0.48355 0 -0.19653 0 0.18072 -0.18721 0.61652 -3.41944
HIS_29 -7.10795 0.93293 6.12173 -0.8297 0.0323 0.91681 2.66189 -3.0552 -2e-05 -0.0004 -2.43723 -0.58549 0 0 0 0 0 -0.0333 0.00335 0 2.93457 0.16877 0 -0.45461 -0.02449 0.83745 0.08143
ARG_30 -5.86828 0.42173 5.8298 -0.67828 0.09017 0.45597 2.29751 -2.59838 -0.01585 -0.0954 -2.60088 0.62511 0 0 -1.77893 0 0 -0.13646 0.07572 1.90008 0 -0.0416 0 -1.2888 0.02058 0.7658 -2.62038
ARG_31 -2.83353 0.45317 3.59429 -0.97749 0.30139 0.77049 1.43473 -1.60131 -0 -0 -0.8597 -0.08355 0 0 -0.4202 0 0 -0.03756 0.00334 2.26115 0 -0.2641 0 -1.2888 0.35305 0.548 1.35339
GLU_32 -5.66889 0.42967 5.83349 -0.59045 0.13656 1.08657 2.73233 -2.49812 -0.00864 -0.11131 -3.06538 -0.67527 0 0 0 -1.16478 0 -0.04283 0.18009 0 3.3227 -0.23726 0 -2.7348 0.16701 0.49102 -2.4183
GLY_33 -2.37095 0.04194 2.69932 -7e-05 0 0 1.3021 -1.36079 -0 -0 -1.54965 -0.39945 0 0 0 0 0 0.00976 0 0 0 -0.81766 0 0.83697 0.62618 0.61311 -0.36919
ALA_34 -4.40855 0.73187 3.60179 -0.03104 0.02 0 2.84588 -2.21353 -0.00698 -0.0892 -2.95542 -0.48313 0 0 0 0 0 0.07063 0 0 0 0.05555 0 1.8394 1.16798 0.58619 0.73145
CYS_35 -4.63273 0.485 3.32318 -0.04965 0.0014 0.01991 1.68162 -1.7448 -0 -0 -1.32188 -0.45098 0 0 0 0 0 -0.04572 0.00953 0.50202 0 0.47475 0 3.6196 0.45647 0.42914 2.75686
VAL_36 -5.29274 0.97332 2.64555 -0.26392 0.13965 0.04261 1.60507 -2.04164 -0 -0 -0.53695 0.35019 0 0 0 0 0 -0.02793 0 0.84128 0 -0.04015 0 1.9342 -0.05837 0.37788 0.64806
ASN_37 -7.46036 0.84327 6.11314 -0.17275 0.00617 0.26052 3.70998 -3.41091 -0.01904 -0.13566 -3.21146 -0.34783 0 0 0 -0.7174 0 0.00824 0.04901 0 1.67227 0.13939 0 -0.93687 -0.04475 0.74872 -2.90632
CYS_38 -9.40666 0.99253 5.58403 -0.04112 0 0.0171 2.80972 -2.97373 -0 -0 -2.22829 -0.31561 0 0 0 0 0 0.12273 0.00211 0.29313 0 0.25892 0 3.6196 0.19873 0.84868 -0.21814
GLU_39 -7.17818 0.33197 6.25415 -0.31091 0.03912 0.34404 3.20416 -3.17354 -0 -0 -4.19786 -0.5602 0 0 0 -0.73059 0 0.1524 0.03796 0 3.31993 -0.16981 0 -2.7348 -0.06475 0.51453 -4.92239
MET_40 -7.5852 0.72441 5.48866 -0.54119 0.29046 0.06357 2.81079 -2.99031 -0 -0 -1.69032 -0.12405 0 0 0 0 0 -0.02261 0.10461 2.16842 0 0.06806 0 0.60916 -0.14707 0.43963 -0.33301
HIS_41 -7.64939 0.69231 6.60543 -0.35148 0.00523 0.41367 2.99055 -3.50869 -0.01904 -0.13566 -3.27652 -0.44417 0 0 0 -0.44738 0 0.11545 0.02783 0 2.5028 0.05793 0 -0.45461 -0.02761 0.53748 -2.36586
ALA_42 -6.66327 0.96684 4.14879 -0.02096 0 0 3.47337 -3.03172 -0 -0 -2.83589 -0.36181 0 0 0 0 0 0.07737 0 0 0 -0.25119 0 1.8394 -0.32444 0.60454 -2.37897
LEU_43 -10.3599 1.45394 4.57101 -0.64961 0.13514 0.23238 3.40578 -3.32526 -0 -0 -2.22633 0.05148 0 0 0 0 0 0.01066 0.01926 0.89139 0 -0.19428 0 0.18072 -0.24527 0.58854 -5.46039
ASN_44 -4.65156 0.30512 5.40214 -0.19064 0.0894 0.29473 2.29023 -2.59534 -0.00919 -0.13163 -1.42558 -0.28687 0 0 0 -0.67068 0 0.32228 0.01323 0 1.46673 0.06523 0 -0.93687 -0.08116 0.50096 -0.22947
GLU_45 -4.61718 0.31209 4.94963 -0.56934 0.08145 1.0114 2.79739 -2.32064 -0 -0 -2.2798 -0.67387 0 0 0 0 0 0.00413 0.01137 0 3.29883 -0.22845 0 -2.7348 -0.15426 0.50559 -0.60646
ILE_46 -11.0048 1.6532 3.79832 -0.51151 0.43186 0.10621 3.28718 -3.24862 -0 -0 -2.71807 -0.17857 0 0 0 0 0 0.18305 0.08011 1.48843 0 0.06152 0 0.73287 -0.23475 0.89658 -5.17702
GLN_47 -7.98761 0.86625 8.01815 -0.8447 0.14677 0.94111 4.54201 -3.73134 -0.0235 -0.23867 -5.18039 -1.04566 0 0 -0.94094 0 0 -0.04532 0.15105 0 2.82323 -0.08121 0 -0.18838 -0.10572 1.21835 -1.70651
GLU_48 -5.01671 0.48703 5.82391 -0.57045 0.12195 1.01792 2.50678 -2.697 -0 -0 -2.20057 -0.7327 0 0 0 0 0 -0.00931 0.00364 0 3.35977 -0.22984 0 -2.7348 -0.11898 0.87202 -0.11734
VAL_49 -6.45701 0.5471 3.39302 -0.30085 0.19953 0.06801 2.18784 -2.37889 -0 -0 -1.24788 -0.05237 0 0 -0.55204 0 0 -0.02142 0.01572 0.09449 0 -0.20492 0 1.9342 -0.1953 0.46567 -2.50509
PHE_50 -12.1423 1.94457 4.71556 -0.52902 0.15249 0.23326 3.19568 -3.60216 -0 -0 -3.19576 -0.09946 0 0 0 0 0 -0.01594 0.05227 0 3.24308 -0.14165 0 1.0402 -0.03649 0.70429 -4.4814
THR_51 -4.96521 0.35885 6.55176 -0.2054 0.15015 0.07519 3.37972 -2.95754 -0 -0 -3.74499 -0.07265 0 0 0 0 0 -0.03058 0.0005 0.10267 0 0.07282 2.30035 -1.0874 0.03509 0.6863 0.64965
LEU_52 -4.4976 0.28626 4.12562 -0.50218 0.21056 0.13752 1.22344 -2.00759 -0 -0 -1.19356 0.20947 0 0 0 0 0 -0.12338 0.08131 0.28159 0 -0.02725 0 0.18072 -0.04109 0.3457 -1.31045
HIS_D_53 -4.68804 0.44447 4.75261 -0.43117 0.04283 0.54896 2.45826 -2.40464 -0.02497 -0.11191 -1.76737 -0.29643 0 0 -0.55204 0 0 -0.00345 0.00012 0 2.29601 -0.42642 0 -0.45461 -0.22595 0.45328 -0.39047
GLY_54 -1.6097 0.04817 2.19446 -5e-05 0 0 0.95612 -1.05794 -0 -0 -1.0469 -0.35308 0 0 0 0 0 -0.15905 0 0 0 -1.42883 0 0.83697 -0.70363 0.66349 -1.65997
MET_55 -7.56984 1.17298 3.86664 -0.38172 0.08653 0.02205 2.04078 -2.14923 -0.03798 -0.23777 -1.15698 -0.00954 0 0 0 0 0 -0.00922 0.10311 2.8945 0 -0.0166 0 0.60916 -0.57636 0.71233 -0.63714
LYS_56 -4.72186 0.47761 3.55493 -0.29967 0.03992 0.15257 2.23235 -1.79086 -0 -0 -0.96691 -0.20513 0 0 0 0 0 0.04332 0.01419 2.15806 0 0.0312 0 -1.5107 -0.10771 0.64835 -0.25035
CYS_57 -7.60808 1.48085 3.50676 -0.05043 0.00743 0.02399 1.96859 -1.995 -0.02691 -0.13267 -1.63652 -0.33363 0 0 -0.94094 0 0 -0.10527 0.15073 0.56663 0 0.27961 0 3.6196 -0.20884 0.73509 -0.69902
SER_58 -4.06544 0.37878 3.30241 -0.03042 0.00101 0.05025 1.21246 -1.76629 -0.01049 -0.1128 -0.20561 -0.98217 0 0 0 0 0 -0.09798 0.01397 0.14986 0 -0.34892 0.62222 -0.77834 -0.38753 0.50869 -2.54633
HIS_D_59 -4.63665 0.52454 3.00147 -0.42859 0.02942 0.56591 1.4279 -1.83789 -0.0001 -0.00025 -0.35514 -0.30697 0 0 0 0 0 0.07458 0.02254 0 1.59724 -0.32572 0 -0.45461 -0.51641 0.34748 -1.27124
PHE_60 -11.4191 2.21428 1.67892 -0.6745 0.23291 0.35828 2.27956 -2.54589 -0.01353 -0.067 -1.24425 0.01253 0 0 0 0 0 -0.04397 0.05076 0 2.43592 -0.29545 0 1.0402 -0.01514 0.67103 -5.34448
LYS_61 -4.98556 0.57218 3.63208 -0.34399 0.03564 0.15094 1.19941 -1.47939 -0.0001 -0.00025 -1.60752 0.16596 0 0 -0.53388 0 0 0.05059 0.03242 1.83954 0 -0.03336 0 -1.5107 0.0338 0.58322 -2.19897
LEU_62 -9.54184 1.10963 3.47126 -0.52848 0.32285 0.16533 2.10373 -2.61291 -0 -0 -0.61671 -0.07538 0 0 0 0 0 1.45498 0.3481 1.76789 0 -0.05104 0 0.18072 0.51191 1.34661 -0.64334
PRO_63 -3.6966 0.58047 2.30584 -0.08612 0.00038 0.05331 0.47139 -0.87361 -0 -0 -0.14197 0.68486 0 0 0 0 0 -0.16386 0.00474 0.61595 0 -0.4816 0 -2.4119 0.5188 1.70478 -0.91514
ASP_64 -3.34133 0.58412 3.41855 -0.10899 0.00072 0.32586 1.31193 -1.50828 -0 -0 -3.64975 -0.57134 0 0 0 0 0 -0.0374 0.00502 0 2.12685 -0.34216 0 -2.3716 -0.34334 0.67334 -3.8278
TYR_65 -6.09527 1.01003 3.75118 -0.66406 0.05467 0.41926 2.71461 -2.15291 -0 -0 -1.99528 -0.1863 0 0 0 0 0 0.33658 0.06096 0 1.96347 -0.11485 0.0042 1.2797 -0.22626 0.90712 1.06688
PRO_66 -4.70879 0.67167 3.12066 -0.0866 5e-05 0.05361 1.18252 -1.34596 -0.01893 -0.16078 -0.37416 0.6909 0 0 0 0 0 -0.05548 0.00325 0.63177 0 -0.55438 0 -2.4119 -0.2703 0.89576 -2.73709
LEU_67 -2.08011 0.29377 2.04617 -0.4929 0.21337 0.1234 0.77616 -0.94088 -0 -0 0.50271 0.23121 0 0 0 0 0 -0.06399 0.01456 0.32136 0 -0.17446 0 0.18072 -0.27925 0.2815 0.95332
LEU_68 -6.7594 1.09862 2.68661 -0.51801 0.1241 0.15256 2.02001 -1.84231 -0 -0 -1.44227 0.14484 0 0 0 0 0 -0.0774 0.08957 0.09715 0 -0.12519 0 0.18072 -0.39383 0.64629 -3.91795
MET_69 -6.34298 0.59182 4.37 -0.44425 0.0851 0.00615 1.6612 -2.19075 -0.01893 -0.16078 -1.02753 0.23693 0 0 0 0 0 0.0206 0.31833 1.98378 0 0.05019 0 0.60916 -0.59874 0.65348 -0.19723
ASN_70 -4.36547 0.90659 3.44114 -0.16551 0.02393 0.2302 1.5163 -1.76378 -0.02256 -0.1973 -0.91643 -0.20763 0 0 0 -0.67068 0 -0.00411 0.02762 0 1.83614 0.13286 0 -0.93687 -0.32865 0.32056 -1.14365
ALA:CtermProteinFull_71 -1.34018 0.4215 0.34933 -0.03287 0.01061 0 0.17254 -0.41597 -0 -0 -0.716 -0.41084 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.0225 0.6581 0.51314
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114278 DOMAINID 110960 MODEL 5 2021-08-21_00000149_1_19
MODEL     5
REMARK    Rerank model01.pdb to model05.pdb score: 42.584
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 20 cluster_threshold: 2.937218
REMARK    SCORE          fa_dun:          91.607
REMARK    SCORE     hbond_lr_bb:          -3.469
REMARK    SCORE            time:           0.000
REMARK    SCORE     rama_prepro:          -7.556
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE           score:        -344.479
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     hbond_bb_sc:          -6.721
REMARK    SCORE     hbond_sr_bb:         -45.550
REMARK    SCORE          fa_rep:          42.488
REMARK    SCORE         fa_elec:        -106.632
REMARK    SCORE         p_aa_pp:         -11.615
REMARK    SCORE          fa_sol:         238.750
REMARK    SCORE     cart_bonded:          42.057
REMARK    SCORE     lk_ball_wtd:         -15.347
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE             ref:          27.225
REMARK    SCORE atom_pair_constraint:        -203.073
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE          fa_atr:        -398.447
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE fa_intra_sol_xover4:          15.601
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     total_score:        -344.479
REMARK    SCORE    fa_intra_rep:           0.693
REMARK    SCORE        hbond_sc:          -4.090
REMARK    SCORE           omega:          -0.401
ATOM      1  N   CYS A   1      -0.204   0.199  -1.367  1.00  3.590          N  
ATOM      2  CA  CYS A   1       1.157   0.129  -0.835  1.00  2.760          C  
ATOM      3  C   CYS A   1       1.754   1.528  -0.695  1.00  2.220          C  
ATOM      4  O   CYS A   1       2.638   1.926  -1.451  1.00  2.380          O  
ATOM      5  CB  CYS A   1       2.032  -0.743  -1.744  1.00  4.200          C  
ATOM      6  SG  CYS A   1       1.586  -2.525  -1.779  1.00  4.200          S  
ATOM      7 1H   CYS A   1      -0.228  -0.295  -2.247  1.00  4.310          H  
ATOM      8 2H   CYS A   1      -0.921  -0.184  -0.748  1.00  4.310          H  
ATOM      9 3H   CYS A   1      -0.408   1.174  -1.536  1.00  4.310          H  
ATOM     10  HA  CYS A   1       1.129  -0.321   0.150  1.00  3.310          H  
ATOM     11 1HB  CYS A   1       1.945  -0.371  -2.765  1.00  5.040          H  
ATOM     12 2HB  CYS A   1       3.063  -0.642  -1.482  1.00  5.040          H  
ATOM     13  HG  CYS A   1       2.072  -2.821  -0.564  1.00  5.040          H  
ATOM     14  N   VAL A   2       1.299   2.265   0.305  1.00  2.150          N  
ATOM     15  CA  VAL A   2       1.708   3.654   0.495  1.00  2.330          C  
ATOM     16  C   VAL A   2       3.200   3.879   0.664  1.00  2.280          C  
ATOM     17  O   VAL A   2       3.719   4.854   0.121  1.00  2.690          O  
ATOM     18  CB  VAL A   2       0.939   4.290   1.675  1.00  3.190          C  
ATOM     19  CG1 VAL A   2       1.525   5.662   2.046  1.00  3.190          C  
ATOM     20  CG2 VAL A   2      -0.518   4.492   1.253  1.00  3.190          C  
ATOM     21  H   VAL A   2       0.617   1.872   0.939  1.00  2.580          H  
ATOM     22  HA  VAL A   2       1.408   4.201  -0.401  1.00  2.800          H  
ATOM     23  HB  VAL A   2       1.008   3.640   2.545  1.00  3.830          H  
ATOM     24 1HG1 VAL A   2       0.955   6.087   2.871  1.00  3.830          H  
ATOM     25 2HG1 VAL A   2       2.561   5.575   2.354  1.00  3.830          H  
ATOM     26 3HG1 VAL A   2       1.468   6.328   1.186  1.00  3.830          H  
ATOM     27 1HG2 VAL A   2      -1.076   4.936   2.077  1.00  3.830          H  
ATOM     28 2HG2 VAL A   2      -0.545   5.161   0.393  1.00  3.830          H  
ATOM     29 3HG2 VAL A   2      -0.971   3.562   0.975  1.00  3.830          H  
ATOM     30  N   PHE A   3       3.906   3.035   1.414  1.00  2.200          N  
ATOM     31  CA  PHE A   3       5.314   3.336   1.599  1.00  2.520          C  
ATOM     32  C   PHE A   3       6.274   2.509   0.739  1.00  2.130          C  
ATOM     33  O   PHE A   3       7.441   2.364   1.098  1.00  2.650          O  
ATOM     34  CB  PHE A   3       5.664   3.245   3.080  1.00  3.400          C  
ATOM     35  CG  PHE A   3       4.885   4.254   3.896  1.00  3.400          C  
ATOM     36  CD1 PHE A   3       3.718   3.908   4.588  1.00  3.400          C  
ATOM     37  CD2 PHE A   3       5.307   5.565   3.954  1.00  3.400          C  
ATOM     38  CE1 PHE A   3       3.014   4.840   5.292  1.00  3.400          C  
ATOM     39  CE2 PHE A   3       4.597   6.500   4.665  1.00  3.400          C  
ATOM     40  CZ  PHE A   3       3.452   6.137   5.325  1.00  3.400          C  
ATOM     41  H   PHE A   3       3.495   2.223   1.880  1.00  2.640          H  
ATOM     42  HA  PHE A   3       5.467   4.377   1.318  1.00  3.020          H  
ATOM     43 1HB  PHE A   3       5.477   2.270   3.445  1.00  4.080          H  
ATOM     44 2HB  PHE A   3       6.716   3.446   3.217  1.00  4.080          H  
ATOM     45  HD1 PHE A   3       3.358   2.905   4.567  1.00  4.080          H  
ATOM     46  HD2 PHE A   3       6.215   5.857   3.423  1.00  4.080          H  
ATOM     47  HE1 PHE A   3       2.107   4.555   5.823  1.00  4.080          H  
ATOM     48  HE2 PHE A   3       4.939   7.535   4.706  1.00  4.080          H  
ATOM     49  HZ  PHE A   3       2.893   6.884   5.884  1.00  4.080          H  
ATOM     50  N   GLY A   4       5.830   1.972  -0.405  1.00  1.730          N  
ATOM     51  CA  GLY A   4       6.807   1.247  -1.222  1.00  1.800          C  
ATOM     52  C   GLY A   4       6.265   0.511  -2.445  1.00  1.760          C  
ATOM     53  O   GLY A   4       5.066   0.438  -2.684  1.00  2.070          O  
ATOM     54  H   GLY A   4       4.853   2.090  -0.706  1.00  2.080          H  
ATOM     55 1HA  GLY A   4       7.563   1.958  -1.554  1.00  2.160          H  
ATOM     56 2HA  GLY A   4       7.329   0.534  -0.588  1.00  2.160          H  
ATOM     57  N   CYS A   5       7.186  -0.039  -3.227  1.00  1.770          N  
ATOM     58  CA  CYS A   5       6.865  -0.796  -4.428  1.00  1.960          C  
ATOM     59  C   CYS A   5       6.308  -2.183  -4.086  1.00  1.900          C  
