USER  MOD reduce.3.24.130724 H: found=0, std=0, add=614, rem=0, adj=26
USER  MOD reduce.3.24.130724 removed 617 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  44 SER OG  :   rot  -66:sc=   0.439
USER  MOD Set 1.2: A  82 HIS     :     no HD1:sc= -0.0727  X(o=0.76,f=1.1)
USER  MOD Set 1.3: A  84 THR OG1 :   rot  -38:sc=   0.395
USER  MOD Single : A  25 MET CE  :methyl  177:sc=  -0.748   (180deg=-0.757)
USER  MOD Single : A  26 LYS NZ  :NH3+   -171:sc= -0.0249   (180deg=-0.197)
USER  MOD Single : A  27 LYS NZ  :NH3+    178:sc=   0.605   (180deg=0.57)
USER  MOD Single : A  28 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  32 LYS NZ  :NH3+   -175:sc=-0.000546   (180deg=-0.0569)
USER  MOD Single : A  35 SER OG  :   rot  180:sc= 0.00583
USER  MOD Single : A  37 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  38 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  39 LYS NZ  :NH3+   -114:sc=   0.637   (180deg=-0.217)
USER  MOD Single : A  42 THR OG1 :   rot -103:sc=    0.35
USER  MOD Single : A  45 THR OG1 :   rot  113:sc=   -0.39
USER  MOD Single : A  46 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  49 MET CE  :methyl -128:sc= -0.0876   (180deg=-2.6!)
USER  MOD Single : A  50 SER OG  :   rot  -56:sc=  0.0998
USER  MOD Single : A  60 LYS NZ  :NH3+   -178:sc=   0.267   (180deg=0.26)
USER  MOD Single : A  61 LYS NZ  :NH3+   -168:sc=   0.568   (180deg=0.415)
USER  MOD Single : A  65 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  73 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  74 SER OG  :   rot -100:sc=  -0.178
USER  MOD Single : A  76 GLN     :      amide:sc=   0.269  K(o=0.27,f=-5.3!)
USER  MOD Single : A  77 THR OG1 :   rot  -32:sc=   0.318
USER  MOD Single : A  79 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  80 LYS NZ  :NH3+    171:sc= -0.0216   (180deg=-0.143)
USER  MOD Single : A  88 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  89 LYS NZ  :NH3+   -170:sc=  -0.805   (180deg=-1.3)
USER  MOD Single : A  90 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  91 LYS NZ  :NH3+   -166:sc= -0.0313   (180deg=-0.247)
USER  MOD Single : A  94 HIS     :     no HD1:sc= -0.0289  X(o=-0.029,f=-0.029)
USER  MOD Single : A  95 HIS     :     no HE2:sc= -0.0808  K(o=-0.081,f=-2)
USER  MOD Single : A  96 HIS     :     no HD1:sc=  -0.135  X(o=-0.14,f=-0.57)
USER  MOD Single : A  97 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  98 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  99 HIS     :     no HD1:sc=       0  X(o=0,f=-0.12)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   ALA A  22       0.505   2.503   8.489  1.00 74.11           N
ATOM      2  CA  ALA A  22       0.161   2.311   7.065  1.00 31.44           C
ATOM      3  C   ALA A  22      -1.177   1.564   6.953  1.00 42.04           C
ATOM      4  O   ALA A  22      -1.390   0.561   7.645  1.00 15.21           O
ATOM      5  CB  ALA A  22       1.285   1.561   6.332  1.00 40.13           C
ATOM      0  HA  ALA A  22       0.053   3.285   6.587  1.00 31.44           H   new
ATOM      0  HB1 ALA A  22       1.012   1.430   5.285  1.00 40.13           H   new
ATOM      0  HB2 ALA A  22       2.209   2.136   6.397  1.00 40.13           H   new
ATOM      0  HB3 ALA A  22       1.432   0.585   6.794  1.00 40.13           H   new
ATOM     13  N   GLU A  23      -2.080   2.070   6.099  1.00 50.32           N
ATOM     14  CA  GLU A  23      -3.416   1.468   5.870  1.00 42.32           C
ATOM     15  C   GLU A  23      -3.423   0.680   4.553  1.00 21.24           C
ATOM     16  O   GLU A  23      -2.579   0.913   3.691  1.00  1.02           O
ATOM     17  CB  GLU A  23      -4.497   2.580   5.839  1.00 13.32           C
ATOM     18  CG  GLU A  23      -4.269   3.658   4.758  1.00  4.42           C
ATOM     19  CD  GLU A  23      -5.326   4.771   4.777  1.00  2.52           C
ATOM     20  OE1 GLU A  23      -5.190   5.713   5.591  1.00  4.13           O
ATOM     21  OE2 GLU A  23      -6.297   4.705   3.992  1.00 53.44           O
ATOM      0  H   GLU A  23      -1.911   2.909   5.544  1.00 50.32           H   new
ATOM      0  HA  GLU A  23      -3.641   0.781   6.686  1.00 42.32           H   new
ATOM      0  HB2 GLU A  23      -5.471   2.119   5.676  1.00 13.32           H   new
ATOM      0  HB3 GLU A  23      -4.533   3.063   6.815  1.00 13.32           H   new
ATOM      0  HG2 GLU A  23      -3.283   4.101   4.899  1.00  4.42           H   new
ATOM      0  HG3 GLU A  23      -4.268   3.184   3.777  1.00  4.42           H   new
ATOM     28  N   ILE A  24      -4.371  -0.252   4.407  1.00 20.55           N
ATOM     29  CA  ILE A  24      -4.544  -1.033   3.170  1.00 24.33           C
ATOM     30  C   ILE A  24      -5.787  -0.539   2.412  1.00 32.25           C
ATOM     31  O   ILE A  24      -6.886  -0.487   2.982  1.00 71.33           O
ATOM     32  CB  ILE A  24      -4.703  -2.575   3.463  1.00 24.21           C
ATOM     33  CG1 ILE A  24      -3.429  -3.167   4.142  1.00 73.45           C
ATOM     34  CG2 ILE A  24      -5.044  -3.362   2.173  1.00  1.52           C
ATOM     35  CD1 ILE A  24      -2.192  -3.254   3.257  1.00 32.45           C
ATOM      0  H   ILE A  24      -5.040  -0.488   5.139  1.00 20.55           H   new
ATOM      0  HA  ILE A  24      -3.647  -0.890   2.567  1.00 24.33           H   new
ATOM      0  HB  ILE A  24      -5.535  -2.682   4.159  1.00 24.21           H   new
ATOM      0 HG12 ILE A  24      -3.188  -2.559   5.014  1.00 73.45           H   new
ATOM      0 HG13 ILE A  24      -3.664  -4.167   4.506  1.00 73.45           H   new
ATOM      0 HG21 ILE A  24      -5.147  -4.421   2.409  1.00  1.52           H   new
ATOM      0 HG22 ILE A  24      -5.980  -2.990   1.757  1.00  1.52           H   new
ATOM      0 HG23 ILE A  24      -4.245  -3.229   1.444  1.00  1.52           H   new
ATOM      0 HD11 ILE A  24      -1.366  -3.679   3.827  1.00 32.45           H   new
ATOM      0 HD12 ILE A  24      -2.404  -3.889   2.397  1.00 32.45           H   new
ATOM      0 HD13 ILE A  24      -1.920  -2.256   2.913  1.00 32.45           H   new
ATOM     47  N   MET A  25      -5.595  -0.163   1.135  1.00 21.21           N
ATOM     48  CA  MET A  25      -6.692   0.037   0.163  1.00 52.54           C
ATOM     49  C   MET A  25      -6.320  -0.682  -1.141  1.00 40.21           C
ATOM     50  O   MET A  25      -5.139  -0.746  -1.502  1.00  2.11           O
ATOM     51  CB  MET A  25      -6.995   1.546  -0.113  1.00 32.01           C
ATOM     52  CG  MET A  25      -7.526   2.334   1.101  1.00 34.00           C
