USER  MOD reduce.3.24.130724 H: found=0, std=0, add=404, rem=0, adj=22
USER  MOD reduce.3.24.130724 removed 405 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  18 TYR OH  :   rot  -30:sc=     2.1
USER  MOD Set 1.2: A  43 TYR OH  :   rot -162:sc=    1.06
USER  MOD Set 2.1: A  36 TYR OH  :   rot  180:sc=   0.386
USER  MOD Set 2.2: A  41 GLN     :      amide:sc=    0.95  K(o=1.3,f=0.72)
USER  MOD Set 3.1: A  32 THR OG1 :   rot -150:sc= -0.0783
USER  MOD Set 3.2: A  61 TYR OH  :   rot  -59:sc= 0.00515
USER  MOD Single : A  10 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  16 SER OG  :   rot  180:sc=  0.0941
USER  MOD Single : A  17 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  19 GLN     :      amide:sc=       0  X(o=0,f=0.036)
USER  MOD Single : A  20 TYR OH  :   rot  180:sc=   -0.05
USER  MOD Single : A  23 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  24 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  26 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  27 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  28 TYR OH  :   rot  180:sc=-0.00205
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.292  X(o=-0.29,f=-0.11)
USER  MOD Single : A  35 TYR OH  :   rot -146:sc=   0.417
USER  MOD Single : A  39 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  40 SER OG  :   rot   75:sc=     1.3
USER  MOD Single : A  42 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  44 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  45 ASN     :      amide:sc= -0.0584  K(o=-0.058,f=-1.4)
USER  MOD Single : A  47 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  48 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  49 GLN     :      amide:sc=       0  X(o=0,f=-0.068)
USER  MOD Single : A  50 GLN     :      amide:sc=  -0.427  X(o=-0.43,f=-0.44)
USER  MOD Single : A  51 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  53 TYR OH  :   rot  138:sc=   0.622
USER  MOD Single : A  60 THR OG1 :   rot   42:sc=   0.607
USER  MOD -----------------------------------------------------------------
ATOM    134  N   TYR A  10       9.311   7.708   1.621  1.00  0.00           N
ATOM    135  CA  TYR A  10       9.782   6.330   1.743  1.00  0.00           C
ATOM    136  C   TYR A  10      11.188   6.159   1.148  1.00  0.00           C
ATOM    137  O   TYR A  10      11.581   6.945   0.280  1.00  0.00           O
ATOM    138  CB  TYR A  10       8.783   5.388   1.062  1.00  0.00           C
ATOM    139  CG  TYR A  10       7.565   5.079   1.906  1.00  0.00           C
ATOM    140  CD1 TYR A  10       7.589   3.982   2.789  1.00  0.00           C
ATOM    141  CD2 TYR A  10       6.414   5.883   1.819  1.00  0.00           C
ATOM    142  CE1 TYR A  10       6.463   3.674   3.570  1.00  0.00           C
ATOM    143  CE2 TYR A  10       5.280   5.569   2.585  1.00  0.00           C
ATOM    144  CZ  TYR A  10       5.303   4.470   3.471  1.00  0.00           C
ATOM    145  OH  TYR A  10       4.212   4.167   4.225  1.00  0.00           O
ATOM      0  HA  TYR A  10       9.850   6.079   2.802  1.00  0.00           H   new
ATOM      0  HB2 TYR A  10       8.459   5.835   0.122  1.00  0.00           H   new
ATOM      0  HB3 TYR A  10       9.288   4.455   0.814  1.00  0.00           H   new
ATOM      0  HD1 TYR A  10       8.478   3.374   2.866  1.00  0.00           H   new
ATOM      0  HD2 TYR A  10       6.403   6.741   1.163  1.00  0.00           H   new
ATOM      0  HE1 TYR A  10       6.485   2.830   4.244  1.00  0.00           H   new
ATOM      0  HE2 TYR A  10       4.387   6.170   2.496  1.00  0.00           H   new
ATOM      0  HH  TYR A  10       3.498   4.812   4.041  1.00  0.00           H   new
ATOM    155  N   PRO A  11      11.942   5.126   1.567  1.00  0.00           N
ATOM    156  CA  PRO A  11      13.250   4.770   1.015  1.00  0.00           C
ATOM    157  C   PRO A  11      13.135   4.134  -0.380  1.00  0.00           C
ATOM    158  O   PRO A  11      12.047   4.035  -0.942  1.00  0.00           O
ATOM    159  CB  PRO A  11      13.857   3.807   2.041  1.00  0.00           C
ATOM    160  CG  PRO A  11      12.653   3.153   2.709  1.00  0.00           C
ATOM    161  CD  PRO A  11      11.584   4.227   2.656  1.00  0.00           C
ATOM      0  HA  PRO A  11      13.879   5.647   0.862  1.00  0.00           H   new
ATOM      0  HB2 PRO A  11      14.496   3.066   1.560  1.00  0.00           H   new
ATOM      0  HB3 PRO A  11      14.474   4.337   2.766  1.00  0.00           H   new
ATOM      0  HG2 PRO A  11      12.342   2.252   2.180  1.00  0.00           H   new
ATOM      0  HG3 PRO A  11      12.875   2.859   3.735  1.00  0.00           H   new
ATOM      0  HD2 PRO A  11      10.602   3.786   2.486  1.00  0.00           H   new
ATOM      0  HD3 PRO A  11      11.532   4.767   3.601  1.00  0.00           H   new
ATOM    169  N   VAL A  12      14.252   3.723  -0.975  1.00  0.00           N
ATOM    170  CA  VAL A  12      14.374   3.167  -2.323  1.00  0.00           C
ATOM    171  C   VAL A  12      14.731   1.681  -2.211  1.00  0.00           C
ATOM    172  O   VAL A  12      15.912   1.360  -2.061  1.00  0.00           O
ATOM    173  CB  VAL A  12      15.333   3.984  -3.212  1.00  0.00           C
ATOM    174  CG1 VAL A  12      15.318   3.465  -4.657  1.00  0.00           C
ATOM    175  CG2 VAL A  12      14.898   5.451  -3.227  1.00  0.00           C
ATOM      0  H   VAL A  12      15.153   3.772  -0.500  1.00  0.00           H   new
ATOM      0  HA  VAL A  12      13.418   3.241  -2.841  1.00  0.00           H   new
ATOM      0  HB  VAL A  12      16.338   3.884  -2.801  1.00  0.00           H   new
ATOM      0 HG11 VAL A  12      16.003   4.058  -5.264  1.00  0.00           H   new
ATOM      0 HG12 VAL A  12      15.631   2.421  -4.672  1.00  0.00           H   new
ATOM      0 HG13 VAL A  12      14.310   3.547  -5.063  1.00  0.00           H   new
ATOM      0 HG21 VAL A  12      15.578   6.026  -3.856  1.00  0.00           H   new
ATOM      0 HG22 VAL A  12      13.885   5.526  -3.624  1.00  0.00           H   new
ATOM      0 HG23 VAL A  12      14.920   5.848  -2.212  1.00  0.00           H   new
ATOM    185  N   PRO A  13      13.746   0.773  -2.099  1.00  0.00           N
ATOM    186  CA  PRO A  13      14.008  -0.658  -2.171  1.00  0.00           C
ATOM    187  C   PRO A  13      14.467  -1.038  -3.593  1.00  0.00           C
ATOM    188  O   PRO A  13      14.237  -0.286  -4.551  1.00  0.00           O
ATOM    189  CB  PRO A  13      12.670  -1.291  -1.799  1.00  0.00           C
ATOM    190  CG  PRO A  13      11.656  -0.343  -2.432  1.00  0.00           C
ATOM    191  CD  PRO A  13      12.309   1.017  -2.191  1.00  0.00           C
ATOM      0  HA  PRO A  13      14.806  -0.996  -1.510  1.00  0.00           H   new
ATOM      0  HB2 PRO A  13      12.578  -2.303  -2.194  1.00  0.00           H   new
ATOM      0  HB3 PRO A  13      12.541  -1.358  -0.719  1.00  0.00           H   new
ATOM      0  HG2 PRO A  13      11.513  -0.546  -3.493  1.00  0.00           H   new
ATOM      0  HG3 PRO A  13      10.677  -0.416  -1.959  1.00  0.00           H   new
ATOM      0  HD2 PRO A  13      12.083   1.706  -3.005  1.00  0.00           H   new
ATOM      0  HD3 PRO A  13      11.933   1.472  -1.275  1.00  0.00           H   new
ATOM    199  N   ASP A  14      15.091  -2.210  -3.745  1.00  0.00           N
ATOM    200  CA  ASP A  14      15.716  -2.630  -5.009  1.00  0.00           C
ATOM    201  C   ASP A  14      15.897  -4.160  -5.063  1.00  0.00           C
ATOM    202  O   ASP A  14      16.877  -4.670  -5.612  1.00  0.00           O
ATOM    203  CB  ASP A  14      17.097  -1.926  -5.059  1.00  0.00           C
ATOM    204  CG  ASP A  14      17.829  -2.018  -6.403  1.00  0.00           C
ATOM    205  OD1 ASP A  14      17.273  -2.480  -7.427  1.00  0.00           O
ATOM    206  OD2 ASP A  14      19.054  -1.738  -6.397  1.00  0.00           O
ATOM      0  H   ASP A  14      15.179  -2.897  -2.996  1.00  0.00           H   new
ATOM      0  HA  ASP A  14      15.090  -2.358  -5.859  1.00  0.00           H   new
ATOM      0  HB2 ASP A  14      16.960  -0.874  -4.810  1.00  0.00           H   new
ATOM      0  HB3 ASP A  14      17.734  -2.356  -4.286  1.00  0.00           H   new
ATOM    211  N   VAL A  15      14.962  -4.886  -4.440  1.00  0.00           N
ATOM    212  CA  VAL A  15      14.885  -6.304  -4.025  1.00  0.00           C
ATOM    213  C   VAL A  15      16.151  -6.906  -3.358  1.00  0.00           C
ATOM    214  O   VAL A  15      16.086  -7.855  -2.582  1.00  0.00           O
ATOM    215  CB  VAL A  15      14.184  -7.170  -5.096  1.00  0.00           C
ATOM    216  CG1 VAL A  15      14.849  -7.082  -6.475  1.00  0.00           C
ATOM    217  CG2 VAL A  15      13.991  -8.642  -4.710  1.00  0.00           C
ATOM      0  H   VAL A  15      14.097  -4.417  -4.169  1.00  0.00           H   new
ATOM      0  HA  VAL A  15      14.225  -6.320  -3.158  1.00  0.00           H   new
ATOM      0  HB  VAL A  15      13.191  -6.724  -5.155  1.00  0.00           H   new
ATOM      0 HG11 VAL A  15      14.308  -7.713  -7.181  1.00  0.00           H   new
ATOM      0 HG12 VAL A  15      14.830  -6.049  -6.823  1.00  0.00           H   new