ATOM     60  O   CYS A   5       6.989  -2.937  -3.404  1.00  1.920          O  
ATOM     61  CB  CYS A   5       8.118  -0.971  -5.283  1.00  2.670          C  
ATOM     62  SG  CYS A   5       7.857  -1.920  -6.782  1.00  2.670          S  
ATOM     63  H   CYS A   5       8.157   0.071  -2.965  1.00  2.120          H  
ATOM     64  HA  CYS A   5       6.147  -0.207  -4.985  1.00  2.350          H  
ATOM     65 1HB  CYS A   5       8.502   0.009  -5.571  1.00  3.200          H  
ATOM     66 2HB  CYS A   5       8.891  -1.462  -4.706  1.00  3.200          H  
ATOM     67  HG  CYS A   5       9.122  -1.886  -7.190  1.00  3.200          H  
ATOM     68  N   PRO A   6       5.139  -2.608  -4.610  1.00  2.120          N  
ATOM     69  CA  PRO A   6       4.522  -3.893  -4.303  1.00  2.360          C  
ATOM     70  C   PRO A   6       5.377  -5.122  -4.656  1.00  2.270          C  
ATOM     71  O   PRO A   6       5.189  -6.184  -4.069  1.00  2.430          O  
ATOM     72  CB  PRO A   6       3.234  -3.859  -5.137  1.00  3.540          C  
ATOM     73  CG  PRO A   6       3.485  -2.836  -6.223  1.00  3.540          C  
ATOM     74  CD  PRO A   6       4.379  -1.792  -5.579  1.00  3.540          C  
ATOM     75  HA  PRO A   6       4.263  -3.901  -3.239  1.00  2.830          H  
ATOM     76 1HB  PRO A   6       3.030  -4.864  -5.541  1.00  4.250          H  
ATOM     77 2HB  PRO A   6       2.381  -3.602  -4.498  1.00  4.250          H  
ATOM     78 1HG  PRO A   6       3.955  -3.316  -7.098  1.00  4.250          H  
ATOM     79 2HG  PRO A   6       2.530  -2.416  -6.571  1.00  4.250          H  
ATOM     80 1HD  PRO A   6       5.008  -1.375  -6.369  1.00  4.250          H  
ATOM     81 2HD  PRO A   6       3.791  -1.017  -5.049  1.00  4.250          H  
ATOM     82  N   SER A   7       6.328  -5.010  -5.589  1.00  2.320          N  
ATOM     83  CA  SER A   7       7.147  -6.176  -5.896  1.00  2.450          C  
ATOM     84  C   SER A   7       8.321  -6.281  -4.923  1.00  2.100          C  
ATOM     85  O   SER A   7       8.872  -7.366  -4.685  1.00  2.270          O  
ATOM     86  CB  SER A   7       7.663  -6.110  -7.320  1.00  3.380          C  
ATOM     87  OG  SER A   7       8.572  -5.061  -7.484  1.00  3.380          O  
ATOM     88  H   SER A   7       6.493  -4.165  -6.126  1.00  2.780          H  
ATOM     89  HA  SER A   7       6.532  -7.071  -5.792  1.00  2.940          H  
ATOM     90 1HB  SER A   7       8.144  -7.054  -7.573  1.00  4.050          H  
ATOM     91 2HB  SER A   7       6.825  -5.976  -8.000  1.00  4.050          H  
ATOM     92  HG  SER A   7       8.885  -5.121  -8.393  1.00  4.050          H  
ATOM     93  N   ALA A   8       8.706  -5.160  -4.318  1.00  1.790          N  
ATOM     94  CA  ALA A   8       9.825  -5.124  -3.403  1.00  1.660          C  
ATOM     95  C   ALA A   8       9.298  -5.457  -2.028  1.00  1.410          C  
ATOM     96  O   ALA A   8       9.248  -4.603  -1.145  1.00  1.210          O  
ATOM     97  CB  ALA A   8      10.499  -3.769  -3.431  1.00  2.380          C  
ATOM     98  H   ALA A   8       8.190  -4.292  -4.461  1.00  2.150          H  
ATOM     99  HA  ALA A   8      10.541  -5.891  -3.699  1.00  1.990          H  
ATOM    100 1HB  ALA A   8      11.332  -3.777  -2.749  1.00  2.850          H  
ATOM    101 2HB  ALA A   8      10.855  -3.564  -4.441  1.00  2.850          H  
ATOM    102 3HB  ALA A   8       9.782  -3.009  -3.133  1.00  2.850          H  
ATOM    103  N   ALA A   9       8.923  -6.709  -1.841  1.00  1.590          N  
ATOM    104  CA  ALA A   9       8.226  -7.137  -0.633  1.00  1.600          C  
ATOM    105  C   ALA A   9       8.967  -6.825   0.666  1.00  1.410          C  
ATOM    106  O   ALA A   9       8.337  -6.426   1.651  1.00  1.430          O  
ATOM    107  CB  ALA A   9       7.981  -8.630  -0.708  1.00  2.240          C  
ATOM    108  H   ALA A   9       9.036  -7.332  -2.650  1.00  1.910          H  
ATOM    109  HA  ALA A   9       7.270  -6.613  -0.601  1.00  1.920          H  
ATOM    110 1HB  ALA A   9       7.443  -8.961   0.161  1.00  2.680          H  
ATOM    111 2HB  ALA A   9       7.408  -8.863  -1.606  1.00  2.680          H  
ATOM    112 3HB  ALA A   9       8.937  -9.150  -0.743  1.00  2.680          H  
ATOM    113  N   ASP A  10      10.295  -6.930   0.685  1.00  1.390          N  
ATOM    114  CA  ASP A  10      10.969  -6.692   1.961  1.00  1.340          C  
ATOM    115  C   ASP A  10      11.184  -5.211   2.209  1.00  1.130          C  
ATOM    116  O   ASP A  10      11.012  -4.736   3.335  1.00  1.140          O  
ATOM    117  CB  ASP A  10      12.319  -7.397   1.977  1.00  1.900          C  
ATOM    118  CG  ASP A  10      12.197  -8.906   1.932  1.00  1.900          C  
ATOM    119  OD1 ASP A  10      11.643  -9.489   2.835  1.00  1.900          O  
ATOM    120  OD2 ASP A  10      12.649  -9.465   0.963  1.00  1.900          O  
ATOM    121  H   ASP A  10      10.798  -7.229  -0.139  1.00  1.670          H  
ATOM    122  HA  ASP A  10      10.350  -7.093   2.763  1.00  1.610          H  
ATOM    123 1HB  ASP A  10      12.913  -7.067   1.127  1.00  2.280          H  
ATOM    124 2HB  ASP A  10      12.861  -7.116   2.884  1.00  2.280          H  
ATOM    125  N   LYS A  11      11.506  -4.464   1.156  1.00  1.090          N  
ATOM    126  CA  LYS A  11      11.732  -3.033   1.306  1.00  1.040          C  
ATOM    127  C   LYS A  11      10.425  -2.367   1.701  1.00  0.890          C  
ATOM    128  O   LYS A  11      10.388  -1.510   2.586  1.00  0.870          O  
ATOM    129  CB  LYS A  11      12.250  -2.418   0.011  1.00  1.480          C  
ATOM    130  CG  LYS A  11      13.667  -2.823  -0.366  1.00  1.480          C  
ATOM    131  CD  LYS A  11      14.095  -2.185  -1.686  1.00  1.480          C  
ATOM    132  CE  LYS A  11      15.505  -2.608  -2.075  1.00  1.480          C  
ATOM    133  NZ  LYS A  11      15.919  -2.032  -3.385  1.00  1.480          N  
ATOM    134  H   LYS A  11      11.632  -4.923   0.267  1.00  1.310          H  
ATOM    135  HA  LYS A  11      12.454  -2.867   2.108  1.00  1.250          H  
ATOM    136 1HB  LYS A  11      11.584  -2.685  -0.795  1.00  1.770          H  
ATOM    137 2HB  LYS A  11      12.228  -1.333   0.099  1.00  1.770          H  
ATOM    138 1HG  LYS A  11      14.353  -2.507   0.422  1.00  1.770          H  
ATOM    139 2HG  LYS A  11      13.722  -3.906  -0.456  1.00  1.770          H  
ATOM    140 1HD  LYS A  11      13.408  -2.478  -2.477  1.00  1.770          H  
ATOM    141 2HD  LYS A  11      14.068  -1.100  -1.590  1.00  1.770          H  
ATOM    142 1HE  LYS A  11      16.201  -2.276  -1.307  1.00  1.770          H  
ATOM    143 2HE  LYS A  11      15.544  -3.696  -2.140  1.00  1.770          H  
ATOM    144 1HZ  LYS A  11      16.857  -2.338  -3.604  1.00  1.770          H  
ATOM    145 2HZ  LYS A  11      15.286  -2.344  -4.108  1.00  1.770          H  
ATOM    146 3HZ  LYS A  11      15.899  -1.023  -3.333  1.00  1.770          H  
ATOM    147  N   LEU A  12       9.345  -2.825   1.061  1.00  0.930          N  
ATOM    148  CA  LEU A  12       8.006  -2.336   1.271  1.00  0.970          C  
ATOM    149  C   LEU A  12       7.608  -2.491   2.716  1.00  0.880          C  
ATOM    150  O   LEU A  12       7.234  -1.517   3.380  1.00  0.990          O  
ATOM    151  CB  LEU A  12       7.056  -3.195   0.424  1.00  1.340          C  
ATOM    152  CG  LEU A  12       5.580  -2.970   0.551  1.00  1.340          C  
ATOM    153  CD1 LEU A  12       5.204  -1.642   0.062  1.00  1.340          C  
ATOM    154  CD2 LEU A  12       4.893  -4.025  -0.199  1.00  1.340          C  
ATOM    155  H   LEU A  12       9.459  -3.542   0.345  1.00  1.120          H  
ATOM    156  HA  LEU A  12       7.966  -1.288   0.988  1.00  1.160          H  
ATOM    157 1HB  LEU A  12       7.314  -3.038  -0.627  1.00  1.610          H  
ATOM    158 2HB  LEU A  12       7.249  -4.238   0.654  1.00  1.610          H  
ATOM    159  HG  LEU A  12       5.304  -3.028   1.586  1.00  1.610          H  
ATOM    160 1HD1 LEU A  12       4.149  -1.520   0.184  1.00  1.610          H  
ATOM    161 2HD1 LEU A  12       5.717  -0.864   0.610  1.00  1.610          H  
ATOM    162 3HD1 LEU A  12       5.463  -1.588  -0.981  1.00  1.610          H  
ATOM    163 1HD2 LEU A  12       3.820  -3.909  -0.120  1.00  1.610          H  
ATOM    164 2HD2 LEU A  12       5.193  -3.969  -1.236  1.00  1.610          H  
ATOM    165 3HD2 LEU A  12       5.184  -4.987   0.215  1.00  1.610          H  
ATOM    166  N   TRP A  13       7.749  -3.701   3.243  1.00  0.850          N  
ATOM    167  CA  TRP A  13       7.387  -3.927   4.619  1.00  0.940          C  
ATOM    168  C   TRP A  13       8.216  -3.142   5.606  1.00  0.910          C  
ATOM    169  O   TRP A  13       7.660  -2.615   6.573  1.00  1.090          O  
ATOM    170  CB  TRP A  13       7.396  -5.411   4.929  1.00  1.280          C  
ATOM    171  CG  TRP A  13       6.088  -5.999   4.651  1.00  1.280          C  
ATOM    172  CD1 TRP A  13       5.696  -6.809   3.650  1.00  1.280          C  
ATOM    173  CD2 TRP A  13       4.943  -5.800   5.477  1.00  1.280          C  
ATOM    174  NE1 TRP A  13       4.377  -7.114   3.803  1.00  1.280          N  
ATOM    175  CE2 TRP A  13       3.912  -6.499   4.922  1.00  1.280          C  
ATOM    176  CE3 TRP A  13       4.737  -5.110   6.634  1.00  1.280          C  
ATOM    177  CZ2 TRP A  13       2.670  -6.505   5.478  1.00  1.280          C  
ATOM    178  CZ3 TRP A  13       3.500  -5.129   7.221  1.00  1.280          C  
ATOM    179  CH2 TRP A  13       2.482  -5.803   6.657  1.00  1.280          C  
ATOM    180  H   TRP A  13       8.080  -4.482   2.667  1.00  1.020          H  
ATOM    181  HA  TRP A  13       6.355  -3.596   4.730  1.00  1.130          H  
ATOM    182 1HB  TRP A  13       8.151  -5.910   4.310  1.00  1.540          H  
ATOM    183 2HB  TRP A  13       7.653  -5.578   5.972  1.00  1.540          H  
ATOM    184  HD1 TRP A  13       6.334  -7.163   2.843  1.00  1.540          H  
ATOM    185  HE1 TRP A  13       3.846  -7.703   3.183  1.00  1.540          H  
ATOM    186  HE3 TRP A  13       5.556  -4.577   7.063  1.00  1.540          H  
ATOM    187  HZ2 TRP A  13       1.864  -7.046   5.030  1.00  1.540          H  
ATOM    188  HZ3 TRP A  13       3.360  -4.588   8.143  1.00  1.540          H  
ATOM    189  HH2 TRP A  13       1.502  -5.796   7.141  1.00  1.540          H  
ATOM    190  N   ASP A  14       9.532  -3.024   5.393  1.00  0.850          N  
ATOM    191  CA  ASP A  14      10.310  -2.255   6.352  1.00  1.010          C  
ATOM    192  C   ASP A  14       9.870  -0.795   6.401  1.00  1.060          C  
ATOM    193  O   ASP A  14       9.746  -0.227   7.492  1.00  1.280          O  
ATOM    194  CB  ASP A  14      11.806  -2.307   6.030  1.00  1.350          C  
ATOM    195  CG  ASP A  14      12.486  -3.647   6.347  1.00  1.350          C  
ATOM    196  OD1 ASP A  14      11.913  -4.468   7.029  1.00  1.350          O  
ATOM    197  OD2 ASP A  14      13.603  -3.816   5.917  1.00  1.350          O  
ATOM    198  H   ASP A  14       9.995  -3.498   4.608  1.00  1.020          H  
ATOM    199  HA  ASP A  14      10.156  -2.690   7.338  1.00  1.210          H  
ATOM    200 1HB  ASP A  14      11.934  -2.107   4.961  1.00  1.620          H  
ATOM    201 2HB  ASP A  14      12.318  -1.514   6.570  1.00  1.620          H  
ATOM    202  N   GLU A  15       9.579  -0.193   5.238  1.00  0.970          N  
ATOM    203  CA  GLU A  15       9.170   1.212   5.210  1.00  1.160          C  
ATOM    204  C   GLU A  15       7.758   1.446   5.753  1.00  1.260          C  
ATOM    205  O   GLU A  15       7.513   2.449   6.442  1.00  1.480          O  
ATOM    206  CB  GLU A  15       9.301   1.780   3.799  1.00  1.550          C  
ATOM    207  CG  GLU A  15      10.748   1.930   3.313  1.00  1.550          C  
ATOM    208  CD  GLU A  15      11.556   2.893   4.156  1.00  1.550          C  
ATOM    209  OE1 GLU A  15      11.063   3.954   4.449  1.00  1.550          O  
ATOM    210  OE2 GLU A  15      12.661   2.562   4.512  1.00  1.550          O  
ATOM    211  H   GLU A  15       9.715  -0.698   4.352  1.00  1.160          H  
ATOM    212  HA  GLU A  15       9.857   1.768   5.845  1.00  1.390          H  
ATOM    213 1HB  GLU A  15       8.773   1.127   3.095  1.00  1.860          H  
ATOM    214 2HB  GLU A  15       8.837   2.756   3.753  1.00  1.860          H  
ATOM    215 1HG  GLU A  15      11.227   0.951   3.333  1.00  1.860          H  
ATOM    216 2HG  GLU A  15      10.733   2.276   2.280  1.00  1.860          H  
ATOM    217  N   ASN A  16       6.826   0.517   5.502  1.00  1.180          N  
ATOM    218  CA  ASN A  16       5.484   0.741   6.013  1.00  1.410          C  
ATOM    219  C   ASN A  16       5.511   0.546   7.529  1.00  1.410          C  
ATOM    220  O   ASN A  16       4.983   1.377   8.275  1.00  1.490          O  
ATOM    221  CB  ASN A  16       4.465  -0.213   5.389  1.00  1.880          C  
ATOM    222  CG  ASN A  16       4.092   0.012   3.917  1.00  1.880          C  
ATOM    223  OD1 ASN A  16       3.271   0.861   3.486  1.00  1.880          O  
ATOM    224  ND2 ASN A  16       4.701  -0.770   3.129  1.00  1.880          N  
ATOM    225  H   ASN A  16       7.049  -0.288   4.905  1.00  1.420          H  
ATOM    226  HA  ASN A  16       5.193   1.771   5.822  1.00  1.690          H  
ATOM    227 1HB  ASN A  16       4.825  -1.239   5.500  1.00  2.260          H  
ATOM    228 2HB  ASN A  16       3.579  -0.122   5.945  1.00  2.260          H  
ATOM    229 1HD2 ASN A  16       4.540  -0.721   2.153  1.00  2.260          H  
ATOM    230 2HD2 ASN A  16       5.380  -1.429   3.491  1.00  2.260          H  
ATOM    231  N   LYS A  17       6.183  -0.524   8.005  1.00  1.420          N  
ATOM    232  CA  LYS A  17       6.273  -0.763   9.442  1.00  1.620          C  
ATOM    233  C   LYS A  17       7.000   0.345  10.159  1.00  1.610          C  
ATOM    234  O   LYS A  17       6.548   0.777  11.214  1.00  1.860          O  