ATOM     53  SD  MET A  25      -8.250   3.939   0.669  1.00 41.44           S
ATOM     54  CE  MET A  25      -6.880   4.789  -0.110  1.00 64.21           C
ATOM      0  H   MET A  25      -4.670   0.012   0.743  1.00 21.21           H   new
ATOM      0  HA  MET A  25      -7.604  -0.380   0.589  1.00 52.54           H   new
ATOM      0  HB2 MET A  25      -6.083   2.026  -0.468  1.00 32.01           H   new
ATOM      0  HB3 MET A  25      -7.725   1.613  -0.919  1.00 32.01           H   new
ATOM      0  HG2 MET A  25      -8.277   1.733   1.613  1.00 34.00           H   new
ATOM      0  HG3 MET A  25      -6.710   2.492   1.806  1.00 34.00           H   new
ATOM      0  HE1 MET A  25      -7.212   5.764  -0.467  1.00 64.21           H   new
ATOM      0  HE2 MET A  25      -6.076   4.922   0.613  1.00 64.21           H   new
ATOM      0  HE3 MET A  25      -6.517   4.199  -0.952  1.00 64.21           H   new
ATOM     64  N   LYS A  26      -7.328  -1.247  -1.828  1.00  3.13           N
ATOM     65  CA  LYS A  26      -7.138  -1.900  -3.131  1.00 33.13           C
ATOM     66  C   LYS A  26      -6.943  -0.825  -4.216  1.00 13.32           C
ATOM     67  O   LYS A  26      -7.380   0.319  -4.032  1.00 54.40           O
ATOM     68  CB  LYS A  26      -8.354  -2.814  -3.439  1.00 41.11           C
ATOM     69  CG  LYS A  26      -8.103  -3.933  -4.493  1.00 42.43           C
ATOM     70  CD  LYS A  26      -8.603  -3.611  -5.924  1.00  0.12           C
ATOM     71  CE  LYS A  26     -10.130  -3.416  -5.979  1.00 41.24           C
ATOM     72  NZ  LYS A  26     -10.874  -4.562  -5.392  1.00 41.32           N
ATOM      0  H   LYS A  26      -8.292  -1.263  -1.496  1.00  3.13           H   new
ATOM      0  HA  LYS A  26      -6.247  -2.527  -3.112  1.00 33.13           H   new
ATOM      0  HB2 LYS A  26      -8.680  -3.281  -2.510  1.00 41.11           H   new
ATOM      0  HB3 LYS A  26      -9.177  -2.189  -3.787  1.00 41.11           H   new
ATOM      0  HG2 LYS A  26      -7.033  -4.137  -4.536  1.00 42.43           H   new
ATOM      0  HG3 LYS A  26      -8.589  -4.847  -4.152  1.00 42.43           H   new
ATOM      0  HD2 LYS A  26      -8.110  -2.708  -6.284  1.00  0.12           H   new
ATOM      0  HD3 LYS A  26      -8.318  -4.420  -6.597  1.00  0.12           H   new
ATOM      0  HE2 LYS A  26     -10.396  -2.503  -5.445  1.00 41.24           H   new
ATOM      0  HE3 LYS A  26     -10.438  -3.280  -7.016  1.00 41.24           H   new
ATOM      0  HZ1 LYS A  26     -11.889  -4.454  -5.589  1.00 41.32           H   new
ATOM      0  HZ2 LYS A  26     -10.532  -5.450  -5.812  1.00 41.32           H   new
ATOM      0  HZ3 LYS A  26     -10.721  -4.585  -4.363  1.00 41.32           H   new
ATOM     86  N   LYS A  27      -6.305  -1.219  -5.335  1.00 14.44           N
ATOM     87  CA  LYS A  27      -5.931  -0.318  -6.442  1.00 34.43           C
ATOM     88  C   LYS A  27      -7.111   0.569  -6.910  1.00 43.30           C
ATOM     89  O   LYS A  27      -6.977   1.793  -6.987  1.00  5.32           O
ATOM     90  CB  LYS A  27      -5.368  -1.167  -7.619  1.00 35.14           C
ATOM     91  CG  LYS A  27      -4.733  -0.364  -8.783  1.00 35.03           C
ATOM     92  CD  LYS A  27      -3.529   0.515  -8.339  1.00 72.22           C
ATOM     93  CE  LYS A  27      -2.875   1.267  -9.511  1.00 23.32           C
ATOM     94  NZ  LYS A  27      -3.856   2.086 -10.257  1.00 71.50           N
ATOM      0  H   LYS A  27      -6.031  -2.188  -5.498  1.00 14.44           H   new
ATOM      0  HA  LYS A  27      -5.164   0.367  -6.080  1.00 34.43           H   new
ATOM      0  HB2 LYS A  27      -4.618  -1.852  -7.223  1.00 35.14           H   new
ATOM      0  HB3 LYS A  27      -6.176  -1.778  -8.022  1.00 35.14           H   new
ATOM      0  HG2 LYS A  27      -4.402  -1.058  -9.556  1.00 35.03           H   new
ATOM      0  HG3 LYS A  27      -5.494   0.274  -9.232  1.00 35.03           H   new
ATOM      0  HD2 LYS A  27      -3.866   1.236  -7.594  1.00 72.22           H   new
ATOM      0  HD3 LYS A  27      -2.783  -0.116  -7.857  1.00 72.22           H   new
ATOM      0  HE2 LYS A  27      -2.080   1.909  -9.132  1.00 23.32           H   new
ATOM      0  HE3 LYS A  27      -2.411   0.550 -10.188  1.00 23.32           H   new
ATOM      0  HZ1 LYS A  27      -3.370   2.603 -11.017  1.00 71.50           H   new
ATOM      0  HZ2 LYS A  27      -4.583   1.467 -10.669  1.00 71.50           H   new
ATOM      0  HZ3 LYS A  27      -4.305   2.765  -9.610  1.00 71.50           H   new
ATOM    108  N   THR A  28      -8.280  -0.061  -7.124  1.00 13.41           N
ATOM    109  CA  THR A  28      -9.487   0.624  -7.639  1.00  2.31           C
ATOM    110  C   THR A  28     -10.036   1.655  -6.622  1.00  1.41           C
ATOM    111  O   THR A  28     -10.362   2.793  -6.990  1.00 32.03           O
ATOM    112  CB  THR A  28     -10.601  -0.414  -7.988  1.00 63.03           C
ATOM    113  OG1 THR A  28     -10.046  -1.449  -8.818  1.00 21.12           O
ATOM    114  CG2 THR A  28     -11.814   0.222  -8.703  1.00 61.40           C
ATOM      0  H   THR A  28      -8.418  -1.056  -6.947  1.00 13.41           H   new
ATOM      0  HA  THR A  28      -9.195   1.158  -8.543  1.00  2.31           H   new
ATOM      0  HB  THR A  28     -10.963  -0.825  -7.046  1.00 63.03           H   new
ATOM      0  HG1 THR A  28     -10.743  -2.102  -9.037  1.00 21.12           H   new
ATOM      0 HG21 THR A  28     -12.554  -0.549  -8.919  1.00 61.40           H   new
ATOM      0 HG22 THR A  28     -12.258   0.981  -8.060  1.00 61.40           H   new
ATOM      0 HG23 THR A  28     -11.487   0.683  -9.635  1.00 61.40           H   new
ATOM    122  N   ASP A  29     -10.099   1.239  -5.338  1.00  3.33           N
ATOM    123  CA  ASP A  29     -10.567   2.095  -4.220  1.00 44.31           C
ATOM    124  C   ASP A  29      -9.640   3.301  -4.035  1.00 12.12           C
ATOM    125  O   ASP A  29     -10.088   4.414  -3.725  1.00 72.33           O
ATOM    126  CB  ASP A  29     -10.624   1.280  -2.901  1.00 63.21           C
ATOM    127  CG  ASP A  29     -11.601   0.099  -2.976  1.00 63.01           C
ATOM    128  OD1 ASP A  29     -11.209  -0.982  -3.476  1.00 71.52           O
ATOM    129  OD2 ASP A  29     -12.771   0.250  -2.557  1.00 61.41           O
ATOM      0  H   ASP A  29      -9.827   0.301  -5.045  1.00  3.33           H   new
ATOM      0  HA  ASP A  29     -11.567   2.452  -4.466  1.00 44.31           H   new
