USER  MOD reduce.3.24.130724 H: found=0, std=0, add=438, rem=0, adj=12
USER  MOD reduce.3.24.130724 removed 439 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  56 SER OG  :   rot  180:sc=  -0.318
USER  MOD Set 1.2: A  59 THR OG1 :   rot -160:sc=  -0.779
USER  MOD Set 2.1: A  53 LYS NZ  :NH3+   -151:sc=    1.41   (180deg=0.832)
USER  MOD Set 2.2: A  64 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  24 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  26 TYR OH  :   rot -101:sc=   0.139
USER  MOD Single : A  28 SER OG  :   rot -170:sc=   0.241
USER  MOD Single : A  32 SER OG  :   rot   31:sc=  0.0257
USER  MOD Single : A  41 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  46 SER OG  :   rot   24:sc=  0.0416
USER  MOD Single : A  58 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  63 SER OG  :   rot  180:sc=-0.00834
USER  MOD Single : A  69 CYS SG  :   rot  180:sc=   -1.48
USER  MOD -----------------------------------------------------------------
ATOM    205  N   ASP A  18      -1.334 -10.573  -2.284  1.00  0.00           N
ATOM    206  CA  ASP A  18      -1.793  -9.964  -1.041  1.00  0.00           C
ATOM    207  C   ASP A  18      -2.003  -8.463  -1.215  1.00  0.00           C
ATOM    208  O   ASP A  18      -1.185  -7.779  -1.831  1.00  0.00           O
ATOM    209  CB  ASP A  18      -0.787 -10.224   0.081  1.00  0.00           C
ATOM    210  CG  ASP A  18      -0.980 -11.581   0.729  1.00  0.00           C
ATOM    211  OD1 ASP A  18      -1.889 -11.711   1.575  1.00  0.00           O
ATOM    212  OD2 ASP A  18      -0.220 -12.514   0.391  1.00  0.00           O
ATOM      0  HA  ASP A  18      -2.748 -10.417  -0.775  1.00  0.00           H   new
ATOM      0  HB2 ASP A  18       0.225 -10.156  -0.319  1.00  0.00           H   new
ATOM      0  HB3 ASP A  18      -0.883  -9.446   0.838  1.00  0.00           H   new
ATOM    217  N   PHE A  19      -3.104  -7.957  -0.670  1.00  0.00           N
ATOM    218  CA  PHE A  19      -3.422  -6.538  -0.767  1.00  0.00           C
ATOM    219  C   PHE A  19      -3.279  -5.854   0.589  1.00  0.00           C
ATOM    220  O   PHE A  19      -3.465  -6.478   1.635  1.00  0.00           O
ATOM    221  CB  PHE A  19      -4.844  -6.347  -1.300  1.00  0.00           C
ATOM    222  CG  PHE A  19      -5.099  -7.063  -2.596  1.00  0.00           C
ATOM    223  CD1 PHE A  19      -4.563  -6.588  -3.782  1.00  0.00           C
ATOM    224  CD2 PHE A  19      -5.876  -8.210  -2.628  1.00  0.00           C
ATOM    225  CE1 PHE A  19      -4.796  -7.244  -4.976  1.00  0.00           C
ATOM    226  CE2 PHE A  19      -6.112  -8.870  -3.819  1.00  0.00           C
ATOM    227  CZ  PHE A  19      -5.573  -8.386  -4.994  1.00  0.00           C
ATOM      0  H   PHE A  19      -3.791  -8.509  -0.156  1.00  0.00           H   new
ATOM      0  HA  PHE A  19      -2.717  -6.080  -1.461  1.00  0.00           H   new
ATOM      0  HB2 PHE A  19      -5.554  -6.701  -0.553  1.00  0.00           H   new
ATOM      0  HB3 PHE A  19      -5.032  -5.282  -1.439  1.00  0.00           H   new
ATOM      0  HD1 PHE A  19      -3.956  -5.695  -3.773  1.00  0.00           H   new
ATOM      0  HD2 PHE A  19      -6.302  -8.592  -1.712  1.00  0.00           H   new
ATOM      0  HE1 PHE A  19      -4.371  -6.864  -5.894  1.00  0.00           H   new
ATOM      0  HE2 PHE A  19      -6.718  -9.764  -3.830  1.00  0.00           H   new
ATOM      0  HZ  PHE A  19      -5.758  -8.899  -5.926  1.00  0.00           H   new
ATOM    237  N   LEU A  20      -2.947  -4.568   0.565  1.00  0.00           N
ATOM    238  CA  LEU A  20      -2.778  -3.798   1.792  1.00  0.00           C
ATOM    239  C   LEU A  20      -3.575  -2.499   1.734  1.00  0.00           C
ATOM    240  O   LEU A  20      -3.287  -1.618   0.924  1.00  0.00           O
ATOM    241  CB  LEU A  20      -1.298  -3.491   2.026  1.00  0.00           C
ATOM    242  CG  LEU A  20      -0.318  -4.615   1.687  1.00  0.00           C
ATOM    243  CD1 LEU A  20       1.086  -4.062   1.502  1.00  0.00           C
ATOM    244  CD2 LEU A  20      -0.334  -5.682   2.772  1.00  0.00           C
ATOM      0  H   LEU A  20      -2.789  -4.036  -0.291  1.00  0.00           H   new
ATOM      0  HA  LEU A  20      -3.154  -4.397   2.621  1.00  0.00           H   new
ATOM      0  HB2 LEU A  20      -1.032  -2.614   1.436  1.00  0.00           H   new
ATOM      0  HB3 LEU A  20      -1.164  -3.223   3.074  1.00  0.00           H   new
ATOM      0  HG  LEU A  20      -0.632  -5.074   0.749  1.00  0.00           H   new
ATOM      0 HD11 LEU A  20       1.769  -4.877   1.261  1.00  0.00           H   new
ATOM      0 HD12 LEU A  20       1.087  -3.336   0.689  1.00  0.00           H   new
ATOM      0 HD13 LEU A  20       1.410  -3.577   2.423  1.00  0.00           H   new
ATOM      0 HD21 LEU A  20       0.369  -6.474   2.514  1.00  0.00           H   new
ATOM      0 HD22 LEU A  20      -0.046  -5.237   3.724  1.00  0.00           H   new
ATOM      0 HD23 LEU A  20      -1.337  -6.101   2.856  1.00  0.00           H   new
ATOM    256  N   ALA A  21      -4.578  -2.386   2.599  1.00  0.00           N
ATOM    257  CA  ALA A  21      -5.413  -1.193   2.649  1.00  0.00           C
ATOM    258  C   ALA A  21      -4.783  -0.117   3.527  1.00  0.00           C
ATOM    259  O   ALA A  21      -4.605  -0.308   4.730  1.00  0.00           O
ATOM    260  CB  ALA A  21      -6.804  -1.543   3.158  1.00  0.00           C
ATOM      0  H   ALA A  21      -4.832  -3.107   3.275  1.00  0.00           H   new
ATOM      0  HA  ALA A  21      -5.496  -0.797   1.637  1.00  0.00           H   new
ATOM      0  HB1 ALA A  21      -7.417  -0.642   3.190  1.00  0.00           H   new
ATOM      0  HB2 ALA A  21      -7.264  -2.271   2.489  1.00  0.00           H   new
ATOM      0  HB3 ALA A  21      -6.729  -1.967   4.159  1.00  0.00           H   new
ATOM    266  N   VAL A  22      -4.445   1.015   2.917  1.00  0.00           N
ATOM    267  CA  VAL A  22      -3.834   2.122   3.643  1.00  0.00           C
ATOM    268  C   VAL A  22      -4.693   2.540   4.832  1.00  0.00           C
ATOM    269  O   VAL A  22      -5.716   3.206   4.669  1.00  0.00           O
ATOM    270  CB  VAL A  22      -3.615   3.341   2.728  1.00  0.00           C
ATOM    271  CG1 VAL A  22      -3.071   4.517   3.525  1.00  0.00           C
ATOM    272  CG2 VAL A  22      -2.680   2.985   1.582  1.00  0.00           C
ATOM      0  H   VAL A  22      -4.584   1.189   1.922  1.00  0.00           H   new
ATOM      0  HA  VAL A  22      -2.867   1.769   4.003  1.00  0.00           H   new
ATOM      0  HB  VAL A  22      -4.576   3.634   2.305  1.00  0.00           H   new
ATOM      0 HG11 VAL A  22      -2.923   5.369   2.861  1.00  0.00           H   new
ATOM      0 HG12 VAL A  22      -3.781   4.786   4.307  1.00  0.00           H   new
ATOM      0 HG13 VAL A  22      -2.119   4.240   3.978  1.00  0.00           H   new
ATOM      0 HG21 VAL A  22      -2.536   3.858   0.945  1.00  0.00           H   new
ATOM      0 HG22 VAL A  22      -1.718   2.666   1.983  1.00  0.00           H   new
ATOM      0 HG23 VAL A  22      -3.115   2.176   0.996  1.00  0.00           H   new
ATOM    282  N   LEU A  23      -4.270   2.146   6.028  1.00  0.00           N
ATOM    283  CA  LEU A  23      -5.000   2.480   7.246  1.00  0.00           C
ATOM    284  C   LEU A  23      -4.963   3.982   7.508  1.00  0.00           C
ATOM    285  O   LEU A  23      -5.899   4.547   8.074  1.00  0.00           O
ATOM    286  CB  LEU A  23      -4.410   1.728   8.440  1.00  0.00           C
ATOM    287  CG  LEU A  23      -4.269   0.214   8.276  1.00  0.00           C
ATOM    288  CD1 LEU A  23      -3.158  -0.318   9.170  1.00  0.00           C
ATOM    289  CD2 LEU A  23      -5.586  -0.481   8.588  1.00  0.00           C
ATOM      0  H   LEU A  23      -3.425   1.595   6.180  1.00  0.00           H   new
ATOM      0  HA  LEU A  23      -6.039   2.179   7.112  1.00  0.00           H   new
ATOM      0  HB2 LEU A  23      -3.425   2.143   8.655  1.00  0.00           H   new
ATOM      0  HB3 LEU A  23      -5.035   1.922   9.311  1.00  0.00           H   new
ATOM      0  HG  LEU A  23      -4.006   0.002   7.239  1.00  0.00           H   new
ATOM      0 HD11 LEU A  23      -3.072  -1.397   9.040  1.00  0.00           H   new
ATOM      0 HD12 LEU A  23      -2.215   0.156   8.900  1.00  0.00           H   new
ATOM      0 HD13 LEU A  23      -3.391  -0.095  10.211  1.00  0.00           H   new
ATOM      0 HD21 LEU A  23      -5.467  -1.558   8.466  1.00  0.00           H   new
ATOM      0 HD22 LEU A  23      -5.879  -0.262   9.615  1.00  0.00           H   new
ATOM      0 HD23 LEU A  23      -6.357  -0.122   7.907  1.00  0.00           H   new
ATOM    301  N   SER A  24      -3.877   4.624   7.090  1.00  0.00           N
ATOM    302  CA  SER A  24      -3.717   6.061   7.281  1.00  0.00           C
ATOM    303  C   SER A  24      -2.670   6.623   6.324  1.00  0.00           C
ATOM    304  O   SER A  24      -1.503   6.233   6.364  1.00  0.00           O