ATOM    235  CB  LYS A  17       6.930  -2.107   9.766  1.00  2.190          C  
ATOM    236  CG  LYS A  17       6.012  -3.297   9.591  1.00  2.190          C  
ATOM    237  CD  LYS A  17       6.745  -4.678   9.721  1.00  2.190          C  
ATOM    238  CE  LYS A  17       7.277  -4.934  11.163  1.00  2.190          C  
ATOM    239  NZ  LYS A  17       7.857  -6.330  11.349  1.00  2.190          N  
ATOM    240  H   LYS A  17       6.617  -1.185   7.359  1.00  1.700          H  
ATOM    241  HA  LYS A  17       5.270  -0.795   9.846  1.00  1.940          H  
ATOM    242 1HB  LYS A  17       7.796  -2.248   9.116  1.00  2.630          H  
ATOM    243 2HB  LYS A  17       7.286  -2.089  10.766  1.00  2.630          H  
ATOM    244 1HG  LYS A  17       5.224  -3.248  10.345  1.00  2.630          H  
ATOM    245 2HG  LYS A  17       5.552  -3.190   8.637  1.00  2.630          H  
ATOM    246 1HD  LYS A  17       6.053  -5.483   9.458  1.00  2.630          H  
ATOM    247 2HD  LYS A  17       7.583  -4.705   9.019  1.00  2.630          H  
ATOM    248 1HE  LYS A  17       8.063  -4.213  11.374  1.00  2.630          H  
ATOM    249 2HE  LYS A  17       6.466  -4.797  11.876  1.00  2.630          H  
ATOM    250 1HZ  LYS A  17       8.193  -6.428  12.290  1.00  2.630          H  
ATOM    251 2HZ  LYS A  17       7.144  -7.067  11.194  1.00  2.630          H  
ATOM    252 3HZ  LYS A  17       8.617  -6.481  10.714  1.00  2.630          H  
ATOM    253  N   SER A  18       8.084   0.877   9.597  1.00  1.420          N  
ATOM    254  CA  SER A  18       8.796   1.939  10.287  1.00  1.580          C  
ATOM    255  C   SER A  18       7.861   3.112  10.542  1.00  1.590          C  
ATOM    256  O   SER A  18       7.744   3.597  11.676  1.00  1.870          O  
ATOM    257  CB  SER A  18       9.987   2.381   9.464  1.00  2.150          C  
ATOM    258  OG  SER A  18      10.690   3.418  10.094  1.00  2.150          O  
ATOM    259  H   SER A  18       8.475   0.508   8.725  1.00  1.700          H  
ATOM    260  HA  SER A  18       9.147   1.558  11.245  1.00  1.900          H  
ATOM    261 1HB  SER A  18      10.649   1.532   9.305  1.00  2.580          H  
ATOM    262 2HB  SER A  18       9.644   2.711   8.480  1.00  2.580          H  
ATOM    263  HG  SER A  18      11.414   3.635   9.501  1.00  2.580          H  
ATOM    264  N   HIS A  19       7.118   3.531   9.511  1.00  1.390          N  
ATOM    265  CA  HIS A  19       6.195   4.646   9.684  1.00  1.470          C  
ATOM    266  C   HIS A  19       5.150   4.390  10.763  1.00  1.340          C  
ATOM    267  O   HIS A  19       4.983   5.183  11.708  1.00  1.400          O  
ATOM    268  CB  HIS A  19       5.434   4.924   8.385  1.00  2.030          C  
ATOM    269  CG  HIS A  19       4.379   5.965   8.555  1.00  2.030          C  
ATOM    270  ND1 HIS A  19       4.660   7.312   8.613  1.00  2.030          N  
ATOM    271  CD2 HIS A  19       3.036   5.851   8.707  1.00  2.030          C  
ATOM    272  CE1 HIS A  19       3.535   7.984   8.786  1.00  2.030          C  
ATOM    273  NE2 HIS A  19       2.537   7.120   8.846  1.00  2.030          N  
ATOM    274  H   HIS A  19       7.222   3.095   8.587  1.00  1.670          H  
ATOM    275  HA  HIS A  19       6.754   5.537   9.960  1.00  1.760          H  
ATOM    276 1HB  HIS A  19       6.129   5.252   7.611  1.00  2.430          H  
ATOM    277 2HB  HIS A  19       4.962   4.007   8.026  1.00  2.430          H  
ATOM    278  HD2 HIS A  19       2.466   4.926   8.719  1.00  2.430          H  
ATOM    279  HE1 HIS A  19       3.445   9.067   8.867  1.00  2.430          H  
ATOM    280  HE2 HIS A  19       1.562   7.349   8.978  1.00  2.430          H  
ATOM    281  N   PHE A  20       4.442   3.273  10.629  1.00  1.250          N  
ATOM    282  CA  PHE A  20       3.354   2.999  11.541  1.00  1.230          C  
ATOM    283  C   PHE A  20       3.815   2.698  12.956  1.00  1.070          C  
ATOM    284  O   PHE A  20       3.242   3.224  13.910  1.00  1.090          O  
ATOM    285  CB  PHE A  20       2.507   1.853  11.006  1.00  1.730          C  
ATOM    286  CG  PHE A  20       1.575   2.232   9.887  1.00  1.730          C  
ATOM    287  CD1 PHE A  20       1.817   1.846   8.586  1.00  1.730          C  
ATOM    288  CD2 PHE A  20       0.452   2.984  10.140  1.00  1.730          C  
ATOM    289  CE1 PHE A  20       0.960   2.189   7.568  1.00  1.730          C  
ATOM    290  CE2 PHE A  20      -0.411   3.332   9.131  1.00  1.730          C  
ATOM    291  CZ  PHE A  20      -0.157   2.932   7.842  1.00  1.730          C  
ATOM    292  H   PHE A  20       4.646   2.632   9.854  1.00  1.500          H  
ATOM    293  HA  PHE A  20       2.728   3.889  11.579  1.00  1.480          H  
ATOM    294 1HB  PHE A  20       3.177   1.084  10.630  1.00  2.080          H  
ATOM    295 2HB  PHE A  20       1.934   1.427  11.802  1.00  2.080          H  
ATOM    296  HD1 PHE A  20       2.686   1.261   8.362  1.00  2.080          H  
ATOM    297  HD2 PHE A  20       0.253   3.311  11.148  1.00  2.080          H  
ATOM    298  HE1 PHE A  20       1.169   1.870   6.548  1.00  2.080          H  
ATOM    299  HE2 PHE A  20      -1.299   3.927   9.351  1.00  2.080          H  
ATOM    300  HZ  PHE A  20      -0.844   3.210   7.046  1.00  2.080          H  
ATOM    301  N   ILE A  21       4.873   1.913  13.120  1.00  0.960          N  
ATOM    302  CA  ILE A  21       5.329   1.565  14.448  1.00  0.850          C  
ATOM    303  C   ILE A  21       5.786   2.783  15.210  1.00  0.760          C  
ATOM    304  O   ILE A  21       5.431   2.915  16.376  1.00  0.680          O  
ATOM    305  CB  ILE A  21       6.422   0.484  14.446  1.00  1.230          C  
ATOM    306  CG1 ILE A  21       5.797  -0.827  13.957  1.00  1.230          C  
ATOM    307  CG2 ILE A  21       7.057   0.326  15.853  1.00  1.230          C  
ATOM    308  CD1 ILE A  21       6.774  -1.920  13.649  1.00  1.230          C  
ATOM    309  H   ILE A  21       5.362   1.530  12.312  1.00  1.150          H  
ATOM    310  HA  ILE A  21       4.476   1.143  14.983  1.00  1.020          H  
ATOM    311  HB  ILE A  21       7.197   0.767  13.728  1.00  1.480          H  
ATOM    312 1HG1 ILE A  21       5.097  -1.174  14.701  1.00  1.480          H  
ATOM    313 2HG1 ILE A  21       5.249  -0.614  13.045  1.00  1.480          H  
ATOM    314 1HG2 ILE A  21       7.831  -0.432  15.834  1.00  1.480          H  
ATOM    315 2HG2 ILE A  21       7.511   1.263  16.166  1.00  1.480          H  
ATOM    316 3HG2 ILE A  21       6.298   0.037  16.567  1.00  1.480          H  
ATOM    317 1HD1 ILE A  21       6.233  -2.786  13.287  1.00  1.480          H  
ATOM    318 2HD1 ILE A  21       7.459  -1.570  12.890  1.00  1.480          H  
ATOM    319 3HD1 ILE A  21       7.332  -2.194  14.532  1.00  1.480          H  
ATOM    320  N   GLU A  22       6.589   3.666  14.597  1.00  0.850          N  
ATOM    321  CA  GLU A  22       7.053   4.828  15.345  1.00  0.870          C  
ATOM    322  C   GLU A  22       5.881   5.719  15.769  1.00  0.790          C  
ATOM    323  O   GLU A  22       5.845   6.212  16.906  1.00  0.770          O  
ATOM    324  CB  GLU A  22       8.039   5.640  14.501  1.00  1.210          C  
ATOM    325  CG  GLU A  22       8.670   6.848  15.219  1.00  1.210          C  
ATOM    326  CD  GLU A  22       9.566   6.449  16.362  1.00  1.210          C  
ATOM    327  OE1 GLU A  22      10.015   5.326  16.374  1.00  1.210          O  
ATOM    328  OE2 GLU A  22       9.799   7.263  17.222  1.00  1.210          O  
ATOM    329  H   GLU A  22       6.890   3.534  13.624  1.00  1.020          H  
ATOM    330  HA  GLU A  22       7.567   4.479  16.240  1.00  1.040          H  
ATOM    331 1HB  GLU A  22       8.847   4.988  14.166  1.00  1.450          H  
ATOM    332 2HB  GLU A  22       7.529   6.002  13.605  1.00  1.450          H  
ATOM    333 1HG  GLU A  22       9.260   7.407  14.496  1.00  1.450          H  
ATOM    334 2HG  GLU A  22       7.885   7.508  15.588  1.00  1.450          H  
ATOM    335  N   ASP A  23       4.888   5.895  14.885  1.00  0.870          N  
ATOM    336  CA  ASP A  23       3.731   6.721  15.217  1.00  0.950          C  
ATOM    337  C   ASP A  23       2.956   6.121  16.394  1.00  0.850          C  
ATOM    338  O   ASP A  23       2.546   6.832  17.331  1.00  0.950          O  
ATOM    339  CB  ASP A  23       2.820   6.838  13.985  1.00  1.300          C  
ATOM    340  CG  ASP A  23       1.631   7.796  14.164  1.00  1.300          C  
ATOM    341  OD1 ASP A  23       1.853   8.959  14.376  1.00  1.300          O  
ATOM    342  OD2 ASP A  23       0.491   7.359  14.106  1.00  1.300          O  
ATOM    343  H   ASP A  23       4.961   5.502  13.940  1.00  1.040          H  
ATOM    344  HA  ASP A  23       4.084   7.714  15.498  1.00  1.140          H  
ATOM    345 1HB  ASP A  23       3.417   7.168  13.129  1.00  1.560          H  
ATOM    346 2HB  ASP A  23       2.435   5.843  13.737  1.00  1.560          H  
ATOM    347  N   PHE A  24       2.782   4.803  16.354  1.00  0.780          N  
ATOM    348  CA  PHE A  24       2.065   4.086  17.376  1.00  0.830          C  
ATOM    349  C   PHE A  24       2.834   4.084  18.670  1.00  0.740          C  
ATOM    350  O   PHE A  24       2.225   4.221  19.722  1.00  0.900          O  
ATOM    351  CB  PHE A  24       1.793   2.667  16.914  1.00  1.140          C  
ATOM    352  CG  PHE A  24       0.889   2.596  15.703  1.00  1.140          C  
ATOM    353  CD1 PHE A  24       0.081   3.678  15.301  1.00  1.140          C  
ATOM    354  CD2 PHE A  24       0.852   1.457  14.930  1.00  1.140          C  
ATOM    355  CE1 PHE A  24      -0.687   3.592  14.206  1.00  1.140          C  
ATOM    356  CE2 PHE A  24       0.050   1.411  13.831  1.00  1.140          C  
ATOM    357  CZ  PHE A  24      -0.699   2.468  13.485  1.00  1.140          C  
ATOM    358  H   PHE A  24       3.113   4.280  15.536  1.00  0.940          H  
ATOM    359  HA  PHE A  24       1.132   4.592  17.589  1.00  1.000          H  
ATOM    360 1HB  PHE A  24       2.735   2.194  16.660  1.00  1.370          H  
ATOM    361 2HB  PHE A  24       1.334   2.101  17.715  1.00  1.370          H  
ATOM    362  HD1 PHE A  24       0.058   4.611  15.839  1.00  1.370          H  
ATOM    363  HD2 PHE A  24       1.466   0.594  15.196  1.00  1.370          H  
ATOM    364  HE1 PHE A  24      -1.297   4.443  13.906  1.00  1.370          H  
ATOM    365  HE2 PHE A  24       0.004   0.544  13.232  1.00  1.370          H  
ATOM    366  HZ  PHE A  24      -1.305   2.425  12.627  1.00  1.370          H  
ATOM    367  N   CYS A  25       4.163   3.947  18.615  1.00  0.620          N  
ATOM    368  CA  CYS A  25       4.953   3.937  19.840  1.00  0.700          C  
ATOM    369  C   CYS A  25       4.818   5.259  20.551  1.00  0.800          C  
ATOM    370  O   CYS A  25       4.589   5.303  21.758  1.00  0.980          O  
ATOM    371  CB  CYS A  25       6.439   3.702  19.548  1.00  0.950          C  
ATOM    372  SG  CYS A  25       6.849   2.034  19.002  1.00  0.950          S  
ATOM    373  H   CYS A  25       4.616   3.798  17.719  1.00  0.740          H  
ATOM    374  HA  CYS A  25       4.594   3.155  20.496  1.00  0.840          H  
ATOM    375 1HB  CYS A  25       6.761   4.393  18.766  1.00  1.140          H  
ATOM    376 2HB  CYS A  25       7.017   3.924  20.434  1.00  1.140          H  
ATOM    377  HG  CYS A  25       6.239   2.173  17.794  1.00  1.140          H  
ATOM    378  N   TRP A  26       4.833   6.366  19.820  1.00  0.820          N  
ATOM    379  CA  TRP A  26       4.718   7.643  20.504  1.00  1.040          C  
ATOM    380  C   TRP A  26       3.404   7.683  21.302  1.00  1.150          C  
ATOM    381  O   TRP A  26       3.401   7.959  22.509  1.00  1.320          O  
ATOM    382  CB  TRP A  26       4.786   8.781  19.483  1.00  1.370          C  
ATOM    383  CG  TRP A  26       4.827  10.168  20.069  1.00  1.370          C  
ATOM    384  CD1 TRP A  26       5.954  10.840  20.426  1.00  1.370          C  
ATOM    385  CD2 TRP A  26       3.726  11.063  20.347  1.00  1.370          C  
ATOM    386  NE1 TRP A  26       5.635  12.080  20.901  1.00  1.370          N  
ATOM    387  CE2 TRP A  26       4.275  12.235  20.862  1.00  1.370          C  
ATOM    388  CE3 TRP A  26       2.352  10.965  20.205  1.00  1.370          C  
ATOM    389  CZ2 TRP A  26       3.489  13.309  21.234  1.00  1.370          C  
ATOM    390  CZ3 TRP A  26       1.557  12.032  20.577  1.00  1.370          C  
ATOM    391  CH2 TRP A  26       2.111  13.178  21.081  1.00  1.370          C  
ATOM    392  H   TRP A  26       5.021   6.322  18.808  1.00  0.980          H  
ATOM    393  HA  TRP A  26       5.551   7.743  21.199  1.00  1.250          H  
ATOM    394 1HB  TRP A  26       5.672   8.647  18.860  1.00  1.640          H  
ATOM    395 2HB  TRP A  26       3.923   8.715  18.819  1.00  1.640          H  
ATOM    396  HD1 TRP A  26       6.966  10.447  20.338  1.00  1.640          H  
ATOM    397  HE1 TRP A  26       6.296  12.773  21.228  1.00  1.640          H  
ATOM    398  HE3 TRP A  26       1.923  10.070  19.807  1.00  1.640          H  
ATOM    399  HZ2 TRP A  26       3.915  14.228  21.638  1.00  1.640          H  
ATOM    400  HZ3 TRP A  26       0.479  11.938  20.457  1.00  1.640          H  
ATOM    401  HH2 TRP A  26       1.459  14.002  21.365  1.00  1.640          H  
ATOM    402  N   LYS A  27       2.285   7.323  20.660  1.00  1.150          N  
ATOM    403  CA  LYS A  27       1.011   7.382  21.380  1.00  1.400          C  
ATOM    404  C   LYS A  27       0.855   6.305  22.456  1.00  1.460          C  
ATOM    405  O   LYS A  27       0.465   6.608  23.588  1.00  1.710          O  
ATOM    406  CB  LYS A  27      -0.160   7.286  20.395  1.00  1.860          C  
ATOM    407  CG  LYS A  27      -0.355   8.515  19.493  1.00  1.860          C  
ATOM    408  CD  LYS A  27      -1.616   8.393  18.632  1.00  1.860          C  
ATOM    409  CE  LYS A  27      -1.351   7.661  17.308  1.00  1.860          C  