ATOM      0  HB2 ASP A  29      -9.627   0.907  -2.666  1.00 63.21           H   new
ATOM      0  HB3 ASP A  29     -10.919   1.939  -2.084  1.00 63.21           H   new
ATOM    134  N   PHE A  30      -8.347   3.049  -4.263  1.00 51.32           N
ATOM    135  CA  PHE A  30      -7.292   4.038  -4.097  1.00 64.32           C
ATOM    136  C   PHE A  30      -7.321   5.092  -5.217  1.00 75.32           C
ATOM    137  O   PHE A  30      -7.129   6.277  -4.937  1.00 73.21           O
ATOM    138  CB  PHE A  30      -5.915   3.340  -4.063  1.00 72.25           C
ATOM    139  CG  PHE A  30      -4.753   4.328  -4.037  1.00 51.21           C
ATOM    140  CD1 PHE A  30      -4.417   4.990  -2.864  1.00 71.12           C
ATOM    141  CD2 PHE A  30      -4.029   4.628  -5.197  1.00  4.34           C
ATOM    142  CE1 PHE A  30      -3.401   5.908  -2.843  1.00  2.33           C
ATOM    143  CE2 PHE A  30      -3.010   5.547  -5.169  1.00 10.40           C
ATOM    144  CZ  PHE A  30      -2.702   6.189  -3.990  1.00 42.14           C
ATOM      0  H   PHE A  30      -8.006   2.139  -4.572  1.00 51.32           H   new
ATOM      0  HA  PHE A  30      -7.463   4.553  -3.151  1.00 64.32           H   new
ATOM      0  HB2 PHE A  30      -5.860   2.698  -3.184  1.00 72.25           H   new
ATOM      0  HB3 PHE A  30      -5.818   2.695  -4.936  1.00 72.25           H   new
ATOM      0  HD1 PHE A  30      -4.964   4.778  -1.957  1.00 71.12           H   new
ATOM      0  HD2 PHE A  30      -4.275   4.131  -6.124  1.00  4.34           H   new
ATOM      0  HE1 PHE A  30      -3.149   6.412  -1.922  1.00  2.33           H   new
ATOM      0  HE2 PHE A  30      -2.452   5.766  -6.067  1.00 10.40           H   new
ATOM      0  HZ  PHE A  30      -1.905   6.918  -3.968  1.00 42.14           H   new
ATOM    154  N   ASP A  31      -7.533   4.641  -6.476  1.00  1.42           N
ATOM    155  CA  ASP A  31      -7.490   5.520  -7.676  1.00 13.02           C
ATOM    156  C   ASP A  31      -8.425   6.730  -7.538  1.00  4.14           C
ATOM    157  O   ASP A  31      -8.077   7.852  -7.936  1.00 21.22           O
ATOM    158  CB  ASP A  31      -7.807   4.722  -8.976  1.00 71.43           C
ATOM    159  CG  ASP A  31      -6.648   3.812  -9.433  1.00 64.32           C
ATOM    160  OD1 ASP A  31      -5.491   4.294  -9.472  1.00 24.34           O
ATOM    161  OD2 ASP A  31      -6.885   2.639  -9.800  1.00 75.23           O
ATOM      0  H   ASP A  31      -7.738   3.665  -6.691  1.00  1.42           H   new
ATOM      0  HA  ASP A  31      -6.472   5.901  -7.751  1.00 13.02           H   new
ATOM      0  HB2 ASP A  31      -8.695   4.112  -8.812  1.00 71.43           H   new
ATOM      0  HB3 ASP A  31      -8.045   5.424  -9.775  1.00 71.43           H   new
ATOM    166  N   LYS A  32      -9.556   6.498  -6.862  1.00 12.02           N
ATOM    167  CA  LYS A  32     -10.591   7.518  -6.602  1.00 13.22           C
ATOM    168  C   LYS A  32     -10.026   8.726  -5.802  1.00 25.14           C
ATOM    169  O   LYS A  32     -10.521   9.854  -5.928  1.00 35.15           O
ATOM    170  CB  LYS A  32     -11.755   6.857  -5.820  1.00 54.42           C
ATOM    171  CG  LYS A  32     -12.280   5.545  -6.451  1.00 71.14           C
ATOM    172  CD  LYS A  32     -13.388   4.854  -5.622  1.00 33.11           C
ATOM    173  CE  LYS A  32     -13.763   3.471  -6.194  1.00 12.13           C
ATOM    174  NZ  LYS A  32     -14.175   3.540  -7.625  1.00 32.11           N
ATOM      0  H   LYS A  32      -9.786   5.584  -6.472  1.00 12.02           H   new
ATOM      0  HA  LYS A  32     -10.946   7.904  -7.557  1.00 13.22           H   new
ATOM      0  HB2 LYS A  32     -11.423   6.650  -4.803  1.00 54.42           H   new
ATOM      0  HB3 LYS A  32     -12.579   7.567  -5.748  1.00 54.42           H   new
ATOM      0  HG2 LYS A  32     -12.666   5.761  -7.447  1.00 71.14           H   new
ATOM      0  HG3 LYS A  32     -11.447   4.853  -6.575  1.00 71.14           H   new
ATOM      0  HD2 LYS A  32     -13.052   4.741  -4.591  1.00 33.11           H   new
ATOM      0  HD3 LYS A  32     -14.274   5.489  -5.600  1.00 33.11           H   new
ATOM      0  HE2 LYS A  32     -12.912   2.797  -6.096  1.00 12.13           H   new
ATOM      0  HE3 LYS A  32     -14.575   3.045  -5.605  1.00 12.13           H   new
ATOM      0  HZ1 LYS A  32     -14.498   2.602  -7.939  1.00 32.11           H   new
ATOM      0  HZ2 LYS A  32     -14.950   4.226  -7.731  1.00 32.11           H   new
ATOM      0  HZ3 LYS A  32     -13.366   3.840  -8.205  1.00 32.11           H   new
ATOM    188  N   VAL A  33      -8.996   8.460  -4.967  1.00 74.15           N
ATOM    189  CA  VAL A  33      -8.299   9.489  -4.153  1.00 14.53           C
ATOM    190  C   VAL A  33      -6.781   9.514  -4.464  1.00 41.15           C
ATOM    191  O   VAL A  33      -6.004  10.057  -3.677  1.00 44.22           O
ATOM    192  CB  VAL A  33      -8.530   9.235  -2.606  1.00  1.43           C
ATOM    193  CG1 VAL A  33     -10.012   9.452  -2.201  1.00 23.14           C
ATOM    194  CG2 VAL A  33      -8.047   7.820  -2.184  1.00 21.25           C
ATOM      0  H   VAL A  33      -8.621   7.521  -4.836  1.00 74.15           H   new
ATOM      0  HA  VAL A  33      -8.721  10.459  -4.417  1.00 14.53           H   new
ATOM      0  HB  VAL A  33      -7.929   9.971  -2.071  1.00  1.43           H   new
ATOM      0 HG11 VAL A  33     -10.128   9.268  -1.133  1.00 23.14           H   new
ATOM      0 HG12 VAL A  33     -10.304  10.478  -2.426  1.00 23.14           H   new
ATOM      0 HG13 VAL A  33     -10.646   8.763  -2.759  1.00 23.14           H   new
ATOM      0 HG21 VAL A  33      -8.220   7.680  -1.117  1.00 21.25           H   new
ATOM      0 HG22 VAL A  33      -8.599   7.065  -2.744  1.00 21.25           H   new
ATOM      0 HG23 VAL A  33      -6.982   7.721  -2.395  1.00 21.25           H   new
ATOM    204  N   ALA A  34      -6.365   8.958  -5.631  1.00  4.23           N
ATOM    205  CA  ALA A  34      -4.919   8.831  -5.989  1.00 11.02           C
ATOM    206  C   ALA A  34      -4.205  10.199  -6.066  1.00 34.33           C
ATOM    207  O   ALA A  34      -3.016  10.315  -5.723  1.00 44.13           O
ATOM    208  CB  ALA A  34      -4.757   8.078  -7.316  1.00 24.34           C
ATOM      0  H   ALA A  34      -7.002   8.591  -6.339  1.00  4.23           H   new
ATOM      0  HA  ALA A  34      -4.445   8.263  -5.189  1.00 11.02           H   new
ATOM      0  HB1 ALA A  34      -3.698   7.995  -7.560  1.00 24.34           H   new