ATOM    305  CB  SER A  24      -3.318   6.363   8.727  1.00  0.00           C
ATOM    306  OG  SER A  24      -3.021   7.739   8.896  1.00  0.00           O
ATOM      0  H   SER A  24      -3.095   4.172   6.617  1.00  0.00           H   new
ATOM      0  HA  SER A  24      -4.673   6.540   7.068  1.00  0.00           H   new
ATOM      0  HB2 SER A  24      -4.128   6.077   9.399  1.00  0.00           H   new
ATOM      0  HB3 SER A  24      -2.450   5.764   9.001  1.00  0.00           H   new
ATOM      0  HG  SER A  24      -2.770   7.907   9.828  1.00  0.00           H   new
ATOM    312  N   ASP A  25      -3.097   7.541   5.464  1.00  0.00           N
ATOM    313  CA  ASP A  25      -2.198   8.159   4.496  1.00  0.00           C
ATOM    314  C   ASP A  25      -0.797   8.318   5.080  1.00  0.00           C
ATOM    315  O   ASP A  25      -0.637   8.658   6.253  1.00  0.00           O
ATOM    316  CB  ASP A  25      -2.740   9.521   4.062  1.00  0.00           C
ATOM    317  CG  ASP A  25      -2.621  10.567   5.153  1.00  0.00           C
ATOM    318  OD1 ASP A  25      -2.882  10.231   6.327  1.00  0.00           O
ATOM    319  OD2 ASP A  25      -2.267  11.721   4.833  1.00  0.00           O
ATOM      0  H   ASP A  25      -4.060   7.874   5.417  1.00  0.00           H   new
ATOM      0  HA  ASP A  25      -2.138   7.506   3.625  1.00  0.00           H   new
ATOM      0  HB2 ASP A  25      -2.199   9.859   3.178  1.00  0.00           H   new
ATOM      0  HB3 ASP A  25      -3.786   9.417   3.775  1.00  0.00           H   new
ATOM    324  N   TYR A  26       0.214   8.068   4.256  1.00  0.00           N
ATOM    325  CA  TYR A  26       1.601   8.179   4.691  1.00  0.00           C
ATOM    326  C   TYR A  26       2.529   8.400   3.501  1.00  0.00           C
ATOM    327  O   TYR A  26       2.269   7.949   2.386  1.00  0.00           O
ATOM    328  CB  TYR A  26       2.021   6.921   5.453  1.00  0.00           C
ATOM    329  CG  TYR A  26       3.491   6.594   5.318  1.00  0.00           C
ATOM    330  CD1 TYR A  26       4.031   6.230   4.091  1.00  0.00           C
ATOM    331  CD2 TYR A  26       4.339   6.647   6.417  1.00  0.00           C
ATOM    332  CE1 TYR A  26       5.373   5.929   3.962  1.00  0.00           C
ATOM    333  CE2 TYR A  26       5.682   6.350   6.297  1.00  0.00           C
ATOM    334  CZ  TYR A  26       6.195   5.991   5.068  1.00  0.00           C
ATOM    335  OH  TYR A  26       7.533   5.692   4.945  1.00  0.00           O
ATOM      0  H   TYR A  26       0.099   7.787   3.282  1.00  0.00           H   new
ATOM      0  HA  TYR A  26       1.679   9.040   5.354  1.00  0.00           H   new
ATOM      0  HB2 TYR A  26       1.781   7.049   6.509  1.00  0.00           H   new
ATOM      0  HB3 TYR A  26       1.435   6.076   5.093  1.00  0.00           H   new
ATOM      0  HD1 TYR A  26       3.390   6.181   3.223  1.00  0.00           H   new
ATOM      0  HD2 TYR A  26       3.941   6.925   7.382  1.00  0.00           H   new
ATOM      0  HE1 TYR A  26       5.776   5.647   3.001  1.00  0.00           H   new
ATOM      0  HE2 TYR A  26       6.328   6.399   7.161  1.00  0.00           H   new
ATOM      0  HH  TYR A  26       7.696   4.781   5.268  1.00  0.00           H   new
ATOM    345  N   PRO A  27       3.640   9.112   3.743  1.00  0.00           N
ATOM    346  CA  PRO A  27       3.960   9.654   5.067  1.00  0.00           C
ATOM    347  C   PRO A  27       3.027  10.792   5.468  1.00  0.00           C
ATOM    348  O   PRO A  27       2.131  11.168   4.712  1.00  0.00           O
ATOM    349  CB  PRO A  27       5.392  10.170   4.902  1.00  0.00           C
ATOM    350  CG  PRO A  27       5.526  10.458   3.446  1.00  0.00           C
ATOM    351  CD  PRO A  27       4.670   9.441   2.743  1.00  0.00           C
ATOM      0  HA  PRO A  27       3.850   8.906   5.852  1.00  0.00           H   new
ATOM      0  HB2 PRO A  27       5.561  11.066   5.500  1.00  0.00           H   new
ATOM      0  HB3 PRO A  27       6.120   9.427   5.227  1.00  0.00           H   new
ATOM      0  HG2 PRO A  27       5.196  11.471   3.217  1.00  0.00           H   new
ATOM      0  HG3 PRO A  27       6.565  10.381   3.127  1.00  0.00           H   new
ATOM      0  HD2 PRO A  27       4.230   9.847   1.832  1.00  0.00           H   new
ATOM      0  HD3 PRO A  27       5.246   8.561   2.455  1.00  0.00           H   new
ATOM    359  N   SER A  28       3.243  11.335   6.662  1.00  0.00           N
ATOM    360  CA  SER A  28       2.419  12.428   7.164  1.00  0.00           C
ATOM    361  C   SER A  28       2.730  13.727   6.427  1.00  0.00           C
ATOM    362  O   SER A  28       3.806  13.904   5.856  1.00  0.00           O
ATOM    363  CB  SER A  28       2.643  12.614   8.666  1.00  0.00           C
ATOM    364  OG  SER A  28       3.649  13.580   8.916  1.00  0.00           O
ATOM      0  H   SER A  28       3.981  11.036   7.299  1.00  0.00           H   new
ATOM      0  HA  SER A  28       1.374  12.173   6.988  1.00  0.00           H   new
ATOM      0  HB2 SER A  28       1.712  12.923   9.140  1.00  0.00           H   new
ATOM      0  HB3 SER A  28       2.928  11.663   9.115  1.00  0.00           H   new
ATOM      0  HG  SER A  28       3.885  13.568   9.867  1.00  0.00           H   new
ATOM    370  N   PRO A  29       1.765  14.658   6.439  1.00  0.00           N
ATOM    371  CA  PRO A  29       1.911  15.958   5.777  1.00  0.00           C
ATOM    372  C   PRO A  29       2.923  16.856   6.481  1.00  0.00           C
ATOM    373  O   PRO A  29       3.112  18.011   6.099  1.00  0.00           O
ATOM    374  CB  PRO A  29       0.507  16.561   5.866  1.00  0.00           C
ATOM    375  CG  PRO A  29      -0.113  15.905   7.051  1.00  0.00           C
ATOM    376  CD  PRO A  29       0.457  14.515   7.100  1.00  0.00           C
ATOM      0  HA  PRO A  29       2.282  15.857   4.757  1.00  0.00           H   new
ATOM      0  HB2 PRO A  29       0.548  17.643   5.989  1.00  0.00           H   new
ATOM      0  HB3 PRO A  29      -0.066  16.365   4.960  1.00  0.00           H   new
ATOM      0  HG2 PRO A  29       0.116  16.453   7.965  1.00  0.00           H   new
ATOM      0  HG3 PRO A  29      -1.199  15.879   6.959  1.00  0.00           H   new
ATOM      0  HD2 PRO A  29       0.562  14.160   8.125  1.00  0.00           H   new
ATOM      0  HD3 PRO A  29      -0.181  13.801   6.579  1.00  0.00           H   new
ATOM    384  N   ASP A  30       3.570  16.319   7.509  1.00  0.00           N
ATOM    385  CA  ASP A  30       4.563  17.072   8.265  1.00  0.00           C
ATOM    386  C   ASP A  30       5.977  16.680   7.845  1.00  0.00           C
ATOM    387  O   ASP A  30       6.946  17.360   8.184  1.00  0.00           O
ATOM    388  CB  ASP A  30       4.380  16.837   9.765  1.00  0.00           C
ATOM    389  CG  ASP A  30       3.134  17.509  10.308  1.00  0.00           C
ATOM    390  OD1 ASP A  30       2.898  18.686   9.964  1.00  0.00           O
ATOM    391  OD2 ASP A  30       2.397  16.859  11.079  1.00  0.00           O
ATOM      0  H   ASP A  30       3.424  15.365   7.838  1.00  0.00           H   new
ATOM      0  HA  ASP A  30       4.420  18.131   8.051  1.00  0.00           H   new
ATOM      0  HB2 ASP A  30       4.325  15.766   9.958  1.00  0.00           H   new
ATOM      0  HB3 ASP A  30       5.254  17.212  10.298  1.00  0.00           H   new
ATOM    396  N   ILE A  31       6.086  15.580   7.108  1.00  0.00           N
ATOM    397  CA  ILE A  31       7.381  15.099   6.643  1.00  0.00           C
ATOM    398  C   ILE A  31       7.428  15.033   5.120  1.00  0.00           C
ATOM    399  O   ILE A  31       8.247  15.698   4.485  1.00  0.00           O
ATOM    400  CB  ILE A  31       7.702  13.706   7.216  1.00  0.00           C
ATOM    401  CG1 ILE A  31       7.250  13.613   8.674  1.00  0.00           C
ATOM    402  CG2 ILE A  31       9.191  13.415   7.098  1.00  0.00           C
ATOM    403  CD1 ILE A  31       7.632  12.312   9.344  1.00  0.00           C
ATOM      0  H   ILE A  31       5.294  15.005   6.820  1.00  0.00           H   new
ATOM      0  HA  ILE A  31       8.128  15.810   6.997  1.00  0.00           H   new
ATOM      0  HB  ILE A  31       7.158  12.958   6.639  1.00  0.00           H   new
ATOM      0 HG12 ILE A  31       7.684  14.442   9.234  1.00  0.00           H   new
ATOM      0 HG13 ILE A  31       6.167  13.731   8.718  1.00  0.00           H   new
ATOM      0 HG21 ILE A  31       9.402  12.427   7.507  1.00  0.00           H   new
ATOM      0 HG22 ILE A  31       9.485  13.444   6.049  1.00  0.00           H   new
ATOM      0 HG23 ILE A  31       9.754  14.166   7.653  1.00  0.00           H   new
ATOM      0 HD11 ILE A  31       7.279  12.317  10.375  1.00  0.00           H   new
ATOM      0 HD12 ILE A  31       7.176  11.479   8.808  1.00  0.00           H   new
ATOM      0 HD13 ILE A  31       8.716  12.201   9.332  1.00  0.00           H   new
ATOM    415  N   SER A  32       6.544  14.228   4.540  1.00  0.00           N
ATOM    416  CA  SER A  32       6.485  14.074   3.091  1.00  0.00           C