ATOM    410  NZ  LYS A  27      -0.701   8.574  16.291  1.00  1.860          N  
ATOM    411  H   LYS A  27       2.334   7.045  19.672  1.00  1.380          H  
ATOM    412  HA  LYS A  27       0.961   8.349  21.878  1.00  1.680          H  
ATOM    413 1HB  LYS A  27      -0.015   6.410  19.763  1.00  2.230          H  
ATOM    414 2HB  LYS A  27      -1.083   7.134  20.957  1.00  2.230          H  
ATOM    415 1HG  LYS A  27      -0.425   9.408  20.111  1.00  2.230          H  
ATOM    416 2HG  LYS A  27       0.510   8.604  18.837  1.00  2.230          H  
ATOM    417 1HD  LYS A  27      -2.383   7.850  19.186  1.00  2.230          H  
ATOM    418 2HD  LYS A  27      -1.995   9.388  18.406  1.00  2.230          H  
ATOM    419 1HE  LYS A  27      -0.684   6.816  17.482  1.00  2.230          H  
ATOM    420 2HE  LYS A  27      -2.292   7.292  16.902  1.00  2.230          H  
ATOM    421 1HZ  LYS A  27      -0.530   8.057  15.409  1.00  2.230          H  
ATOM    422 2HZ  LYS A  27      -1.300   9.351  16.095  1.00  2.230          H  
ATOM    423 3HZ  LYS A  27       0.185   8.925  16.631  1.00  2.230          H  
ATOM    424  N   LEU A  28       1.162   5.059  22.123  1.00  1.310          N  
ATOM    425  CA  LEU A  28       1.019   3.971  23.070  1.00  1.470          C  
ATOM    426  C   LEU A  28       1.948   4.067  24.248  1.00  1.510          C  
ATOM    427  O   LEU A  28       1.565   3.650  25.339  1.00  1.690          O  
ATOM    428  CB  LEU A  28       1.131   2.616  22.362  1.00  1.990          C  
ATOM    429  CG  LEU A  28      -0.121   2.220  21.490  1.00  1.990          C  
ATOM    430  CD1 LEU A  28       0.205   1.049  20.623  1.00  1.990          C  
ATOM    431  CD2 LEU A  28      -1.283   1.811  22.421  1.00  1.990          C  
ATOM    432  H   LEU A  28       1.495   4.855  21.186  1.00  1.570          H  
ATOM    433  HA  LEU A  28       0.019   4.040  23.471  1.00  1.760          H  
ATOM    434 1HB  LEU A  28       2.003   2.644  21.707  1.00  2.390          H  
ATOM    435 2HB  LEU A  28       1.297   1.840  23.109  1.00  2.390          H  
ATOM    436  HG  LEU A  28      -0.420   3.058  20.859  1.00  2.390          H  
ATOM    437 1HD1 LEU A  28      -0.666   0.765  20.030  1.00  2.390          H  
ATOM    438 2HD1 LEU A  28       0.980   1.333  19.966  1.00  2.390          H  
ATOM    439 3HD1 LEU A  28       0.517   0.213  21.231  1.00  2.390          H  
ATOM    440 1HD2 LEU A  28      -2.141   1.522  21.810  1.00  2.390          H  
ATOM    441 2HD2 LEU A  28      -0.974   0.963  23.032  1.00  2.390          H  
ATOM    442 3HD2 LEU A  28      -1.578   2.628  23.068  1.00  2.390          H  
ATOM    443  N   HIS A  29       3.163   4.570  24.078  1.00  1.410          N  
ATOM    444  CA  HIS A  29       4.037   4.668  25.222  1.00  1.610          C  
ATOM    445  C   HIS A  29       3.541   5.796  26.143  1.00  1.810          C  
ATOM    446  O   HIS A  29       3.485   5.625  27.361  1.00  2.020          O  
ATOM    447  CB  HIS A  29       5.481   4.844  24.769  1.00  2.170          C  
ATOM    448  CG  HIS A  29       6.004   3.591  24.051  1.00  2.170          C  
ATOM    449  ND1 HIS A  29       7.220   3.556  23.401  1.00  2.170          N  
ATOM    450  CD2 HIS A  29       5.445   2.358  23.871  1.00  2.170          C  
ATOM    451  CE1 HIS A  29       7.392   2.353  22.862  1.00  2.170          C  
ATOM    452  NE2 HIS A  29       6.331   1.617  23.130  1.00  2.170          N  
ATOM    453  H   HIS A  29       3.505   4.868  23.159  1.00  1.690          H  
ATOM    454  HA  HIS A  29       3.993   3.742  25.797  1.00  1.930          H  
ATOM    455 1HB  HIS A  29       5.551   5.696  24.089  1.00  2.610          H  
ATOM    456 2HB  HIS A  29       6.117   5.048  25.627  1.00  2.610          H  
ATOM    457  HD1 HIS A  29       7.746   4.360  23.128  1.00  2.610          H  
ATOM    458  HD2 HIS A  29       4.497   1.915  24.187  1.00  2.610          H  
ATOM    459  HE1 HIS A  29       8.297   2.122  22.301  1.00  2.610          H  
ATOM    460  N   ARG A  30       3.079   6.927  25.574  1.00  1.820          N  
ATOM    461  CA  ARG A  30       2.540   8.024  26.391  1.00  2.100          C  
ATOM    462  C   ARG A  30       1.339   7.564  27.223  1.00  2.240          C  
ATOM    463  O   ARG A  30       1.150   7.993  28.365  1.00  2.430          O  
ATOM    464  CB  ARG A  30       2.137   9.197  25.516  1.00  2.830          C  
ATOM    465  CG  ARG A  30       3.295  10.002  24.959  1.00  2.830          C  
ATOM    466  CD  ARG A  30       2.848  10.983  23.948  1.00  2.830          C  
ATOM    467  NE  ARG A  30       1.921  11.983  24.488  1.00  2.830          N  
ATOM    468  CZ  ARG A  30       2.272  13.131  25.110  1.00  2.830          C  
ATOM    469  NH1 ARG A  30       3.541  13.444  25.289  1.00  2.830          N  
ATOM    470  NH2 ARG A  30       1.325  13.949  25.544  1.00  2.830          N  
ATOM    471  H   ARG A  30       3.141   7.068  24.560  1.00  2.180          H  
ATOM    472  HA  ARG A  30       3.322   8.359  27.070  1.00  2.520          H  
ATOM    473 1HB  ARG A  30       1.560   8.828  24.667  1.00  3.390          H  
ATOM    474 2HB  ARG A  30       1.497   9.869  26.082  1.00  3.390          H  
ATOM    475 1HG  ARG A  30       3.776  10.539  25.771  1.00  3.390          H  
ATOM    476 2HG  ARG A  30       4.018   9.335  24.495  1.00  3.390          H  
ATOM    477 1HD  ARG A  30       3.712  11.487  23.543  1.00  3.390          H  
ATOM    478 2HD  ARG A  30       2.340  10.447  23.147  1.00  3.390          H  
ATOM    479  HE  ARG A  30       0.932  11.801  24.372  1.00  3.390          H  
ATOM    480 1HH1 ARG A  30       4.268  12.828  24.960  1.00  3.390          H  
ATOM    481 2HH1 ARG A  30       3.788  14.305  25.757  1.00  3.390          H  
ATOM    482 1HH2 ARG A  30       0.351  13.711  25.409  1.00  3.390          H  
ATOM    483 2HH2 ARG A  30       1.571  14.810  26.011  1.00  3.390          H  
ATOM    484  N   ARG A  31       0.559   6.647  26.653  1.00  2.210          N  
ATOM    485  CA  ARG A  31      -0.634   6.069  27.263  1.00  2.410          C  
ATOM    486  C   ARG A  31      -0.346   4.876  28.196  1.00  2.040          C  
ATOM    487  O   ARG A  31      -1.291   4.246  28.677  1.00  2.140          O  
ATOM    488  CB  ARG A  31      -1.589   5.621  26.170  1.00  3.290          C  
ATOM    489  CG  ARG A  31      -2.175   6.745  25.328  1.00  3.290          C  
ATOM    490  CD  ARG A  31      -2.951   6.218  24.182  1.00  3.290          C  
ATOM    491  NE  ARG A  31      -3.464   7.292  23.338  1.00  3.290          N  
ATOM    492  CZ  ARG A  31      -4.214   7.123  22.226  1.00  3.290          C  
ATOM    493  NH1 ARG A  31      -4.553   5.913  21.822  1.00  3.290          N  
ATOM    494  NH2 ARG A  31      -4.613   8.183  21.540  1.00  3.290          N  
ATOM    495  H   ARG A  31       0.762   6.399  25.678  1.00  2.650          H  
ATOM    496  HA  ARG A  31      -1.119   6.848  27.849  1.00  2.890          H  
ATOM    497 1HB  ARG A  31      -1.064   4.947  25.497  1.00  3.950          H  
ATOM    498 2HB  ARG A  31      -2.416   5.067  26.609  1.00  3.950          H  
ATOM    499 1HG  ARG A  31      -2.852   7.331  25.946  1.00  3.950          H  
ATOM    500 2HG  ARG A  31      -1.388   7.392  24.957  1.00  3.950          H  
ATOM    501 1HD  ARG A  31      -2.298   5.586  23.575  1.00  3.950          H  
ATOM    502 2HD  ARG A  31      -3.793   5.635  24.553  1.00  3.950          H  
ATOM    503  HE  ARG A  31      -3.233   8.241  23.606  1.00  3.950          H  
ATOM    504 1HH1 ARG A  31      -4.258   5.103  22.344  1.00  3.950          H  
ATOM    505 2HH1 ARG A  31      -5.116   5.796  20.991  1.00  3.950          H  
ATOM    506 1HH2 ARG A  31      -4.355   9.111  21.848  1.00  3.950          H  
ATOM    507 2HH2 ARG A  31      -5.176   8.069  20.710  1.00  3.950          H  
ATOM    508  N   GLU A  32       0.942   4.587  28.454  1.00  1.860          N  
ATOM    509  CA  GLU A  32       1.434   3.485  29.293  1.00  1.980          C  
ATOM    510  C   GLU A  32       1.151   2.081  28.738  1.00  1.800          C  
ATOM    511  O   GLU A  32       0.874   1.144  29.489  1.00  2.120          O  
ATOM    512  CB  GLU A  32       0.850   3.573  30.718  1.00  2.720          C  
ATOM    513  CG  GLU A  32       1.197   4.848  31.493  1.00  2.720          C  
ATOM    514  CD  GLU A  32       0.641   4.830  32.903  1.00  2.720          C  
ATOM    515  OE1 GLU A  32      -0.218   4.021  33.156  1.00  2.720          O  
ATOM    516  OE2 GLU A  32       1.076   5.614  33.715  1.00  2.720          O  
ATOM    517  H   GLU A  32       1.673   5.152  28.013  1.00  2.230          H  
ATOM    518  HA  GLU A  32       2.516   3.594  29.366  1.00  2.380          H  
ATOM    519 1HB  GLU A  32      -0.228   3.468  30.700  1.00  3.270          H  
ATOM    520 2HB  GLU A  32       1.234   2.741  31.306  1.00  3.270          H  
ATOM    521 1HG  GLU A  32       2.279   4.956  31.535  1.00  3.270          H  
ATOM    522 2HG  GLU A  32       0.794   5.708  30.956  1.00  3.270          H  
ATOM    523  N   GLY A  33       1.274   1.940  27.420  1.00  1.410          N  
ATOM    524  CA  GLY A  33       1.141   0.686  26.703  1.00  1.300          C  
ATOM    525  C   GLY A  33       2.531   0.135  26.387  1.00  1.100          C  
ATOM    526  O   GLY A  33       3.483   0.346  27.143  1.00  1.180          O  
ATOM    527  H   GLY A  33       1.479   2.753  26.853  1.00  1.690          H  
ATOM    528 1HA  GLY A  33       0.578  -0.028  27.303  1.00  1.560          H  
ATOM    529 2HA  GLY A  33       0.589   0.855  25.778  1.00  1.560          H  
ATOM    530  N   ALA A  34       2.650  -0.602  25.285  1.00  1.180          N  
ATOM    531  CA  ALA A  34       3.921  -1.223  24.921  1.00  1.280          C  
ATOM    532  C   ALA A  34       3.988  -1.498  23.430  1.00  1.070          C  
ATOM    533  O   ALA A  34       2.941  -1.680  22.795  1.00  0.830          O  
ATOM    534  CB  ALA A  34       4.115  -2.518  25.691  1.00  1.750          C  
ATOM    535  H   ALA A  34       1.843  -0.735  24.694  1.00  1.420          H  
ATOM    536  HA  ALA A  34       4.726  -0.530  25.170  1.00  1.540          H  
ATOM    537 1HB  ALA A  34       5.074  -2.962  25.427  1.00  2.100          H  
ATOM    538 2HB  ALA A  34       4.095  -2.305  26.762  1.00  2.100          H  
ATOM    539 3HB  ALA A  34       3.318  -3.209  25.448  1.00  2.100          H  
ATOM    540  N   CYS A  35       5.228  -1.638  22.932  1.00  1.380          N  
ATOM    541  CA  CYS A  35       5.588  -1.885  21.530  1.00  1.380          C  
ATOM    542  C   CYS A  35       4.879  -3.060  20.874  1.00  1.310          C  
ATOM    543  O   CYS A  35       4.670  -3.085  19.659  1.00  1.260          O  
ATOM    544  CB  CYS A  35       7.078  -2.160  21.439  1.00  1.930          C  
ATOM    545  SG  CYS A  35       7.568  -3.669  22.320  1.00  1.930          S  
ATOM    546  H   CYS A  35       5.994  -1.478  23.574  1.00  1.660          H  
ATOM    547  HA  CYS A  35       5.381  -0.979  20.973  1.00  1.660          H  
ATOM    548 1HB  CYS A  35       7.367  -2.264  20.393  1.00  2.320          H  
ATOM    549 2HB  CYS A  35       7.633  -1.317  21.857  1.00  2.320          H  
ATOM    550  HG  CYS A  35       8.829  -3.674  21.893  1.00  2.320          H  
ATOM    551  N   VAL A  36       4.431  -4.010  21.664  1.00  1.500          N  
ATOM    552  CA  VAL A  36       3.779  -5.177  21.093  1.00  1.830          C  
ATOM    553  C   VAL A  36       2.504  -4.770  20.343  1.00  1.670          C  
ATOM    554  O   VAL A  36       2.138  -5.388  19.332  1.00  2.060          O  
ATOM    555  CB  VAL A  36       3.469  -6.198  22.210  1.00  2.430          C  
ATOM    556  CG1 VAL A  36       4.786  -6.648  22.844  1.00  2.430          C  
ATOM    557  CG2 VAL A  36       2.538  -5.584  23.274  1.00  2.430          C  
ATOM    558  H   VAL A  36       4.600  -3.924  22.653  1.00  1.800          H  
ATOM    559  HA  VAL A  36       4.464  -5.642  20.385  1.00  2.200          H  
ATOM    560  HB  VAL A  36       2.995  -7.078  21.772  1.00  2.920          H  
ATOM    561 1HG1 VAL A  36       4.586  -7.390  23.619  1.00  2.920          H  
ATOM    562 2HG1 VAL A  36       5.423  -7.088  22.076  1.00  2.920          H  
ATOM    563 3HG1 VAL A  36       5.295  -5.797  23.288  1.00  2.920          H  
ATOM    564 1HG2 VAL A  36       2.344  -6.323  24.048  1.00  2.920          H  
ATOM    565 2HG2 VAL A  36       3.004  -4.718  23.715  1.00  2.920          H  
ATOM    566 3HG2 VAL A  36       1.596  -5.296  22.831  1.00  2.920          H  
ATOM    567  N   ASN A  37       1.880  -3.670  20.781  1.00  1.280          N  
ATOM    568  CA  ASN A  37       0.661  -3.182  20.182  1.00  1.470          C  
ATOM    569  C   ASN A  37       0.948  -2.120  19.139  1.00  1.220          C  
ATOM    570  O   ASN A  37       0.039  -1.451  18.660  1.00  1.300          O  
ATOM    571  CB  ASN A  37      -0.282  -2.685  21.247  1.00  1.980          C  
ATOM    572  CG  ASN A  37      -0.836  -3.806  22.076  1.00  1.980          C  
ATOM    573  OD1 ASN A  37      -1.124  -4.906  21.586  1.00  1.980          O  
ATOM    574  ND2 ASN A  37      -0.989  -3.547  23.342  1.00  1.980          N  
ATOM    575  H   ASN A  37       2.245  -3.152  21.588  1.00  1.540          H  
ATOM    576  HA  ASN A  37       0.178  -4.011  19.667  1.00  1.760          H  
ATOM    577 1HB  ASN A  37       0.256  -2.007  21.909  1.00  2.380          H  
ATOM    578 2HB  ASN A  37      -1.104  -2.128  20.795  1.00  2.380          H  
ATOM    579 1HD2 ASN A  37      -1.354  -4.247  23.959  1.00  2.380          H  
ATOM    580 2HD2 ASN A  37      -0.738  -2.650  23.688  1.00  2.380          H  
ATOM    581  N   CYS A  38       2.213  -2.001  18.750  1.00  1.010          N  
ATOM    582  CA  CYS A  38       2.618  -1.086  17.709  1.00  0.810          C  
ATOM    583  C   CYS A  38       3.003  -1.970  16.541  1.00  0.790          C  
ATOM    584  O   CYS A  38       2.608  -1.703  15.405  1.00  0.750          O  