ATOM      0  HB2 ALA A  34      -5.187   7.081  -7.223  1.00 24.34           H   new
ATOM      0  HB3 ALA A  34      -5.271   8.622  -8.108  1.00 24.34           H   new
ATOM    214  N   SER A  35      -4.962  11.226  -6.481  1.00 11.35           N
ATOM    215  CA  SER A  35      -4.474  12.615  -6.625  1.00 70.34           C
ATOM    216  C   SER A  35      -4.128  13.271  -5.263  1.00 65.30           C
ATOM    217  O   SER A  35      -3.552  14.363  -5.233  1.00 43.23           O
ATOM    218  CB  SER A  35      -5.543  13.441  -7.375  1.00 24.04           C
ATOM    219  OG  SER A  35      -6.820  13.286  -6.773  1.00 44.53           O
ATOM      0  H   SER A  35      -5.945  11.118  -6.731  1.00 11.35           H   new
ATOM      0  HA  SER A  35      -3.545  12.593  -7.195  1.00 70.34           H   new
ATOM      0  HB2 SER A  35      -5.261  14.494  -7.373  1.00 24.04           H   new
ATOM      0  HB3 SER A  35      -5.587  13.125  -8.417  1.00 24.04           H   new
ATOM      0  HG  SER A  35      -7.480  13.819  -7.264  1.00 44.53           H   new
ATOM    225  N   GLU A  36      -4.485  12.599  -4.148  1.00 62.24           N
ATOM    226  CA  GLU A  36      -4.144  13.047  -2.782  1.00 64.01           C
ATOM    227  C   GLU A  36      -2.745  12.542  -2.372  1.00  2.35           C
ATOM    228  O   GLU A  36      -2.241  12.921  -1.311  1.00 43.23           O
ATOM    229  CB  GLU A  36      -5.202  12.500  -1.777  1.00 13.25           C
ATOM    230  CG  GLU A  36      -6.671  12.842  -2.112  1.00 14.43           C
ATOM    231  CD  GLU A  36      -7.009  14.330  -1.980  1.00 25.41           C
ATOM    232  OE1 GLU A  36      -6.719  15.108  -2.911  1.00 32.44           O
ATOM    233  OE2 GLU A  36      -7.558  14.730  -0.935  1.00 13.43           O
ATOM      0  H   GLU A  36      -5.018  11.730  -4.170  1.00 62.24           H   new
ATOM      0  HA  GLU A  36      -4.141  14.137  -2.767  1.00 64.01           H   new
ATOM      0  HB2 GLU A  36      -5.102  11.416  -1.724  1.00 13.25           H   new
ATOM      0  HB3 GLU A  36      -4.973  12.890  -0.785  1.00 13.25           H   new
ATOM      0  HG2 GLU A  36      -6.885  12.520  -3.131  1.00 14.43           H   new
ATOM      0  HG3 GLU A  36      -7.326  12.271  -1.453  1.00 14.43           H   new
ATOM    240  N   TYR A  37      -2.132  11.661  -3.207  1.00  1.44           N
ATOM    241  CA  TYR A  37      -0.932  10.868  -2.820  1.00 22.51           C
ATOM    242  C   TYR A  37       0.208  10.966  -3.853  1.00 12.44           C
ATOM    243  O   TYR A  37       0.059  11.597  -4.907  1.00 24.40           O
ATOM    244  CB  TYR A  37      -1.350   9.388  -2.601  1.00 43.10           C
ATOM    245  CG  TYR A  37      -2.396   9.231  -1.484  1.00 24.21           C
ATOM    246  CD1 TYR A  37      -2.025   9.336  -0.151  1.00 73.32           C
ATOM    247  CD2 TYR A  37      -3.750   9.042  -1.764  1.00 50.12           C
ATOM    248  CE1 TYR A  37      -2.953   9.260   0.858  1.00 22.31           C
ATOM    249  CE2 TYR A  37      -4.684   8.951  -0.748  1.00 23.25           C
ATOM    250  CZ  TYR A  37      -4.280   9.065   0.559  1.00 72.32           C
ATOM    251  OH  TYR A  37      -5.209   8.991   1.570  1.00 21.45           O
ATOM      0  H   TYR A  37      -2.451  11.481  -4.159  1.00  1.44           H   new
ATOM      0  HA  TYR A  37      -0.538  11.287  -1.894  1.00 22.51           H   new
ATOM      0  HB2 TYR A  37      -1.753   8.986  -3.531  1.00 43.10           H   new
ATOM      0  HB3 TYR A  37      -0.468   8.797  -2.354  1.00 43.10           H   new
ATOM      0  HD1 TYR A  37      -0.984   9.481   0.098  1.00 73.32           H   new
ATOM      0  HD2 TYR A  37      -4.074   8.965  -2.791  1.00 50.12           H   new
ATOM      0  HE1 TYR A  37      -2.640   9.354   1.887  1.00 22.31           H   new
ATOM      0  HE2 TYR A  37      -5.726   8.791  -0.982  1.00 23.25           H   new
ATOM      0  HH  TYR A  37      -6.100   8.852   1.186  1.00 21.45           H   new
ATOM    261  N   THR A  38       1.360  10.333  -3.513  1.00 41.25           N
ATOM    262  CA  THR A  38       2.575  10.315  -4.353  1.00 60.25           C
ATOM    263  C   THR A  38       3.280   8.935  -4.236  1.00  5.23           C
ATOM    264  O   THR A  38       3.466   8.426  -3.127  1.00 61.41           O
ATOM    265  CB  THR A  38       3.550  11.487  -3.965  1.00 40.10           C
ATOM    266  OG1 THR A  38       4.620  11.575  -4.918  1.00 45.54           O
ATOM    267  CG2 THR A  38       4.134  11.360  -2.540  1.00 31.22           C
ATOM      0  H   THR A  38       1.468   9.818  -2.639  1.00 41.25           H   new
ATOM      0  HA  THR A  38       2.282  10.468  -5.392  1.00 60.25           H   new
ATOM      0  HB  THR A  38       2.951  12.398  -3.979  1.00 40.10           H   new
ATOM      0  HG1 THR A  38       5.220  12.308  -4.669  1.00 45.54           H   new
ATOM      0 HG21 THR A  38       4.797  12.202  -2.342  1.00 31.22           H   new
ATOM      0 HG22 THR A  38       3.322  11.358  -1.813  1.00 31.22           H   new
ATOM      0 HG23 THR A  38       4.696  10.429  -2.459  1.00 31.22           H   new
ATOM    275  N   LYS A  39       3.627   8.320  -5.387  1.00 54.32           N
ATOM    276  CA  LYS A  39       4.203   6.949  -5.440  1.00 61.54           C
ATOM    277  C   LYS A  39       5.693   6.997  -5.080  1.00 31.01           C
ATOM    278  O   LYS A  39       6.487   7.609  -5.805  1.00  3.33           O
ATOM    279  CB  LYS A  39       3.970   6.342  -6.865  1.00 43.22           C
ATOM    280  CG  LYS A  39       4.109   4.798  -7.000  1.00  2.25           C
ATOM    281  CD  LYS A  39       5.562   4.298  -7.182  1.00 61.31           C
ATOM    282  CE  LYS A  39       5.634   2.782  -7.421  1.00 14.41           C
ATOM    283  NZ  LYS A  39       4.867   2.342  -8.613  1.00 14.12           N
ATOM      0  H   LYS A  39       3.518   8.753  -6.304  1.00 54.32           H   new
ATOM      0  HA  LYS A  39       3.707   6.306  -4.713  1.00 61.54           H   new
ATOM      0  HB2 LYS A  39       2.970   6.623  -7.195  1.00 43.22           H   new
ATOM      0  HB3 LYS A  39       4.676   6.808  -7.553  1.00 43.22           H   new
ATOM      0  HG2 LYS A  39       3.685   4.329  -6.112  1.00  2.25           H   new
ATOM      0  HG3 LYS A  39       3.514   4.465  -7.851  1.00  2.25           H   new
ATOM      0  HD2 LYS A  39       6.020   4.818  -8.024  1.00 61.31           H   new
ATOM      0  HD3 LYS A  39       6.144   4.552  -6.296  1.00 61.31           H   new
ATOM      0  HE2 LYS A  39       6.677   2.488  -7.539  1.00 14.41           H   new