ATOM    417  C   SER A  32       5.056  13.807   2.630  1.00  0.00           C
ATOM    418  O   SER A  32       4.181  13.440   3.416  1.00  0.00           O
ATOM    419  CB  SER A  32       7.400  12.932   2.641  1.00  0.00           C
ATOM    420  OG  SER A  32       8.687  13.415   2.300  1.00  0.00           O
ATOM      0  H   SER A  32       5.858  13.672   5.051  1.00  0.00           H   new
ATOM      0  HA  SER A  32       6.826  15.005   2.637  1.00  0.00           H   new
ATOM      0  HB2 SER A  32       7.485  12.194   3.438  1.00  0.00           H   new
ATOM      0  HB3 SER A  32       6.959  12.425   1.783  1.00  0.00           H   new
ATOM      0  HG  SER A  32       8.895  14.204   2.843  1.00  0.00           H   new
ATOM    426  N   PRO A  33       4.811  13.995   1.325  1.00  0.00           N
ATOM    427  CA  PRO A  33       3.489  13.781   0.729  1.00  0.00           C
ATOM    428  C   PRO A  33       3.104  12.306   0.688  1.00  0.00           C
ATOM    429  O   PRO A  33       3.912  11.437   0.360  1.00  0.00           O
ATOM    430  CB  PRO A  33       3.647  14.332  -0.691  1.00  0.00           C
ATOM    431  CG  PRO A  33       5.103  14.218  -0.981  1.00  0.00           C
ATOM    432  CD  PRO A  33       5.805  14.432   0.331  1.00  0.00           C
ATOM      0  HA  PRO A  33       2.699  14.265   1.304  1.00  0.00           H   new
ATOM      0  HB2 PRO A  33       3.055  13.760  -1.406  1.00  0.00           H   new
ATOM      0  HB3 PRO A  33       3.311  15.367  -0.754  1.00  0.00           H   new
ATOM      0  HG2 PRO A  33       5.343  13.239  -1.397  1.00  0.00           H   new
ATOM      0  HG3 PRO A  33       5.414  14.961  -1.716  1.00  0.00           H   new
ATOM      0  HD2 PRO A  33       6.722  13.847   0.396  1.00  0.00           H   new
ATOM      0  HD3 PRO A  33       6.082  15.477   0.473  1.00  0.00           H   new
ATOM    440  N   PRO A  34       1.840  12.014   1.029  1.00  0.00           N
ATOM    441  CA  PRO A  34       1.319  10.644   1.038  1.00  0.00           C
ATOM    442  C   PRO A  34       1.177  10.068  -0.367  1.00  0.00           C
ATOM    443  O   PRO A  34       0.431  10.597  -1.192  1.00  0.00           O
ATOM    444  CB  PRO A  34      -0.055  10.791   1.697  1.00  0.00           C
ATOM    445  CG  PRO A  34      -0.453  12.202   1.431  1.00  0.00           C
ATOM    446  CD  PRO A  34       0.822  12.999   1.431  1.00  0.00           C
ATOM      0  HA  PRO A  34       1.986   9.958   1.560  1.00  0.00           H   new
ATOM      0  HB2 PRO A  34      -0.774  10.090   1.273  1.00  0.00           H   new
ATOM      0  HB3 PRO A  34      -0.005  10.589   2.767  1.00  0.00           H   new
ATOM      0  HG2 PRO A  34      -0.967  12.289   0.474  1.00  0.00           H   new
ATOM      0  HG3 PRO A  34      -1.140  12.565   2.196  1.00  0.00           H   new
ATOM      0  HD2 PRO A  34       0.774  13.835   0.733  1.00  0.00           H   new
ATOM      0  HD3 PRO A  34       1.034  13.418   2.415  1.00  0.00           H   new
ATOM    454  N   ILE A  35       1.896   8.983  -0.632  1.00  0.00           N
ATOM    455  CA  ILE A  35       1.848   8.335  -1.937  1.00  0.00           C
ATOM    456  C   ILE A  35       0.623   7.436  -2.060  1.00  0.00           C
ATOM    457  O   ILE A  35       0.130   7.187  -3.160  1.00  0.00           O
ATOM    458  CB  ILE A  35       3.114   7.498  -2.197  1.00  0.00           C
ATOM    459  CG1 ILE A  35       4.357   8.251  -1.718  1.00  0.00           C
ATOM    460  CG2 ILE A  35       3.231   7.158  -3.675  1.00  0.00           C
ATOM    461  CD1 ILE A  35       4.733   7.947  -0.285  1.00  0.00           C
ATOM      0  H   ILE A  35       2.519   8.534   0.039  1.00  0.00           H   new
ATOM      0  HA  ILE A  35       1.789   9.129  -2.681  1.00  0.00           H   new
ATOM      0  HB  ILE A  35       3.037   6.567  -1.636  1.00  0.00           H   new
ATOM      0 HG12 ILE A  35       5.196   8.000  -2.366  1.00  0.00           H   new
ATOM      0 HG13 ILE A  35       4.185   9.322  -1.820  1.00  0.00           H   new
ATOM      0 HG21 ILE A  35       4.131   6.566  -3.842  1.00  0.00           H   new
ATOM      0 HG22 ILE A  35       2.357   6.586  -3.987  1.00  0.00           H   new
ATOM      0 HG23 ILE A  35       3.289   8.078  -4.257  1.00  0.00           H   new
ATOM      0 HD11 ILE A  35       5.623   8.515  -0.014  1.00  0.00           H   new
ATOM      0 HD12 ILE A  35       3.910   8.225   0.374  1.00  0.00           H   new
ATOM      0 HD13 ILE A  35       4.938   6.881  -0.181  1.00  0.00           H   new
ATOM    473  N   PHE A  36       0.135   6.952  -0.923  1.00  0.00           N
ATOM    474  CA  PHE A  36      -1.034   6.080  -0.902  1.00  0.00           C
ATOM    475  C   PHE A  36      -2.048   6.555   0.135  1.00  0.00           C
ATOM    476  O   PHE A  36      -1.964   6.196   1.310  1.00  0.00           O
ATOM    477  CB  PHE A  36      -0.617   4.639  -0.602  1.00  0.00           C
ATOM    478  CG  PHE A  36       0.502   4.145  -1.474  1.00  0.00           C
ATOM    479  CD1 PHE A  36       0.493   4.386  -2.838  1.00  0.00           C
ATOM    480  CD2 PHE A  36       1.563   3.440  -0.929  1.00  0.00           C
ATOM    481  CE1 PHE A  36       1.521   3.932  -3.643  1.00  0.00           C
ATOM    482  CE2 PHE A  36       2.594   2.984  -1.729  1.00  0.00           C
ATOM    483  CZ  PHE A  36       2.573   3.231  -3.087  1.00  0.00           C
ATOM      0  H   PHE A  36       0.531   7.149  -0.004  1.00  0.00           H   new
ATOM      0  HA  PHE A  36      -1.502   6.118  -1.886  1.00  0.00           H   new
ATOM      0  HB2 PHE A  36      -0.312   4.567   0.442  1.00  0.00           H   new
ATOM      0  HB3 PHE A  36      -1.480   3.986  -0.728  1.00  0.00           H   new
ATOM      0  HD1 PHE A  36      -0.327   4.935  -3.278  1.00  0.00           H   new
ATOM      0  HD2 PHE A  36       1.585   3.245   0.133  1.00  0.00           H   new
ATOM      0  HE1 PHE A  36       1.501   4.125  -4.705  1.00  0.00           H   new
ATOM      0  HE2 PHE A  36       3.415   2.435  -1.292  1.00  0.00           H   new
ATOM      0  HZ  PHE A  36       3.378   2.877  -3.714  1.00  0.00           H   new
ATOM    493  N   ARG A  37      -3.005   7.363  -0.309  1.00  0.00           N
ATOM    494  CA  ARG A  37      -4.034   7.888   0.581  1.00  0.00           C
ATOM    495  C   ARG A  37      -4.751   6.757   1.311  1.00  0.00           C
ATOM    496  O   ARG A  37      -4.699   5.601   0.889  1.00  0.00           O
ATOM    497  CB  ARG A  37      -5.046   8.720  -0.211  1.00  0.00           C
ATOM    498  CG  ARG A  37      -4.411   9.827  -1.036  1.00  0.00           C
ATOM    499  CD  ARG A  37      -4.132  11.061  -0.193  1.00  0.00           C
ATOM    500  NE  ARG A  37      -5.359  11.771   0.160  1.00  0.00           N
ATOM    501  CZ  ARG A  37      -5.377  12.991   0.686  1.00  0.00           C
ATOM    502  NH1 ARG A  37      -4.240  13.633   0.918  1.00  0.00           N
ATOM    503  NH2 ARG A  37      -6.533  13.571   0.980  1.00  0.00           N
ATOM      0  H   ARG A  37      -3.089   7.668  -1.279  1.00  0.00           H   new
ATOM      0  HA  ARG A  37      -3.549   8.524   1.321  1.00  0.00           H   new
ATOM      0  HB2 ARG A  37      -5.607   8.061  -0.874  1.00  0.00           H   new
ATOM      0  HB3 ARG A  37      -5.763   9.160   0.482  1.00  0.00           H   new
ATOM      0  HG2 ARG A  37      -3.480   9.467  -1.475  1.00  0.00           H   new
ATOM      0  HG3 ARG A  37      -5.072  10.091  -1.862  1.00  0.00           H   new
ATOM      0  HD2 ARG A  37      -3.608  10.768   0.717  1.00  0.00           H   new
ATOM      0  HD3 ARG A  37      -3.470  11.732  -0.740  1.00  0.00           H   new
ATOM      0  HE  ARG A  37      -6.251  11.305  -0.006  1.00  0.00           H   new
ATOM      0 HH11 ARG A  37      -3.349  13.190   0.693  1.00  0.00           H   new
ATOM      0 HH12 ARG A  37      -4.256  14.570   1.322  1.00  0.00           H   new
ATOM      0 HH21 ARG A  37      -7.409  13.080   0.802  1.00  0.00           H   new
ATOM      0 HH22 ARG A  37      -6.546  14.508   1.384  1.00  0.00           H   new
ATOM    517  N   ARG A  38      -5.418   7.097   2.409  1.00  0.00           N
ATOM    518  CA  ARG A  38      -6.143   6.109   3.199  1.00  0.00           C
ATOM    519  C   ARG A  38      -7.257   5.467   2.377  1.00  0.00           C
ATOM    520  O   ARG A  38      -7.848   6.106   1.508  1.00  0.00           O
ATOM    521  CB  ARG A  38      -6.730   6.760   4.453  1.00  0.00           C
ATOM    522  CG  ARG A  38      -7.079   5.765   5.549  1.00  0.00           C
ATOM    523  CD  ARG A  38      -8.254   6.246   6.384  1.00  0.00           C
ATOM    524  NE  ARG A  38      -7.860   7.273   7.345  1.00  0.00           N
ATOM    525  CZ  ARG A  38      -8.605   7.633   8.384  1.00  0.00           C
ATOM    526  NH1 ARG A  38      -9.778   7.053   8.595  1.00  0.00           N
ATOM    527  NH2 ARG A  38      -8.177   8.576   9.214  1.00  0.00           N