ATOM      0 HG13 VAL A  15      15.882  -7.421  -6.403  1.00  0.00           H   new
ATOM      0 HG21 VAL A  15      13.491  -9.169  -5.523  1.00  0.00           H   new
ATOM      0 HG22 VAL A  15      14.963  -9.100  -4.524  1.00  0.00           H   new
ATOM      0 HG23 VAL A  15      13.382  -8.705  -3.808  1.00  0.00           H   new
ATOM    227  N   SER A  16      17.319  -6.333  -3.596  1.00  0.00           N
ATOM    228  CA  SER A  16      18.637  -6.769  -3.193  1.00  0.00           C
ATOM    229  C   SER A  16      18.852  -6.624  -1.689  1.00  0.00           C
ATOM    230  O   SER A  16      19.754  -7.260  -1.139  1.00  0.00           O
ATOM    231  CB  SER A  16      19.667  -5.969  -4.010  1.00  0.00           C
ATOM    232  OG  SER A  16      19.299  -4.609  -4.199  1.00  0.00           O
ATOM      0  H   SER A  16      17.367  -5.465  -4.130  1.00  0.00           H   new
ATOM      0  HA  SER A  16      18.755  -7.833  -3.397  1.00  0.00           H   new
ATOM      0  HB2 SER A  16      20.632  -6.010  -3.505  1.00  0.00           H   new
ATOM      0  HB3 SER A  16      19.795  -6.442  -4.983  1.00  0.00           H   new
ATOM      0  HG  SER A  16      19.991  -4.153  -4.722  1.00  0.00           H   new
ATOM    238  N   THR A  17      18.048  -5.824  -0.990  1.00  0.00           N
ATOM    239  CA  THR A  17      18.129  -5.709   0.460  1.00  0.00           C
ATOM    240  C   THR A  17      17.257  -6.778   1.140  1.00  0.00           C
ATOM    241  O   THR A  17      17.369  -6.973   2.348  1.00  0.00           O
ATOM    242  CB  THR A  17      17.717  -4.291   0.892  1.00  0.00           C
ATOM    243  OG1 THR A  17      16.323  -4.140   0.802  1.00  0.00           O
ATOM    244  CG2 THR A  17      18.311  -3.164   0.032  1.00  0.00           C
ATOM      0  H   THR A  17      17.326  -5.241  -1.413  1.00  0.00           H   new
ATOM      0  HA  THR A  17      19.158  -5.880   0.775  1.00  0.00           H   new
ATOM      0  HB  THR A  17      18.097  -4.200   1.909  1.00  0.00           H   new
ATOM      0  HG1 THR A  17      16.073  -3.234   1.081  1.00  0.00           H   new
ATOM      0 HG21 THR A  17      17.968  -2.200   0.408  1.00  0.00           H   new
ATOM      0 HG22 THR A  17      19.399  -3.205   0.079  1.00  0.00           H   new
ATOM      0 HG23 THR A  17      17.988  -3.286  -1.002  1.00  0.00           H   new
ATOM    252  N   TYR A  18      16.362  -7.438   0.391  1.00  0.00           N
ATOM    253  CA  TYR A  18      15.243  -8.148   0.978  1.00  0.00           C
ATOM    254  C   TYR A  18      15.705  -9.414   1.669  1.00  0.00           C
ATOM    255  O   TYR A  18      16.632 -10.106   1.236  1.00  0.00           O
ATOM    256  CB  TYR A  18      14.161  -8.462  -0.067  1.00  0.00           C
ATOM    257  CG  TYR A  18      13.359  -7.291  -0.595  1.00  0.00           C
ATOM    258  CD1 TYR A  18      13.566  -5.982  -0.117  1.00  0.00           C
ATOM    259  CD2 TYR A  18      12.389  -7.519  -1.592  1.00  0.00           C
ATOM    260  CE1 TYR A  18      12.798  -4.928  -0.621  1.00  0.00           C
ATOM    261  CE2 TYR A  18      11.612  -6.459  -2.091  1.00  0.00           C
ATOM    262  CZ  TYR A  18      11.771  -5.165  -1.549  1.00  0.00           C
ATOM    263  OH  TYR A  18      10.912  -4.156  -1.845  1.00  0.00           O
ATOM      0  H   TYR A  18      16.402  -7.488  -0.627  1.00  0.00           H   new
ATOM      0  HA  TYR A  18      14.799  -7.492   1.727  1.00  0.00           H   new
ATOM      0  HB2 TYR A  18      14.639  -8.955  -0.913  1.00  0.00           H   new
ATOM      0  HB3 TYR A  18      13.466  -9.180   0.369  1.00  0.00           H   new
ATOM      0  HD1 TYR A  18      14.316  -5.793   0.637  1.00  0.00           H   new
ATOM      0  HD2 TYR A  18      12.241  -8.517  -1.976  1.00  0.00           H   new
ATOM      0  HE1 TYR A  18      12.997  -3.919  -0.292  1.00  0.00           H   new
ATOM      0  HE2 TYR A  18      10.899  -6.633  -2.883  1.00  0.00           H   new
ATOM      0  HH  TYR A  18      10.816  -3.569  -1.066  1.00  0.00           H   new
ATOM    273  N   GLN A  19      14.978  -9.753   2.721  1.00  0.00           N
ATOM    274  CA  GLN A  19      15.097 -11.019   3.414  1.00  0.00           C
ATOM    275  C   GLN A  19      14.168 -11.983   2.686  1.00  0.00           C
ATOM    276  O   GLN A  19      12.951 -11.921   2.843  1.00  0.00           O
ATOM    277  CB  GLN A  19      14.729 -10.850   4.898  1.00  0.00           C
ATOM    278  CG  GLN A  19      15.813 -10.035   5.617  1.00  0.00           C
ATOM    279  CD  GLN A  19      15.594  -9.884   7.124  1.00  0.00           C
ATOM    280  OE1 GLN A  19      14.602  -9.335   7.594  1.00  0.00           O
ATOM    281  NE2 GLN A  19      16.533 -10.339   7.939  1.00  0.00           N
ATOM      0  H   GLN A  19      14.272  -9.138   3.124  1.00  0.00           H   new
ATOM      0  HA  GLN A  19      16.117 -11.404   3.405  1.00  0.00           H   new
ATOM      0  HB2 GLN A  19      13.765 -10.348   4.988  1.00  0.00           H   new
ATOM      0  HB3 GLN A  19      14.624 -11.827   5.369  1.00  0.00           H   new
ATOM      0  HG2 GLN A  19      16.779 -10.510   5.448  1.00  0.00           H   new
ATOM      0  HG3 GLN A  19      15.863  -9.043   5.168  1.00  0.00           H   new
ATOM      0 HE21 GLN A  19      17.361 -10.797   7.558  1.00  0.00           H   new
ATOM      0 HE22 GLN A  19      16.428 -10.232   8.948  1.00  0.00           H   new
ATOM    290  N   TYR A  20      14.728 -12.852   1.845  1.00  0.00           N
ATOM    291  CA  TYR A  20      14.004 -14.054   1.464  1.00  0.00           C
ATOM    292  C   TYR A  20      13.701 -14.841   2.742  1.00  0.00           C
ATOM    293  O   TYR A  20      14.524 -14.857   3.659  1.00  0.00           O
ATOM    294  CB  TYR A  20      14.847 -14.853   0.476  1.00  0.00           C
ATOM    295  CG  TYR A  20      14.193 -16.133   0.010  1.00  0.00           C
ATOM    296  CD1 TYR A  20      13.135 -16.078  -0.920  1.00  0.00           C
ATOM    297  CD2 TYR A  20      14.654 -17.372   0.493  1.00  0.00           C
ATOM    298  CE1 TYR A  20      12.558 -17.266  -1.401  1.00  0.00           C
ATOM    299  CE2 TYR A  20      14.104 -18.557  -0.008  1.00  0.00           C
ATOM    300  CZ  TYR A  20      13.054 -18.510  -0.945  1.00  0.00           C
ATOM    301  OH  TYR A  20      12.494 -19.680  -1.351  1.00  0.00           O
ATOM      0  H   TYR A  20      15.653 -12.748   1.428  1.00  0.00           H   new
ATOM      0  HA  TYR A  20      13.062 -13.821   0.968  1.00  0.00           H   new
ATOM      0  HB2 TYR A  20      15.061 -14.229  -0.392  1.00  0.00           H   new
ATOM      0  HB3 TYR A  20      15.804 -15.093   0.940  1.00  0.00           H   new
ATOM      0  HD1 TYR A  20      12.767 -15.122  -1.263  1.00  0.00           H   new
ATOM      0  HD2 TYR A  20      15.428 -17.408   1.246  1.00  0.00           H   new
ATOM      0  HE1 TYR A  20      11.745 -17.230  -2.111  1.00  0.00           H   new
ATOM      0  HE2 TYR A  20      14.486 -19.511   0.325  1.00  0.00           H   new
ATOM      0  HH  TYR A  20      12.967 -20.431  -0.936  1.00  0.00           H   new
ATOM    311  N   ASP A  21      12.529 -15.462   2.806  1.00  0.00           N
ATOM    312  CA  ASP A  21      12.022 -16.199   3.956  1.00  0.00           C
ATOM    313  C   ASP A  21      11.618 -17.557   3.397  1.00  0.00           C
ATOM    314  O   ASP A  21      10.485 -17.725   2.936  1.00  0.00           O
ATOM    315  CB  ASP A  21      10.846 -15.445   4.629  1.00  0.00           C
ATOM    316  CG  ASP A  21      11.139 -14.619   5.884  1.00  0.00           C
ATOM    317  OD1 ASP A  21      12.297 -14.535   6.354  1.00  0.00           O
ATOM    318  OD2 ASP A  21      10.180 -14.023   6.436  1.00  0.00           O
ATOM      0  H   ASP A  21      11.877 -15.465   2.022  1.00  0.00           H   new
ATOM      0  HA  ASP A  21      12.763 -16.309   4.748  1.00  0.00           H   new
ATOM      0  HB2 ASP A  21      10.410 -14.778   3.886  1.00  0.00           H   new
ATOM      0  HB3 ASP A  21      10.083 -16.180   4.885  1.00  0.00           H   new
ATOM    323  N   GLU A  22      12.548 -18.513   3.366  1.00  0.00           N
ATOM    324  CA  GLU A  22      12.388 -19.810   2.693  1.00  0.00           C
ATOM    325  C   GLU A  22      11.163 -20.604   3.167  1.00  0.00           C
ATOM    326  O   GLU A  22      10.606 -21.383   2.384  1.00  0.00           O
ATOM    327  CB  GLU A  22      13.651 -20.683   2.815  1.00  0.00           C
ATOM    328  CG  GLU A  22      14.345 -20.634   4.168  1.00  0.00           C
ATOM    329  CD  GLU A  22      15.105 -21.911   4.516  1.00  0.00           C
ATOM    330  OE1 GLU A  22      14.489 -22.993   4.623  1.00  0.00           O
ATOM    331  OE2 GLU A  22      16.340 -21.840   4.739  1.00  0.00           O
ATOM      0  H   GLU A  22      13.456 -18.408   3.818  1.00  0.00           H   new
ATOM      0  HA  GLU A  22      12.226 -19.560   1.645  1.00  0.00           H   new
ATOM      0  HB2 GLU A  22      13.380 -21.717   2.601  1.00  0.00           H   new
ATOM      0  HB3 GLU A  22      14.362 -20.374   2.049  1.00  0.00           H   new
ATOM      0  HG2 GLU A  22      15.040 -19.794   4.180  1.00  0.00           H   new