ATOM      0  HE3 LYS A  39       5.254   2.263  -6.541  1.00 14.41           H   new
ATOM      0  HZ1 LYS A  39       4.069   1.747  -8.312  1.00 14.12           H   new
ATOM      0  HZ2 LYS A  39       4.506   3.175  -9.120  1.00 14.12           H   new
ATOM      0  HZ3 LYS A  39       5.488   1.795  -9.243  1.00 14.12           H   new
ATOM    297  N   ILE A  40       6.071   6.357  -3.956  1.00 75.04           N
ATOM    298  CA  ILE A  40       7.464   6.403  -3.458  1.00 31.21           C
ATOM    299  C   ILE A  40       8.218   5.084  -3.742  1.00 23.24           C
ATOM    300  O   ILE A  40       9.454   5.072  -3.769  1.00  1.43           O
ATOM    301  CB  ILE A  40       7.524   6.755  -1.923  1.00 31.51           C
ATOM    302  CG1 ILE A  40       6.877   5.633  -1.051  1.00 52.04           C
ATOM    303  CG2 ILE A  40       6.837   8.123  -1.655  1.00 63.12           C
ATOM    304  CD1 ILE A  40       7.119   5.763   0.441  1.00 20.23           C
ATOM      0  H   ILE A  40       5.438   5.805  -3.378  1.00 75.04           H   new
ATOM      0  HA  ILE A  40       7.965   7.201  -4.006  1.00 31.21           H   new
ATOM      0  HB  ILE A  40       8.574   6.827  -1.638  1.00 31.51           H   new
ATOM      0 HG12 ILE A  40       5.802   5.628  -1.231  1.00 52.04           H   new
ATOM      0 HG13 ILE A  40       7.260   4.668  -1.384  1.00 52.04           H   new
ATOM      0 HG21 ILE A  40       6.886   8.353  -0.591  1.00 63.12           H   new
ATOM      0 HG22 ILE A  40       7.348   8.903  -2.219  1.00 63.12           H   new
ATOM      0 HG23 ILE A  40       5.794   8.074  -1.968  1.00 63.12           H   new
ATOM      0 HD11 ILE A  40       6.631   4.939   0.962  1.00 20.23           H   new
ATOM      0 HD12 ILE A  40       8.190   5.734   0.640  1.00 20.23           H   new
ATOM      0 HD13 ILE A  40       6.709   6.709   0.795  1.00 20.23           H   new
ATOM    316  N   GLY A  41       7.466   3.989  -3.957  1.00 71.45           N
ATOM    317  CA  GLY A  41       8.051   2.673  -4.243  1.00  1.32           C
ATOM    318  C   GLY A  41       6.997   1.585  -4.366  1.00  1.33           C
ATOM    319  O   GLY A  41       5.794   1.876  -4.325  1.00 13.24           O
ATOM      0  H   GLY A  41       6.446   3.994  -3.937  1.00 71.45           H   new
ATOM      0  HA2 GLY A  41       8.624   2.726  -5.169  1.00  1.32           H   new
ATOM      0  HA3 GLY A  41       8.751   2.409  -3.450  1.00  1.32           H   new
ATOM    323  N   THR A  42       7.442   0.332  -4.548  1.00  0.31           N
ATOM    324  CA  THR A  42       6.552  -0.849  -4.555  1.00 20.10           C
ATOM    325  C   THR A  42       7.174  -1.951  -3.684  1.00 75.45           C
ATOM    326  O   THR A  42       8.375  -2.238  -3.802  1.00 52.43           O
ATOM    327  CB  THR A  42       6.311  -1.396  -6.010  1.00 74.52           C
ATOM    328  OG1 THR A  42       5.877  -0.326  -6.861  1.00  2.35           O
ATOM    329  CG2 THR A  42       5.254  -2.529  -6.049  1.00 42.03           C
ATOM      0  H   THR A  42       8.426   0.105  -4.694  1.00  0.31           H   new
ATOM      0  HA  THR A  42       5.584  -0.547  -4.154  1.00 20.10           H   new
ATOM      0  HB  THR A  42       7.257  -1.809  -6.359  1.00 74.52           H   new
ATOM      0  HG1 THR A  42       4.911  -0.397  -7.010  1.00  2.35           H   new
ATOM      0 HG21 THR A  42       5.125  -2.871  -7.076  1.00 42.03           H   new
ATOM      0 HG22 THR A  42       5.589  -3.360  -5.429  1.00 42.03           H   new
ATOM      0 HG23 THR A  42       4.304  -2.153  -5.670  1.00 42.03           H   new
ATOM    337  N   ILE A  43       6.353  -2.558  -2.807  1.00  3.32           N
ATOM    338  CA  ILE A  43       6.764  -3.694  -1.953  1.00  3.23           C
ATOM    339  C   ILE A  43       5.977  -4.954  -2.351  1.00 54.31           C
ATOM    340  O   ILE A  43       4.972  -4.866  -3.068  1.00 44.24           O
ATOM    341  CB  ILE A  43       6.558  -3.377  -0.420  1.00 61.34           C
ATOM    342  CG1 ILE A  43       5.058  -3.086  -0.094  1.00  1.25           C
ATOM    343  CG2 ILE A  43       7.462  -2.197   0.025  1.00 45.14           C
ATOM    344  CD1 ILE A  43       4.764  -2.814   1.373  1.00 65.34           C
ATOM      0  H   ILE A  43       5.383  -2.276  -2.668  1.00  3.32           H   new
ATOM      0  HA  ILE A  43       7.829  -3.867  -2.109  1.00  3.23           H   new
ATOM      0  HB  ILE A  43       6.851  -4.262   0.144  1.00 61.34           H   new
ATOM      0 HG12 ILE A  43       4.734  -2.226  -0.680  1.00  1.25           H   new
ATOM      0 HG13 ILE A  43       4.459  -3.937  -0.418  1.00  1.25           H   new
ATOM      0 HG21 ILE A  43       7.303  -1.996   1.085  1.00 45.14           H   new
ATOM      0 HG22 ILE A  43       8.507  -2.456  -0.143  1.00 45.14           H   new
ATOM      0 HG23 ILE A  43       7.211  -1.308  -0.554  1.00 45.14           H   new
ATOM      0 HD11 ILE A  43       3.699  -2.623   1.501  1.00 65.34           H   new
ATOM      0 HD12 ILE A  43       5.052  -3.680   1.968  1.00 65.34           H   new
ATOM      0 HD13 ILE A  43       5.331  -1.943   1.702  1.00 65.34           H   new
ATOM    356  N   SER A  44       6.448  -6.123  -1.891  1.00 31.43           N
ATOM    357  CA  SER A  44       5.804  -7.416  -2.175  1.00 74.32           C
ATOM    358  C   SER A  44       6.094  -8.416  -1.046  1.00 31.33           C
ATOM    359  O   SER A  44       7.163  -8.370  -0.416  1.00 12.41           O
ATOM    360  CB  SER A  44       6.292  -7.972  -3.540  1.00  2.13           C
ATOM    361  OG  SER A  44       5.624  -9.177  -3.909  1.00  4.30           O
ATOM      0  H   SER A  44       7.285  -6.199  -1.313  1.00 31.43           H   new
ATOM      0  HA  SER A  44       4.726  -7.266  -2.231  1.00 74.32           H   new
ATOM      0  HB2 SER A  44       6.132  -7.220  -4.313  1.00  2.13           H   new
ATOM      0  HB3 SER A  44       7.365  -8.156  -3.491  1.00  2.13           H   new
ATOM      0  HG  SER A  44       5.869  -9.891  -3.284  1.00  4.30           H   new
ATOM    367  N   THR A  45       5.129  -9.312  -0.793  1.00 21.02           N
ATOM    368  CA  THR A  45       5.280 -10.417   0.161  1.00  1.02           C
ATOM    369  C   THR A  45       6.176 -11.514  -0.444  1.00 53.04           C
ATOM    370  O   THR A  45       6.427 -11.518  -1.662  1.00 12.32           O
ATOM    371  CB  THR A  45       3.892 -11.025   0.542  1.00  1.52           C