ATOM      0  H   ARG A  38      -5.471   8.049   2.772  1.00  0.00           H   new
ATOM      0  HA  ARG A  38      -5.440   5.331   3.496  1.00  0.00           H   new
ATOM      0  HB2 ARG A  38      -6.015   7.484   4.845  1.00  0.00           H   new
ATOM      0  HB3 ARG A  38      -7.627   7.315   4.178  1.00  0.00           H   new
ATOM      0  HG2 ARG A  38      -7.319   4.800   5.103  1.00  0.00           H   new
ATOM      0  HG3 ARG A  38      -6.213   5.612   6.192  1.00  0.00           H   new
ATOM      0  HD2 ARG A  38      -9.027   6.643   5.726  1.00  0.00           H   new
ATOM      0  HD3 ARG A  38      -8.691   5.401   6.916  1.00  0.00           H   new
ATOM      0  HE  ARG A  38      -6.963   7.740   7.211  1.00  0.00           H   new
ATOM      0 HH11 ARG A  38     -10.110   6.328   7.959  1.00  0.00           H   new
ATOM      0 HH12 ARG A  38     -10.348   7.331   9.394  1.00  0.00           H   new
ATOM      0 HH21 ARG A  38      -7.275   9.025   9.054  1.00  0.00           H   new
ATOM      0 HH22 ARG A  38      -8.750   8.852  10.012  1.00  0.00           H   new
ATOM    541  N   GLY A  39      -7.538   4.199   2.659  1.00  0.00           N
ATOM    542  CA  GLY A  39      -8.579   3.491   1.937  1.00  0.00           C
ATOM    543  C   GLY A  39      -8.119   3.016   0.573  1.00  0.00           C
ATOM    544  O   GLY A  39      -8.847   2.308  -0.122  1.00  0.00           O
ATOM      0  H   GLY A  39      -7.063   3.649   3.375  1.00  0.00           H   new
ATOM      0  HA2 GLY A  39      -8.906   2.634   2.525  1.00  0.00           H   new
ATOM      0  HA3 GLY A  39      -9.443   4.145   1.818  1.00  0.00           H   new
ATOM    548  N   GLU A  40      -6.908   3.408   0.190  1.00  0.00           N
ATOM    549  CA  GLU A  40      -6.354   3.019  -1.102  1.00  0.00           C
ATOM    550  C   GLU A  40      -5.801   1.598  -1.051  1.00  0.00           C
ATOM    551  O   GLU A  40      -5.097   1.226  -0.111  1.00  0.00           O
ATOM    552  CB  GLU A  40      -5.251   3.992  -1.522  1.00  0.00           C
ATOM    553  CG  GLU A  40      -4.886   3.900  -2.994  1.00  0.00           C
ATOM    554  CD  GLU A  40      -6.063   3.501  -3.863  1.00  0.00           C
ATOM    555  OE1 GLU A  40      -7.027   4.291  -3.954  1.00  0.00           O
ATOM    556  OE2 GLU A  40      -6.021   2.401  -4.451  1.00  0.00           O
ATOM      0  H   GLU A  40      -6.293   3.994   0.755  1.00  0.00           H   new
ATOM      0  HA  GLU A  40      -7.157   3.052  -1.838  1.00  0.00           H   new
ATOM      0  HB2 GLU A  40      -5.572   5.010  -1.299  1.00  0.00           H   new
ATOM      0  HB3 GLU A  40      -4.361   3.800  -0.923  1.00  0.00           H   new
ATOM      0  HG2 GLU A  40      -4.501   4.863  -3.330  1.00  0.00           H   new
ATOM      0  HG3 GLU A  40      -4.083   3.174  -3.121  1.00  0.00           H   new
ATOM    563  N   LYS A  41      -6.125   0.806  -2.068  1.00  0.00           N
ATOM    564  CA  LYS A  41      -5.661  -0.574  -2.142  1.00  0.00           C
ATOM    565  C   LYS A  41      -4.263  -0.647  -2.748  1.00  0.00           C
ATOM    566  O   LYS A  41      -3.961   0.044  -3.722  1.00  0.00           O
ATOM    567  CB  LYS A  41      -6.633  -1.416  -2.971  1.00  0.00           C
ATOM    568  CG  LYS A  41      -6.432  -2.913  -2.809  1.00  0.00           C
ATOM    569  CD  LYS A  41      -7.613  -3.697  -3.357  1.00  0.00           C
ATOM    570  CE  LYS A  41      -8.736  -3.799  -2.337  1.00  0.00           C
ATOM    571  NZ  LYS A  41      -9.899  -4.562  -2.867  1.00  0.00           N
ATOM      0  H   LYS A  41      -6.708   1.097  -2.853  1.00  0.00           H   new
ATOM      0  HA  LYS A  41      -5.619  -0.972  -1.128  1.00  0.00           H   new
ATOM      0  HB2 LYS A  41      -7.654  -1.162  -2.687  1.00  0.00           H   new
ATOM      0  HB3 LYS A  41      -6.521  -1.155  -4.023  1.00  0.00           H   new
ATOM      0  HG2 LYS A  41      -5.521  -3.217  -3.325  1.00  0.00           H   new
ATOM      0  HG3 LYS A  41      -6.294  -3.150  -1.754  1.00  0.00           H   new
ATOM      0  HD2 LYS A  41      -7.984  -3.214  -4.261  1.00  0.00           H   new
ATOM      0  HD3 LYS A  41      -7.286  -4.697  -3.641  1.00  0.00           H   new
ATOM      0  HE2 LYS A  41      -8.364  -4.284  -1.435  1.00  0.00           H   new
ATOM      0  HE3 LYS A  41      -9.058  -2.798  -2.051  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  41     -10.643  -4.609  -2.142  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  41     -10.270  -4.085  -3.713  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  41      -9.597  -5.526  -3.117  1.00  0.00           H   new
ATOM    585  N   LEU A  42      -3.415  -1.489  -2.168  1.00  0.00           N
ATOM    586  CA  LEU A  42      -2.049  -1.654  -2.653  1.00  0.00           C
ATOM    587  C   LEU A  42      -1.709  -3.130  -2.832  1.00  0.00           C
ATOM    588  O   LEU A  42      -2.107  -3.971  -2.026  1.00  0.00           O
ATOM    589  CB  LEU A  42      -1.061  -1.006  -1.681  1.00  0.00           C
ATOM    590  CG  LEU A  42      -1.495   0.328  -1.073  1.00  0.00           C
ATOM    591  CD1 LEU A  42      -0.592   0.702   0.092  1.00  0.00           C
ATOM    592  CD2 LEU A  42      -1.488   1.423  -2.129  1.00  0.00           C
ATOM      0  H   LEU A  42      -3.649  -2.068  -1.361  1.00  0.00           H   new
ATOM      0  HA  LEU A  42      -1.972  -1.162  -3.623  1.00  0.00           H   new
ATOM      0  HB2 LEU A  42      -0.868  -1.707  -0.869  1.00  0.00           H   new
ATOM      0  HB3 LEU A  42      -0.116  -0.855  -2.202  1.00  0.00           H   new
ATOM      0  HG  LEU A  42      -2.513   0.220  -0.697  1.00  0.00           H   new
ATOM      0 HD11 LEU A  42      -0.916   1.654   0.512  1.00  0.00           H   new
ATOM      0 HD12 LEU A  42      -0.648  -0.071   0.859  1.00  0.00           H   new
ATOM      0 HD13 LEU A  42       0.436   0.791  -0.259  1.00  0.00           H   new
ATOM      0 HD21 LEU A  42      -1.800   2.365  -1.678  1.00  0.00           H   new
ATOM      0 HD22 LEU A  42      -0.482   1.530  -2.535  1.00  0.00           H   new
ATOM      0 HD23 LEU A  42      -2.177   1.159  -2.931  1.00  0.00           H   new
ATOM    604  N   ARG A  43      -0.970  -3.437  -3.894  1.00  0.00           N
ATOM    605  CA  ARG A  43      -0.576  -4.811  -4.178  1.00  0.00           C
ATOM    606  C   ARG A  43       0.792  -5.120  -3.578  1.00  0.00           C
ATOM    607  O   ARG A  43       1.764  -4.403  -3.819  1.00  0.00           O
ATOM    608  CB  ARG A  43      -0.549  -5.054  -5.689  1.00  0.00           C
ATOM    609  CG  ARG A  43      -0.483  -6.524  -6.068  1.00  0.00           C
ATOM    610  CD  ARG A  43      -0.758  -6.730  -7.549  1.00  0.00           C
ATOM    611  NE  ARG A  43       0.465  -6.689  -8.345  1.00  0.00           N
ATOM    612  CZ  ARG A  43       0.480  -6.517  -9.662  1.00  0.00           C
ATOM    613  NH1 ARG A  43      -0.657  -6.371 -10.328  1.00  0.00           N
ATOM    614  NH2 ARG A  43       1.635  -6.491 -10.316  1.00  0.00           N
ATOM      0  H   ARG A  43      -0.633  -2.753  -4.571  1.00  0.00           H   new
ATOM      0  HA  ARG A  43      -1.311  -5.475  -3.723  1.00  0.00           H   new
ATOM      0  HB2 ARG A  43      -1.440  -4.612  -6.136  1.00  0.00           H   new
ATOM      0  HB3 ARG A  43       0.311  -4.538  -6.116  1.00  0.00           H   new
ATOM      0  HG2 ARG A  43       0.502  -6.921  -5.821  1.00  0.00           H   new
ATOM      0  HG3 ARG A  43      -1.209  -7.085  -5.480  1.00  0.00           H   new
ATOM      0  HD2 ARG A  43      -1.253  -7.690  -7.695  1.00  0.00           H   new
ATOM      0  HD3 ARG A  43      -1.445  -5.960  -7.900  1.00  0.00           H   new
ATOM      0  HE  ARG A  43       1.357  -6.798  -7.863  1.00  0.00           H   new
ATOM      0 HH11 ARG A  43      -1.546  -6.391  -9.829  1.00  0.00           H   new
ATOM      0 HH12 ARG A  43      -0.642  -6.239 -11.339  1.00  0.00           H   new
ATOM      0 HH21 ARG A  43       2.512  -6.603  -9.807  1.00  0.00           H   new
ATOM      0 HH22 ARG A  43       1.646  -6.359 -11.327  1.00  0.00           H   new
ATOM    628  N   VAL A  44       0.861  -6.191  -2.794  1.00  0.00           N
ATOM    629  CA  VAL A  44       2.110  -6.595  -2.159  1.00  0.00           C
ATOM    630  C   VAL A  44       3.136  -7.036  -3.197  1.00  0.00           C
ATOM    631  O   VAL A  44       2.968  -8.065  -3.852  1.00  0.00           O
ATOM    632  CB  VAL A  44       1.884  -7.743  -1.157  1.00  0.00           C
ATOM    633  CG1 VAL A  44       3.210  -8.215  -0.579  1.00  0.00           C
ATOM    634  CG2 VAL A  44       0.937  -7.304  -0.050  1.00  0.00           C
ATOM      0  H   VAL A  44       0.066  -6.795  -2.583  1.00  0.00           H   new
ATOM      0  HA  VAL A  44       2.490  -5.725  -1.624  1.00  0.00           H   new
ATOM      0  HB  VAL A  44       1.426  -8.579  -1.685  1.00  0.00           H   new
ATOM      0 HG11 VAL A  44       3.031  -9.026   0.127  1.00  0.00           H   new