ATOM    585  CB  CYS A  38       3.831  -0.274  18.139  1.00  1.210          C  
ATOM    586  SG  CYS A  38       3.564   0.657  19.604  1.00  1.210          S  
ATOM    587  H   CYS A  38       2.934  -2.561  19.197  1.00  1.210          H  
ATOM    588  HA  CYS A  38       1.792  -0.431  17.438  1.00  0.970          H  
ATOM    589 1HB  CYS A  38       4.674  -0.937  18.310  1.00  1.460          H  
ATOM    590 2HB  CYS A  38       4.115   0.418  17.352  1.00  1.460          H  
ATOM    591  HG  CYS A  38       2.818  -0.273  20.206  1.00  1.460          H  
ATOM    592  N   GLU A  39       3.717  -3.072  16.828  1.00  0.910          N  
ATOM    593  CA  GLU A  39       4.114  -4.008  15.780  1.00  0.950          C  
ATOM    594  C   GLU A  39       2.900  -4.692  15.159  1.00  0.940          C  
ATOM    595  O   GLU A  39       2.811  -4.819  13.932  1.00  0.980          O  
ATOM    596  CB  GLU A  39       5.070  -5.067  16.336  1.00  1.310          C  
ATOM    597  CG  GLU A  39       6.464  -4.545  16.700  1.00  1.310          C  
ATOM    598  CD  GLU A  39       7.355  -5.605  17.306  1.00  1.310          C  
ATOM    599  OE1 GLU A  39       6.843  -6.619  17.725  1.00  1.310          O  
ATOM    600  OE2 GLU A  39       8.548  -5.405  17.335  1.00  1.310          O  
ATOM    601  H   GLU A  39       4.034  -3.227  17.787  1.00  1.090          H  
ATOM    602  HA  GLU A  39       4.623  -3.456  14.997  1.00  1.140          H  
ATOM    603 1HB  GLU A  39       4.632  -5.504  17.238  1.00  1.580          H  
ATOM    604 2HB  GLU A  39       5.186  -5.869  15.607  1.00  1.580          H  
ATOM    605 1HG  GLU A  39       6.940  -4.163  15.804  1.00  1.580          H  
ATOM    606 2HG  GLU A  39       6.355  -3.719  17.403  1.00  1.580          H  
ATOM    607  N   MET A  40       1.939  -5.104  15.997  1.00  0.970          N  
ATOM    608  CA  MET A  40       0.757  -5.765  15.467  1.00  1.050          C  
ATOM    609  C   MET A  40      -0.250  -4.766  14.945  1.00  0.970          C  
ATOM    610  O   MET A  40      -0.987  -5.058  13.999  1.00  0.990          O  
ATOM    611  CB  MET A  40       0.166  -6.694  16.512  1.00  1.440          C  
ATOM    612  CG  MET A  40       1.074  -7.890  16.856  1.00  1.440          C  
ATOM    613  SD  MET A  40       1.425  -8.982  15.419  1.00  1.440          S  
ATOM    614  CE  MET A  40       3.067  -8.476  14.844  1.00  1.440          C  
ATOM    615  H   MET A  40       2.072  -5.029  17.012  1.00  1.160          H  
ATOM    616  HA  MET A  40       1.051  -6.368  14.616  1.00  1.260          H  
ATOM    617 1HB  MET A  40      -0.008  -6.136  17.435  1.00  1.730          H  
ATOM    618 2HB  MET A  40      -0.795  -7.075  16.168  1.00  1.730          H  
ATOM    619 1HG  MET A  40       2.024  -7.512  17.242  1.00  1.730          H  
ATOM    620 2HG  MET A  40       0.606  -8.487  17.637  1.00  1.730          H  
ATOM    621 1HE  MET A  40       3.356  -9.092  13.995  1.00  1.730          H  
ATOM    622 2HE  MET A  40       3.062  -7.443  14.536  1.00  1.730          H  
ATOM    623 3HE  MET A  40       3.793  -8.606  15.648  1.00  1.730          H  
ATOM    624  N   HIS A  41      -0.291  -3.576  15.534  1.00  0.940          N  
ATOM    625  CA  HIS A  41      -1.224  -2.588  15.038  1.00  0.960          C  
ATOM    626  C   HIS A  41      -0.757  -2.252  13.618  1.00  0.860          C  
ATOM    627  O   HIS A  41      -1.565  -2.223  12.685  1.00  0.910          O  
ATOM    628  CB  HIS A  41      -1.344  -1.369  15.967  1.00  1.340          C  
ATOM    629  CG  HIS A  41      -2.402  -0.369  15.547  1.00  1.340          C  
ATOM    630  ND1 HIS A  41      -2.577   0.859  16.169  1.00  1.340          N  
ATOM    631  CD2 HIS A  41      -3.342  -0.434  14.583  1.00  1.340          C  
ATOM    632  CE1 HIS A  41      -3.562   1.510  15.568  1.00  1.340          C  
ATOM    633  NE2 HIS A  41      -4.038   0.741  14.602  1.00  1.340          N  
ATOM    634  H   HIS A  41       0.321  -3.369  16.310  1.00  1.130          H  
ATOM    635  HA  HIS A  41      -2.216  -3.024  14.963  1.00  1.150          H  
ATOM    636 1HB  HIS A  41      -1.623  -1.719  16.950  1.00  1.600          H  
ATOM    637 2HB  HIS A  41      -0.387  -0.871  16.054  1.00  1.600          H  
ATOM    638  HD2 HIS A  41      -3.526  -1.253  13.896  1.00  1.600          H  
ATOM    639  HE1 HIS A  41      -3.916   2.507  15.822  1.00  1.600          H  
ATOM    640  HE2 HIS A  41      -4.809   0.956  13.931  1.00  1.600          H  
ATOM    641  N   ALA A  42       0.553  -2.019  13.430  1.00  0.780          N  
ATOM    642  CA  ALA A  42       1.073  -1.725  12.105  1.00  0.740          C  
ATOM    643  C   ALA A  42       0.778  -2.865  11.145  1.00  0.760          C  
ATOM    644  O   ALA A  42       0.298  -2.623  10.047  1.00  0.820          O  
ATOM    645  CB  ALA A  42       2.563  -1.468  12.178  1.00  1.050          C  
ATOM    646  H   ALA A  42       1.205  -2.024  14.217  1.00  0.940          H  
ATOM    647  HA  ALA A  42       0.574  -0.841  11.719  1.00  0.890          H  
ATOM    648 1HB  ALA A  42       2.947  -1.235  11.193  1.00  1.260          H  
ATOM    649 2HB  ALA A  42       2.752  -0.634  12.855  1.00  1.260          H  
ATOM    650 3HB  ALA A  42       3.064  -2.359  12.560  1.00  1.260          H  
ATOM    651  N   LEU A  43       0.923  -4.128  11.559  1.00  0.760          N  
ATOM    652  CA  LEU A  43       0.609  -5.206  10.626  1.00  0.790          C  
ATOM    653  C   LEU A  43      -0.817  -5.009  10.096  1.00  0.800          C  
ATOM    654  O   LEU A  43      -1.066  -5.124   8.890  1.00  0.810          O  
ATOM    655  CB  LEU A  43       0.750  -6.580  11.314  1.00  1.090          C  
ATOM    656  CG  LEU A  43       0.656  -7.884  10.410  1.00  1.090          C  
ATOM    657  CD1 LEU A  43       1.442  -8.999  11.123  1.00  1.090          C  
ATOM    658  CD2 LEU A  43      -0.806  -8.341  10.183  1.00  1.090          C  
ATOM    659  H   LEU A  43       1.334  -4.345  12.474  1.00  0.910          H  
ATOM    660  HA  LEU A  43       1.302  -5.156   9.788  1.00  0.950          H  
ATOM    661 1HB  LEU A  43       1.711  -6.601  11.831  1.00  1.310          H  
ATOM    662 2HB  LEU A  43      -0.033  -6.655  12.074  1.00  1.310          H  
ATOM    663  HG  LEU A  43       1.119  -7.687   9.443  1.00  1.310          H  
ATOM    664 1HD1 LEU A  43       1.426  -9.901  10.532  1.00  1.310          H  
ATOM    665 2HD1 LEU A  43       2.475  -8.681  11.266  1.00  1.310          H  
ATOM    666 3HD1 LEU A  43       0.992  -9.200  12.094  1.00  1.310          H  
ATOM    667 1HD2 LEU A  43      -0.804  -9.244   9.572  1.00  1.310          H  
ATOM    668 2HD2 LEU A  43      -1.278  -8.551  11.143  1.00  1.310          H  
ATOM    669 3HD2 LEU A  43      -1.381  -7.584   9.667  1.00  1.310          H  
ATOM    670  N   ASN A  44      -1.767  -4.753  11.003  1.00  0.850          N  
ATOM    671  CA  ASN A  44      -3.157  -4.576  10.589  1.00  0.900          C  
ATOM    672  C   ASN A  44      -3.436  -3.290   9.781  1.00  0.880          C  
ATOM    673  O   ASN A  44      -4.205  -3.334   8.812  1.00  0.900          O  
ATOM    674  CB  ASN A  44      -4.044  -4.671  11.809  1.00  1.240          C  
ATOM    675  CG  ASN A  44      -4.173  -6.104  12.288  1.00  1.240          C  
ATOM    676  OD1 ASN A  44      -4.068  -7.055  11.500  1.00  1.240          O  
ATOM    677  ND2 ASN A  44      -4.395  -6.277  13.565  1.00  1.240          N  
ATOM    678  H   ASN A  44      -1.507  -4.720  11.998  1.00  1.020          H  
ATOM    679  HA  ASN A  44      -3.409  -5.409   9.936  1.00  1.080          H  
ATOM    680 1HB  ASN A  44      -3.616  -4.065  12.613  1.00  1.490          H  
ATOM    681 2HB  ASN A  44      -5.032  -4.273  11.582  1.00  1.490          H  
ATOM    682 1HD2 ASN A  44      -4.485  -7.202  13.935  1.00  1.490          H  
ATOM    683 2HD2 ASN A  44      -4.467  -5.488  14.174  1.00  1.490          H  
ATOM    684  N   GLU A  45      -2.806  -2.158  10.122  1.00  0.890          N  
ATOM    685  CA  GLU A  45      -3.051  -0.949   9.326  1.00  0.950          C  
ATOM    686  C   GLU A  45      -2.433  -1.096   7.950  1.00  0.930          C  
ATOM    687  O   GLU A  45      -2.973  -0.593   6.964  1.00  1.020          O  
ATOM    688  CB  GLU A  45      -2.528   0.317   9.993  1.00  1.310          C  
ATOM    689  CG  GLU A  45      -3.285   0.734  11.234  1.00  1.310          C  
ATOM    690  CD  GLU A  45      -4.755   1.070  11.052  1.00  1.310          C  
ATOM    691  OE1 GLU A  45      -5.140   1.366   9.951  1.00  1.310          O  
ATOM    692  OE2 GLU A  45      -5.485   1.079  12.042  1.00  1.310          O  
ATOM    693  H   GLU A  45      -2.208  -2.141  10.954  1.00  1.070          H  
ATOM    694  HA  GLU A  45      -4.128  -0.835   9.197  1.00  1.140          H  
ATOM    695 1HB  GLU A  45      -1.482   0.165  10.278  1.00  1.570          H  
ATOM    696 2HB  GLU A  45      -2.555   1.142   9.284  1.00  1.570          H  
ATOM    697 1HG  GLU A  45      -3.190  -0.070  11.926  1.00  1.570          H  
ATOM    698 2HG  GLU A  45      -2.826   1.579  11.637  1.00  1.570          H  
ATOM    699  N   ILE A  46      -1.302  -1.784   7.888  1.00  0.860          N  
ATOM    700  CA  ILE A  46      -0.612  -2.016   6.644  1.00  0.890          C  
ATOM    701  C   ILE A  46      -1.501  -2.935   5.811  1.00  0.850          C  
ATOM    702  O   ILE A  46      -1.676  -2.730   4.612  1.00  0.860          O  
ATOM    703  CB  ILE A  46       0.790  -2.529   6.867  1.00  1.230          C  
ATOM    704  CG1 ILE A  46       1.560  -1.408   7.558  1.00  1.230          C  
ATOM    705  CG2 ILE A  46       1.403  -2.797   5.491  1.00  1.230          C  
ATOM    706  CD1 ILE A  46       2.871  -1.794   8.154  1.00  1.230          C  
ATOM    707  H   ILE A  46      -0.896  -2.139   8.755  1.00  1.030          H  
ATOM    708  HA  ILE A  46      -0.510  -1.067   6.133  1.00  1.070          H  
ATOM    709  HB  ILE A  46       0.792  -3.414   7.502  1.00  1.480          H  
ATOM    710 1HG1 ILE A  46       1.701  -0.630   6.839  1.00  1.480          H  
ATOM    711 2HG1 ILE A  46       0.946  -1.004   8.355  1.00  1.480          H  
ATOM    712 1HG2 ILE A  46       2.426  -3.119   5.577  1.00  1.480          H  
ATOM    713 2HG2 ILE A  46       0.834  -3.574   4.986  1.00  1.480          H  
ATOM    714 3HG2 ILE A  46       1.370  -1.885   4.893  1.00  1.480          H  
ATOM    715 1HD1 ILE A  46       3.309  -0.930   8.616  1.00  1.480          H  
ATOM    716 2HD1 ILE A  46       2.708  -2.556   8.908  1.00  1.480          H  
ATOM    717 3HD1 ILE A  46       3.538  -2.172   7.398  1.00  1.480          H  
ATOM    718  N   GLN A  47      -2.090  -3.972   6.426  1.00  0.820          N  
ATOM    719  CA  GLN A  47      -3.020  -4.793   5.667  1.00  0.810          C  
ATOM    720  C   GLN A  47      -4.072  -3.914   4.988  1.00  0.880          C  
ATOM    721  O   GLN A  47      -4.375  -4.152   3.817  1.00  0.890          O  
ATOM    722  CB  GLN A  47      -3.707  -5.820   6.582  1.00  1.140          C  
ATOM    723  CG  GLN A  47      -4.767  -6.711   5.917  1.00  1.140          C  
ATOM    724  CD  GLN A  47      -4.279  -7.601   4.815  1.00  1.140          C  
ATOM    725  OE1 GLN A  47      -3.275  -8.333   4.937  1.00  1.140          O  
ATOM    726  NE2 GLN A  47      -5.012  -7.553   3.719  1.00  1.140          N  
ATOM    727  H   GLN A  47      -1.872  -4.204   7.397  1.00  0.980          H  
ATOM    728  HA  GLN A  47      -2.462  -5.322   4.898  1.00  0.970          H  
ATOM    729 1HB  GLN A  47      -2.965  -6.445   7.063  1.00  1.370          H  
ATOM    730 2HB  GLN A  47      -4.220  -5.293   7.371  1.00  1.370          H  
ATOM    731 1HG  GLN A  47      -5.198  -7.347   6.688  1.00  1.370          H  
ATOM    732 2HG  GLN A  47      -5.550  -6.070   5.503  1.00  1.370          H  
ATOM    733 1HE2 GLN A  47      -4.795  -8.112   2.930  1.00  1.370          H  
ATOM    734 2HE2 GLN A  47      -5.821  -6.933   3.663  1.00  1.370          H  
ATOM    735  N   GLU A  48      -4.612  -2.889   5.665  1.00  0.990          N  
ATOM    736  CA  GLU A  48      -5.587  -2.006   5.003  1.00  1.120          C  
ATOM    737  C   GLU A  48      -4.944  -1.206   3.841  1.00  1.150          C  
ATOM    738  O   GLU A  48      -5.544  -1.055   2.769  1.00  1.240          O  
ATOM    739  CB  GLU A  48      -6.237  -1.056   6.012  1.00  1.520          C  
ATOM    740  CG  GLU A  48      -7.183  -1.735   7.016  1.00  1.520          C  
ATOM    741  CD  GLU A  48      -8.416  -2.318   6.366  1.00  1.520          C  
ATOM    742  OE1 GLU A  48      -9.039  -1.624   5.601  1.00  1.520          O  
ATOM    743  OE2 GLU A  48      -8.729  -3.453   6.629  1.00  1.520          O  
ATOM    744  H   GLU A  48      -4.387  -2.782   6.664  1.00  1.190          H  
ATOM    745  HA  GLU A  48      -6.378  -2.633   4.587  1.00  1.340          H  
ATOM    746 1HB  GLU A  48      -5.464  -0.547   6.584  1.00  1.820          H  
ATOM    747 2HB  GLU A  48      -6.802  -0.292   5.481  1.00  1.820          H  
ATOM    748 1HG  GLU A  48      -6.636  -2.535   7.521  1.00  1.820          H  
ATOM    749 2HG  GLU A  48      -7.481  -1.007   7.770  1.00  1.820          H  
ATOM    750  N   VAL A  49      -3.693  -0.767   4.043  1.00  1.100          N  
ATOM    751  CA  VAL A  49      -2.900  -0.024   3.046  1.00  1.170          C  
ATOM    752  C   VAL A  49      -2.690  -0.842   1.769  1.00  1.090          C  
ATOM    753  O   VAL A  49      -2.706  -0.306   0.653  1.00  1.270          O  
ATOM    754  CB  VAL A  49      -1.529   0.398   3.656  1.00  1.610          C  
ATOM    755  CG1 VAL A  49      -0.594   0.930   2.636  1.00  1.610          C  
ATOM    756  CG2 VAL A  49      -1.754   1.493   4.690  1.00  1.610          C  
ATOM    757  H   VAL A  49      -3.312  -0.897   4.987  1.00  1.320          H  
ATOM    758  HA  VAL A  49      -3.451   0.880   2.786  1.00  1.400          H  
ATOM    759  HB  VAL A  49      -1.070  -0.452   4.095  1.00  1.930          H  