ATOM    372  OG1 THR A  45       3.254 -11.576  -0.617  1.00 62.01           O
ATOM    373  CG2 THR A  45       2.952  -9.982   1.169  1.00 63.22           C
ATOM      0  H   THR A  45       4.217  -9.289  -1.248  1.00 21.02           H   new
ATOM      0  HA  THR A  45       5.743 -10.023   1.065  1.00  1.02           H   new
ATOM      0  HB  THR A  45       4.084 -11.805   1.279  1.00  1.52           H   new
ATOM      0  HG1 THR A  45       3.195 -12.550  -0.526  1.00 62.01           H   new
ATOM      0 HG21 THR A  45       2.000 -10.452   1.417  1.00 63.22           H   new
ATOM      0 HG22 THR A  45       3.406  -9.582   2.076  1.00 63.22           H   new
ATOM      0 HG23 THR A  45       2.783  -9.172   0.460  1.00 63.22           H   new
ATOM    381  N   THR A  46       6.637 -12.447   0.408  1.00 25.43           N
ATOM    382  CA  THR A  46       7.494 -13.573  -0.007  1.00 65.40           C
ATOM    383  C   THR A  46       6.808 -14.442  -1.092  1.00  4.43           C
ATOM    384  O   THR A  46       7.435 -14.818  -2.092  1.00 42.14           O
ATOM    385  CB  THR A  46       7.861 -14.446   1.230  1.00 44.02           C
ATOM    386  OG1 THR A  46       8.441 -13.607   2.239  1.00  0.10           O
ATOM    387  CG2 THR A  46       8.842 -15.584   0.881  1.00 30.13           C
ATOM      0  H   THR A  46       6.426 -12.442   1.406  1.00 25.43           H   new
ATOM      0  HA  THR A  46       8.405 -13.160  -0.441  1.00 65.40           H   new
ATOM      0  HB  THR A  46       6.944 -14.910   1.591  1.00 44.02           H   new
ATOM      0  HG1 THR A  46       8.673 -14.149   3.022  1.00  0.10           H   new
ATOM      0 HG21 THR A  46       9.064 -16.161   1.779  1.00 30.13           H   new
ATOM      0 HG22 THR A  46       8.391 -16.236   0.133  1.00 30.13           H   new
ATOM      0 HG23 THR A  46       9.765 -15.160   0.485  1.00 30.13           H   new
ATOM    395  N   GLY A  47       5.514 -14.725  -0.881  1.00  1.41           N
ATOM    396  CA  GLY A  47       4.706 -15.488  -1.835  1.00 24.13           C
ATOM    397  C   GLY A  47       3.222 -15.318  -1.586  1.00 55.02           C
ATOM    398  O   GLY A  47       2.810 -14.372  -0.899  1.00 50.35           O
ATOM      0  H   GLY A  47       5.003 -14.432  -0.048  1.00  1.41           H   new
ATOM      0  HA2 GLY A  47       4.943 -15.166  -2.849  1.00 24.13           H   new
ATOM      0  HA3 GLY A  47       4.966 -16.544  -1.767  1.00 24.13           H   new
ATOM    402  N   GLU A  48       2.413 -16.226  -2.157  1.00 32.51           N
ATOM    403  CA  GLU A  48       0.959 -16.229  -1.956  1.00 65.01           C
ATOM    404  C   GLU A  48       0.615 -16.589  -0.495  1.00  2.51           C
ATOM    405  O   GLU A  48       0.930 -17.686  -0.011  1.00 44.04           O
ATOM    406  CB  GLU A  48       0.243 -17.188  -2.955  1.00 31.13           C
ATOM    407  CG  GLU A  48       0.770 -18.636  -2.991  1.00 63.24           C
ATOM    408  CD  GLU A  48      -0.147 -19.587  -3.772  1.00 65.04           C
ATOM    409  OE1 GLU A  48      -0.125 -19.557  -5.020  1.00 24.43           O
ATOM    410  OE2 GLU A  48      -0.904 -20.359  -3.133  1.00 14.42           O
ATOM      0  H   GLU A  48       2.748 -16.972  -2.766  1.00 32.51           H   new
ATOM      0  HA  GLU A  48       0.592 -15.222  -2.157  1.00 65.01           H   new
ATOM      0  HB2 GLU A  48      -0.818 -17.214  -2.707  1.00 31.13           H   new
ATOM      0  HB3 GLU A  48       0.326 -16.766  -3.957  1.00 31.13           H   new
ATOM      0  HG2 GLU A  48       1.762 -18.645  -3.442  1.00 63.24           H   new
ATOM      0  HG3 GLU A  48       0.880 -19.002  -1.970  1.00 63.24           H   new
ATOM    417  N   MET A  49       0.015 -15.623   0.216  1.00 52.53           N
ATOM    418  CA  MET A  49      -0.428 -15.786   1.616  1.00  4.23           C
ATOM    419  C   MET A  49      -1.904 -15.365   1.731  1.00 55.01           C
ATOM    420  O   MET A  49      -2.465 -14.792   0.786  1.00 14.10           O
ATOM    421  CB  MET A  49       0.480 -14.955   2.584  1.00 33.41           C
ATOM    422  CG  MET A  49       1.975 -15.350   2.555  1.00 71.30           C
ATOM    423  SD  MET A  49       2.960 -14.652   3.910  1.00 12.11           S
ATOM    424  CE  MET A  49       2.791 -12.887   3.665  1.00 42.41           C
ATOM      0  H   MET A  49      -0.180 -14.697  -0.164  1.00 52.53           H   new
ATOM      0  HA  MET A  49      -0.337 -16.832   1.907  1.00  4.23           H   new
ATOM      0  HB2 MET A  49       0.391 -13.899   2.329  1.00 33.41           H   new
ATOM      0  HB3 MET A  49       0.106 -15.070   3.601  1.00 33.41           H   new
ATOM      0  HG2 MET A  49       2.052 -16.437   2.588  1.00 71.30           H   new
ATOM      0  HG3 MET A  49       2.405 -15.029   1.606  1.00 71.30           H   new
ATOM      0  HE1 MET A  49       3.779 -12.426   3.645  1.00 42.41           H   new
ATOM      0  HE2 MET A  49       2.283 -12.698   2.719  1.00 42.41           H   new
ATOM      0  HE3 MET A  49       2.208 -12.461   4.481  1.00 42.41           H   new
ATOM    434  N   SER A  50      -2.524 -15.671   2.884  1.00 21.12           N
ATOM    435  CA  SER A  50      -3.923 -15.294   3.184  1.00 75.15           C
ATOM    436  C   SER A  50      -4.091 -13.750   3.142  1.00 23.03           C
ATOM    437  O   SER A  50      -3.157 -13.052   3.535  1.00 62.23           O
ATOM    438  CB  SER A  50      -4.317 -15.863   4.567  1.00 12.23           C
ATOM    439  OG  SER A  50      -4.196 -17.276   4.591  1.00  5.54           O
ATOM      0  H   SER A  50      -2.071 -16.188   3.638  1.00 21.12           H   new
ATOM      0  HA  SER A  50      -4.586 -15.716   2.428  1.00 75.15           H   new
ATOM      0  HB2 SER A  50      -3.681 -15.427   5.338  1.00 12.23           H   new
ATOM      0  HB3 SER A  50      -5.343 -15.579   4.802  1.00 12.23           H   new
ATOM      0  HG  SER A  50      -4.736 -17.663   3.870  1.00  5.54           H   new
ATOM    445  N   PRO A  51      -5.265 -13.198   2.639  1.00 31.14           N
ATOM    446  CA  PRO A  51      -5.471 -11.735   2.410  1.00 44.12           C
ATOM    447  C   PRO A  51      -4.968 -10.840   3.563  1.00 23.11           C
ATOM    448  O   PRO A  51      -4.008 -10.091   3.383  1.00 44.23           O
ATOM    449  CB  PRO A  51      -7.015 -11.601   2.219  1.00  0.21           C
ATOM    450  CG  PRO A  51      -7.582 -12.969   2.496  1.00 43.13           C
ATOM    451  CD  PRO A  51      -6.473 -13.951   2.222  1.00 33.44           C
ATOM      0  HA  PRO A  51      -4.892 -11.390   1.553  1.00 44.12           H   new