ATOM      0  HG3 GLU A  22      13.601 -20.443   4.941  1.00  0.00           H   new
ATOM    338  N   THR A  23      10.737 -20.393   4.415  1.00  0.00           N
ATOM    339  CA  THR A  23       9.572 -21.007   5.038  1.00  0.00           C
ATOM    340  C   THR A  23       8.355 -20.967   4.098  1.00  0.00           C
ATOM    341  O   THR A  23       7.798 -22.021   3.779  1.00  0.00           O
ATOM    342  CB  THR A  23       9.374 -20.373   6.428  1.00  0.00           C
ATOM    343  OG1 THR A  23       8.321 -20.981   7.143  1.00  0.00           O
ATOM    344  CG2 THR A  23       9.168 -18.851   6.410  1.00  0.00           C
ATOM      0  H   THR A  23      11.223 -19.756   5.046  1.00  0.00           H   new
ATOM      0  HA  THR A  23       9.721 -22.073   5.207  1.00  0.00           H   new
ATOM      0  HB  THR A  23      10.318 -20.559   6.939  1.00  0.00           H   new
ATOM      0  HG1 THR A  23       8.230 -20.551   8.019  1.00  0.00           H   new
ATOM      0 HG21 THR A  23       9.037 -18.490   7.430  1.00  0.00           H   new
ATOM      0 HG22 THR A  23      10.039 -18.371   5.964  1.00  0.00           H   new
ATOM      0 HG23 THR A  23       8.281 -18.611   5.823  1.00  0.00           H   new
ATOM    352  N   SER A  24       7.993 -19.792   3.572  1.00  0.00           N
ATOM    353  CA  SER A  24       7.001 -19.676   2.503  1.00  0.00           C
ATOM    354  C   SER A  24       7.677 -19.670   1.131  1.00  0.00           C
ATOM    355  O   SER A  24       7.149 -20.257   0.185  1.00  0.00           O
ATOM    356  CB  SER A  24       6.168 -18.402   2.656  1.00  0.00           C
ATOM    357  OG  SER A  24       5.550 -18.297   3.926  1.00  0.00           O
ATOM      0  H   SER A  24       8.379 -18.898   3.876  1.00  0.00           H   new
ATOM      0  HA  SER A  24       6.343 -20.542   2.579  1.00  0.00           H   new
ATOM      0  HB2 SER A  24       6.808 -17.534   2.496  1.00  0.00           H   new
ATOM      0  HB3 SER A  24       5.401 -18.380   1.881  1.00  0.00           H   new
ATOM      0  HG  SER A  24       5.033 -17.466   3.970  1.00  0.00           H   new
ATOM    363  N   GLY A  25       8.861 -19.061   1.018  1.00  0.00           N
ATOM    364  CA  GLY A  25       9.541 -18.858  -0.247  1.00  0.00           C
ATOM    365  C   GLY A  25       8.949 -17.655  -0.971  1.00  0.00           C
ATOM    366  O   GLY A  25       8.428 -17.790  -2.073  1.00  0.00           O
ATOM      0  H   GLY A  25       9.374 -18.693   1.819  1.00  0.00           H   new
ATOM      0  HA2 GLY A  25      10.606 -18.701  -0.076  1.00  0.00           H   new
ATOM      0  HA3 GLY A  25       9.446 -19.749  -0.867  1.00  0.00           H   new
ATOM    370  N   TYR A  26       8.997 -16.501  -0.310  1.00  0.00           N
ATOM    371  CA  TYR A  26       8.653 -15.149  -0.745  1.00  0.00           C
ATOM    372  C   TYR A  26       9.688 -14.215  -0.102  1.00  0.00           C
ATOM    373  O   TYR A  26      10.423 -14.634   0.805  1.00  0.00           O
ATOM    374  CB  TYR A  26       7.241 -14.765  -0.271  1.00  0.00           C
ATOM    375  CG  TYR A  26       6.125 -15.278  -1.151  1.00  0.00           C
ATOM    376  CD1 TYR A  26       5.713 -16.617  -1.059  1.00  0.00           C
ATOM    377  CD2 TYR A  26       5.512 -14.414  -2.073  1.00  0.00           C
ATOM    378  CE1 TYR A  26       4.685 -17.094  -1.887  1.00  0.00           C
ATOM    379  CE2 TYR A  26       4.428 -14.865  -2.850  1.00  0.00           C
ATOM    380  CZ  TYR A  26       4.013 -16.209  -2.755  1.00  0.00           C
ATOM    381  OH  TYR A  26       2.979 -16.666  -3.512  1.00  0.00           O
ATOM      0  H   TYR A  26       9.316 -16.490   0.659  1.00  0.00           H   new
ATOM      0  HA  TYR A  26       8.662 -15.078  -1.833  1.00  0.00           H   new
ATOM      0  HB2 TYR A  26       7.094 -15.146   0.740  1.00  0.00           H   new
ATOM      0  HB3 TYR A  26       7.173 -13.679  -0.215  1.00  0.00           H   new
ATOM      0  HD1 TYR A  26       6.187 -17.280  -0.351  1.00  0.00           H   new
ATOM      0  HD2 TYR A  26       5.873 -13.402  -2.186  1.00  0.00           H   new
ATOM      0  HE1 TYR A  26       4.409 -18.138  -1.859  1.00  0.00           H   new
ATOM      0  HE2 TYR A  26       3.917 -14.185  -3.515  1.00  0.00           H   new
ATOM      0  HH  TYR A  26       2.622 -15.933  -4.055  1.00  0.00           H   new
ATOM    391  N   TYR A  27       9.720 -12.943  -0.505  1.00  0.00           N
ATOM    392  CA  TYR A  27      10.641 -11.956   0.053  1.00  0.00           C
ATOM    393  C   TYR A  27       9.935 -11.056   1.057  1.00  0.00           C
ATOM    394  O   TYR A  27       8.762 -10.751   0.866  1.00  0.00           O
ATOM    395  CB  TYR A  27      11.183 -11.080  -1.072  1.00  0.00           C
ATOM    396  CG  TYR A  27      12.154 -11.784  -1.985  1.00  0.00           C
ATOM    397  CD1 TYR A  27      11.687 -12.484  -3.112  1.00  0.00           C
ATOM    398  CD2 TYR A  27      13.530 -11.732  -1.701  1.00  0.00           C
ATOM    399  CE1 TYR A  27      12.599 -13.105  -3.980  1.00  0.00           C
ATOM    400  CE2 TYR A  27      14.448 -12.324  -2.578  1.00  0.00           C
ATOM    401  CZ  TYR A  27      13.982 -13.006  -3.722  1.00  0.00           C
ATOM    402  OH  TYR A  27      14.876 -13.517  -4.603  1.00  0.00           O
ATOM      0  H   TYR A  27       9.106 -12.570  -1.229  1.00  0.00           H   new
ATOM      0  HA  TYR A  27      11.447 -12.491   0.555  1.00  0.00           H   new
ATOM      0  HB2 TYR A  27      10.347 -10.709  -1.665  1.00  0.00           H   new
ATOM      0  HB3 TYR A  27      11.675 -10.210  -0.636  1.00  0.00           H   new
ATOM      0  HD1 TYR A  27      10.627 -12.544  -3.310  1.00  0.00           H   new
ATOM      0  HD2 TYR A  27      13.879 -11.236  -0.807  1.00  0.00           H   new
ATOM      0  HE1 TYR A  27      12.244 -13.655  -4.839  1.00  0.00           H   new
ATOM      0  HE2 TYR A  27      15.508 -12.259  -2.379  1.00  0.00           H   new
ATOM      0  HH  TYR A  27      15.786 -13.362  -4.273  1.00  0.00           H   new
ATOM    412  N   TYR A  28      10.674 -10.552   2.039  1.00  0.00           N
ATOM    413  CA  TYR A  28      10.277  -9.588   3.046  1.00  0.00           C
ATOM    414  C   TYR A  28      11.182  -8.354   2.901  1.00  0.00           C
ATOM    415  O   TYR A  28      12.384  -8.483   2.653  1.00  0.00           O
ATOM    416  CB  TYR A  28      10.415 -10.254   4.424  1.00  0.00           C
ATOM    417  CG  TYR A  28      10.283  -9.299   5.587  1.00  0.00           C
ATOM    418  CD1 TYR A  28       9.070  -8.635   5.834  1.00  0.00           C
ATOM    419  CD2 TYR A  28      11.396  -9.033   6.397  1.00  0.00           C
ATOM    420  CE1 TYR A  28       8.982  -7.680   6.862  1.00  0.00           C
ATOM    421  CE2 TYR A  28      11.328  -8.063   7.402  1.00  0.00           C
ATOM    422  CZ  TYR A  28      10.133  -7.346   7.618  1.00  0.00           C
ATOM    423  OH  TYR A  28      10.110  -6.351   8.551  1.00  0.00           O
ATOM      0  H   TYR A  28      11.647 -10.834   2.156  1.00  0.00           H   new
ATOM      0  HA  TYR A  28       9.242  -9.267   2.929  1.00  0.00           H   new
ATOM      0  HB2 TYR A  28       9.656 -11.031   4.518  1.00  0.00           H   new
ATOM      0  HB3 TYR A  28      11.385 -10.748   4.481  1.00  0.00           H   new
ATOM      0  HD1 TYR A  28       8.202  -8.859   5.232  1.00  0.00           H   new
ATOM      0  HD2 TYR A  28      12.313  -9.582   6.244  1.00  0.00           H   new
ATOM      0  HE1 TYR A  28       8.038  -7.201   7.075  1.00  0.00           H   new
ATOM      0  HE2 TYR A  28      12.194  -7.862   8.015  1.00  0.00           H   new
ATOM      0  HH  TYR A  28      10.994  -6.271   8.966  1.00  0.00           H   new
ATOM    433  N   ASP A  29      10.609  -7.164   3.064  1.00  0.00           N
ATOM    434  CA  ASP A  29      11.235  -5.845   2.921  1.00  0.00           C
ATOM    435  C   ASP A  29      11.481  -5.232   4.300  1.00  0.00           C
ATOM    436  O   ASP A  29      10.608  -4.525   4.809  1.00  0.00           O
ATOM    437  CB  ASP A  29      10.374  -4.922   2.044  1.00  0.00           C
ATOM    438  CG  ASP A  29      11.029  -3.584   1.654  1.00  0.00           C
ATOM    439  OD1 ASP A  29      11.948  -3.107   2.360  1.00  0.00           O
ATOM    440  OD2 ASP A  29      10.639  -3.015   0.598  1.00  0.00           O
ATOM      0  H   ASP A  29       9.624  -7.087   3.318  1.00  0.00           H   new
ATOM      0  HA  ASP A  29      12.197  -5.964   2.422  1.00  0.00           H   new
ATOM      0  HB2 ASP A  29      10.110  -5.458   1.132  1.00  0.00           H   new
ATOM      0  HB3 ASP A  29       9.443  -4.712   2.571  1.00  0.00           H   new
ATOM    445  N   PRO A  30      12.611  -5.515   4.974  1.00  0.00           N
ATOM    446  CA  PRO A  30      12.865  -5.030   6.332  1.00  0.00           C
ATOM    447  C   PRO A  30      12.926  -3.502   6.441  1.00  0.00           C
ATOM    448  O   PRO A  30      12.889  -2.961   7.545  1.00  0.00           O
ATOM    449  CB  PRO A  30      14.202  -5.650   6.749  1.00  0.00           C