ATOM      0 HG12 VAL A  44       3.852  -8.570  -1.385  1.00  0.00           H   new
ATOM      0 HG13 VAL A  44       3.698  -7.387  -0.064  1.00  0.00           H   new
ATOM      0 HG21 VAL A  44       0.788  -8.127   0.649  1.00  0.00           H   new
ATOM      0 HG22 VAL A  44       1.365  -6.452   0.478  1.00  0.00           H   new
ATOM      0 HG23 VAL A  44      -0.022  -7.018  -0.483  1.00  0.00           H   new
ATOM    644  N   ILE A  45       4.199  -6.251  -3.340  1.00  0.00           N
ATOM    645  CA  ILE A  45       5.253  -6.562  -4.297  1.00  0.00           C
ATOM    646  C   ILE A  45       6.315  -7.461  -3.673  1.00  0.00           C
ATOM    647  O   ILE A  45       6.642  -8.519  -4.211  1.00  0.00           O
ATOM    648  CB  ILE A  45       5.927  -5.282  -4.827  1.00  0.00           C
ATOM    649  CG1 ILE A  45       5.165  -4.743  -6.040  1.00  0.00           C
ATOM    650  CG2 ILE A  45       7.379  -5.558  -5.187  1.00  0.00           C
ATOM    651  CD1 ILE A  45       4.108  -3.721  -5.684  1.00  0.00           C
ATOM      0  H   ILE A  45       4.353  -5.396  -2.806  1.00  0.00           H   new
ATOM      0  HA  ILE A  45       4.780  -7.085  -5.128  1.00  0.00           H   new
ATOM      0  HB  ILE A  45       5.905  -4.526  -4.042  1.00  0.00           H   new
ATOM      0 HG12 ILE A  45       5.875  -4.293  -6.734  1.00  0.00           H   new
ATOM      0 HG13 ILE A  45       4.693  -5.575  -6.562  1.00  0.00           H   new
ATOM      0 HG21 ILE A  45       7.841  -4.644  -5.560  1.00  0.00           H   new
ATOM      0 HG22 ILE A  45       7.915  -5.901  -4.302  1.00  0.00           H   new
ATOM      0 HG23 ILE A  45       7.423  -6.327  -5.958  1.00  0.00           H   new
ATOM      0 HD11 ILE A  45       3.608  -3.383  -6.592  1.00  0.00           H   new
ATOM      0 HD12 ILE A  45       3.376  -4.173  -5.014  1.00  0.00           H   new
ATOM      0 HD13 ILE A  45       4.577  -2.870  -5.189  1.00  0.00           H   new
ATOM    663  N   SER A  46       6.849  -7.033  -2.533  1.00  0.00           N
ATOM    664  CA  SER A  46       7.876  -7.798  -1.836  1.00  0.00           C
ATOM    665  C   SER A  46       7.715  -7.671  -0.324  1.00  0.00           C
ATOM    666  O   SER A  46       7.319  -6.622   0.183  1.00  0.00           O
ATOM    667  CB  SER A  46       9.269  -7.323  -2.254  1.00  0.00           C
ATOM    668  OG  SER A  46       9.689  -7.961  -3.447  1.00  0.00           O
ATOM      0  H   SER A  46       6.587  -6.161  -2.073  1.00  0.00           H   new
ATOM      0  HA  SER A  46       7.761  -8.847  -2.110  1.00  0.00           H   new
ATOM      0  HB2 SER A  46       9.260  -6.243  -2.400  1.00  0.00           H   new
ATOM      0  HB3 SER A  46       9.982  -7.531  -1.456  1.00  0.00           H   new
ATOM      0  HG  SER A  46       8.904  -8.258  -3.953  1.00  0.00           H   new
ATOM    674  N   ASP A  47       8.025  -8.747   0.390  1.00  0.00           N
ATOM    675  CA  ASP A  47       7.917  -8.758   1.844  1.00  0.00           C
ATOM    676  C   ASP A  47       9.298  -8.762   2.492  1.00  0.00           C
ATOM    677  O   ASP A  47      10.082  -9.689   2.297  1.00  0.00           O
ATOM    678  CB  ASP A  47       7.118  -9.976   2.309  1.00  0.00           C
ATOM    679  CG  ASP A  47       6.893  -9.984   3.808  1.00  0.00           C
ATOM    680  OD1 ASP A  47       5.894  -9.388   4.261  1.00  0.00           O
ATOM    681  OD2 ASP A  47       7.717 -10.586   4.529  1.00  0.00           O
ATOM      0  H   ASP A  47       8.353  -9.624  -0.015  1.00  0.00           H   new
ATOM      0  HA  ASP A  47       7.394  -7.852   2.151  1.00  0.00           H   new
ATOM      0  HB2 ASP A  47       6.154  -9.990   1.800  1.00  0.00           H   new
ATOM      0  HB3 ASP A  47       7.645 -10.885   2.019  1.00  0.00           H   new
ATOM    686  N   GLU A  48       9.587  -7.718   3.263  1.00  0.00           N
ATOM    687  CA  GLU A  48      10.875  -7.601   3.938  1.00  0.00           C
ATOM    688  C   GLU A  48      10.686  -7.300   5.422  1.00  0.00           C
ATOM    689  O   GLU A  48      10.687  -6.142   5.836  1.00  0.00           O
ATOM    690  CB  GLU A  48      11.720  -6.504   3.287  1.00  0.00           C
ATOM    691  CG  GLU A  48      11.980  -6.734   1.807  1.00  0.00           C
ATOM    692  CD  GLU A  48      13.301  -6.148   1.349  1.00  0.00           C
ATOM    693  OE1 GLU A  48      14.332  -6.431   1.995  1.00  0.00           O
ATOM    694  OE2 GLU A  48      13.304  -5.406   0.345  1.00  0.00           O
ATOM      0  H   GLU A  48       8.948  -6.942   3.436  1.00  0.00           H   new
ATOM      0  HA  GLU A  48      11.395  -8.554   3.842  1.00  0.00           H   new
ATOM      0  HB2 GLU A  48      11.217  -5.546   3.414  1.00  0.00           H   new
ATOM      0  HB3 GLU A  48      12.675  -6.435   3.809  1.00  0.00           H   new
ATOM      0  HG2 GLU A  48      11.971  -7.805   1.603  1.00  0.00           H   new
ATOM      0  HG3 GLU A  48      11.170  -6.292   1.227  1.00  0.00           H   new
ATOM    701  N   GLY A  49      10.523  -8.352   6.218  1.00  0.00           N
ATOM    702  CA  GLY A  49      10.335  -8.180   7.646  1.00  0.00           C
ATOM    703  C   GLY A  49       9.102  -7.361   7.974  1.00  0.00           C
ATOM    704  O   GLY A  49       7.994  -7.701   7.562  1.00  0.00           O
ATOM      0  H   GLY A  49      10.518  -9.321   5.899  1.00  0.00           H   new
ATOM      0  HA2 GLY A  49      10.254  -9.159   8.119  1.00  0.00           H   new
ATOM      0  HA3 GLY A  49      11.214  -7.693   8.069  1.00  0.00           H   new
ATOM    708  N   GLY A  50       9.295  -6.277   8.720  1.00  0.00           N
ATOM    709  CA  GLY A  50       8.181  -5.425   9.091  1.00  0.00           C
ATOM    710  C   GLY A  50       7.809  -4.445   7.995  1.00  0.00           C
ATOM    711  O   GLY A  50       6.705  -3.902   7.988  1.00  0.00           O
ATOM      0  H   GLY A  50      10.203  -5.974   9.074  1.00  0.00           H   new
ATOM      0  HA2 GLY A  50       7.317  -6.045   9.328  1.00  0.00           H   new
ATOM      0  HA3 GLY A  50       8.435  -4.873   9.996  1.00  0.00           H   new
ATOM    715  N   TRP A  51       8.733  -4.219   7.069  1.00  0.00           N
ATOM    716  CA  TRP A  51       8.497  -3.297   5.964  1.00  0.00           C
ATOM    717  C   TRP A  51       8.449  -4.041   4.634  1.00  0.00           C
ATOM    718  O   TRP A  51       9.322  -4.856   4.337  1.00  0.00           O
ATOM    719  CB  TRP A  51       9.589  -2.226   5.924  1.00  0.00           C
ATOM    720  CG  TRP A  51       9.398  -1.145   6.944  1.00  0.00           C
ATOM    721  CD1 TRP A  51       9.497  -1.271   8.300  1.00  0.00           C
ATOM    722  CD2 TRP A  51       9.074   0.226   6.689  1.00  0.00           C
ATOM    723  NE1 TRP A  51       9.254  -0.061   8.904  1.00  0.00           N
ATOM    724  CE2 TRP A  51       8.992   0.874   7.937  1.00  0.00           C
ATOM    725  CE3 TRP A  51       8.846   0.970   5.528  1.00  0.00           C
ATOM    726  CZ2 TRP A  51       8.692   2.228   8.055  1.00  0.00           C
ATOM    727  CZ3 TRP A  51       8.548   2.314   5.646  1.00  0.00           C
ATOM    728  CH2 TRP A  51       8.474   2.933   6.902  1.00  0.00           C
ATOM      0  H   TRP A  51       9.652  -4.661   7.061  1.00  0.00           H   new
ATOM      0  HA  TRP A  51       7.532  -2.817   6.125  1.00  0.00           H   new
ATOM      0  HB2 TRP A  51      10.558  -2.699   6.084  1.00  0.00           H   new
ATOM      0  HB3 TRP A  51       9.613  -1.778   4.931  1.00  0.00           H   new
ATOM      0  HD1 TRP A  51       9.732  -2.187   8.821  1.00  0.00           H   new
ATOM      0  HE1 TRP A  51       9.267   0.113   9.909  1.00  0.00           H   new
ATOM      0  HE3 TRP A  51       8.902   0.503   4.556  1.00  0.00           H   new
ATOM      0  HZ2 TRP A  51       8.633   2.705   9.022  1.00  0.00           H   new
ATOM      0  HZ3 TRP A  51       8.369   2.898   4.755  1.00  0.00           H   new
ATOM      0  HH2 TRP A  51       8.241   3.986   6.961  1.00  0.00           H   new
ATOM    739  N   TRP A  52       7.424  -3.757   3.839  1.00  0.00           N
ATOM    740  CA  TRP A  52       7.263  -4.400   2.540  1.00  0.00           C
ATOM    741  C   TRP A  52       6.958  -3.372   1.457  1.00  0.00           C
ATOM    742  O   TRP A  52       6.595  -2.233   1.752  1.00  0.00           O
ATOM    743  CB  TRP A  52       6.145  -5.443   2.599  1.00  0.00           C
ATOM    744  CG  TRP A  52       4.922  -4.962   3.319  1.00  0.00           C
ATOM    745  CD1 TRP A  52       4.570  -3.665   3.560  1.00  0.00           C
ATOM    746  CD2 TRP A  52       3.891  -5.773   3.893  1.00  0.00           C
ATOM    747  NE1 TRP A  52       3.382  -3.621   4.249  1.00  0.00           N
ATOM    748  CE2 TRP A  52       2.945  -4.901   4.465  1.00  0.00           C
ATOM    749  CE3 TRP A  52       3.675  -7.151   3.978  1.00  0.00           C