ATOM      0  HB2 PRO A  51      -7.431 -10.860   2.901  1.00  0.21           H   new
ATOM      0  HB3 PRO A  51      -7.257 -11.275   1.208  1.00  0.21           H   new
ATOM      0  HG2 PRO A  51      -7.923 -13.046   3.528  1.00 43.13           H   new
ATOM      0  HG3 PRO A  51      -8.444 -13.169   1.859  1.00 43.13           H   new
ATOM      0  HD2 PRO A  51      -6.595 -14.871   2.794  1.00 33.44           H   new
ATOM      0  HD3 PRO A  51      -6.432 -14.233   1.170  1.00 33.44           H   new
ATOM    459  N   LEU A  52      -5.579 -10.985   4.752  1.00 12.25           N
ATOM    460  CA  LEU A  52      -5.295 -10.124   5.924  1.00 74.24           C
ATOM    461  C   LEU A  52      -3.860 -10.360   6.452  1.00 25.25           C
ATOM    462  O   LEU A  52      -3.227  -9.428   6.937  1.00 35.50           O
ATOM    463  CB  LEU A  52      -6.352 -10.349   7.055  1.00 10.33           C
ATOM    464  CG  LEU A  52      -7.820  -9.843   6.800  1.00 60.02           C
ATOM    465  CD1 LEU A  52      -7.851  -8.340   6.453  1.00 40.21           C
ATOM    466  CD2 LEU A  52      -8.557 -10.689   5.735  1.00 50.34           C
ATOM      0  H   LEU A  52      -6.284 -11.700   4.932  1.00 12.25           H   new
ATOM      0  HA  LEU A  52      -5.366  -9.086   5.601  1.00 74.24           H   new
ATOM      0  HB2 LEU A  52      -6.398 -11.418   7.262  1.00 10.33           H   new
ATOM      0  HB3 LEU A  52      -5.983  -9.864   7.959  1.00 10.33           H   new
ATOM      0  HG  LEU A  52      -8.363  -9.975   7.736  1.00 60.02           H   new
ATOM      0 HD11 LEU A  52      -8.881  -8.027   6.284  1.00 40.21           H   new
ATOM      0 HD12 LEU A  52      -7.429  -7.767   7.279  1.00 40.21           H   new
ATOM      0 HD13 LEU A  52      -7.265  -8.163   5.551  1.00 40.21           H   new
ATOM      0 HD21 LEU A  52      -9.566 -10.300   5.595  1.00 50.34           H   new
ATOM      0 HD22 LEU A  52      -8.014 -10.638   4.791  1.00 50.34           H   new
ATOM      0 HD23 LEU A  52      -8.611 -11.726   6.067  1.00 50.34           H   new
ATOM    478  N   ASP A  53      -3.354 -11.600   6.299  1.00  5.02           N
ATOM    479  CA  ASP A  53      -1.982 -11.991   6.716  1.00  0.31           C
ATOM    480  C   ASP A  53      -0.907 -11.244   5.892  1.00  0.34           C
ATOM    481  O   ASP A  53       0.060 -10.694   6.446  1.00 61.54           O
ATOM    482  CB  ASP A  53      -1.823 -13.527   6.549  1.00 51.40           C
ATOM    483  CG  ASP A  53      -0.426 -14.060   6.923  1.00 10.41           C
ATOM    484  OD1 ASP A  53      -0.138 -14.205   8.135  1.00 71.33           O
ATOM    485  OD2 ASP A  53       0.387 -14.337   6.016  1.00 20.23           O
ATOM      0  H   ASP A  53      -3.883 -12.365   5.882  1.00  5.02           H   new
ATOM      0  HA  ASP A  53      -1.839 -11.715   7.761  1.00  0.31           H   new
ATOM      0  HB2 ASP A  53      -2.568 -14.028   7.167  1.00 51.40           H   new
ATOM      0  HB3 ASP A  53      -2.036 -13.793   5.514  1.00 51.40           H   new
ATOM    490  N   ALA A  54      -1.108 -11.239   4.565  1.00 63.21           N
ATOM    491  CA  ALA A  54      -0.238 -10.546   3.599  1.00 42.50           C
ATOM    492  C   ALA A  54      -0.352  -9.022   3.762  1.00 12.24           C
ATOM    493  O   ALA A  54       0.637  -8.286   3.638  1.00 41.41           O
ATOM    494  CB  ALA A  54      -0.604 -10.980   2.167  1.00 54.53           C
ATOM      0  H   ALA A  54      -1.891 -11.723   4.125  1.00 63.21           H   new
ATOM      0  HA  ALA A  54       0.799 -10.821   3.792  1.00 42.50           H   new
ATOM      0  HB1 ALA A  54       0.041 -10.466   1.455  1.00 54.53           H   new
ATOM      0  HB2 ALA A  54      -0.469 -12.057   2.067  1.00 54.53           H   new
ATOM      0  HB3 ALA A  54      -1.644 -10.725   1.964  1.00 54.53           H   new
ATOM    500  N   ARG A  55      -1.576  -8.570   4.082  1.00 22.43           N
ATOM    501  CA  ARG A  55      -1.878  -7.156   4.321  1.00 54.55           C
ATOM    502  C   ARG A  55      -1.115  -6.625   5.552  1.00 32.23           C
ATOM    503  O   ARG A  55      -0.599  -5.520   5.500  1.00 33.12           O
ATOM    504  CB  ARG A  55      -3.415  -6.951   4.449  1.00 31.43           C
ATOM    505  CG  ARG A  55      -4.164  -7.006   3.089  1.00 71.31           C
ATOM    506  CD  ARG A  55      -5.700  -7.110   3.233  1.00 42.41           C
ATOM    507  NE  ARG A  55      -6.268  -6.029   4.072  1.00 35.11           N
ATOM    508  CZ  ARG A  55      -7.498  -5.501   3.943  1.00 33.03           C
ATOM    509  NH1 ARG A  55      -8.333  -5.930   3.015  1.00 71.33           N
ATOM    510  NH2 ARG A  55      -7.890  -4.554   4.776  1.00  4.35           N
ATOM      0  H   ARG A  55      -2.386  -9.182   4.182  1.00 22.43           H   new
ATOM      0  HA  ARG A  55      -1.536  -6.573   3.466  1.00 54.55           H   new
ATOM      0  HB2 ARG A  55      -3.822  -7.717   5.110  1.00 31.43           H   new
ATOM      0  HB3 ARG A  55      -3.607  -5.988   4.921  1.00 31.43           H   new
ATOM      0  HG2 ARG A  55      -3.921  -6.113   2.513  1.00 71.31           H   new
ATOM      0  HG3 ARG A  55      -3.802  -7.861   2.518  1.00 71.31           H   new
ATOM      0  HD2 ARG A  55      -6.157  -7.076   2.244  1.00 42.41           H   new
ATOM      0  HD3 ARG A  55      -5.956  -8.076   3.669  1.00 42.41           H   new
ATOM      0  HE  ARG A  55      -5.675  -5.653   4.811  1.00 35.11           H   new
ATOM      0 HH11 ARG A  55      -8.050  -6.675   2.379  1.00 71.33           H   new
ATOM      0 HH12 ARG A  55      -9.262  -5.516   2.934  1.00 71.33           H   new
ATOM      0 HH21 ARG A  55      -7.261  -4.228   5.510  1.00  4.35           H   new
ATOM      0 HH22 ARG A  55      -8.821  -4.148   4.685  1.00  4.35           H   new
ATOM    524  N   GLU A  56      -1.007  -7.445   6.621  1.00 62.51           N
ATOM    525  CA  GLU A  56      -0.211  -7.109   7.834  1.00 73.31           C
ATOM    526  C   GLU A  56       1.288  -6.968   7.506  1.00 42.33           C
ATOM    527  O   GLU A  56       1.965  -6.069   8.031  1.00 42.15           O
ATOM    528  CB  GLU A  56      -0.407  -8.191   8.929  1.00  0.44           C
ATOM    529  CG  GLU A  56      -1.819  -8.211   9.537  1.00  5.55           C
ATOM    530  CD  GLU A  56      -2.039  -9.335  10.560  1.00 64.25           C
ATOM    531  OE1 GLU A  56      -1.550  -9.207  11.704  1.00 71.35           O
ATOM    532  OE2 GLU A  56      -2.711 -10.341  10.232  1.00 73.02           O