ATOM    450  CG  PRO A  30      14.903  -5.942   5.424  1.00  0.00           C
ATOM    451  CD  PRO A  30      13.745  -6.284   4.488  1.00  0.00           C
ATOM      0  HA  PRO A  30      12.041  -5.321   6.983  1.00  0.00           H   new
ATOM      0  HB2 PRO A  30      14.784  -4.966   7.366  1.00  0.00           H   new
ATOM      0  HB3 PRO A  30      14.056  -6.559   7.332  1.00  0.00           H   new
ATOM      0  HG2 PRO A  30      15.468  -5.080   5.068  1.00  0.00           H   new
ATOM      0  HG3 PRO A  30      15.607  -6.770   5.514  1.00  0.00           H   new
ATOM      0  HD2 PRO A  30      13.984  -6.022   3.457  1.00  0.00           H   new
ATOM      0  HD3 PRO A  30      13.530  -7.352   4.504  1.00  0.00           H   new
ATOM    459  N   GLN A  31      13.030  -2.798   5.314  1.00  0.00           N
ATOM    460  CA  GLN A  31      13.110  -1.350   5.262  1.00  0.00           C
ATOM    461  C   GLN A  31      11.748  -0.702   5.546  1.00  0.00           C
ATOM    462  O   GLN A  31      11.671   0.506   5.778  1.00  0.00           O
ATOM    463  CB  GLN A  31      13.601  -0.982   3.859  1.00  0.00           C
ATOM    464  CG  GLN A  31      14.531   0.230   3.809  1.00  0.00           C
ATOM    465  CD  GLN A  31      15.060   0.486   2.394  1.00  0.00           C
ATOM    466  OE1 GLN A  31      16.242   0.750   2.202  1.00  0.00           O
ATOM    467  NE2 GLN A  31      14.219   0.436   1.364  1.00  0.00           N
ATOM      0  H   GLN A  31      13.061  -3.235   4.393  1.00  0.00           H   new
ATOM      0  HA  GLN A  31      13.794  -0.981   6.027  1.00  0.00           H   new
ATOM      0  HB2 GLN A  31      14.121  -1.840   3.433  1.00  0.00           H   new
ATOM      0  HB3 GLN A  31      12.736  -0.786   3.225  1.00  0.00           H   new
ATOM      0  HG2 GLN A  31      13.997   1.112   4.162  1.00  0.00           H   new
ATOM      0  HG3 GLN A  31      15.370   0.072   4.487  1.00  0.00           H   new
ATOM      0 HE21 GLN A  31      13.235   0.217   1.519  1.00  0.00           H   new
ATOM      0 HE22 GLN A  31      14.558   0.617   0.419  1.00  0.00           H   new
ATOM    476  N   THR A  32      10.664  -1.475   5.503  1.00  0.00           N
ATOM    477  CA  THR A  32       9.284  -1.006   5.586  1.00  0.00           C
ATOM    478  C   THR A  32       8.445  -1.967   6.419  1.00  0.00           C
ATOM    479  O   THR A  32       7.677  -1.543   7.284  1.00  0.00           O
ATOM    480  CB  THR A  32       8.705  -0.893   4.167  1.00  0.00           C
ATOM    481  OG1 THR A  32       9.127  -1.973   3.352  1.00  0.00           O
ATOM    482  CG2 THR A  32       9.069   0.441   3.512  1.00  0.00           C
ATOM      0  H   THR A  32      10.728  -2.488   5.405  1.00  0.00           H   new
ATOM      0  HA  THR A  32       9.264  -0.029   6.068  1.00  0.00           H   new
ATOM      0  HB  THR A  32       7.620  -0.936   4.262  1.00  0.00           H   new
ATOM      0  HG1 THR A  32       9.177  -1.679   2.419  1.00  0.00           H   new
ATOM      0 HG21 THR A  32       8.642   0.483   2.510  1.00  0.00           H   new
ATOM      0 HG22 THR A  32       8.672   1.261   4.111  1.00  0.00           H   new
ATOM      0 HG23 THR A  32      10.153   0.531   3.448  1.00  0.00           H   new
ATOM    490  N   GLY A  33       8.584  -3.265   6.168  1.00  0.00           N
ATOM    491  CA  GLY A  33       7.796  -4.295   6.808  1.00  0.00           C
ATOM    492  C   GLY A  33       6.652  -4.709   5.894  1.00  0.00           C
ATOM    493  O   GLY A  33       5.504  -4.772   6.342  1.00  0.00           O
ATOM      0  H   GLY A  33       9.263  -3.630   5.500  1.00  0.00           H   new
ATOM      0  HA2 GLY A  33       8.423  -5.157   7.035  1.00  0.00           H   new
ATOM      0  HA3 GLY A  33       7.402  -3.929   7.756  1.00  0.00           H   new
ATOM    497  N   LEU A  34       6.950  -4.930   4.614  1.00  0.00           N
ATOM    498  CA  LEU A  34       6.068  -5.477   3.585  1.00  0.00           C
ATOM    499  C   LEU A  34       6.697  -6.781   3.082  1.00  0.00           C
ATOM    500  O   LEU A  34       7.826  -7.093   3.455  1.00  0.00           O
ATOM    501  CB  LEU A  34       5.955  -4.474   2.423  1.00  0.00           C
ATOM    502  CG  LEU A  34       5.373  -3.094   2.791  1.00  0.00           C
ATOM    503  CD1 LEU A  34       5.884  -2.041   1.806  1.00  0.00           C
ATOM    504  CD2 LEU A  34       3.840  -3.132   2.809  1.00  0.00           C
ATOM      0  H   LEU A  34       7.876  -4.717   4.244  1.00  0.00           H   new
ATOM      0  HA  LEU A  34       5.072  -5.663   3.987  1.00  0.00           H   new
ATOM      0  HB2 LEU A  34       6.946  -4.328   1.994  1.00  0.00           H   new
ATOM      0  HB3 LEU A  34       5.333  -4.915   1.644  1.00  0.00           H   new
ATOM      0  HG  LEU A  34       5.705  -2.828   3.794  1.00  0.00           H   new
ATOM      0 HD11 LEU A  34       5.471  -1.067   2.068  1.00  0.00           H   new
ATOM      0 HD12 LEU A  34       6.972  -1.998   1.851  1.00  0.00           H   new
ATOM      0 HD13 LEU A  34       5.573  -2.307   0.796  1.00  0.00           H   new
ATOM      0 HD21 LEU A  34       3.455  -2.147   3.071  1.00  0.00           H   new
ATOM      0 HD22 LEU A  34       3.471  -3.415   1.823  1.00  0.00           H   new
ATOM      0 HD23 LEU A  34       3.503  -3.861   3.546  1.00  0.00           H   new
ATOM    516  N   TYR A  35       5.999  -7.533   2.233  1.00  0.00           N
ATOM    517  CA  TYR A  35       6.559  -8.659   1.490  1.00  0.00           C
ATOM    518  C   TYR A  35       6.468  -8.374  -0.014  1.00  0.00           C
ATOM    519  O   TYR A  35       5.789  -7.434  -0.448  1.00  0.00           O
ATOM    520  CB  TYR A  35       5.840  -9.965   1.852  1.00  0.00           C
ATOM    521  CG  TYR A  35       6.283 -10.650   3.131  1.00  0.00           C
ATOM    522  CD1 TYR A  35       5.937 -10.114   4.383  1.00  0.00           C
ATOM    523  CD2 TYR A  35       7.011 -11.854   3.069  1.00  0.00           C
ATOM    524  CE1 TYR A  35       6.346 -10.755   5.566  1.00  0.00           C
ATOM    525  CE2 TYR A  35       7.418 -12.510   4.242  1.00  0.00           C
ATOM    526  CZ  TYR A  35       7.103 -11.957   5.503  1.00  0.00           C
ATOM    527  OH  TYR A  35       7.530 -12.583   6.638  1.00  0.00           O
ATOM      0  H   TYR A  35       5.010  -7.373   2.039  1.00  0.00           H   new
ATOM      0  HA  TYR A  35       7.608  -8.780   1.762  1.00  0.00           H   new
ATOM      0  HB2 TYR A  35       4.773  -9.757   1.929  1.00  0.00           H   new
ATOM      0  HB3 TYR A  35       5.970 -10.666   1.027  1.00  0.00           H   new
ATOM      0  HD1 TYR A  35       5.355  -9.206   4.437  1.00  0.00           H   new
ATOM      0  HD2 TYR A  35       7.259 -12.278   2.107  1.00  0.00           H   new
ATOM      0  HE1 TYR A  35       6.084 -10.333   6.525  1.00  0.00           H   new
ATOM      0  HE2 TYR A  35       7.971 -13.436   4.180  1.00  0.00           H   new
ATOM      0  HH  TYR A  35       8.399 -13.004   6.472  1.00  0.00           H   new
ATOM    537  N   TYR A  36       7.181  -9.155  -0.824  1.00  0.00           N
ATOM    538  CA  TYR A  36       7.264  -9.036  -2.277  1.00  0.00           C
ATOM    539  C   TYR A  36       7.351 -10.439  -2.907  1.00  0.00           C
ATOM    540  O   TYR A  36       7.757 -11.400  -2.243  1.00  0.00           O
ATOM    541  CB  TYR A  36       8.472  -8.142  -2.634  1.00  0.00           C
ATOM    542  CG  TYR A  36       8.831  -8.061  -4.108  1.00  0.00           C
ATOM    543  CD1 TYR A  36       8.171  -7.145  -4.950  1.00  0.00           C
ATOM    544  CD2 TYR A  36       9.833  -8.902  -4.632  1.00  0.00           C
ATOM    545  CE1 TYR A  36       8.502  -7.068  -6.315  1.00  0.00           C
ATOM    546  CE2 TYR A  36      10.170  -8.835  -5.993  1.00  0.00           C
ATOM    547  CZ  TYR A  36       9.494  -7.929  -6.840  1.00  0.00           C
ATOM    548  OH  TYR A  36       9.794  -7.877  -8.166  1.00  0.00           O
ATOM      0  H   TYR A  36       7.744  -9.926  -0.466  1.00  0.00           H   new
ATOM      0  HA  TYR A  36       6.370  -8.563  -2.683  1.00  0.00           H   new
ATOM      0  HB2 TYR A  36       8.270  -7.133  -2.274  1.00  0.00           H   new
ATOM      0  HB3 TYR A  36       9.342  -8.507  -2.088  1.00  0.00           H   new
ATOM      0  HD1 TYR A  36       7.407  -6.498  -4.545  1.00  0.00           H   new
ATOM      0  HD2 TYR A  36      10.343  -9.600  -3.985  1.00  0.00           H   new
ATOM      0  HE1 TYR A  36       8.003  -6.357  -6.957  1.00  0.00           H   new
ATOM      0  HE2 TYR A  36      10.944  -9.474  -6.391  1.00  0.00           H   new
ATOM      0  HH  TYR A  36      10.496  -8.530  -8.368  1.00  0.00           H   new
ATOM    558  N   ASP A  37       7.001 -10.568  -4.190  1.00  0.00           N
ATOM    559  CA  ASP A  37       7.113 -11.796  -4.981  1.00  0.00           C
ATOM    560  C   ASP A  37       7.797 -11.517  -6.330  1.00  0.00           C
ATOM    561  O   ASP A  37       7.513 -10.497  -6.957  1.00  0.00           O
ATOM    562  CB  ASP A  37       5.715 -12.352  -5.269  1.00  0.00           C
ATOM    563  CG  ASP A  37       5.776 -13.649  -6.084  1.00  0.00           C