ATOM    750  CZ2 TRP A  52       1.802  -5.364   5.113  1.00  0.00           C
ATOM    751  CZ3 TRP A  52       2.540  -7.609   4.621  1.00  0.00           C
ATOM    752  CH2 TRP A  52       1.615  -6.718   5.181  1.00  0.00           C
ATOM      0  H   TRP A  52       6.692  -3.086   4.071  1.00  0.00           H   new
ATOM      0  HA  TRP A  52       8.201  -4.896   2.290  1.00  0.00           H   new
ATOM      0  HB2 TRP A  52       5.871  -5.729   1.584  1.00  0.00           H   new
ATOM      0  HB3 TRP A  52       6.520  -6.339   3.093  1.00  0.00           H   new
ATOM      0  HD1 TRP A  52       5.141  -2.801   3.254  1.00  0.00           H   new
ATOM      0  HE1 TRP A  52       2.903  -2.772   4.551  1.00  0.00           H   new
ATOM      0  HE3 TRP A  52       4.382  -7.846   3.549  1.00  0.00           H   new
ATOM      0  HZ2 TRP A  52       1.089  -4.679   5.546  1.00  0.00           H   new
ATOM      0  HZ3 TRP A  52       2.363  -8.672   4.693  1.00  0.00           H   new
ATOM      0  HH2 TRP A  52       0.737  -7.107   5.676  1.00  0.00           H   new
ATOM    763  N   LYS A  53       7.107  -3.779   0.201  1.00  0.00           N
ATOM    764  CA  LYS A  53       6.846  -2.894  -0.928  1.00  0.00           C
ATOM    765  C   LYS A  53       5.473  -3.171  -1.531  1.00  0.00           C
ATOM    766  O   LYS A  53       5.043  -4.321  -1.616  1.00  0.00           O
ATOM    767  CB  LYS A  53       7.929  -3.063  -1.996  1.00  0.00           C
ATOM    768  CG  LYS A  53       8.099  -1.846  -2.888  1.00  0.00           C
ATOM    769  CD  LYS A  53       8.546  -2.237  -4.287  1.00  0.00           C
ATOM    770  CE  LYS A  53       8.445  -1.066  -5.252  1.00  0.00           C
ATOM    771  NZ  LYS A  53       9.665  -0.213  -5.221  1.00  0.00           N
ATOM      0  H   LYS A  53       7.408  -4.718  -0.061  1.00  0.00           H   new
ATOM      0  HA  LYS A  53       6.862  -1.867  -0.564  1.00  0.00           H   new
ATOM      0  HB2 LYS A  53       8.879  -3.280  -1.507  1.00  0.00           H   new
ATOM      0  HB3 LYS A  53       7.685  -3.926  -2.616  1.00  0.00           H   new
ATOM      0  HG2 LYS A  53       7.157  -1.301  -2.945  1.00  0.00           H   new
ATOM      0  HG3 LYS A  53       8.831  -1.170  -2.447  1.00  0.00           H   new
ATOM      0  HD2 LYS A  53       9.575  -2.595  -4.254  1.00  0.00           H   new
ATOM      0  HD3 LYS A  53       7.932  -3.062  -4.649  1.00  0.00           H   new
ATOM      0  HE2 LYS A  53       8.291  -1.442  -6.263  1.00  0.00           H   new
ATOM      0  HE3 LYS A  53       7.573  -0.462  -5.000  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  53       9.411   0.766  -5.465  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  53      10.080  -0.236  -4.268  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  53      10.357  -0.572  -5.909  1.00  0.00           H   new
ATOM    785  N   ALA A  54       4.791  -2.111  -1.950  1.00  0.00           N
ATOM    786  CA  ALA A  54       3.468  -2.241  -2.549  1.00  0.00           C
ATOM    787  C   ALA A  54       3.205  -1.120  -3.548  1.00  0.00           C
ATOM    788  O   ALA A  54       3.830  -0.061  -3.485  1.00  0.00           O
ATOM    789  CB  ALA A  54       2.398  -2.249  -1.467  1.00  0.00           C
ATOM      0  H   ALA A  54       5.132  -1.152  -1.886  1.00  0.00           H   new
ATOM      0  HA  ALA A  54       3.431  -3.188  -3.088  1.00  0.00           H   new
ATOM      0  HB1 ALA A  54       1.415  -2.347  -1.928  1.00  0.00           H   new
ATOM      0  HB2 ALA A  54       2.568  -3.089  -0.793  1.00  0.00           H   new
ATOM      0  HB3 ALA A  54       2.444  -1.317  -0.903  1.00  0.00           H   new
ATOM    795  N   ILE A  55       2.277  -1.360  -4.469  1.00  0.00           N
ATOM    796  CA  ILE A  55       1.932  -0.369  -5.481  1.00  0.00           C
ATOM    797  C   ILE A  55       0.451  -0.012  -5.418  1.00  0.00           C
ATOM    798  O   ILE A  55      -0.391  -0.861  -5.124  1.00  0.00           O
ATOM    799  CB  ILE A  55       2.268  -0.871  -6.897  1.00  0.00           C
ATOM    800  CG1 ILE A  55       1.991   0.224  -7.929  1.00  0.00           C
ATOM    801  CG2 ILE A  55       1.468  -2.125  -7.219  1.00  0.00           C
ATOM    802  CD1 ILE A  55       2.508  -0.104  -9.312  1.00  0.00           C
ATOM      0  H   ILE A  55       1.751  -2.231  -4.535  1.00  0.00           H   new
ATOM      0  HA  ILE A  55       2.527   0.520  -5.269  1.00  0.00           H   new
ATOM      0  HB  ILE A  55       3.328  -1.121  -6.936  1.00  0.00           H   new
ATOM      0 HG12 ILE A  55       0.916   0.397  -7.983  1.00  0.00           H   new
ATOM      0 HG13 ILE A  55       2.447   1.154  -7.591  1.00  0.00           H   new
ATOM      0 HG21 ILE A  55       1.717  -2.467  -8.223  1.00  0.00           H   new
ATOM      0 HG22 ILE A  55       1.711  -2.906  -6.499  1.00  0.00           H   new
ATOM      0 HG23 ILE A  55       0.403  -1.901  -7.166  1.00  0.00           H   new
ATOM      0 HD11 ILE A  55       2.276   0.716  -9.991  1.00  0.00           H   new
ATOM      0 HD12 ILE A  55       3.588  -0.248  -9.272  1.00  0.00           H   new
ATOM      0 HD13 ILE A  55       2.033  -1.017  -9.671  1.00  0.00           H   new
ATOM    814  N   SER A  56       0.139   1.249  -5.698  1.00  0.00           N
ATOM    815  CA  SER A  56      -1.241   1.719  -5.672  1.00  0.00           C
ATOM    816  C   SER A  56      -1.922   1.480  -7.016  1.00  0.00           C
ATOM    817  O   SER A  56      -1.424   1.900  -8.061  1.00  0.00           O
ATOM    818  CB  SER A  56      -1.288   3.208  -5.321  1.00  0.00           C
ATOM    819  OG  SER A  56      -0.302   3.932  -6.036  1.00  0.00           O
ATOM      0  H   SER A  56       0.823   1.964  -5.946  1.00  0.00           H   new
ATOM      0  HA  SER A  56      -1.777   1.155  -4.908  1.00  0.00           H   new
ATOM      0  HB2 SER A  56      -2.276   3.608  -5.551  1.00  0.00           H   new
ATOM      0  HB3 SER A  56      -1.133   3.337  -4.250  1.00  0.00           H   new
ATOM      0  HG  SER A  56      -0.354   4.881  -5.795  1.00  0.00           H   new
ATOM    825  N   LEU A  57      -3.064   0.803  -6.981  1.00  0.00           N
ATOM    826  CA  LEU A  57      -3.816   0.506  -8.195  1.00  0.00           C
ATOM    827  C   LEU A  57      -4.539   1.749  -8.705  1.00  0.00           C
ATOM    828  O   LEU A  57      -5.313   1.681  -9.660  1.00  0.00           O
ATOM    829  CB  LEU A  57      -4.824  -0.614  -7.934  1.00  0.00           C
ATOM    830  CG  LEU A  57      -4.303  -1.815  -7.143  1.00  0.00           C
ATOM    831  CD1 LEU A  57      -5.458  -2.584  -6.519  1.00  0.00           C
ATOM    832  CD2 LEU A  57      -3.476  -2.725  -8.038  1.00  0.00           C
ATOM      0  H   LEU A  57      -3.490   0.449  -6.124  1.00  0.00           H   new
ATOM      0  HA  LEU A  57      -3.111   0.179  -8.959  1.00  0.00           H   new
ATOM      0  HB2 LEU A  57      -5.674  -0.193  -7.398  1.00  0.00           H   new
ATOM      0  HB3 LEU A  57      -5.197  -0.971  -8.894  1.00  0.00           H   new
ATOM      0  HG  LEU A  57      -3.662  -1.448  -6.341  1.00  0.00           H   new
ATOM      0 HD11 LEU A  57      -5.069  -3.435  -5.960  1.00  0.00           H   new
ATOM      0 HD12 LEU A  57      -6.009  -1.929  -5.845  1.00  0.00           H   new
ATOM      0 HD13 LEU A  57      -6.125  -2.940  -7.304  1.00  0.00           H   new
ATOM      0 HD21 LEU A  57      -3.114  -3.574  -7.458  1.00  0.00           H   new
ATOM      0 HD22 LEU A  57      -4.093  -3.085  -8.861  1.00  0.00           H   new
ATOM      0 HD23 LEU A  57      -2.627  -2.169  -8.437  1.00  0.00           H   new
ATOM    844  N   SER A  58      -4.281   2.883  -8.061  1.00  0.00           N
ATOM    845  CA  SER A  58      -4.909   4.141  -8.448  1.00  0.00           C
ATOM    846  C   SER A  58      -4.041   4.896  -9.450  1.00  0.00           C
ATOM    847  O   SER A  58      -4.523   5.351 -10.489  1.00  0.00           O
ATOM    848  CB  SER A  58      -5.158   5.011  -7.215  1.00  0.00           C
ATOM    849  OG  SER A  58      -6.241   5.900  -7.428  1.00  0.00           O
ATOM      0  H   SER A  58      -3.642   2.956  -7.269  1.00  0.00           H   new
ATOM      0  HA  SER A  58      -5.864   3.912  -8.921  1.00  0.00           H   new
ATOM      0  HB2 SER A  58      -5.369   4.376  -6.355  1.00  0.00           H   new
ATOM      0  HB3 SER A  58      -4.258   5.579  -6.979  1.00  0.00           H   new
ATOM      0  HG  SER A  58      -6.381   6.444  -6.625  1.00  0.00           H   new
ATOM    855  N   THR A  59      -2.757   5.026  -9.132  1.00  0.00           N
ATOM    856  CA  THR A  59      -1.821   5.726 -10.002  1.00  0.00           C
ATOM    857  C   THR A  59      -0.717   4.793 -10.487  1.00  0.00           C
ATOM    858  O   THR A  59      -0.165   4.979 -11.570  1.00  0.00           O
ATOM    859  CB  THR A  59      -1.181   6.930  -9.285  1.00  0.00           C
ATOM    860  OG1 THR A  59      -0.246   6.475  -8.301  1.00  0.00           O