ATOM    760 1HG1 VAL A  49       0.346   1.212   3.121  1.00  1.930          H  
ATOM    761 2HG1 VAL A  49      -0.400   0.180   1.892  1.00  1.930          H  
ATOM    762 3HG1 VAL A  49      -1.055   1.779   2.191  1.00  1.930          H  
ATOM    763 1HG2 VAL A  49      -0.800   1.772   5.117  1.00  1.930          H  
ATOM    764 2HG2 VAL A  49      -2.204   2.358   4.206  1.00  1.930          H  
ATOM    765 3HG2 VAL A  49      -2.409   1.147   5.468  1.00  1.930          H  
ATOM    766  N   PHE A  50      -2.417  -2.123   1.941  1.00  0.890          N  
ATOM    767  CA  PHE A  50      -2.232  -3.046   0.834  1.00  0.880          C  
ATOM    768  C   PHE A  50      -3.577  -3.454   0.201  1.00  0.920          C  
ATOM    769  O   PHE A  50      -3.722  -3.424  -1.036  1.00  0.990          O  
ATOM    770  CB  PHE A  50      -1.493  -4.276   1.330  1.00  1.240          C  
ATOM    771  CG  PHE A  50      -0.084  -4.053   1.742  1.00  1.240          C  
ATOM    772  CD1 PHE A  50       0.590  -2.839   1.594  1.00  1.240          C  
ATOM    773  CD2 PHE A  50       0.589  -5.088   2.249  1.00  1.240          C  
ATOM    774  CE1 PHE A  50       1.896  -2.719   1.967  1.00  1.240          C  
ATOM    775  CE2 PHE A  50       1.872  -4.970   2.590  1.00  1.240          C  
ATOM    776  CZ  PHE A  50       2.541  -3.804   2.466  1.00  1.240          C  
ATOM    777  H   PHE A  50      -2.325  -2.456   2.904  1.00  1.070          H  
ATOM    778  HA  PHE A  50      -1.648  -2.562   0.058  1.00  1.060          H  
ATOM    779 1HB  PHE A  50      -2.033  -4.689   2.187  1.00  1.480          H  
ATOM    780 2HB  PHE A  50      -1.494  -5.028   0.574  1.00  1.480          H  
ATOM    781  HD1 PHE A  50       0.087  -1.986   1.195  1.00  1.480          H  
ATOM    782  HD2 PHE A  50       0.083  -6.048   2.366  1.00  1.480          H  
ATOM    783  HE1 PHE A  50       2.412  -1.772   1.863  1.00  1.480          H  
ATOM    784  HE2 PHE A  50       2.359  -5.818   2.952  1.00  1.480          H  
ATOM    785  HZ  PHE A  50       3.581  -3.751   2.769  1.00  1.480          H  
ATOM    786  N   THR A  51      -4.584  -3.746   1.048  1.00  0.940          N  
ATOM    787  CA  THR A  51      -5.924  -4.199   0.641  1.00  1.080          C  
ATOM    788  C   THR A  51      -6.521  -3.196  -0.323  1.00  1.180          C  
ATOM    789  O   THR A  51      -7.144  -3.566  -1.323  1.00  1.280          O  
ATOM    790  CB  THR A  51      -6.866  -4.415   1.854  1.00  1.460          C  
ATOM    791  OG1 THR A  51      -6.321  -5.441   2.700  1.00  1.460          O  
ATOM    792  CG2 THR A  51      -8.255  -4.842   1.393  1.00  1.460          C  
ATOM    793  H   THR A  51      -4.391  -3.731   2.042  1.00  1.130          H  
ATOM    794  HA  THR A  51      -5.819  -5.155   0.127  1.00  1.300          H  
ATOM    795  HB  THR A  51      -6.942  -3.489   2.420  1.00  1.750          H  
ATOM    796  HG1 THR A  51      -5.476  -5.103   3.052  1.00  1.750          H  
ATOM    797 1HG2 THR A  51      -8.887  -4.991   2.266  1.00  1.750          H  
ATOM    798 2HG2 THR A  51      -8.696  -4.075   0.759  1.00  1.750          H  
ATOM    799 3HG2 THR A  51      -8.177  -5.773   0.834  1.00  1.750          H  
ATOM    800  N   LEU A  52      -6.302  -1.916  -0.044  1.00  1.230          N  
ATOM    801  CA  LEU A  52      -6.763  -0.809  -0.866  1.00  1.390          C  
ATOM    802  C   LEU A  52      -6.494  -1.034  -2.360  1.00  1.360          C  
ATOM    803  O   LEU A  52      -7.280  -0.588  -3.201  1.00  1.500          O  
ATOM    804  CB  LEU A  52      -6.053   0.478  -0.408  1.00  1.880          C  
ATOM    805  CG  LEU A  52      -6.388   1.813  -1.142  1.00  1.880          C  
ATOM    806  CD1 LEU A  52      -7.862   2.168  -0.977  1.00  1.880          C  
ATOM    807  CD2 LEU A  52      -5.494   2.916  -0.565  1.00  1.880          C  
ATOM    808  H   LEU A  52      -5.822  -1.691   0.834  1.00  1.480          H  
ATOM    809  HA  LEU A  52      -7.835  -0.712  -0.714  1.00  1.670          H  
ATOM    810 1HB  LEU A  52      -6.255   0.619   0.654  1.00  2.260          H  
ATOM    811 2HB  LEU A  52      -4.980   0.316  -0.514  1.00  2.260          H  
ATOM    812  HG  LEU A  52      -6.183   1.707  -2.210  1.00  2.260          H  
ATOM    813 1HD1 LEU A  52      -8.065   3.104  -1.497  1.00  2.260          H  
ATOM    814 2HD1 LEU A  52      -8.485   1.385  -1.405  1.00  2.260          H  
ATOM    815 3HD1 LEU A  52      -8.094   2.282   0.081  1.00  2.260          H  
ATOM    816 1HD2 LEU A  52      -5.698   3.856  -1.078  1.00  2.260          H  
ATOM    817 2HD2 LEU A  52      -5.693   3.030   0.499  1.00  2.260          H  
ATOM    818 3HD2 LEU A  52      -4.448   2.645  -0.712  1.00  2.260          H  
ATOM    819  N   HIS A  53      -5.359  -1.660  -2.705  1.00  1.270          N  
ATOM    820  CA  HIS A  53      -4.978  -1.879  -4.091  1.00  1.370          C  
ATOM    821  C   HIS A  53      -4.975  -3.369  -4.474  1.00  1.410          C  
ATOM    822  O   HIS A  53      -4.349  -3.765  -5.460  1.00  1.630          O  
ATOM    823  CB  HIS A  53      -3.614  -1.253  -4.343  1.00  1.880          C  
ATOM    824  CG  HIS A  53      -3.631   0.232  -4.171  1.00  1.880          C  
ATOM    825  ND1 HIS A  53      -4.122   1.087  -5.133  1.00  1.880          N  
ATOM    826  CD2 HIS A  53      -3.250   1.008  -3.139  1.00  1.880          C  
ATOM    827  CE1 HIS A  53      -4.019   2.330  -4.704  1.00  1.880          C  
ATOM    828  NE2 HIS A  53      -3.484   2.312  -3.500  1.00  1.880          N  
ATOM    829  H   HIS A  53      -4.737  -2.048  -1.992  1.00  1.520          H  
ATOM    830  HA  HIS A  53      -5.695  -1.381  -4.741  1.00  1.640          H  
ATOM    831 1HB  HIS A  53      -2.887  -1.679  -3.647  1.00  2.250          H  
ATOM    832 2HB  HIS A  53      -3.284  -1.482  -5.353  1.00  2.250          H  
ATOM    833  HD1 HIS A  53      -4.633   0.823  -5.949  1.00  2.250          H  
ATOM    834  HD2 HIS A  53      -2.830   0.779  -2.166  1.00  2.250          H  
ATOM    835  HE1 HIS A  53      -4.349   3.160  -5.324  1.00  2.250          H  
ATOM    836  N   GLY A  54      -5.673  -4.191  -3.686  1.00  1.330          N  
ATOM    837  CA  GLY A  54      -5.804  -5.628  -3.930  1.00  1.470          C  
ATOM    838  C   GLY A  54      -4.712  -6.564  -3.380  1.00  1.450          C  
ATOM    839  O   GLY A  54      -4.714  -7.749  -3.720  1.00  1.680          O  
ATOM    840  H   GLY A  54      -6.169  -3.803  -2.883  1.00  1.600          H  
ATOM    841 1HA  GLY A  54      -6.762  -5.943  -3.514  1.00  1.760          H  
ATOM    842 2HA  GLY A  54      -5.884  -5.783  -5.004  1.00  1.760          H  
ATOM    843  N   MET A  55      -3.774  -6.074  -2.565  1.00  1.240          N  
ATOM    844  CA  MET A  55      -2.717  -6.943  -2.050  1.00  1.260          C  
ATOM    845  C   MET A  55      -2.932  -7.310  -0.588  1.00  1.190          C  
ATOM    846  O   MET A  55      -3.456  -6.508   0.173  1.00  1.390          O  
ATOM    847  CB  MET A  55      -1.372  -6.259  -2.218  1.00  1.760          C  
ATOM    848  CG  MET A  55      -0.975  -5.929  -3.648  1.00  1.760          C  
ATOM    849  SD  MET A  55      -0.695  -7.409  -4.662  1.00  1.760          S  
ATOM    850  CE  MET A  55       0.831  -8.105  -3.982  1.00  1.760          C  
ATOM    851  H   MET A  55      -3.783  -5.097  -2.259  1.00  1.490          H  
ATOM    852  HA  MET A  55      -2.715  -7.873  -2.620  1.00  1.510          H  
ATOM    853 1HB  MET A  55      -1.368  -5.325  -1.668  1.00  2.110          H  
ATOM    854 2HB  MET A  55      -0.637  -6.893  -1.796  1.00  2.110          H  
ATOM    855 1HG  MET A  55      -1.772  -5.342  -4.113  1.00  2.110          H  
ATOM    856 2HG  MET A  55      -0.067  -5.325  -3.653  1.00  2.110          H  
ATOM    857 1HE  MET A  55       1.094  -9.008  -4.532  1.00  2.110          H  
ATOM    858 2HE  MET A  55       1.642  -7.378  -4.077  1.00  2.110          H  
ATOM    859 3HE  MET A  55       0.696  -8.358  -2.938  1.00  2.110          H  
ATOM    860  N   LYS A  56      -2.509  -8.504  -0.177  1.00  1.210          N  
ATOM    861  CA  LYS A  56      -2.608  -8.897   1.237  1.00  1.210          C  
ATOM    862  C   LYS A  56      -1.232  -9.111   1.876  1.00  1.040          C  
ATOM    863  O   LYS A  56      -0.259  -9.362   1.184  1.00  1.140          O  
ATOM    864  CB  LYS A  56      -3.477 -10.145   1.364  1.00  1.690          C  
ATOM    865  CG  LYS A  56      -4.912  -9.916   0.873  1.00  1.690          C  
ATOM    866  CD  LYS A  56      -5.797 -11.128   1.065  1.00  1.690          C  
ATOM    867  CE  LYS A  56      -7.215 -10.834   0.568  1.00  1.690          C  
ATOM    868  NZ  LYS A  56      -8.115 -12.007   0.707  1.00  1.690          N  
ATOM    869  H   LYS A  56      -2.143  -9.176  -0.862  1.00  1.450          H  
ATOM    870  HA  LYS A  56      -3.085  -8.088   1.783  1.00  1.450          H  
ATOM    871 1HB  LYS A  56      -3.037 -10.964   0.806  1.00  2.030          H  
ATOM    872 2HB  LYS A  56      -3.524 -10.449   2.407  1.00  2.030          H  
ATOM    873 1HG  LYS A  56      -5.350  -9.066   1.378  1.00  2.030          H  
ATOM    874 2HG  LYS A  56      -4.878  -9.682  -0.192  1.00  2.030          H  
ATOM    875 1HD  LYS A  56      -5.386 -11.975   0.512  1.00  2.030          H  
ATOM    876 2HD  LYS A  56      -5.837 -11.385   2.122  1.00  2.030          H  
ATOM    877 1HE  LYS A  56      -7.625 -10.006   1.145  1.00  2.030          H  
ATOM    878 2HE  LYS A  56      -7.171 -10.546  -0.482  1.00  2.030          H  
ATOM    879 1HZ  LYS A  56      -9.036 -11.766   0.369  1.00  2.030          H  
ATOM    880 2HZ  LYS A  56      -7.748 -12.775   0.162  1.00  2.030          H  
ATOM    881 3HZ  LYS A  56      -8.174 -12.278   1.678  1.00  2.030          H  
ATOM    882  N   CYS A  57      -1.146  -9.119   3.212  1.00  0.970          N  
ATOM    883  CA  CYS A  57       0.156  -9.310   3.888  1.00  0.950          C  
ATOM    884  C   CYS A  57       0.886 -10.605   3.492  1.00  1.100          C  
ATOM    885  O   CYS A  57       2.118 -10.625   3.311  1.00  1.300          O  
ATOM    886  CB  CYS A  57      -0.025  -9.378   5.416  1.00  1.340          C  
ATOM    887  SG  CYS A  57      -0.512  -7.844   6.241  1.00  1.340          S  
ATOM    888  H   CYS A  57      -1.984  -8.939   3.770  1.00  1.160          H  
ATOM    889  HA  CYS A  57       0.791  -8.465   3.635  1.00  1.140          H  
ATOM    890 1HB  CYS A  57      -0.786 -10.120   5.648  1.00  1.610          H  
ATOM    891 2HB  CYS A  57       0.903  -9.722   5.870  1.00  1.610          H  
ATOM    892  HG  CYS A  57      -1.791  -7.859   5.807  1.00  1.610          H  
ATOM    893  N   SER A  58       0.115 -11.668   3.290  1.00  1.230          N  
ATOM    894  CA  SER A  58       0.651 -12.968   2.921  1.00  1.550          C  
ATOM    895  C   SER A  58       1.238 -12.989   1.505  1.00  1.830          C  
ATOM    896  O   SER A  58       2.067 -13.836   1.181  1.00  2.190          O  
ATOM    897  CB  SER A  58      -0.436 -14.006   3.045  1.00  2.040          C  
ATOM    898  OG  SER A  58      -1.450 -13.778   2.108  1.00  2.040          O  
ATOM    899  H   SER A  58      -0.884 -11.575   3.416  1.00  1.480          H  
ATOM    900  HA  SER A  58       1.445 -13.219   3.627  1.00  1.860          H  
ATOM    901 1HB  SER A  58      -0.008 -14.987   2.897  1.00  2.450          H  
ATOM    902 2HB  SER A  58      -0.844 -13.991   4.038  1.00  2.450          H  
ATOM    903  HG  SER A  58      -2.135 -14.429   2.289  1.00  2.450          H  
ATOM    904  N   HIS A  59       0.892 -12.010   0.675  1.00  1.800          N  
ATOM    905  CA  HIS A  59       1.345 -11.949  -0.711  1.00  2.170          C  
ATOM    906  C   HIS A  59       2.766 -11.458  -0.806  1.00  2.240          C  
ATOM    907  O   HIS A  59       3.403 -11.554  -1.855  1.00  2.590          O  
ATOM    908  CB  HIS A  59       0.423 -11.048  -1.524  1.00  2.890          C  
ATOM    909  CG  HIS A  59      -0.936 -11.622  -1.653  1.00  2.890          C  
ATOM    910  ND1 HIS A  59      -2.042 -10.864  -1.925  1.00  2.890          N  
ATOM    911  CD2 HIS A  59      -1.365 -12.898  -1.541  1.00  2.890          C  
ATOM    912  CE1 HIS A  59      -3.116 -11.667  -1.991  1.00  2.890          C  
ATOM    913  NE2 HIS A  59      -2.724 -12.909  -1.748  1.00  2.890          N  
ATOM    914  H   HIS A  59       0.274 -11.266   0.998  1.00  2.160          H  
ATOM    915  HA  HIS A  59       1.328 -12.944  -1.148  1.00  2.600          H  
ATOM    916 1HB  HIS A  59       0.359 -10.068  -1.062  1.00  3.470          H  
ATOM    917 2HB  HIS A  59       0.837 -10.912  -2.521  1.00  3.470          H  
ATOM    918  HD2 HIS A  59      -0.746 -13.754  -1.324  1.00  3.470          H  
ATOM    919  HE1 HIS A  59      -4.138 -11.349  -2.192  1.00  3.470          H  
ATOM    920  HE2 HIS A  59      -3.326 -13.775  -1.709  1.00  3.470          H  
ATOM    921  N   PHE A  60       3.262 -10.912   0.293  1.00  2.020          N  
ATOM    922  CA  PHE A  60       4.599 -10.385   0.357  1.00  2.190          C  
ATOM    923  C   PHE A  60       5.421 -11.318   1.232  1.00  2.300          C  
ATOM    924  O   PHE A  60       6.560 -11.016   1.588  1.00  2.810          O  
ATOM    925  CB  PHE A  60       4.528  -9.013   0.983  1.00  3.000          C  
ATOM    926  CG  PHE A  60       3.669  -8.076   0.212  1.00  3.000          C  
ATOM    927  CD1 PHE A  60       2.370  -7.894   0.593  1.00  3.000          C  
ATOM    928  CD2 PHE A  60       4.123  -7.383  -0.885  1.00  3.000          C  
ATOM    929  CE1 PHE A  60       1.553  -7.048  -0.085  1.00  3.000          C  
ATOM    930  CE2 PHE A  60       3.283  -6.526  -1.547  1.00  3.000          C  
ATOM    931  CZ  PHE A  60       2.014  -6.359  -1.143  1.00  3.000          C  
ATOM    932  H   PHE A  60       2.706 -10.869   1.152  1.00  2.420          H  
ATOM    933  HA  PHE A  60       5.031 -10.342  -0.642  1.00  2.630          H  
ATOM    934 1HB  PHE A  60       4.105  -9.133   1.969  1.00  3.600          H  