ATOM    564  OD1 ASP A  37       6.040 -14.737  -5.541  1.00  0.00           O
ATOM    565  OD2 ASP A  37       5.585 -13.576  -7.317  1.00  0.00           O
ATOM      0  H   ASP A  37       6.617  -9.790  -4.726  1.00  0.00           H   new
ATOM      0  HA  ASP A  37       7.705 -12.511  -4.410  1.00  0.00           H   new
ATOM      0  HB2 ASP A  37       5.197 -12.538  -4.328  1.00  0.00           H   new
ATOM      0  HB3 ASP A  37       5.133 -11.608  -5.812  1.00  0.00           H   new
ATOM    570  N   PRO A  38       8.624 -12.439  -6.850  1.00  0.00           N
ATOM    571  CA  PRO A  38       9.350 -12.254  -8.103  1.00  0.00           C
ATOM    572  C   PRO A  38       8.479 -12.372  -9.363  1.00  0.00           C
ATOM    573  O   PRO A  38       8.736 -11.670 -10.339  1.00  0.00           O
ATOM    574  CB  PRO A  38      10.458 -13.318  -8.092  1.00  0.00           C
ATOM    575  CG  PRO A  38       9.888 -14.402  -7.176  1.00  0.00           C
ATOM    576  CD  PRO A  38       9.167 -13.575  -6.131  1.00  0.00           C
ATOM      0  HA  PRO A  38       9.739 -11.237  -8.154  1.00  0.00           H   new
ATOM      0  HB2 PRO A  38      10.660 -13.701  -9.093  1.00  0.00           H   new
ATOM      0  HB3 PRO A  38      11.397 -12.919  -7.708  1.00  0.00           H   new
ATOM      0  HG2 PRO A  38       9.211 -15.071  -7.707  1.00  0.00           H   new
ATOM      0  HG3 PRO A  38      10.671 -15.021  -6.739  1.00  0.00           H   new
ATOM      0  HD2 PRO A  38       8.376 -14.151  -5.651  1.00  0.00           H   new
ATOM      0  HD3 PRO A  38       9.850 -13.253  -5.345  1.00  0.00           H   new
ATOM    584  N   ASN A  39       7.463 -13.242  -9.397  1.00  0.00           N
ATOM    585  CA  ASN A  39       6.533 -13.316 -10.524  1.00  0.00           C
ATOM    586  C   ASN A  39       5.527 -12.158 -10.479  1.00  0.00           C
ATOM    587  O   ASN A  39       4.915 -11.816 -11.496  1.00  0.00           O
ATOM    588  CB  ASN A  39       5.755 -14.639 -10.467  1.00  0.00           C
ATOM    589  CG  ASN A  39       6.448 -15.797 -11.167  1.00  0.00           C
ATOM    590  OD1 ASN A  39       6.242 -16.035 -12.353  1.00  0.00           O
ATOM    591  ND2 ASN A  39       7.252 -16.563 -10.452  1.00  0.00           N
ATOM      0  H   ASN A  39       7.265 -13.908  -8.650  1.00  0.00           H   new
ATOM      0  HA  ASN A  39       7.113 -13.254 -11.445  1.00  0.00           H   new
ATOM      0  HB2 ASN A  39       5.589 -14.906  -9.423  1.00  0.00           H   new
ATOM      0  HB3 ASN A  39       4.774 -14.491 -10.918  1.00  0.00           H   new
ATOM      0 HD21 ASN A  39       7.711 -17.364 -10.885  1.00  0.00           H   new
ATOM      0 HD22 ASN A  39       7.414 -16.353  -9.467  1.00  0.00           H   new
ATOM    598  N   SER A  40       5.308 -11.592  -9.291  1.00  0.00           N
ATOM    599  CA  SER A  40       4.117 -10.826  -8.959  1.00  0.00           C
ATOM    600  C   SER A  40       4.535  -9.555  -8.231  1.00  0.00           C
ATOM    601  O   SER A  40       4.538  -9.504  -7.007  1.00  0.00           O
ATOM    602  CB  SER A  40       3.137 -11.683  -8.135  1.00  0.00           C
ATOM    603  OG  SER A  40       3.273 -13.061  -8.422  1.00  0.00           O
ATOM      0  H   SER A  40       5.972 -11.658  -8.519  1.00  0.00           H   new
ATOM      0  HA  SER A  40       3.588 -10.538  -9.867  1.00  0.00           H   new
ATOM      0  HB2 SER A  40       3.312 -11.514  -7.072  1.00  0.00           H   new
ATOM      0  HB3 SER A  40       2.115 -11.368  -8.344  1.00  0.00           H   new
ATOM      0  HG  SER A  40       4.089 -13.404  -8.001  1.00  0.00           H   new
ATOM    609  N   GLN A  41       4.859  -8.500  -8.970  1.00  0.00           N
ATOM    610  CA  GLN A  41       5.361  -7.230  -8.434  1.00  0.00           C
ATOM    611  C   GLN A  41       4.360  -6.494  -7.513  1.00  0.00           C
ATOM    612  O   GLN A  41       4.648  -5.394  -7.047  1.00  0.00           O
ATOM    613  CB  GLN A  41       5.819  -6.317  -9.583  1.00  0.00           C
ATOM    614  CG  GLN A  41       7.187  -6.673 -10.177  1.00  0.00           C
ATOM    615  CD  GLN A  41       7.272  -8.058 -10.806  1.00  0.00           C
ATOM    616  OE1 GLN A  41       6.763  -8.298 -11.897  1.00  0.00           O
ATOM    617  NE2 GLN A  41       7.872  -9.007 -10.113  1.00  0.00           N
ATOM      0  H   GLN A  41       4.779  -8.500  -9.987  1.00  0.00           H   new
ATOM      0  HA  GLN A  41       6.210  -7.481  -7.799  1.00  0.00           H   new
ATOM      0  HB2 GLN A  41       5.073  -6.353 -10.377  1.00  0.00           H   new
ATOM      0  HB3 GLN A  41       5.851  -5.289  -9.222  1.00  0.00           H   new
ATOM      0  HG2 GLN A  41       7.443  -5.930 -10.933  1.00  0.00           H   new
ATOM      0  HG3 GLN A  41       7.938  -6.600  -9.391  1.00  0.00           H   new
ATOM      0 HE21 GLN A  41       8.290  -8.791  -9.208  1.00  0.00           H   new
ATOM      0 HE22 GLN A  41       7.918  -9.957 -10.482  1.00  0.00           H   new
ATOM    626  N   TYR A  42       3.163  -7.027  -7.274  1.00  0.00           N
ATOM    627  CA  TYR A  42       2.193  -6.477  -6.336  1.00  0.00           C
ATOM    628  C   TYR A  42       2.622  -6.855  -4.920  1.00  0.00           C
ATOM    629  O   TYR A  42       2.641  -8.037  -4.557  1.00  0.00           O
ATOM    630  CB  TYR A  42       0.793  -6.988  -6.673  1.00  0.00           C
ATOM    631  CG  TYR A  42       0.365  -6.646  -8.087  1.00  0.00           C
ATOM    632  CD1 TYR A  42       0.184  -5.298  -8.443  1.00  0.00           C
ATOM    633  CD2 TYR A  42       0.194  -7.656  -9.054  1.00  0.00           C
ATOM    634  CE1 TYR A  42      -0.196  -4.954  -9.751  1.00  0.00           C
ATOM    635  CE2 TYR A  42      -0.187  -7.319 -10.368  1.00  0.00           C
ATOM    636  CZ  TYR A  42      -0.390  -5.964 -10.719  1.00  0.00           C
ATOM    637  OH  TYR A  42      -0.754  -5.622 -11.987  1.00  0.00           O
ATOM      0  H   TYR A  42       2.835  -7.873  -7.740  1.00  0.00           H   new
ATOM      0  HA  TYR A  42       2.159  -5.390  -6.407  1.00  0.00           H   new
ATOM      0  HB2 TYR A  42       0.765  -8.070  -6.542  1.00  0.00           H   new
ATOM      0  HB3 TYR A  42       0.077  -6.563  -5.969  1.00  0.00           H   new
ATOM      0  HD1 TYR A  42       0.338  -4.523  -7.707  1.00  0.00           H   new
ATOM      0  HD2 TYR A  42       0.355  -8.690  -8.788  1.00  0.00           H   new
ATOM      0  HE1 TYR A  42      -0.340  -3.917 -10.016  1.00  0.00           H   new
ATOM      0  HE2 TYR A  42      -0.324  -8.095 -11.107  1.00  0.00           H   new
ATOM      0  HH  TYR A  42      -0.846  -6.432 -12.531  1.00  0.00           H   new
ATOM    647  N   TYR A  43       3.061  -5.861  -4.157  1.00  0.00           N
ATOM    648  CA  TYR A  43       3.593  -6.001  -2.812  1.00  0.00           C
ATOM    649  C   TYR A  43       2.514  -6.543  -1.884  1.00  0.00           C
ATOM    650  O   TYR A  43       1.346  -6.174  -2.023  1.00  0.00           O
ATOM    651  CB  TYR A  43       4.051  -4.624  -2.318  1.00  0.00           C
ATOM    652  CG  TYR A  43       5.429  -4.206  -2.790  1.00  0.00           C
ATOM    653  CD1 TYR A  43       5.709  -3.954  -4.147  1.00  0.00           C
ATOM    654  CD2 TYR A  43       6.457  -4.109  -1.842  1.00  0.00           C
ATOM    655  CE1 TYR A  43       7.018  -3.630  -4.547  1.00  0.00           C
ATOM    656  CE2 TYR A  43       7.771  -3.823  -2.238  1.00  0.00           C
ATOM    657  CZ  TYR A  43       8.063  -3.578  -3.597  1.00  0.00           C
ATOM    658  OH  TYR A  43       9.334  -3.290  -3.992  1.00  0.00           O
ATOM      0  H   TYR A  43       3.054  -4.892  -4.476  1.00  0.00           H   new
ATOM      0  HA  TYR A  43       4.435  -6.694  -2.819  1.00  0.00           H   new
ATOM      0  HB2 TYR A  43       3.328  -3.877  -2.646  1.00  0.00           H   new
ATOM      0  HB3 TYR A  43       4.040  -4.622  -1.228  1.00  0.00           H   new
ATOM      0  HD1 TYR A  43       4.918  -4.010  -4.881  1.00  0.00           H   new
ATOM      0  HD2 TYR A  43       6.234  -4.256  -0.795  1.00  0.00           H   new
ATOM      0  HE1 TYR A  43       7.226  -3.420  -5.586  1.00  0.00           H   new
ATOM      0  HE2 TYR A  43       8.561  -3.790  -1.502  1.00  0.00           H   new
ATOM      0  HH  TYR A  43       9.964  -3.562  -3.292  1.00  0.00           H   new
ATOM    668  N   TYR A  44       2.912  -7.354  -0.901  1.00  0.00           N
ATOM    669  CA  TYR A  44       1.999  -7.909   0.089  1.00  0.00           C
ATOM    670  C   TYR A  44       2.157  -7.120   1.374  1.00  0.00           C
ATOM    671  O   TYR A  44       3.204  -7.112   2.028  1.00  0.00           O
ATOM    672  CB  TYR A  44       2.221  -9.401   0.308  1.00  0.00           C
ATOM    673  CG  TYR A  44       1.341 -10.003   1.393  1.00  0.00           C
ATOM    674  CD1 TYR A  44      -0.045 -10.122   1.176  1.00  0.00           C
ATOM    675  CD2 TYR A  44       1.892 -10.447   2.610  1.00  0.00           C
ATOM    676  CE1 TYR A  44      -0.863 -10.752   2.131  1.00  0.00           C