ATOM    861  CG2 THR A  59      -2.244   7.792  -8.621  1.00  0.00           C
ATOM      0  H   THR A  59      -2.341   4.655  -8.277  1.00  0.00           H   new
ATOM      0  HA  THR A  59      -2.393   6.084 -10.858  1.00  0.00           H   new
ATOM      0  HB  THR A  59      -0.660   7.532 -10.029  1.00  0.00           H   new
ATOM      0  HG1 THR A  59      -0.084   7.188  -7.649  1.00  0.00           H   new
ATOM      0 HG21 THR A  59      -1.768   8.636  -8.121  1.00  0.00           H   new
ATOM      0 HG22 THR A  59      -2.937   8.162  -9.377  1.00  0.00           H   new
ATOM      0 HG23 THR A  59      -2.790   7.197  -7.889  1.00  0.00           H   new
ATOM    869  N   GLY A  60      -0.401   3.786  -9.677  1.00  0.00           N
ATOM    870  CA  GLY A  60       0.635   2.838 -10.041  1.00  0.00           C
ATOM    871  C   GLY A  60       1.986   3.204  -9.459  1.00  0.00           C
ATOM    872  O   GLY A  60       3.026   2.836 -10.007  1.00  0.00           O
ATOM      0  H   GLY A  60      -0.845   3.611  -8.775  1.00  0.00           H   new
ATOM      0  HA2 GLY A  60       0.351   1.844  -9.696  1.00  0.00           H   new
ATOM      0  HA3 GLY A  60       0.712   2.788 -11.127  1.00  0.00           H   new
ATOM    876  N   ARG A  61       1.972   3.930  -8.347  1.00  0.00           N
ATOM    877  CA  ARG A  61       3.206   4.348  -7.691  1.00  0.00           C
ATOM    878  C   ARG A  61       3.777   3.220  -6.837  1.00  0.00           C
ATOM    879  O   ARG A  61       3.057   2.592  -6.061  1.00  0.00           O
ATOM    880  CB  ARG A  61       2.955   5.583  -6.824  1.00  0.00           C
ATOM    881  CG  ARG A  61       2.912   6.882  -7.612  1.00  0.00           C
ATOM    882  CD  ARG A  61       3.052   8.091  -6.700  1.00  0.00           C
ATOM    883  NE  ARG A  61       3.088   9.343  -7.452  1.00  0.00           N
ATOM    884  CZ  ARG A  61       2.881  10.535  -6.905  1.00  0.00           C
ATOM    885  NH1 ARG A  61       2.626  10.638  -5.608  1.00  0.00           N
ATOM    886  NH2 ARG A  61       2.930  11.628  -7.655  1.00  0.00           N
ATOM      0  H   ARG A  61       1.120   4.242  -7.881  1.00  0.00           H   new
ATOM      0  HA  ARG A  61       3.932   4.598  -8.464  1.00  0.00           H   new
ATOM      0  HB2 ARG A  61       2.011   5.458  -6.294  1.00  0.00           H   new
ATOM      0  HB3 ARG A  61       3.738   5.652  -6.069  1.00  0.00           H   new
ATOM      0  HG2 ARG A  61       3.713   6.887  -8.351  1.00  0.00           H   new
ATOM      0  HG3 ARG A  61       1.972   6.945  -8.160  1.00  0.00           H   new
ATOM      0  HD2 ARG A  61       2.219   8.114  -5.998  1.00  0.00           H   new
ATOM      0  HD3 ARG A  61       3.964   7.996  -6.110  1.00  0.00           H   new
ATOM      0  HE  ARG A  61       3.283   9.299  -8.452  1.00  0.00           H   new
ATOM      0 HH11 ARG A  61       2.588   9.800  -5.028  1.00  0.00           H   new
ATOM      0 HH12 ARG A  61       2.467  11.555  -5.191  1.00  0.00           H   new
ATOM      0 HH21 ARG A  61       3.127  11.553  -8.653  1.00  0.00           H   new
ATOM      0 HH22 ARG A  61       2.771  12.543  -7.234  1.00  0.00           H   new
ATOM    900  N   GLU A  62       5.074   2.970  -6.985  1.00  0.00           N
ATOM    901  CA  GLU A  62       5.740   1.917  -6.228  1.00  0.00           C
ATOM    902  C   GLU A  62       6.562   2.506  -5.085  1.00  0.00           C
ATOM    903  O   GLU A  62       7.508   3.260  -5.311  1.00  0.00           O
ATOM    904  CB  GLU A  62       6.642   1.090  -7.146  1.00  0.00           C
ATOM    905  CG  GLU A  62       5.940  -0.100  -7.778  1.00  0.00           C
ATOM    906  CD  GLU A  62       6.580  -0.529  -9.084  1.00  0.00           C
ATOM    907  OE1 GLU A  62       6.494   0.239 -10.066  1.00  0.00           O
ATOM    908  OE2 GLU A  62       7.165  -1.631  -9.125  1.00  0.00           O
ATOM      0  H   GLU A  62       5.684   3.482  -7.622  1.00  0.00           H   new
ATOM      0  HA  GLU A  62       4.973   1.268  -5.805  1.00  0.00           H   new
ATOM      0  HB2 GLU A  62       7.030   1.733  -7.936  1.00  0.00           H   new
ATOM      0  HB3 GLU A  62       7.499   0.734  -6.575  1.00  0.00           H   new
ATOM      0  HG2 GLU A  62       5.952  -0.937  -7.080  1.00  0.00           H   new
ATOM      0  HG3 GLU A  62       4.895   0.152  -7.956  1.00  0.00           H   new
ATOM    915  N   SER A  63       6.192   2.156  -3.857  1.00  0.00           N
ATOM    916  CA  SER A  63       6.892   2.652  -2.678  1.00  0.00           C
ATOM    917  C   SER A  63       6.876   1.615  -1.559  1.00  0.00           C
ATOM    918  O   SER A  63       6.177   0.605  -1.644  1.00  0.00           O
ATOM    919  CB  SER A  63       6.252   3.954  -2.190  1.00  0.00           C
ATOM    920  OG  SER A  63       7.105   4.633  -1.285  1.00  0.00           O
ATOM      0  H   SER A  63       5.412   1.531  -3.653  1.00  0.00           H   new
ATOM      0  HA  SER A  63       7.928   2.845  -2.956  1.00  0.00           H   new
ATOM      0  HB2 SER A  63       6.034   4.598  -3.042  1.00  0.00           H   new
ATOM      0  HB3 SER A  63       5.301   3.736  -1.704  1.00  0.00           H   new
ATOM      0  HG  SER A  63       6.674   5.462  -0.989  1.00  0.00           H   new
ATOM    926  N   TYR A  64       7.652   1.871  -0.512  1.00  0.00           N
ATOM    927  CA  TYR A  64       7.730   0.959   0.623  1.00  0.00           C
ATOM    928  C   TYR A  64       7.078   1.571   1.859  1.00  0.00           C
ATOM    929  O   TYR A  64       7.485   2.634   2.327  1.00  0.00           O
ATOM    930  CB  TYR A  64       9.188   0.608   0.922  1.00  0.00           C
ATOM    931  CG  TYR A  64       9.927   0.028  -0.263  1.00  0.00           C
ATOM    932  CD1 TYR A  64      10.383   0.845  -1.290  1.00  0.00           C
ATOM    933  CD2 TYR A  64      10.168  -1.337  -0.356  1.00  0.00           C
ATOM    934  CE1 TYR A  64      11.058   0.320  -2.375  1.00  0.00           C
ATOM    935  CE2 TYR A  64      10.843  -1.871  -1.437  1.00  0.00           C
ATOM    936  CZ  TYR A  64      11.286  -1.039  -2.443  1.00  0.00           C
ATOM    937  OH  TYR A  64      11.957  -1.567  -3.522  1.00  0.00           O
ATOM      0  H   TYR A  64       8.236   2.703  -0.426  1.00  0.00           H   new
ATOM      0  HA  TYR A  64       7.190   0.048   0.363  1.00  0.00           H   new
ATOM      0  HB2 TYR A  64       9.707   1.505   1.259  1.00  0.00           H   new
ATOM      0  HB3 TYR A  64       9.220  -0.107   1.744  1.00  0.00           H   new
ATOM      0  HD1 TYR A  64      10.207   1.909  -1.239  1.00  0.00           H   new
ATOM      0  HD2 TYR A  64       9.822  -1.992   0.430  1.00  0.00           H   new
ATOM      0  HE1 TYR A  64      11.405   0.969  -3.165  1.00  0.00           H   new
ATOM      0  HE2 TYR A  64      11.023  -2.934  -1.493  1.00  0.00           H   new
ATOM      0  HH  TYR A  64      12.035  -2.538  -3.415  1.00  0.00           H   new
ATOM    947  N   ILE A  65       6.064   0.890   2.383  1.00  0.00           N
ATOM    948  CA  ILE A  65       5.357   1.364   3.566  1.00  0.00           C
ATOM    949  C   ILE A  65       5.301   0.286   4.643  1.00  0.00           C
ATOM    950  O   ILE A  65       5.278  -0.911   4.356  1.00  0.00           O
ATOM    951  CB  ILE A  65       3.922   1.807   3.224  1.00  0.00           C
ATOM    952  CG1 ILE A  65       3.057   0.592   2.886  1.00  0.00           C
ATOM    953  CG2 ILE A  65       3.934   2.794   2.066  1.00  0.00           C
ATOM    954  CD1 ILE A  65       3.526  -0.162   1.661  1.00  0.00           C
ATOM      0  H   ILE A  65       5.714   0.009   2.007  1.00  0.00           H   new
ATOM      0  HA  ILE A  65       5.914   2.222   3.943  1.00  0.00           H   new
ATOM      0  HB  ILE A  65       3.494   2.304   4.095  1.00  0.00           H   new
ATOM      0 HG12 ILE A  65       3.049  -0.086   3.739  1.00  0.00           H   new
ATOM      0 HG13 ILE A  65       2.029   0.920   2.729  1.00  0.00           H   new
ATOM      0 HG21 ILE A  65       2.913   3.098   1.836  1.00  0.00           H   new
ATOM      0 HG22 ILE A  65       4.520   3.671   2.341  1.00  0.00           H   new
ATOM      0 HG23 ILE A  65       4.378   2.321   1.190  1.00  0.00           H   new
ATOM      0 HD11 ILE A  65       2.866  -1.011   1.481  1.00  0.00           H   new
ATOM      0 HD12 ILE A  65       3.508   0.501   0.796  1.00  0.00           H   new
ATOM      0 HD13 ILE A  65       4.543  -0.521   1.822  1.00  0.00           H   new
ATOM    966  N   PRO A  66       5.277   0.718   5.912  1.00  0.00           N
ATOM    967  CA  PRO A  66       5.220  -0.195   7.058  1.00  0.00           C
ATOM    968  C   PRO A  66       3.874  -0.903   7.170  1.00  0.00           C
ATOM    969  O   PRO A  66       2.822  -0.278   7.045  1.00  0.00           O
ATOM    970  CB  PRO A  66       5.440   0.729   8.259  1.00  0.00           C
ATOM    971  CG  PRO A  66       4.981   2.068   7.795  1.00  0.00           C