ATOM    935 2HB  PHE A  60       5.502  -8.581   1.092  1.00  3.600          H  
ATOM    936  HD1 PHE A  60       1.986  -8.439   1.449  1.00  3.600          H  
ATOM    937  HD2 PHE A  60       5.146  -7.503  -1.229  1.00  3.600          H  
ATOM    938  HE1 PHE A  60       0.523  -6.932   0.234  1.00  3.600          H  
ATOM    939  HE2 PHE A  60       3.629  -5.978  -2.394  1.00  3.600          H  
ATOM    940  HZ  PHE A  60       1.368  -5.677  -1.676  1.00  3.600          H  
ATOM    941  N   LYS A  61       4.799 -12.441   1.615  1.00  2.160          N  
ATOM    942  CA  LYS A  61       5.367 -13.440   2.495  1.00  2.230          C  
ATOM    943  C   LYS A  61       5.885 -12.810   3.783  1.00  2.060          C  
ATOM    944  O   LYS A  61       6.993 -13.098   4.227  1.00  2.400          O  
ATOM    945  CB  LYS A  61       6.439 -14.252   1.751  1.00  3.090          C  
ATOM    946  CG  LYS A  61       7.017 -15.472   2.507  1.00  3.090          C  
ATOM    947  CD  LYS A  61       7.947 -16.272   1.615  1.00  3.090          C  
ATOM    948  CE  LYS A  61       8.531 -17.463   2.357  1.00  3.090          C  
ATOM    949  NZ  LYS A  61       9.455 -18.260   1.497  1.00  3.090          N  
ATOM    950  H   LYS A  61       3.867 -12.654   1.257  1.00  2.590          H  
ATOM    951  HA  LYS A  61       4.569 -14.121   2.785  1.00  2.680          H  
ATOM    952 1HB  LYS A  61       6.022 -14.612   0.812  1.00  3.710          H  
ATOM    953 2HB  LYS A  61       7.274 -13.596   1.504  1.00  3.710          H  
ATOM    954 1HG  LYS A  61       7.595 -15.175   3.370  1.00  3.710          H  
ATOM    955 2HG  LYS A  61       6.205 -16.108   2.847  1.00  3.710          H  
ATOM    956 1HD  LYS A  61       7.392 -16.632   0.747  1.00  3.710          H  
ATOM    957 2HD  LYS A  61       8.758 -15.631   1.269  1.00  3.710          H  
ATOM    958 1HE  LYS A  61       9.078 -17.104   3.228  1.00  3.710          H  
ATOM    959 2HE  LYS A  61       7.716 -18.106   2.692  1.00  3.710          H  
ATOM    960 1HZ  LYS A  61       9.820 -19.041   2.028  1.00  3.710          H  
ATOM    961 2HZ  LYS A  61       8.954 -18.608   0.691  1.00  3.710          H  
ATOM    962 3HZ  LYS A  61      10.221 -17.677   1.190  1.00  3.710          H  
ATOM    963  N   LEU A  62       5.077 -11.960   4.413  1.00  1.860          N  
ATOM    964  CA  LEU A  62       5.502 -11.343   5.656  1.00  2.070          C  
ATOM    965  C   LEU A  62       5.863 -12.413   6.706  1.00  2.100          C  
ATOM    966  O   LEU A  62       5.025 -13.247   7.024  1.00  2.000          O  
ATOM    967  CB  LEU A  62       4.325 -10.489   6.172  1.00  2.810          C  
ATOM    968  CG  LEU A  62       4.471  -9.784   7.521  1.00  2.810          C  
ATOM    969  CD1 LEU A  62       5.523  -8.735   7.496  1.00  2.810          C  
ATOM    970  CD2 LEU A  62       3.154  -9.171   7.886  1.00  2.810          C  
ATOM    971  H   LEU A  62       4.162 -11.718   4.017  1.00  2.230          H  
ATOM    972  HA  LEU A  62       6.334 -10.689   5.430  1.00  2.480          H  
ATOM    973 1HB  LEU A  62       4.118  -9.717   5.425  1.00  3.380          H  
ATOM    974 2HB  LEU A  62       3.453 -11.128   6.222  1.00  3.380          H  
ATOM    975  HG  LEU A  62       4.726 -10.493   8.244  1.00  3.380          H  
ATOM    976 1HD1 LEU A  62       5.585  -8.256   8.478  1.00  3.380          H  
ATOM    977 2HD1 LEU A  62       6.464  -9.139   7.253  1.00  3.380          H  
ATOM    978 3HD1 LEU A  62       5.269  -8.026   6.779  1.00  3.380          H  
ATOM    979 1HD2 LEU A  62       3.243  -8.685   8.848  1.00  3.380          H  
ATOM    980 2HD2 LEU A  62       2.885  -8.471   7.166  1.00  3.380          H  
ATOM    981 3HD2 LEU A  62       2.406  -9.906   7.928  1.00  3.380          H  
ATOM    982  N   PRO A  63       7.075 -12.409   7.318  1.00  2.540          N  
ATOM    983  CA  PRO A  63       7.500 -13.351   8.360  1.00  2.780          C  
ATOM    984  C   PRO A  63       6.619 -13.335   9.608  1.00  2.790          C  
ATOM    985  O   PRO A  63       6.560 -14.306  10.359  1.00  3.160          O  
ATOM    986  CB  PRO A  63       8.919 -12.865   8.693  1.00  4.170          C  
ATOM    987  CG  PRO A  63       9.398 -12.179   7.434  1.00  4.170          C  
ATOM    988  CD  PRO A  63       8.173 -11.514   6.852  1.00  4.170          C  
ATOM    989  HA  PRO A  63       7.523 -14.362   7.929  1.00  3.340          H  
ATOM    990 1HB  PRO A  63       8.888 -12.183   9.569  1.00  5.000          H  
ATOM    991 2HB  PRO A  63       9.547 -13.718   8.982  1.00  5.000          H  
ATOM    992 1HG  PRO A  63      10.200 -11.461   7.671  1.00  5.000          H  
ATOM    993 2HG  PRO A  63       9.833 -12.922   6.748  1.00  5.000          H  
ATOM    994 1HD  PRO A  63       8.096 -10.518   7.263  1.00  5.000          H  
ATOM    995 2HD  PRO A  63       8.277 -11.526   5.752  1.00  5.000          H  
ATOM    996  N   ASP A  64       5.908 -12.238   9.796  1.00  2.950          N  
ATOM    997  CA  ASP A  64       5.039 -12.043  10.943  1.00  3.280          C  
ATOM    998  C   ASP A  64       3.635 -12.617  10.706  1.00  3.190          C  
ATOM    999  O   ASP A  64       2.802 -12.621  11.616  1.00  3.560          O  
ATOM   1000  CB  ASP A  64       4.860 -10.548  11.221  1.00  4.460          C  
ATOM   1001  CG  ASP A  64       6.128  -9.762  11.556  1.00  4.460          C  
ATOM   1002  OD1 ASP A  64       7.080 -10.308  12.044  1.00  4.460          O  
ATOM   1003  OD2 ASP A  64       6.119  -8.563  11.273  1.00  4.460          O  
ATOM   1004  H   ASP A  64       6.029 -11.485   9.141  1.00  3.540          H  
ATOM   1005  HA  ASP A  64       5.481 -12.537  11.811  1.00  3.940          H  
ATOM   1006 1HB  ASP A  64       4.372 -10.085  10.404  1.00  5.350          H  
ATOM   1007 2HB  ASP A  64       4.195 -10.455  12.070  1.00  5.350          H  
ATOM   1008  N   TYR A  65       3.341 -13.038   9.471  1.00  3.010          N  
ATOM   1009  CA  TYR A  65       2.009 -13.514   9.126  1.00  3.160          C  
ATOM   1010  C   TYR A  65       2.125 -14.778   8.253  1.00  3.210          C  
ATOM   1011  O   TYR A  65       2.383 -14.671   7.056  1.00  3.530          O  
ATOM   1012  CB  TYR A  65       1.309 -12.387   8.384  1.00  4.360          C  
ATOM   1013  CG  TYR A  65      -0.115 -12.531   8.095  1.00  4.360          C  
ATOM   1014  CD1 TYR A  65      -1.023 -12.316   9.106  1.00  4.360          C  
ATOM   1015  CD2 TYR A  65      -0.535 -12.835   6.827  1.00  4.360          C  
ATOM   1016  CE1 TYR A  65      -2.364 -12.412   8.850  1.00  4.360          C  
ATOM   1017  CE2 TYR A  65      -1.881 -12.927   6.566  1.00  4.360          C  
ATOM   1018  CZ  TYR A  65      -2.792 -12.716   7.571  1.00  4.360          C  
ATOM   1019  OH  TYR A  65      -4.135 -12.806   7.309  1.00  4.360          O  
ATOM   1020  H   TYR A  65       4.066 -13.064   8.747  1.00  3.610          H  
ATOM   1021  HA  TYR A  65       1.454 -13.707  10.032  1.00  3.790          H  
ATOM   1022 1HB  TYR A  65       1.413 -11.506   8.975  1.00  5.240          H  
ATOM   1023 2HB  TYR A  65       1.820 -12.216   7.446  1.00  5.240          H  
ATOM   1024  HD1 TYR A  65      -0.675 -12.067  10.111  1.00  5.240          H  
ATOM   1025  HD2 TYR A  65       0.198 -12.993   6.038  1.00  5.240          H  
ATOM   1026  HE1 TYR A  65      -3.087 -12.240   9.648  1.00  5.240          H  
ATOM   1027  HE2 TYR A  65      -2.233 -13.160   5.570  1.00  5.240          H  
ATOM   1028  HH  TYR A  65      -4.631 -12.639   8.113  1.00  5.240          H  
ATOM   1029  N   PRO A  66       1.825 -15.983   8.780  1.00  3.490          N  
ATOM   1030  CA  PRO A  66       1.967 -17.260   8.093  1.00  3.950          C  
ATOM   1031  C   PRO A  66       1.212 -17.281   6.780  1.00  4.120          C  
ATOM   1032  O   PRO A  66       0.088 -16.788   6.715  1.00  4.180          O  
ATOM   1033  CB  PRO A  66       1.344 -18.244   9.087  1.00  5.930          C  
ATOM   1034  CG  PRO A  66       1.536 -17.589  10.435  1.00  5.930          C  
ATOM   1035  CD  PRO A  66       1.364 -16.104  10.177  1.00  5.930          C  
ATOM   1036  HA  PRO A  66       3.033 -17.469   7.934  1.00  4.740          H  
ATOM   1037 1HB  PRO A  66       0.284 -18.412   8.828  1.00  7.110          H  
ATOM   1038 2HB  PRO A  66       1.841 -19.221   9.006  1.00  7.110          H  
ATOM   1039 1HG  PRO A  66       0.804 -17.988  11.156  1.00  7.110          H  
ATOM   1040 2HG  PRO A  66       2.531 -17.830  10.833  1.00  7.110          H  
ATOM   1041 1HD  PRO A  66       0.309 -15.799  10.269  1.00  7.110          H  
ATOM   1042 2HD  PRO A  66       2.032 -15.571  10.872  1.00  7.110          H  
ATOM   1043  N   LEU A  67       1.796 -17.917   5.767  1.00  4.730          N  
ATOM   1044  CA  LEU A  67       1.142 -17.989   4.475  1.00  5.420          C  
ATOM   1045  C   LEU A  67      -0.165 -18.736   4.583  1.00  5.630          C  
ATOM   1046  O   LEU A  67      -0.304 -19.699   5.340  1.00  6.090          O  
ATOM   1047  CB  LEU A  67       2.039 -18.666   3.429  1.00  7.310          C  
ATOM   1048  CG  LEU A  67       3.334 -17.903   2.999  1.00  7.310          C  
ATOM   1049  CD1 LEU A  67       4.157 -18.800   2.086  1.00  7.310          C  
ATOM   1050  CD2 LEU A  67       2.971 -16.611   2.256  1.00  7.310          C  
ATOM   1051  H   LEU A  67       2.710 -18.325   5.890  1.00  5.680          H  
ATOM   1052  HA  LEU A  67       0.907 -16.980   4.153  1.00  6.500          H  
ATOM   1053 1HB  LEU A  67       2.343 -19.635   3.816  1.00  8.770          H  
ATOM   1054 2HB  LEU A  67       1.441 -18.835   2.529  1.00  8.770          H  
ATOM   1055  HG  LEU A  67       3.931 -17.663   3.877  1.00  8.770          H  
ATOM   1056 1HD1 LEU A  67       5.065 -18.280   1.788  1.00  8.770          H  
ATOM   1057 2HD1 LEU A  67       4.423 -19.715   2.616  1.00  8.770          H  
ATOM   1058 3HD1 LEU A  67       3.575 -19.050   1.200  1.00  8.770          H  
ATOM   1059 1HD2 LEU A  67       3.878 -16.115   1.947  1.00  8.770          H  
ATOM   1060 2HD2 LEU A  67       2.383 -16.848   1.369  1.00  8.770          H  
ATOM   1061 3HD2 LEU A  67       2.405 -15.938   2.889  1.00  8.770          H  
ATOM   1062  N   LEU A  68      -1.117 -18.263   3.811  1.00  5.610          N  
ATOM   1063  CA  LEU A  68      -2.467 -18.772   3.748  1.00  6.060          C  
ATOM   1064  C   LEU A  68      -2.701 -19.552   2.469  1.00  6.020          C  
ATOM   1065  O   LEU A  68      -2.008 -19.348   1.477  1.00  6.260          O  
ATOM   1066  CB  LEU A  68      -3.428 -17.584   3.771  1.00  8.300          C  
ATOM   1067  CG  LEU A  68      -3.247 -16.574   4.932  1.00  8.300          C  
ATOM   1068  CD1 LEU A  68      -4.236 -15.449   4.719  1.00  8.300          C  
ATOM   1069  CD2 LEU A  68      -3.433 -17.241   6.283  1.00  8.300          C  
ATOM   1070  H   LEU A  68      -0.875 -17.480   3.228  1.00  6.730          H  
ATOM   1071  HA  LEU A  68      -2.639 -19.435   4.593  1.00  7.270          H  
ATOM   1072 1HB  LEU A  68      -3.324 -17.036   2.839  1.00  9.960          H  
ATOM   1073 2HB  LEU A  68      -4.445 -17.965   3.833  1.00  9.960          H  
ATOM   1074  HG  LEU A  68      -2.239 -16.150   4.898  1.00  9.960          H  
ATOM   1075 1HD1 LEU A  68      -4.118 -14.712   5.507  1.00  9.960          H  
ATOM   1076 2HD1 LEU A  68      -4.053 -14.978   3.754  1.00  9.960          H  
ATOM   1077 3HD1 LEU A  68      -5.249 -15.842   4.744  1.00  9.960          H  
ATOM   1078 1HD2 LEU A  68      -3.295 -16.496   7.069  1.00  9.960          H  
ATOM   1079 2HD2 LEU A  68      -4.430 -17.666   6.356  1.00  9.960          H  
ATOM   1080 3HD2 LEU A  68      -2.688 -18.030   6.415  1.00  9.960          H  
ATOM   1081  N   MET A  69      -3.760 -20.358   2.443  1.00  6.070          N  
ATOM   1082  CA  MET A  69      -4.150 -21.078   1.220  1.00  6.330          C  
ATOM   1083  C   MET A  69      -4.550 -20.106   0.102  1.00  6.180          C  
ATOM   1084  O   MET A  69      -4.566 -20.458  -1.077  1.00  6.330          O  
ATOM   1085  CB  MET A  69      -5.304 -22.034   1.510  1.00  8.760          C  
ATOM   1086  CG  MET A  69      -4.938 -23.243   2.378  1.00  8.760          C  
ATOM   1087  SD  MET A  69      -3.619 -24.276   1.669  1.00  8.760          S  
ATOM   1088  CE  MET A  69      -4.389 -24.952   0.192  1.00  8.760          C  
ATOM   1089  H   MET A  69      -4.291 -20.497   3.291  1.00  7.280          H  
ATOM   1090  HA  MET A  69      -3.293 -21.648   0.867  1.00  7.600          H  
ATOM   1091 1HB  MET A  69      -6.090 -21.489   2.032  1.00 10.510          H  
ATOM   1092 2HB  MET A  69      -5.736 -22.382   0.577  1.00 10.510          H  
ATOM   1093 1HG  MET A  69      -4.608 -22.901   3.355  1.00 10.510          H  
ATOM   1094 2HG  MET A  69      -5.820 -23.867   2.519  1.00 10.510          H  
ATOM   1095 1HE  MET A  69      -3.682 -25.607  -0.316  1.00 10.510          H  
ATOM   1096 2HE  MET A  69      -5.276 -25.523   0.471  1.00 10.510          H  
ATOM   1097 3HE  MET A  69      -4.672 -24.145  -0.483  1.00 10.510          H  
ATOM   1098  N   ASN A  70      -4.887 -18.887   0.506  1.00  6.260          N  
ATOM   1099  CA  ASN A  70      -5.312 -17.795  -0.358  1.00  6.490          C  
ATOM   1100  C   ASN A  70      -4.171 -16.797  -0.642  1.00  6.530          C  
ATOM   1101  O   ASN A  70      -4.427 -15.663  -1.091  1.00  6.960          O  
ATOM   1102  CB  ASN A  70      -6.479 -17.086   0.293  1.00  8.990          C  
ATOM   1103  CG  ASN A  70      -7.709 -17.955   0.379  1.00  8.990          C  
ATOM   1104  OD1 ASN A  70      -8.052 -18.689  -0.556  1.00  8.990          O  
ATOM   1105  ND2 ASN A  70      -8.384 -17.887   1.503  1.00  8.990          N  
ATOM   1106  H   ASN A  70      -4.834 -18.718   1.497  1.00  7.510          H  
ATOM   1107  HA  ASN A  70      -5.627 -18.213  -1.315  1.00  7.790          H  
ATOM   1108 1HB  ASN A  70      -6.193 -16.776   1.299  1.00 10.790          H  
ATOM   1109 2HB  ASN A  70      -6.721 -16.186  -0.272  1.00 10.790          H  
ATOM   1110 1HD2 ASN A  70      -9.210 -18.440   1.624  1.00 10.790          H  