ATOM    677  CE2 TYR A  44       1.080 -11.057   3.580  1.00  0.00           C
ATOM    678  CZ  TYR A  44      -0.298 -11.237   3.332  1.00  0.00           C
ATOM    679  OH  TYR A  44      -1.072 -11.877   4.250  1.00  0.00           O
ATOM      0  H   TYR A  44       3.882  -7.643  -0.773  1.00  0.00           H   new
ATOM      0  HA  TYR A  44       0.975  -7.819  -0.275  1.00  0.00           H   new
ATOM      0  HB2 TYR A  44       2.037  -9.927  -0.629  1.00  0.00           H   new
ATOM      0  HB3 TYR A  44       3.266  -9.568   0.567  1.00  0.00           H   new
ATOM      0  HD1 TYR A  44      -0.483  -9.727   0.271  1.00  0.00           H   new
ATOM      0  HD2 TYR A  44       2.947 -10.318   2.799  1.00  0.00           H   new
ATOM      0  HE1 TYR A  44      -1.921 -10.865   1.947  1.00  0.00           H   new
ATOM      0  HE2 TYR A  44       1.509 -11.388   4.514  1.00  0.00           H   new
ATOM      0  HH  TYR A  44      -0.520 -12.144   5.014  1.00  0.00           H   new
ATOM    689  N   ASN A  45       1.102  -6.400   1.707  1.00  0.00           N
ATOM    690  CA  ASN A  45       0.967  -5.634   2.919  1.00  0.00           C
ATOM    691  C   ASN A  45       0.473  -6.554   4.026  1.00  0.00           C
ATOM    692  O   ASN A  45      -0.725  -6.532   4.332  1.00  0.00           O
ATOM    693  CB  ASN A  45      -0.010  -4.491   2.646  1.00  0.00           C
ATOM    694  CG  ASN A  45      -0.173  -3.576   3.846  1.00  0.00           C
ATOM    695  OD1 ASN A  45       0.795  -3.230   4.515  1.00  0.00           O
ATOM    696  ND2 ASN A  45      -1.391  -3.132   4.114  1.00  0.00           N
ATOM      0  H   ASN A  45       0.280  -6.334   1.107  1.00  0.00           H   new
ATOM      0  HA  ASN A  45       1.918  -5.209   3.239  1.00  0.00           H   new
ATOM      0  HB2 ASN A  45       0.342  -3.910   1.794  1.00  0.00           H   new
ATOM      0  HB3 ASN A  45      -0.981  -4.903   2.371  1.00  0.00           H   new
ATOM      0 HD21 ASN A  45      -1.540  -2.488   4.891  1.00  0.00           H   new
ATOM      0 HD22 ASN A  45      -2.181  -3.434   3.544  1.00  0.00           H   new
ATOM    703  N   ALA A  46       1.379  -7.327   4.640  1.00  0.00           N
ATOM    704  CA  ALA A  46       1.106  -8.203   5.779  1.00  0.00           C
ATOM    705  C   ALA A  46       0.237  -7.509   6.837  1.00  0.00           C
ATOM    706  O   ALA A  46      -0.686  -8.115   7.382  1.00  0.00           O
ATOM    707  CB  ALA A  46       2.432  -8.629   6.409  1.00  0.00           C
ATOM      0  H   ALA A  46       2.355  -7.358   4.344  1.00  0.00           H   new
ATOM      0  HA  ALA A  46       0.557  -9.072   5.416  1.00  0.00           H   new
ATOM      0  HB1 ALA A  46       2.237  -9.283   7.259  1.00  0.00           H   new
ATOM      0  HB2 ALA A  46       3.031  -9.162   5.671  1.00  0.00           H   new
ATOM      0  HB3 ALA A  46       2.975  -7.746   6.747  1.00  0.00           H   new
ATOM    713  N   GLN A  47       0.481  -6.206   7.032  1.00  0.00           N
ATOM    714  CA  GLN A  47      -0.185  -5.299   7.964  1.00  0.00           C
ATOM    715  C   GLN A  47      -1.712  -5.460   7.961  1.00  0.00           C
ATOM    716  O   GLN A  47      -2.337  -5.474   9.028  1.00  0.00           O
ATOM    717  CB  GLN A  47       0.182  -3.851   7.564  1.00  0.00           C
ATOM    718  CG  GLN A  47       0.470  -2.989   8.779  1.00  0.00           C
ATOM    719  CD  GLN A  47       0.819  -1.560   8.367  1.00  0.00           C
ATOM    720  OE1 GLN A  47       0.019  -0.866   7.752  1.00  0.00           O
ATOM    721  NE2 GLN A  47       2.028  -1.093   8.618  1.00  0.00           N
ATOM      0  H   GLN A  47       1.206  -5.726   6.499  1.00  0.00           H   new
ATOM      0  HA  GLN A  47       0.153  -5.536   8.973  1.00  0.00           H   new
ATOM      0  HB2 GLN A  47       1.055  -3.864   6.912  1.00  0.00           H   new
ATOM      0  HB3 GLN A  47      -0.636  -3.413   6.993  1.00  0.00           H   new
ATOM      0  HG2 GLN A  47      -0.399  -2.980   9.437  1.00  0.00           H   new
ATOM      0  HG3 GLN A  47       1.295  -3.419   9.347  1.00  0.00           H   new
ATOM      0 HE21 GLN A  47       2.700  -1.665   9.130  1.00  0.00           H   new
ATOM      0 HE22 GLN A  47       2.290  -0.160   8.300  1.00  0.00           H   new
ATOM    730  N   SER A  48      -2.300  -5.586   6.767  1.00  0.00           N
ATOM    731  CA  SER A  48      -3.723  -5.792   6.545  1.00  0.00           C
ATOM    732  C   SER A  48      -3.960  -6.940   5.559  1.00  0.00           C
ATOM    733  O   SER A  48      -5.005  -6.990   4.918  1.00  0.00           O
ATOM    734  CB  SER A  48      -4.394  -4.479   6.092  1.00  0.00           C
ATOM    735  OG  SER A  48      -4.561  -3.613   7.198  1.00  0.00           O
ATOM      0  H   SER A  48      -1.770  -5.545   5.897  1.00  0.00           H   new
ATOM      0  HA  SER A  48      -4.189  -6.084   7.486  1.00  0.00           H   new
ATOM      0  HB2 SER A  48      -3.785  -3.994   5.329  1.00  0.00           H   new
ATOM      0  HB3 SER A  48      -5.362  -4.693   5.638  1.00  0.00           H   new
ATOM      0  HG  SER A  48      -4.986  -2.781   6.901  1.00  0.00           H   new
ATOM    741  N   GLN A  49      -2.993  -7.840   5.375  1.00  0.00           N
ATOM    742  CA  GLN A  49      -2.992  -8.916   4.382  1.00  0.00           C
ATOM    743  C   GLN A  49      -3.374  -8.420   2.970  1.00  0.00           C
ATOM    744  O   GLN A  49      -3.974  -9.162   2.191  1.00  0.00           O
ATOM    745  CB  GLN A  49      -3.905 -10.057   4.863  1.00  0.00           C
ATOM    746  CG  GLN A  49      -3.661 -10.569   6.293  1.00  0.00           C
ATOM    747  CD  GLN A  49      -4.858 -11.401   6.744  1.00  0.00           C
ATOM    748  OE1 GLN A  49      -5.969 -10.890   6.844  1.00  0.00           O
ATOM    749  NE2 GLN A  49      -4.686 -12.690   6.996  1.00  0.00           N
ATOM      0  H   GLN A  49      -2.146  -7.838   5.943  1.00  0.00           H   new
ATOM      0  HA  GLN A  49      -1.975  -9.296   4.289  1.00  0.00           H   new
ATOM      0  HB2 GLN A  49      -4.939  -9.720   4.792  1.00  0.00           H   new
ATOM      0  HB3 GLN A  49      -3.795 -10.896   4.176  1.00  0.00           H   new
ATOM      0  HG2 GLN A  49      -2.753 -11.171   6.326  1.00  0.00           H   new
ATOM      0  HG3 GLN A  49      -3.511  -9.729   6.971  1.00  0.00           H   new
ATOM      0 HE21 GLN A  49      -3.759 -13.107   6.911  1.00  0.00           H   new
ATOM      0 HE22 GLN A  49      -5.480 -13.265   7.275  1.00  0.00           H   new
ATOM    758  N   GLN A  50      -3.103  -7.149   2.658  1.00  0.00           N
ATOM    759  CA  GLN A  50      -3.572  -6.474   1.457  1.00  0.00           C
ATOM    760  C   GLN A  50      -2.526  -6.560   0.350  1.00  0.00           C
ATOM    761  O   GLN A  50      -1.385  -6.938   0.606  1.00  0.00           O
ATOM    762  CB  GLN A  50      -3.924  -5.016   1.813  1.00  0.00           C
ATOM    763  CG  GLN A  50      -5.272  -4.561   1.237  1.00  0.00           C
ATOM    764  CD  GLN A  50      -6.416  -5.520   1.559  1.00  0.00           C
ATOM    765  OE1 GLN A  50      -7.148  -5.959   0.687  1.00  0.00           O
ATOM    766  NE2 GLN A  50      -6.558  -5.943   2.799  1.00  0.00           N
ATOM      0  H   GLN A  50      -2.534  -6.549   3.255  1.00  0.00           H   new
ATOM      0  HA  GLN A  50      -4.469  -6.964   1.077  1.00  0.00           H   new
ATOM      0  HB2 GLN A  50      -3.945  -4.909   2.897  1.00  0.00           H   new
ATOM      0  HB3 GLN A  50      -3.138  -4.358   1.443  1.00  0.00           H   new
ATOM      0  HG2 GLN A  50      -5.513  -3.573   1.629  1.00  0.00           H   new
ATOM      0  HG3 GLN A  50      -5.183  -4.461   0.155  1.00  0.00           H   new
ATOM      0 HE21 GLN A  50      -5.950  -5.581   3.534  1.00  0.00           H   new
ATOM      0 HE22 GLN A  50      -7.276  -6.632   3.024  1.00  0.00           H   new
ATOM    775  N   TYR A  51      -2.890  -6.173  -0.870  1.00  0.00           N
ATOM    776  CA  TYR A  51      -1.943  -5.990  -1.967  1.00  0.00           C
ATOM    777  C   TYR A  51      -1.803  -4.494  -2.236  1.00  0.00           C
ATOM    778  O   TYR A  51      -2.786  -3.751  -2.135  1.00  0.00           O
ATOM    779  CB  TYR A  51      -2.441  -6.699  -3.238  1.00  0.00           C
ATOM    780  CG  TYR A  51      -2.123  -8.181  -3.359  1.00  0.00           C
ATOM    781  CD1 TYR A  51      -2.258  -9.064  -2.268  1.00  0.00           C
ATOM    782  CD2 TYR A  51      -1.688  -8.680  -4.602  1.00  0.00           C
ATOM    783  CE1 TYR A  51      -1.917 -10.420  -2.403  1.00  0.00           C
ATOM    784  CE2 TYR A  51      -1.344 -10.032  -4.750  1.00  0.00           C
ATOM    785  CZ  TYR A  51      -1.451 -10.906  -3.647  1.00  0.00           C
ATOM    786  OH  TYR A  51      -1.048 -12.202  -3.768  1.00  0.00           O
ATOM      0  H   TYR A  51      -3.857  -5.976  -1.127  1.00  0.00           H   new
ATOM      0  HA  TYR A  51      -0.980  -6.421  -1.692  1.00  0.00           H   new
ATOM      0  HB2 TYR A  51      -3.523  -6.577  -3.295  1.00  0.00           H   new
ATOM      0  HB3 TYR A  51      -2.017  -6.188  -4.102  1.00  0.00           H   new