ATOM    972  CD  PRO A  66       5.302   2.130   6.327  1.00  0.00           C
ATOM      0  HA  PRO A  66       5.956  -0.995   6.978  1.00  0.00           H   new
ATOM      0  HB2 PRO A  66       4.871   0.394   9.126  1.00  0.00           H   new
ATOM      0  HB3 PRO A  66       6.489   0.751   8.555  1.00  0.00           H   new
ATOM      0  HG2 PRO A  66       3.912   2.195   7.966  1.00  0.00           H   new
ATOM      0  HG3 PRO A  66       5.488   2.865   8.339  1.00  0.00           H   new
ATOM      0  HD2 PRO A  66       4.569   2.723   5.780  1.00  0.00           H   new
ATOM      0  HD3 PRO A  66       6.276   2.584   6.148  1.00  0.00           H   new
ATOM    980  N   GLY A  67       3.916  -2.210   7.407  1.00  0.00           N
ATOM    981  CA  GLY A  67       2.693  -2.981   7.532  1.00  0.00           C
ATOM    982  C   GLY A  67       1.696  -2.337   8.475  1.00  0.00           C
ATOM    983  O   GLY A  67       0.486  -2.489   8.308  1.00  0.00           O
ATOM      0  H   GLY A  67       4.775  -2.749   7.515  1.00  0.00           H   new
ATOM      0  HA2 GLY A  67       2.237  -3.095   6.549  1.00  0.00           H   new
ATOM      0  HA3 GLY A  67       2.933  -3.982   7.890  1.00  0.00           H   new
ATOM    987  N   ILE A  68       2.205  -1.619   9.471  1.00  0.00           N
ATOM    988  CA  ILE A  68       1.350  -0.951  10.444  1.00  0.00           C
ATOM    989  C   ILE A  68       0.521   0.147   9.786  1.00  0.00           C
ATOM    990  O   ILE A  68      -0.592   0.445  10.223  1.00  0.00           O
ATOM    991  CB  ILE A  68       2.175  -0.338  11.591  1.00  0.00           C
ATOM    992  CG1 ILE A  68       1.250   0.285  12.638  1.00  0.00           C
ATOM    993  CG2 ILE A  68       3.145   0.702  11.049  1.00  0.00           C
ATOM    994  CD1 ILE A  68       0.536  -0.736  13.497  1.00  0.00           C
ATOM      0  H   ILE A  68       3.204  -1.485   9.625  1.00  0.00           H   new
ATOM      0  HA  ILE A  68       0.683  -1.711  10.852  1.00  0.00           H   new
ATOM      0  HB  ILE A  68       2.751  -1.131  12.068  1.00  0.00           H   new
ATOM      0 HG12 ILE A  68       1.834   0.944  13.281  1.00  0.00           H   new
ATOM      0 HG13 ILE A  68       0.509   0.905  12.134  1.00  0.00           H   new
ATOM      0 HG21 ILE A  68       3.721   1.126  11.872  1.00  0.00           H   new
ATOM      0 HG22 ILE A  68       3.823   0.231  10.337  1.00  0.00           H   new
ATOM      0 HG23 ILE A  68       2.587   1.495  10.550  1.00  0.00           H   new
ATOM      0 HD11 ILE A  68      -0.102  -0.223  14.217  1.00  0.00           H   new
ATOM      0 HD12 ILE A  68      -0.075  -1.380  12.865  1.00  0.00           H   new
ATOM      0 HD13 ILE A  68       1.270  -1.341  14.029  1.00  0.00           H   new
ATOM   1006  N   CYS A  69       1.069   0.744   8.734  1.00  0.00           N
ATOM   1007  CA  CYS A  69       0.379   1.809   8.014  1.00  0.00           C
ATOM   1008  C   CYS A  69      -0.583   1.232   6.981  1.00  0.00           C
ATOM   1009  O   CYS A  69      -1.149   1.963   6.168  1.00  0.00           O
ATOM   1010  CB  CYS A  69       1.392   2.728   7.329  1.00  0.00           C
ATOM   1011  SG  CYS A  69       2.114   3.975   8.420  1.00  0.00           S
ATOM      0  H   CYS A  69       1.989   0.509   8.360  1.00  0.00           H   new
ATOM      0  HA  CYS A  69      -0.197   2.389   8.735  1.00  0.00           H   new
ATOM      0  HB2 CYS A  69       2.193   2.119   6.910  1.00  0.00           H   new
ATOM      0  HB3 CYS A  69       0.904   3.230   6.494  1.00  0.00           H   new
ATOM      0  HG  CYS A  69       2.959   4.701   7.750  1.00  0.00           H   new
ATOM   1017  N   VAL A  70      -0.764  -0.084   7.019  1.00  0.00           N
ATOM   1018  CA  VAL A  70      -1.658  -0.760   6.086  1.00  0.00           C
ATOM   1019  C   VAL A  70      -2.287  -1.993   6.723  1.00  0.00           C
ATOM   1020  O   VAL A  70      -1.876  -2.426   7.799  1.00  0.00           O
ATOM   1021  CB  VAL A  70      -0.916  -1.180   4.803  1.00  0.00           C
ATOM   1022  CG1 VAL A  70      -0.281   0.028   4.133  1.00  0.00           C
ATOM   1023  CG2 VAL A  70       0.131  -2.238   5.116  1.00  0.00           C
ATOM      0  H   VAL A  70      -0.304  -0.703   7.686  1.00  0.00           H   new
ATOM      0  HA  VAL A  70      -2.442  -0.049   5.827  1.00  0.00           H   new
ATOM      0  HB  VAL A  70      -1.639  -1.610   4.110  1.00  0.00           H   new
ATOM      0 HG11 VAL A  70       0.238  -0.289   3.229  1.00  0.00           H   new
ATOM      0 HG12 VAL A  70      -1.056   0.749   3.873  1.00  0.00           H   new
ATOM      0 HG13 VAL A  70       0.430   0.491   4.817  1.00  0.00           H   new
ATOM      0 HG21 VAL A  70       0.646  -2.523   4.198  1.00  0.00           H   new
ATOM      0 HG22 VAL A  70       0.853  -1.836   5.827  1.00  0.00           H   new
ATOM      0 HG23 VAL A  70      -0.354  -3.114   5.547  1.00  0.00           H   new
ATOM   1033  N   ALA A  71      -3.287  -2.555   6.051  1.00  0.00           N
ATOM   1034  CA  ALA A  71      -3.972  -3.740   6.551  1.00  0.00           C
ATOM   1035  C   ALA A  71      -4.097  -4.802   5.463  1.00  0.00           C
ATOM   1036  O   ALA A  71      -4.504  -4.507   4.339  1.00  0.00           O
ATOM   1037  CB  ALA A  71      -5.346  -3.369   7.088  1.00  0.00           C
ATOM      0  H   ALA A  71      -3.640  -2.208   5.159  1.00  0.00           H   new
ATOM      0  HA  ALA A  71      -3.377  -4.157   7.363  1.00  0.00           H   new
ATOM      0  HB1 ALA A  71      -5.846  -4.264   7.458  1.00  0.00           H   new
ATOM      0  HB2 ALA A  71      -5.237  -2.652   7.901  1.00  0.00           H   new
ATOM      0  HB3 ALA A  71      -5.941  -2.925   6.290  1.00  0.00           H   new
ATOM   1043  N   ARG A  72      -3.744  -6.037   5.804  1.00  0.00           N
ATOM   1044  CA  ARG A  72      -3.815  -7.141   4.855  1.00  0.00           C
ATOM   1045  C   ARG A  72      -5.265  -7.483   4.526  1.00  0.00           C
ATOM   1046  O   ARG A  72      -6.007  -7.972   5.378  1.00  0.00           O
ATOM   1047  CB  ARG A  72      -3.104  -8.373   5.419  1.00  0.00           C
ATOM   1048  CG  ARG A  72      -2.463  -9.247   4.354  1.00  0.00           C
ATOM   1049  CD  ARG A  72      -1.227  -9.957   4.887  1.00  0.00           C
ATOM   1050  NE  ARG A  72      -1.546 -11.272   5.436  1.00  0.00           N
ATOM   1051  CZ  ARG A  72      -1.944 -11.468   6.688  1.00  0.00           C
ATOM   1052  NH1 ARG A  72      -2.072 -10.440   7.516  1.00  0.00           N
ATOM   1053  NH2 ARG A  72      -2.215 -12.695   7.115  1.00  0.00           N
ATOM      0  H   ARG A  72      -3.406  -6.298   6.730  1.00  0.00           H   new
ATOM      0  HA  ARG A  72      -3.316  -6.831   3.937  1.00  0.00           H   new
ATOM      0  HB2 ARG A  72      -2.336  -8.049   6.122  1.00  0.00           H   new
ATOM      0  HB3 ARG A  72      -3.821  -8.969   5.983  1.00  0.00           H   new
ATOM      0  HG2 ARG A  72      -3.185  -9.984   4.004  1.00  0.00           H   new
ATOM      0  HG3 ARG A  72      -2.190  -8.635   3.495  1.00  0.00           H   new
ATOM      0  HD2 ARG A  72      -0.497 -10.066   4.085  1.00  0.00           H   new
ATOM      0  HD3 ARG A  72      -0.762  -9.345   5.660  1.00  0.00           H   new
ATOM      0  HE  ARG A  72      -1.458 -12.084   4.825  1.00  0.00           H   new
ATOM      0 HH11 ARG A  72      -1.865  -9.495   7.192  1.00  0.00           H   new
ATOM      0 HH12 ARG A  72      -2.378 -10.594   8.477  1.00  0.00           H   new
ATOM      0 HH21 ARG A  72      -2.118 -13.489   6.482  1.00  0.00           H   new
ATOM      0 HH22 ARG A  72      -2.521 -12.844   8.077  1.00  0.00           H   new
ATOM   1067  N   VAL A  73      -5.662  -7.222   3.285  1.00  0.00           N
ATOM   1068  CA  VAL A  73      -7.023  -7.503   2.843  1.00  0.00           C
ATOM   1069  C   VAL A  73      -7.156  -8.939   2.350  1.00  0.00           C
ATOM   1070  O   VAL A  73      -6.234  -9.487   1.746  1.00  0.00           O
ATOM   1071  CB  VAL A  73      -7.457  -6.544   1.718  1.00  0.00           C
ATOM   1072  CG1 VAL A  73      -8.967  -6.580   1.538  1.00  0.00           C
ATOM   1073  CG2 VAL A  73      -6.981  -5.129   2.012  1.00  0.00           C
ATOM      0  H   VAL A  73      -5.061  -6.816   2.568  1.00  0.00           H   new
ATOM      0  HA  VAL A  73      -7.672  -7.357   3.706  1.00  0.00           H   new
ATOM      0  HB  VAL A  73      -6.996  -6.872   0.786  1.00  0.00           H   new
ATOM      0 HG11 VAL A  73      -9.255  -5.896   0.739  1.00  0.00           H   new
ATOM      0 HG12 VAL A  73      -9.279  -7.592   1.279  1.00  0.00           H   new
ATOM      0 HG13 VAL A  73      -9.451  -6.277   2.466  1.00  0.00           H   new
ATOM      0 HG21 VAL A  73      -7.296  -4.465   1.207  1.00  0.00           H   new
ATOM      0 HG22 VAL A  73      -7.412  -4.788   2.954  1.00  0.00           H   new
ATOM      0 HG23 VAL A  73      -5.894  -5.119   2.086  1.00  0.00           H   new