ATOM   1111 2HD2 ASN A  70      -8.079 -17.283   2.240  1.00 10.790          H  
ATOM   1112  N   ALA A  71      -2.931 -17.204  -0.331  1.00  6.450          N  
ATOM   1113  CA  ALA A  71      -1.761 -16.370  -0.537  1.00  6.910          C  
ATOM   1114  C   ALA A  71      -1.136 -16.618  -1.911  1.00  7.380          C  
ATOM   1115  O   ALA A  71      -1.699 -16.260  -2.948  1.00  7.840          O  
ATOM   1116  OXT ALA A  71      -0.095 -17.271  -1.983  1.00 10.370          O  
ATOM   1117  CB  ALA A  71      -0.730 -16.625   0.548  1.00  9.050          C  
ATOM   1118  H   ALA A  71      -2.777 -18.134   0.066  1.00  7.740          H  
ATOM   1119  HA  ALA A  71      -2.082 -15.341  -0.475  1.00  8.290          H  
ATOM   1120 1HB  ALA A  71       0.124 -15.962   0.399  1.00 10.860          H  
ATOM   1121 2HB  ALA A  71      -1.181 -16.433   1.501  1.00 10.860          H  
ATOM   1122 3HB  ALA A  71      -0.400 -17.663   0.501  1.00 10.860          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 -398.114 42.4919 289.742 -25.6513 7.29666 18.3873 146.27 -159.319 -0.41026 -2.31345 -122.708 -14.9686 -51.6685 -3.93045 -6.9459 -4.13009 0 -0.48091 5.56318 31.067 71.3597 -11.803 4.17219 0.75494 -8.40267 42.3176 -151.423
CYS:NtermProteinFull_1 -6.08116 0.50864 2.53278 -0.06414 0.01076 0.02172 1.47859 -1.62233 -0 -0 -0.61019 0.57703 0 0 0 0 0 0.128 0.10946 0.35069 0 0 0 3.6196 0 0.21509 1.17454
VAL_2 -3.19713 0.46755 0.72055 -0.32552 0.26661 0.07598 0.81957 -0.92974 -0 -0 0.15662 -0.19776 0 0 0 0 0 -0.00241 0.02133 0.19742 0 -0.11276 0 1.9342 -0.09087 0.66449 0.46814
PHE_3 -6.92263 0.83162 2.07157 -0.66912 0.06393 0.39147 0.89428 -1.78276 -0 -0 -0.54341 0.05577 0 0 -0.64456 0 0 -0.01026 0.0303 0 1.95223 -0.25704 0 1.0402 -0.17574 0.90144 -2.77271
GLY_4 -2.63014 0.29827 2.24792 -0.00098 0 0 1.19257 -1.23931 -0 -0 -0.19397 -0.31204 0 0 0 0 0 -0.12291 0 0 0 -1.43241 0 0.83697 0.16282 0.67984 -0.51337
CYS_5 -4.05885 0.48268 2.82436 -0.07128 0.00225 0.05233 1.75728 -1.5347 -0 -0 -0.56727 -0.33001 0 0 0 0 0 -0.0358 0.03026 0.4732 0 0.09755 0 3.6196 -0.04689 1.03564 3.73035
PRO_6 -4.02049 0.70354 1.1932 -0.08401 3e-05 0.05196 0.74468 -0.73405 -0 -0 -0.09489 0.67719 0 0 0 0 0 -0.10278 0.01134 0.57677 0 -0.36677 0 -2.4119 -0.53384 1.21238 -3.17763
SER_7 -2.22481 0.27312 2.13989 -0.02809 0 0.04569 1.09555 -1.0806 -0 -0 -0.62389 -1.16711 0 0 0 0 0 -0.03268 0.00363 0.3974 0 -0.08775 0.60564 -0.77834 -0.36812 0.51799 -1.31248
ALA_8 -4.21792 0.37515 3.67763 -0.03028 0.01011 0 2.68438 -2.1208 -0.01564 -0.0966 -1.51922 -0.525 0 0 0 0 0 0.18953 0 0 0 -0.07774 0 1.8394 0.03679 0.37348 0.58326
ALA_9 -4.13652 0.40891 3.10449 -0.02236 0 0 1.92656 -1.95541 -0 -0 -1.69685 -0.36118 0 0 0 0 0 -0.06092 0 0 0 -0.40723 0 1.8394 -0.09159 0.60538 -0.84732
ASP_10 -2.94839 0.19738 3.92609 -0.11011 0.00129 0.33235 1.3253 -1.84719 -0 -0 -0.59564 -0.5907 0 0 0 0 0 0.03287 0.01131 0 2.37127 -0.16783 0 -2.3716 -0.34611 0.43398 -0.34573
LYS_11 -3.69024 0.17525 4.06552 -0.29951 0.02587 0.1308 1.61763 -1.96229 -0 -0 -0.80374 -0.02936 0 0 0 0 0 -0.01536 0.00667 1.77206 0 -0.01089 0 -1.5107 -0.27544 0.21605 -0.58767
LEU_12 -10.4164 1.50635 5.00462 -0.67966 0.22264 0.2023 3.06784 -3.61698 -0.00294 -0.02123 -2.9105 0.22562 0 0 0 0 0 0.01539 0.14328 0.74752 0 -0.1636 0 0.18072 -0.03664 0.55637 -5.9753
TRP_13 -12.1275 2.30186 4.63518 -1.21199 0.13088 0.36842 3.17822 -3.42029 -0.01564 -0.0966 -2.17902 -0.53669 0 0 0 0 0 0.00252 0.68403 0 1.99137 -0.00043 0 1.6906 0.02017 1.06421 -3.52073
ASP_14 -3.95583 0.12056 5.44713 -0.10773 0.01007 0.3287 2.20472 -2.47032 -0 -0 -2.49036 -0.30317 0 0 0 0 0 -0.03856 0.02233 0 1.70964 0.23624 0 -2.3716 -0.25026 0.80011 -1.10834
GLU_15 -4.82267 0.19026 5.43447 -0.46019 0.07501 0.91513 2.2803 -2.4954 -0 -0 -2.06622 -0.41901 0 0 0 0 0 -0.0026 0.00514 0 3.15638 -0.31279 0 -2.7348 -0.29786 0.38866 -1.16618
ASN_16 -9.45323 1.29328 7.09636 -0.18447 0.00287 0.22951 3.78241 -3.95411 -3e-05 -0.00021 -3.8438 -0.30858 0 0 -0.64456 0 0 0.062 0.00949 0 2.93598 0.44325 0 -0.93687 0.03556 0.7006 -2.73455
LYS_17 -7.3751 0.72439 6.5694 -0.42869 0.108 0.14465 3.50399 -3.2233 -0.02498 -0.12435 -5.18904 -0.00796 0 0 0 -0.68388 0 -0.02851 0.25607 2.64967 0 -0.00453 0 -1.5107 -0.00775 0.91134 -3.7413
SER_18 -3.54879 0.18466 4.85737 -0.02536 0 0.05915 2.09722 -2.22579 -0.00391 -0.02919 -2.06567 -0.65783 0 0 0 0 0 0.01073 0.00015 0.63008 0 0.3588 0.60016 -0.77834 -0.05881 0.53532 -0.06005
HIS_19 -5.66137 0.37293 4.62327 -0.78474 0.04406 0.81426 1.88412 -2.46214 -0 -0 -1.7448 -0.33154 0 0 0 0 0 0.08198 0.11867 0 1.50355 -0.34026 0 -0.45461 0.37935 0.24706 -1.71021
PHE_20 -9.91033 0.96764 3.93511 -0.58714 0.03522 0.2564 2.74266 -2.97955 -0 -0 -2.25537 0.01347 0 0 0 0 0 -0.03741 0.04261 0 2.66441 -0.03662 0 1.0402 0.17724 0.34336 -3.58809
ILE_21 -8.60783 0.76833 5.37776 -0.51908 0.40513 0.10658 2.76284 -3.07656 -3e-05 -0.00021 -3.36128 -0.03103 0 0 0 0 0 -0.06316 0.00579 0.53316 0 -0.44385 0 0.73287 -0.02918 0.531 -4.90874
GLU_22 -3.90384 0.14591 4.68406 -0.61326 0.1154 1.11928 1.94427 -2.21138 -0.02204 -0.10312 -1.97204 -0.65977 0 0 0 0 0 -0.0001 0.01029 0 3.55644 -0.24899 0 -2.7348 -0.27222 0.44308 -0.72284
ASP_23 -4.90082 0.23396 7.12105 -0.21527 0.00048 0.70007 3.16434 -3.1002 -0.00555 -0.03272 -5.33255 -0.1101 0 0 0 -0.45272 0 -0.02206 0.00145 0 3.17533 0.29243 0 -2.3716 -0.34115 0.24997 -1.94565
PHE_24 -11.5593 1.30249 6.149 -0.63882 0.51925 0.33398 3.34469 -3.87589 -0 -0 -2.42441 -0.26539 0 0 0 0 0 -0.00284 0.29609 0 2.97333 0.06182 0 1.0402 -0.12452 0.54646 -2.32386
CYS_25 -7.52304 0.75682 6.09513 -0.04672 0 0.0161 2.83608 -3.03287 -0.01918 -0.0869 -3.40013 -0.03485 0 0 0 0 0 -0.03124 0.00689 0.27968 0 0.26242 0 3.6196 0.07615 0.70223 0.47616
TRP_26 -5.90063 0.53859 5.31929 -1.13363 0.04183 0.32797 2.14591 -2.52173 -0 -0 -2.26594 -0.39634 0 0 0 0 0 -0.01357 0.16098 0 1.70453 -0.33298 0 1.6906 0.18563 0.53786 0.08836
LYS_27 -6.626 0.44779 8.00636 -0.46134 0.08295 0.32788 3.11611 -3.43645 -0.00164 -0.00353 -5.03855 0.36515 0 0 0 -0.45272 0 -0.02167 0.89585 1.95363 0 -0.01815 0 -1.5107 0.05849 0.40586 -1.91069
LEU_28 -7.34919 0.60825 5.37615 -0.50398 0.26636 0.14072 2.50718 -3.02743 -0 -0 -2.9294 0.18127 0 0 0 0 0 0.0114 0.39485 0.29067 0 -0.31511 0 0.18072 -0.17152 0.65919 -3.67985
HIS_D_29 -6.36707 0.35713 6.12872 -0.4076 0.11148 0.42861 2.51623 -3.12188 -0 -0 -2.54964 -0.53546 0 0 0 0 0 0.1584 0.05087 0 2.71547 -0.02999 0 -0.45461 -0.23566 0.80229 -0.43272
ARG_30 -4.71186 0.38163 4.22939 -0.79475 0.12642 0.46209 1.57934 -1.93652 -0.01918 -0.0869 -0.9727 0.29601 0 0 0 0 0 -0.04794 0.15616 3.00505 0 -0.18766 0 -1.2888 -0.31967 0.52285 0.39295
ARG_31 -4.29663 0.38443 4.42578 -0.47417 0.07622 0.27624 1.26515 -1.94354 -0.01336 -0.11094 -0.89488 0.19241 0 0 0 0 0 -0.07605 0.13789 1.84564 0 -0.01126 0 -1.2888 -0.38714 0.43777 -0.45522
GLU_32 -1.98898 0.20346 2.71244 -0.2449 0.06006 0.43223 1.11037 -1.2559 -0.01336 -0.11094 -1.16734 -0.49457 0 0 0 0 0 -0.0287 0.00413 0 2.71617 0.17428 0 -2.7348 0.04638 0.45407 -0.12589
GLY_33 -1.94946 0.08594 2.0381 -0.00031 0 0 0.94217 -1.08201 -0 -0 -1.00274 -0.16132 0 0 0 0 0 -0.11496 0 0 0 -1.2214 0 0.83697 0.33021 0.29934 -0.99947
ALA_34 -3.17624 0.24377 2.3437 -0.02183 0 0 1.44985 -1.47338 -0.02975 -0.19199 -1.27828 -0.41199 0 0 0 0 0 0.1476 0 0 0 -0.55579 0 1.8394 0.129 0.36711 -0.61883
CYS_35 -4.37799 0.49907 3.42463 -0.0649 7e-05 0.03831 1.99512 -1.80306 -0.00386 -0.03475 -2.47153 -0.33654 0 0 0 0 0 -0.19083 0.0014 0.58396 0 0.49419 0 3.6196 0.03964 0.56753 1.98006
VAL_36 -4.27623 0.53277 2.83938 -0.26402 0.16437 0.04212 1.61017 -1.84594 -0.00254 -0.04423 -0.83205 0.39161 0 0 0 0 0 -0.08461 0.00041 0.69453 0 0.2604 0 1.9342 -0.07907 0.44777 1.48904
ASN_37 -4.43816 0.66022 3.39932 -0.19572 0.04282 0.31283 1.61129 -1.97056 -0.02507 -0.16696 -0.99262 -0.47116 0 0 0 0 0 0.04326 0.0015 0 2.05242 -0.59453 0 -0.93687 -0.51008 0.27187 -1.90618
CYS_38 -9.27693 1.13927 5.21876 -0.05295 0 0.01447 2.66218 -2.87871 -0.00468 -0.02503 -2.18846 -0.68391 0 0 0 0 0 0.11568 0.05798 0.19295 0 0.09498 0 3.6196 0.27297 0.49015 -1.23169
GLU_39 -5.16715 0.22211 4.34011 -0.20787 0.02577 0.28239 1.81587 -2.27386 -0.00254 -0.04423 -1.52795 -0.55061 0 0 0 0 0 -0.00544 0.00365 0 3.08731 -0.18636 0 -2.7348 0.43813 0.51749 -1.96799
MET_40 -5.13974 0.23999 4.38398 -0.73585 0.28245 0.3423 2.00446 -2.31235 -0.00386 -0.03475 -1.40827 -0.2222 0 0 0 0 0 0.10523 0.01689 2.22396 0 -0.01765 0 0.60916 -0.18123 0.31787 0.47039
HIS_41 -7.22271 0.70731 6.61422 -0.63056 0.28421 0.66253 2.90148 -3.3595 -0.00125 -0.00873 -1.87685 -0.79501 0 0 0 -0.92845 0 0.06655 0.04002 0 3.22334 -0.09465 0 -0.45461 -0.01344 0.63271 -0.25337
ALA_42 -7.00965 0.96225 4.25247 -0.02085 0 0 2.78272 -3.07316 -0.00104 -0.00532 -2.3784 -0.34114 0 0 0 0 0 0.02345 0 0 0 -0.25655 0 1.8394 -0.21018 0.76825 -2.66776
LEU_43 -8.00338 0.43401 4.22418 -0.62354 0.34592 0.25088 2.45456 -2.70355 -0 -0 -2.09425 -0.19706 0 0 0 0 0 -0.01989 0.09985 1.09991 0 -0.17637 0 0.18072 -0.13307 0.59836 -4.26272
ASN_44 -4.93834 0.3123 5.50457 -0.18487 0.05973 0.27657 2.4453 -2.71373 -0 -0 -1.70765 -0.27081 0 0 0 0 0 0.07953 0.00759 0 1.53834 0.36401 0 -0.93687 0.13353 0.57542 0.54463
GLU_45 -6.53425 0.76946 6.30535 -0.43294 0.09672 0.87512 3.22335 -2.94204 -0 -0 -3.24202 -0.52984 0 0 0 -0.92845 0 0.02835 0.00711 0 3.4056 -0.34457 0 -2.7348 -0.14773 0.56491 -2.56067
ILE_46 -11.1068 1.83262 4.2948 -0.51315 0.37392 0.10395 3.11345 -3.4648 -0.00624 -0.03911 -2.44699 -0.1353 0 0 0 0 0 0.21167 0.10451 0.71619 0 -0.4032 0 0.73287 -0.25401 0.99163 -5.89399
GLN_47 -7.91083 0.59243 8.14968 -0.85451 0.07074 0.90226 4.58224 -3.72585 -0.01831 -0.13052 -5.64529 -0.74017 0 0 -1.04135 0 0 0.09423 0.2822 0 2.81374 -0.02304 0 -0.18838 0.02414 1.12088 -1.6457
GLU_48 -4.62768 0.2993 5.65678 -0.42674 0.05408 0.82038 2.45439 -2.59718 -0 -0 -1.89263 -0.43814 0 0 0 0 0 0.08133 0.01639 0 3.32364 -0.29401 0 -2.7348 -0.2193 0.62454 0.10035
VAL_49 -6.83927 0.83 4.08375 -0.31659 0.21047 0.07215 2.84216 -2.74869 -0 -0 -1.71039 -0.12919 0 0 0 0 0 0.00122 0.04576 0.17047 0 -0.15557 0 1.9342 -0.38037 0.55628 -1.53362
PHE_50 -12.6131 1.78487 4.41614 -0.59152 0.45451 0.28088 3.24801 -3.66221 -0 -0 -3.37466 -0.20811 0 0 0 0 0 -0.039 0.06551 0 3.54174 -0.10083 0 1.0402 -0.03597 0.83962 -4.95392
THR_51 -4.99158 0.36372 6.64729 -0.20641 0.12085 0.07571 3.25509 -3.01875 -0.00499 -0.03039 -3.71901 -0.12358 0 0 0 0 0 0.03959 0.00609 0.19168 0 0.20299 2.35533 -1.0874 0.08863 0.70262 0.86747
LEU_52 -3.87528 0.26726 3.66704 -0.69369 0.17279 0.28734 1.35561 -1.82224 -0 -0 -0.81341 0.01999 0 0 0 0 0 -0.11177 0.00878 0.66787 0 -0.02953 0 0.18072 0.26386 0.38617 -0.06849
HIS_D_53 -3.68092 0.31459 3.87058 -0.4267 0.02888 0.55379 1.24781 -1.87298 -0.02987 -0.12585 -0.79044 -0.33599 0 0 0 0 0 -0.03975 0.00088 0 1.61184 -0.45161 0 -0.45461 0.05111 0.33104 -0.19821
GLY_54 -1.87481 0.06778 2.35852 -5e-05 0 0 1.00983 -1.12218 -0 -0 -1.09834 -0.35211 0 0 0 0 0 -0.1856 0 0 0 -1.47067 0 0.83697 -0.68044 0.54353 -1.96757
MET_55 -6.37138 0.64944 3.96149 -0.45705 0.16778 0.04959 1.70589 -2.09358 -0.04545 -0.22769 -1.11152 -0.06263 0 0 0 0 0 0.00219 0.05286 1.55584 0 -0.01734 0 0.60916 -0.53083 0.60179 -1.56142
LYS_56 -6.04116 0.53827 5.61547 -0.29765 0.04979 0.14708 2.68266 -2.5995 -0.00176 -0.00528 -1.99767 -0.12402 0 0 -0.93567 0 0 0.05678 0.05213 1.93739 0 0.02066 0 -1.5107 -0.05052 0.419 -2.0447
CYS_57 -7.31423 0.65546 3.4911 -0.04677 0 0.01644 2.33389 -1.96541 -0 -0 -2.79218 0.03028 0 0 -1.04135 0 0 -0.06069 0.00111 0.3309 0 0.2964 0 3.6196 0.08998 0.48563 -1.86984
SER_58 -5.51225 0.48514 3.94976 -0.02885 3e-05 0.04572 1.76057 -2.20437 -0.00168 -0.02335 -0.32081 -1.04577 0 0 0 0 0 -0.05431 0.01391 0.17488 0 -0.26947 0.61096 -0.77834 -0.24606 0.42344 -3.02083
HIS_59 -6.90222 0.62673 5.76389 -0.48163 0.21584 0.4924 3.16344 -2.9637 -0 -0 -2.60946 -0.54392 0 0 -1.78705 0 0 -0.02567 0.00573 0 3.20239 -0.11965 0 -0.45461 -0.5906 0.33952 -2.66857
PHE_60 -9.7504 1.79692 1.86058 -0.67659 0.07377 0.40531 2.1884 -2.33826 -0.03582 -0.13855 -0.56791 0.15517 0 0 0 0 0 -0.02811 0.06813 0 2.00571 -0.19537 0 1.0402 -0.44884 0.60074 -3.98492
LYS_61 -3.26711 0.29183 2.5257 -0.46533 0.40083 0.36936 1.31869 -1.28442 -0 -0 -0.68831 -0.63086 0 0 0 0 0 -0.07735 0.12341 2.08472 0 -0.18212 0 -1.5107 -0.32399 0.65544 -0.66021
LEU_62 -8.57444 1.95482 3.63063 -0.60195 0.13307 0.16848 2.01585 -2.38257 -0.03406 -0.13327 -0.24042 0.30044 0 0 0 0 0 -0.01043 0.29415 0.3734 0 -0.13138 0 0.18072 -0.11395 1.50053 -1.67036
PRO_63 -2.26597 0.48978 1.56035 -0.07198 0 0.04396 0.65686 -0.66076 -0 -0 0.34136 0.5945 0 0 0 0 0 -0.17395 0.02483 0.44691 0 -0.48753 0 -2.4119 -0.20192 1.48777 -0.6277
ASP_64 -3.89634 0.56043 3.27292 -0.11754 0.00847 0.35617 1.49387 -1.53654 -0 -0 -2.95286 -0.34539 0 0 0 -0.68388 0 -0.02309 0.24504 0 2.08302 -0.22888 0 -2.3716 -0.48227 0.48642 -4.13204
TYR_65 -6.21096 0.90596 2.9178 -0.77484 0.04461 0.2579 1.54621 -1.78175 -0 -0 -0.52879 -0.47956 0 0 0 0 0 -0.05465 0.08627 0 2.28311 -0.13966 0.0001 1.2797 0.45203 1.28949 1.09296
PRO_66 -2.14571 0.35704 1.75436 -0.12356 0.00447 0.09042 0.53848 -0.8075 -0 -0 -0.04478 0.22891 0 0 0 0 0 -0.0997 0.01441 0.12493 0 -1.03591 0 -2.4119 0.35574 1.16891 -2.03142
LEU_67 -3.51362 0.1937 0.74806 -0.44981 0.2008 0.07036 0.48896 -0.84708 -0 -0 0.02542 0.36952 0 0 0 0 0 0.04917 0.00952 0.51821 0 -0.00347 0 0.18072 -0.63081 0.37308 -2.21728
LEU_68 -4.84064 0.4493 3.10185 -0.48527 0.18752 0.09857 2.10904 -1.80624 -0 -0 0.28411 0.19889 0 0 0 0 0 0.03253 0.14832 0.40812 0 -0.23729 0 0.18072 -0.2639 0.42722 -0.00716
MET_69 -1.39763 0.07478 1.42776 -0.64962 0.16361 0.17792 0.33873 -0.70394 -0 -0 0.31723 -0.00355 0 0 0 0 0 -0.08765 0.0066 0.86757 0 -0.07651 0 0.60916 -0.15486 0.35259 1.2622
ASN_70 -2.10398 0.31851 2.19394 -0.19483 0.03244 0.31106 0.83339 -1.05149 -0 -0 -0.36944 -0.47527 0 0 -0.85137 0 0 -0.06709 0.02292 0 2.06143 -0.59586 0 -0.93687 -0.53065 0.24485 -1.1583
ALA:CtermProteinFull_71 -3.84093 0.46993 2.20117 -0.03351 0.01018 0 1.518 -1.62811 -0 -0 -0.81317 -0.09125 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.37516 0.25075 -0.4927
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