ATOM      0  HD1 TYR A  51      -2.626  -8.695  -1.322  1.00  0.00           H   new
ATOM      0  HD2 TYR A  51      -1.619  -8.015  -5.450  1.00  0.00           H   new
ATOM      0  HE1 TYR A  51      -2.010 -11.089  -1.560  1.00  0.00           H   new
ATOM      0  HE2 TYR A  51      -0.999 -10.402  -5.704  1.00  0.00           H   new
ATOM      0  HH  TYR A  51      -0.759 -12.370  -4.689  1.00  0.00           H   new
ATOM    796  N   LEU A  52      -0.595  -4.067  -2.598  1.00  0.00           N
ATOM    797  CA  LEU A  52      -0.195  -2.693  -2.890  1.00  0.00           C
ATOM    798  C   LEU A  52       0.803  -2.736  -4.060  1.00  0.00           C
ATOM    799  O   LEU A  52       1.159  -3.818  -4.533  1.00  0.00           O
ATOM    800  CB  LEU A  52       0.470  -2.063  -1.646  1.00  0.00           C
ATOM    801  CG  LEU A  52      -0.365  -2.002  -0.347  1.00  0.00           C
ATOM    802  CD1 LEU A  52       0.493  -1.452   0.791  1.00  0.00           C
ATOM    803  CD2 LEU A  52      -1.610  -1.118  -0.413  1.00  0.00           C
ATOM      0  H   LEU A  52       0.184  -4.717  -2.702  1.00  0.00           H   new
ATOM      0  HA  LEU A  52      -1.063  -2.089  -3.154  1.00  0.00           H   new
ATOM      0  HB2 LEU A  52       1.383  -2.620  -1.434  1.00  0.00           H   new
ATOM      0  HB3 LEU A  52       0.769  -1.047  -1.902  1.00  0.00           H   new
ATOM      0  HG  LEU A  52      -0.693  -3.029  -0.188  1.00  0.00           H   new
ATOM      0 HD11 LEU A  52      -0.099  -1.410   1.705  1.00  0.00           H   new
ATOM      0 HD12 LEU A  52       1.354  -2.103   0.945  1.00  0.00           H   new
ATOM      0 HD13 LEU A  52       0.837  -0.450   0.536  1.00  0.00           H   new
ATOM      0 HD21 LEU A  52      -2.125  -1.143   0.547  1.00  0.00           H   new
ATOM      0 HD22 LEU A  52      -1.317  -0.093  -0.641  1.00  0.00           H   new
ATOM      0 HD23 LEU A  52      -2.277  -1.486  -1.192  1.00  0.00           H   new
ATOM    815  N   TYR A  53       1.310  -1.589  -4.508  1.00  0.00           N
ATOM    816  CA  TYR A  53       2.441  -1.489  -5.422  1.00  0.00           C
ATOM    817  C   TYR A  53       3.385  -0.390  -4.922  1.00  0.00           C
ATOM    818  O   TYR A  53       2.935   0.594  -4.325  1.00  0.00           O
ATOM    819  CB  TYR A  53       1.960  -1.284  -6.875  1.00  0.00           C
ATOM    820  CG  TYR A  53       1.345   0.061  -7.249  1.00  0.00           C
ATOM    821  CD1 TYR A  53       0.048   0.432  -6.830  1.00  0.00           C
ATOM    822  CD2 TYR A  53       2.059   0.926  -8.100  1.00  0.00           C
ATOM    823  CE1 TYR A  53      -0.500   1.671  -7.196  1.00  0.00           C
ATOM    824  CE2 TYR A  53       1.514   2.162  -8.486  1.00  0.00           C
ATOM    825  CZ  TYR A  53       0.253   2.567  -7.997  1.00  0.00           C
ATOM    826  OH  TYR A  53      -0.201   3.825  -8.259  1.00  0.00           O
ATOM      0  H   TYR A  53       0.934  -0.681  -4.237  1.00  0.00           H   new
ATOM      0  HA  TYR A  53       3.004  -2.422  -5.437  1.00  0.00           H   new
ATOM      0  HB2 TYR A  53       2.811  -1.456  -7.534  1.00  0.00           H   new
ATOM      0  HB3 TYR A  53       1.225  -2.058  -7.095  1.00  0.00           H   new
ATOM      0  HD1 TYR A  53      -0.529  -0.247  -6.220  1.00  0.00           H   new
ATOM      0  HD2 TYR A  53       3.035   0.636  -8.460  1.00  0.00           H   new
ATOM      0  HE1 TYR A  53      -1.493   1.942  -6.868  1.00  0.00           H   new
ATOM      0  HE2 TYR A  53       2.062   2.805  -9.159  1.00  0.00           H   new
ATOM      0  HH  TYR A  53       0.541   4.462  -8.188  1.00  0.00           H   new
ATOM    836  N   TRP A  54       4.696  -0.566  -5.124  1.00  0.00           N
ATOM    837  CA  TRP A  54       5.682   0.507  -5.000  1.00  0.00           C
ATOM    838  C   TRP A  54       5.486   1.393  -6.232  1.00  0.00           C
ATOM    839  O   TRP A  54       5.379   0.870  -7.347  1.00  0.00           O
ATOM    840  CB  TRP A  54       7.109  -0.087  -4.934  1.00  0.00           C
ATOM    841  CG  TRP A  54       8.269   0.873  -4.899  1.00  0.00           C
ATOM    842  CD1 TRP A  54       9.234   0.992  -5.841  1.00  0.00           C
ATOM    843  CD2 TRP A  54       8.612   1.860  -3.885  1.00  0.00           C
ATOM    844  NE1 TRP A  54      10.111   2.003  -5.509  1.00  0.00           N
ATOM    845  CE2 TRP A  54       9.757   2.595  -4.323  1.00  0.00           C
ATOM    846  CE3 TRP A  54       8.012   2.281  -2.681  1.00  0.00           C
ATOM    847  CZ2 TRP A  54      10.240   3.722  -3.640  1.00  0.00           C
ATOM    848  CZ3 TRP A  54       8.501   3.386  -1.963  1.00  0.00           C
ATOM    849  CH2 TRP A  54       9.593   4.124  -2.456  1.00  0.00           C
ATOM      0  H   TRP A  54       5.103  -1.466  -5.380  1.00  0.00           H   new
ATOM      0  HA  TRP A  54       5.553   1.088  -4.087  1.00  0.00           H   new
ATOM      0  HB2 TRP A  54       7.169  -0.717  -4.046  1.00  0.00           H   new
ATOM      0  HB3 TRP A  54       7.240  -0.739  -5.797  1.00  0.00           H   new
ATOM      0  HD1 TRP A  54       9.307   0.381  -6.728  1.00  0.00           H   new
ATOM      0  HE1 TRP A  54      10.917   2.275  -6.071  1.00  0.00           H   new
ATOM      0  HE3 TRP A  54       7.157   1.742  -2.301  1.00  0.00           H   new
ATOM      0  HZ2 TRP A  54      11.091   4.270  -4.015  1.00  0.00           H   new
ATOM      0  HZ3 TRP A  54       8.037   3.670  -1.030  1.00  0.00           H   new
ATOM      0  HH2 TRP A  54       9.935   5.000  -1.925  1.00  0.00           H   new
ATOM    860  N   ASP A  55       5.425   2.712  -6.039  1.00  0.00           N
ATOM    861  CA  ASP A  55       5.125   3.681  -7.098  1.00  0.00           C
ATOM    862  C   ASP A  55       6.175   4.772  -7.080  1.00  0.00           C
ATOM    863  O   ASP A  55       5.967   5.861  -6.536  1.00  0.00           O
ATOM    864  CB  ASP A  55       3.722   4.264  -6.912  1.00  0.00           C
ATOM    865  CG  ASP A  55       3.245   5.135  -8.075  1.00  0.00           C
ATOM    866  OD1 ASP A  55       3.966   5.248  -9.093  1.00  0.00           O
ATOM    867  OD2 ASP A  55       2.104   5.646  -8.022  1.00  0.00           O
ATOM      0  H   ASP A  55       5.585   3.145  -5.129  1.00  0.00           H   new
ATOM      0  HA  ASP A  55       5.146   3.182  -8.067  1.00  0.00           H   new
ATOM      0  HB2 ASP A  55       3.016   3.445  -6.773  1.00  0.00           H   new
ATOM      0  HB3 ASP A  55       3.706   4.858  -5.998  1.00  0.00           H   new
ATOM    872  N   GLY A  56       7.360   4.451  -7.608  1.00  0.00           N
ATOM    873  CA  GLY A  56       8.525   5.321  -7.617  1.00  0.00           C
ATOM    874  C   GLY A  56       8.265   6.667  -8.306  1.00  0.00           C
ATOM    875  O   GLY A  56       9.100   7.566  -8.204  1.00  0.00           O
ATOM      0  H   GLY A  56       7.533   3.550  -8.053  1.00  0.00           H   new
ATOM      0  HA2 GLY A  56       8.845   5.501  -6.591  1.00  0.00           H   new
ATOM      0  HA3 GLY A  56       9.346   4.813  -8.123  1.00  0.00           H   new
ATOM    879  N   GLU A  57       7.103   6.861  -8.940  1.00  0.00           N
ATOM    880  CA  GLU A  57       6.674   8.165  -9.427  1.00  0.00           C
ATOM    881  C   GLU A  57       6.448   9.105  -8.236  1.00  0.00           C
ATOM    882  O   GLU A  57       6.675  10.309  -8.347  1.00  0.00           O
ATOM    883  CB  GLU A  57       5.376   8.000 -10.225  1.00  0.00           C
ATOM    884  CG  GLU A  57       5.517   7.049 -11.428  1.00  0.00           C
ATOM    885  CD  GLU A  57       6.185   7.670 -12.658  1.00  0.00           C
ATOM    886  OE1 GLU A  57       6.705   8.804 -12.605  1.00  0.00           O
ATOM    887  OE2 GLU A  57       6.207   6.985 -13.713  1.00  0.00           O
ATOM      0  H   GLU A  57       6.436   6.112  -9.127  1.00  0.00           H   new
ATOM      0  HA  GLU A  57       7.441   8.592 -10.073  1.00  0.00           H   new
ATOM      0  HB2 GLU A  57       4.596   7.624  -9.563  1.00  0.00           H   new
ATOM      0  HB3 GLU A  57       5.049   8.977 -10.580  1.00  0.00           H   new
ATOM      0  HG2 GLU A  57       6.094   6.177 -11.119  1.00  0.00           H   new
ATOM      0  HG3 GLU A  57       4.526   6.692 -11.710  1.00  0.00           H   new
ATOM    894  N   ARG A  58       6.006   8.567  -7.095  1.00  0.00           N
ATOM    895  CA  ARG A  58       5.622   9.276  -5.877  1.00  0.00           C
ATOM    896  C   ARG A  58       6.473   8.906  -4.664  1.00  0.00           C
ATOM    897  O   ARG A  58       6.421   9.634  -3.673  1.00  0.00           O
ATOM    898  CB  ARG A  58       4.150   8.968  -5.568  1.00  0.00           C
ATOM    899  CG  ARG A  58       3.199   9.618  -6.577  1.00  0.00           C
ATOM    900  CD  ARG A  58       1.746   9.341  -6.187  1.00  0.00           C
ATOM    901  NE  ARG A  58       0.811  10.211  -6.924  1.00  0.00           N
ATOM    902  CZ  ARG A  58      -0.366   9.839  -7.444  1.00  0.00           C
ATOM    903  NH1 ARG A  58      -0.815   8.594  -7.312  1.00  0.00           N
ATOM    904  NH2 ARG A  58      -1.121  10.708  -8.099  1.00  0.00           N
ATOM      0  H   ARG A  58       5.901   7.557  -6.994  1.00  0.00           H   new
ATOM      0  HA  ARG A  58       5.781  10.338  -6.062  1.00  0.00           H   new
ATOM      0  HB2 ARG A  58       3.998   7.889  -5.571  1.00  0.00           H   new
ATOM      0  HB3 ARG A  58       3.909   9.321  -4.565  1.00  0.00           H   new
ATOM      0  HG2 ARG A  58       3.375  10.693  -6.613  1.00  0.00           H   new
ATOM      0  HG3 ARG A  58       3.396   9.229  -7.576  1.00  0.00           H   new
ATOM      0  HD2 ARG A  58       1.507   8.297  -6.388  1.00  0.00           H   new
ATOM      0  HD3 ARG A  58       1.620   9.496  -5.115  1.00  0.00           H   new
ATOM      0  HE  ARG A  58       1.086  11.185  -7.049  1.00  0.00           H   new
ATOM      0 HH11 ARG A  58      -0.260   7.903  -6.807  1.00  0.00           H   new
ATOM      0 HH12 ARG A  58      -1.714   8.331  -7.715  1.00  0.00           H   new
ATOM      0 HH21 ARG A  58      -0.808  11.672  -8.212  1.00  0.00           H   new
ATOM      0 HH22 ARG A  58      -2.015  10.413  -8.491  1.00  0.00           H   new
ATOM    918  N   ARG A  59       7.267   7.830  -4.718  1.00  0.00           N
ATOM    919  CA  ARG A  59       8.032   7.296  -3.581  1.00  0.00           C
ATOM    920  C   ARG A  59       7.106   6.976  -2.410  1.00  0.00           C
ATOM    921  O   ARG A  59       7.254   7.519  -1.313  1.00  0.00           O
ATOM    922  CB  ARG A  59       9.195   8.198  -3.166  1.00  0.00           C
ATOM    923  CG  ARG A  59      10.200   8.461  -4.293  1.00  0.00           C
ATOM    924  CD  ARG A  59      11.200   9.494  -3.751  1.00  0.00           C
ATOM    925  NE  ARG A  59      12.133   9.983  -4.769  1.00  0.00           N
ATOM    926  CZ  ARG A  59      13.331  10.538  -4.558  1.00  0.00           C
ATOM    927  NH1 ARG A  59      13.901  10.534  -3.355  1.00  0.00           N
ATOM    928  NH2 ARG A  59      13.942  11.122  -5.577  1.00  0.00           N
ATOM      0  H   ARG A  59       7.400   7.292  -5.574  1.00  0.00           H   new
ATOM      0  HA  ARG A  59       8.491   6.365  -3.913  1.00  0.00           H   new
ATOM      0  HB2 ARG A  59       8.798   9.150  -2.815  1.00  0.00           H   new
ATOM      0  HB3 ARG A  59       9.716   7.741  -2.325  1.00  0.00           H   new
ATOM      0  HG2 ARG A  59      10.710   7.542  -4.581  1.00  0.00           H   new
ATOM      0  HG3 ARG A  59       9.696   8.838  -5.183  1.00  0.00           H   new
ATOM      0  HD2 ARG A  59      10.651  10.339  -3.335  1.00  0.00           H   new
ATOM      0  HD3 ARG A  59      11.766   9.048  -2.933  1.00  0.00           H   new
ATOM      0  HE  ARG A  59      11.838   9.890  -5.741  1.00  0.00           H   new
ATOM      0 HH11 ARG A  59      13.423  10.100  -2.565  1.00  0.00           H   new
ATOM      0 HH12 ARG A  59      14.816  10.965  -3.223  1.00  0.00           H   new
ATOM      0 HH21 ARG A  59      13.498  11.141  -6.495  1.00  0.00           H   new
ATOM      0 HH22 ARG A  59      14.857  11.553  -5.444  1.00  0.00           H   new
ATOM    942  N   THR A  60       6.146   6.086  -2.630  1.00  0.00           N
ATOM    943  CA  THR A  60       5.260   5.589  -1.592  1.00  0.00           C
ATOM    944  C   THR A  60       4.758   4.187  -1.988  1.00  0.00           C
ATOM    945  O   THR A  60       5.127   3.665  -3.043  1.00  0.00           O
ATOM    946  CB  THR A  60       4.151   6.633  -1.360  1.00  0.00           C
ATOM    947  OG1 THR A  60       3.536   6.401  -0.108  1.00  0.00           O
ATOM    948  CG2 THR A  60       3.130   6.694  -2.502  1.00  0.00           C
ATOM      0  H   THR A  60       5.961   5.685  -3.549  1.00  0.00           H   new
ATOM      0  HA  THR A  60       5.767   5.461  -0.636  1.00  0.00           H   new
ATOM      0  HB  THR A  60       4.619   7.617  -1.348  1.00  0.00           H   new
ATOM      0  HG1 THR A  60       4.221   6.184   0.558  1.00  0.00           H   new
ATOM      0 HG21 THR A  60       2.376   7.449  -2.276  1.00  0.00           H   new
ATOM      0 HG22 THR A  60       3.638   6.955  -3.431  1.00  0.00           H   new
ATOM      0 HG23 THR A  60       2.649   5.722  -2.612  1.00  0.00           H   new
ATOM    956  N   TYR A  61       3.914   3.570  -1.159  1.00  0.00           N
ATOM    957  CA  TYR A  61       3.235   2.319  -1.482  1.00  0.00           C
ATOM    958  C   TYR A  61       1.734   2.576  -1.516  1.00  0.00           C
ATOM    959  O   TYR A  61       1.157   3.046  -0.533  1.00  0.00           O
ATOM    960  CB  TYR A  61       3.572   1.222  -0.473  1.00  0.00           C
ATOM    961  CG  TYR A  61       5.036   0.832  -0.427  1.00  0.00           C
ATOM    962  CD1 TYR A  61       5.551  -0.163  -1.283  1.00  0.00           C
ATOM    963  CD2 TYR A  61       5.879   1.451   0.512  1.00  0.00           C
ATOM    964  CE1 TYR A  61       6.885  -0.592  -1.140  1.00  0.00           C
ATOM    965  CE2 TYR A  61       7.221   1.061   0.617  1.00  0.00           C
ATOM    966  CZ  TYR A  61       7.726   0.007  -0.175  1.00  0.00           C
ATOM    967  OH  TYR A  61       9.025  -0.384  -0.021  1.00  0.00           O
ATOM      0  H   TYR A  61       3.682   3.931  -0.234  1.00  0.00           H   new
ATOM      0  HA  TYR A  61       3.575   1.970  -2.457  1.00  0.00           H   new
ATOM      0  HB2 TYR A  61       3.267   1.554   0.519  1.00  0.00           H   new
ATOM      0  HB3 TYR A  61       2.981   0.337  -0.708  1.00  0.00           H   new
ATOM      0  HD1 TYR A  61       4.923  -0.596  -2.048  1.00  0.00           H   new
ATOM      0  HD2 TYR A  61       5.492   2.229   1.154  1.00  0.00           H   new
ATOM      0  HE1 TYR A  61       7.267  -1.382  -1.770  1.00  0.00           H   new
ATOM      0  HE2 TYR A  61       7.874   1.571   1.310  1.00  0.00           H   new
ATOM      0  HH  TYR A  61       9.055  -1.337   0.205  1.00  0.00           H   new
ATOM    977  N   VAL A  62       1.102   2.274  -2.644  1.00  0.00           N
ATOM    978  CA  VAL A  62      -0.271   2.645  -2.987  1.00  0.00           C
ATOM    979  C   VAL A  62      -1.088   1.396  -3.334  1.00  0.00           C
ATOM    980  O   VAL A  62      -0.500   0.357  -3.630  1.00  0.00           O
ATOM    981  CB  VAL A  62      -0.275   3.713  -4.112  1.00  0.00           C
ATOM    982  CG1 VAL A  62      -0.393   5.111  -3.499  1.00  0.00           C
ATOM    983  CG2 VAL A  62       1.001   3.721  -4.972  1.00  0.00           C
ATOM      0  H   VAL A  62       1.554   1.736  -3.384  1.00  0.00           H   new
ATOM      0  HA  VAL A  62      -0.755   3.102  -2.124  1.00  0.00           H   new
ATOM      0  HB  VAL A  62      -1.122   3.455  -4.748  1.00  0.00           H   new
ATOM      0 HG11 VAL A  62      -0.395   5.858  -4.293  1.00  0.00           H   new
ATOM      0 HG12 VAL A  62      -1.321   5.182  -2.931  1.00  0.00           H   new
ATOM      0 HG13 VAL A  62       0.453   5.290  -2.835  1.00  0.00           H   new
ATOM      0 HG21 VAL A  62       0.920   4.495  -5.735  1.00  0.00           H   new
ATOM      0 HG22 VAL A  62       1.865   3.924  -4.339  1.00  0.00           H   new
ATOM      0 HG23 VAL A  62       1.123   2.750  -5.451  1.00  0.00           H   new
ATOM    993  N   PRO A  63      -2.427   1.441  -3.226  1.00  0.00           N
ATOM    994  CA  PRO A  63      -3.252   0.253  -3.370  1.00  0.00           C
ATOM    995  C   PRO A  63      -3.300  -0.204  -4.824  1.00  0.00           C
ATOM    996  O   PRO A  63      -3.567   0.593  -5.726  1.00  0.00           O
ATOM    997  CB  PRO A  63      -4.621   0.630  -2.809  1.00  0.00           C
ATOM    998  CG  PRO A  63      -4.687   2.145  -2.951  1.00  0.00           C
ATOM    999  CD  PRO A  63      -3.232   2.589  -2.835  1.00  0.00           C
ATOM      0  HA  PRO A  63      -2.849  -0.601  -2.826  1.00  0.00           H   new
ATOM      0  HB2 PRO A  63      -5.424   0.144  -3.363  1.00  0.00           H   new
ATOM      0  HB3 PRO A  63      -4.721   0.324  -1.768  1.00  0.00           H   new
ATOM      0  HG2 PRO A  63      -5.119   2.438  -3.908  1.00  0.00           H   new
ATOM      0  HG3 PRO A  63      -5.304   2.593  -2.172  1.00  0.00           H   new
ATOM      0  HD2 PRO A  63      -3.033   3.443  -3.482  1.00  0.00           H   new
ATOM      0  HD3 PRO A  63      -2.999   2.899  -1.816  1.00  0.00           H   new
ATOM   1007  N   ALA A  64      -3.058  -1.500  -5.043  1.00  0.00           N
ATOM   1008  CA  ALA A  64      -2.989  -2.105  -6.370  1.00  0.00           C
ATOM   1009  C   ALA A  64      -4.217  -2.986  -6.640  1.00  0.00           C
ATOM   1010  O   ALA A  64      -4.132  -4.072  -7.225  1.00  0.00           O
ATOM   1011  CB  ALA A  64      -1.696  -2.883  -6.523  1.00  0.00           C
ATOM      0  H   ALA A  64      -2.902  -2.167  -4.287  1.00  0.00           H   new
ATOM      0  HA  ALA A  64      -2.995  -1.311  -7.117  1.00  0.00           H   new
ATOM      0  HB1 ALA A  64      -1.656  -3.330  -7.516  1.00  0.00           H   new
ATOM      0  HB2 ALA A  64      -0.849  -2.210  -6.393  1.00  0.00           H   new
ATOM      0  HB3 ALA A  64      -1.653  -3.669  -5.770  1.00  0.00           H   new