ATOM      0  H   GLU A  56      -1.465  -8.355   6.672  1.00 62.51           H   new
ATOM      0  HA  GLU A  56      -0.571  -6.150   8.205  1.00 73.31           H   new
ATOM      0  HB2 GLU A  56      -0.192  -9.170   8.501  1.00  0.44           H   new
ATOM      0  HB3 GLU A  56       0.319  -8.024   9.725  1.00  0.44           H   new
ATOM      0  HG2 GLU A  56      -2.010  -7.252  10.018  1.00  5.55           H   new
ATOM      0  HG3 GLU A  56      -2.549  -8.316   8.734  1.00  5.55           H   new
ATOM    539  N   ASP A  57       1.780  -7.863   6.629  1.00 54.23           N
ATOM    540  CA  ASP A  57       3.176  -7.847   6.134  1.00 34.02           C
ATOM    541  C   ASP A  57       3.484  -6.490   5.470  1.00 74.50           C
ATOM    542  O   ASP A  57       4.437  -5.770   5.846  1.00 73.12           O
ATOM    543  CB  ASP A  57       3.367  -9.013   5.119  1.00  1.12           C
ATOM    544  CG  ASP A  57       4.785  -9.118   4.527  1.00 63.43           C
ATOM    545  OD1 ASP A  57       5.646  -9.790   5.133  1.00 31.42           O
ATOM    546  OD2 ASP A  57       5.049  -8.530   3.448  1.00 63.21           O
ATOM      0  H   ASP A  57       1.221  -8.622   6.240  1.00 54.23           H   new
ATOM      0  HA  ASP A  57       3.866  -7.981   6.967  1.00 34.02           H   new
ATOM      0  HB2 ASP A  57       3.123  -9.953   5.614  1.00  1.12           H   new
ATOM      0  HB3 ASP A  57       2.655  -8.888   4.303  1.00  1.12           H   new
ATOM    551  N   LEU A  58       2.607  -6.140   4.519  1.00 32.14           N
ATOM    552  CA  LEU A  58       2.721  -4.918   3.716  1.00 74.03           C
ATOM    553  C   LEU A  58       2.511  -3.635   4.564  1.00  0.52           C
ATOM    554  O   LEU A  58       3.191  -2.629   4.331  1.00 22.45           O
ATOM    555  CB  LEU A  58       1.739  -5.003   2.520  1.00 21.40           C
ATOM    556  CG  LEU A  58       1.953  -6.239   1.574  1.00 60.11           C
ATOM    557  CD1 LEU A  58       0.853  -6.342   0.502  1.00 43.45           C
ATOM    558  CD2 LEU A  58       3.363  -6.241   0.927  1.00 11.44           C
ATOM      0  H   LEU A  58       1.790  -6.704   4.284  1.00 32.14           H   new
ATOM      0  HA  LEU A  58       3.737  -4.844   3.329  1.00 74.03           H   new
ATOM      0  HB2 LEU A  58       0.720  -5.032   2.907  1.00 21.40           H   new
ATOM      0  HB3 LEU A  58       1.830  -4.092   1.929  1.00 21.40           H   new
ATOM      0  HG  LEU A  58       1.881  -7.125   2.205  1.00 60.11           H   new
ATOM      0 HD11 LEU A  58       1.041  -7.210  -0.130  1.00 43.45           H   new
ATOM      0 HD12 LEU A  58      -0.118  -6.448   0.986  1.00 43.45           H   new
ATOM      0 HD13 LEU A  58       0.856  -5.440  -0.111  1.00 43.45           H   new
ATOM      0 HD21 LEU A  58       3.466  -7.113   0.281  1.00 11.44           H   new
ATOM      0 HD22 LEU A  58       3.493  -5.335   0.336  1.00 11.44           H   new
ATOM      0 HD23 LEU A  58       4.122  -6.277   1.709  1.00 11.44           H   new
ATOM    570  N   ILE A  59       1.602  -3.700   5.575  1.00  3.23           N
ATOM    571  CA  ILE A  59       1.383  -2.594   6.548  1.00  3.55           C
ATOM    572  C   ILE A  59       2.685  -2.301   7.298  1.00 33.34           C
ATOM    573  O   ILE A  59       3.137  -1.159   7.328  1.00 53.35           O
ATOM    574  CB  ILE A  59       0.241  -2.921   7.610  1.00 72.33           C
ATOM    575  CG1 ILE A  59      -1.170  -2.882   6.952  1.00 73.32           C
ATOM    576  CG2 ILE A  59       0.284  -1.969   8.846  1.00 60.53           C
ATOM    577  CD1 ILE A  59      -2.307  -3.391   7.830  1.00  0.33           C
ATOM      0  H   ILE A  59       1.006  -4.512   5.737  1.00  3.23           H   new
ATOM      0  HA  ILE A  59       1.061  -1.727   5.971  1.00  3.55           H   new
ATOM      0  HB  ILE A  59       0.436  -3.932   7.967  1.00 72.33           H   new
ATOM      0 HG12 ILE A  59      -1.389  -1.855   6.660  1.00 73.32           H   new
ATOM      0 HG13 ILE A  59      -1.144  -3.475   6.038  1.00 73.32           H   new
ATOM      0 HG21 ILE A  59      -0.515  -2.235   9.538  1.00 60.53           H   new
ATOM      0 HG22 ILE A  59       1.247  -2.067   9.348  1.00 60.53           H   new
ATOM      0 HG23 ILE A  59       0.150  -0.939   8.516  1.00 60.53           H   new
ATOM      0 HD11 ILE A  59      -3.247  -3.323   7.283  1.00  0.33           H   new
ATOM      0 HD12 ILE A  59      -2.119  -4.430   8.102  1.00  0.33           H   new
ATOM      0 HD13 ILE A  59      -2.368  -2.784   8.734  1.00  0.33           H   new
ATOM    589  N   LYS A  60       3.281  -3.367   7.867  1.00 52.20           N
ATOM    590  CA  LYS A  60       4.476  -3.262   8.717  1.00 41.30           C
ATOM    591  C   LYS A  60       5.651  -2.641   7.936  1.00 32.21           C
ATOM    592  O   LYS A  60       6.206  -1.606   8.346  1.00 72.34           O
ATOM    593  CB  LYS A  60       4.853  -4.665   9.265  1.00  4.32           C
ATOM    594  CG  LYS A  60       5.980  -4.661  10.320  1.00 41.12           C
ATOM    595  CD  LYS A  60       6.318  -6.072  10.863  1.00 41.51           C
ATOM    596  CE  LYS A  60       7.383  -6.019  11.975  1.00 34.24           C
ATOM    597  NZ  LYS A  60       8.660  -5.407  11.517  1.00 13.14           N
ATOM      0  H   LYS A  60       2.945  -4.323   7.748  1.00 52.20           H   new
ATOM      0  HA  LYS A  60       4.255  -2.605   9.558  1.00 41.30           H   new
ATOM      0  HB2 LYS A  60       3.965  -5.120   9.703  1.00  4.32           H   new
ATOM      0  HB3 LYS A  60       5.157  -5.297   8.430  1.00  4.32           H   new
ATOM      0  HG2 LYS A  60       6.877  -4.224   9.881  1.00 41.12           H   new
ATOM      0  HG3 LYS A  60       5.687  -4.020  11.152  1.00 41.12           H   new
ATOM      0  HD2 LYS A  60       5.412  -6.539  11.250  1.00 41.51           H   new
ATOM      0  HD3 LYS A  60       6.676  -6.699  10.047  1.00 41.51           H   new
ATOM      0  HE2 LYS A  60       6.994  -5.449  12.819  1.00 34.24           H   new
ATOM      0  HE3 LYS A  60       7.577  -7.029  12.335  1.00 34.24           H   new
ATOM      0  HZ1 LYS A  60       9.352  -5.427  12.293  1.00 13.14           H   new
ATOM      0  HZ2 LYS A  60       9.032  -5.944  10.708  1.00 13.14           H   new
ATOM      0  HZ3 LYS A  60       8.490  -4.422  11.230  1.00 13.14           H   new
ATOM    611  N   LYS A  61       5.955  -3.249   6.774  1.00 53.23           N
ATOM    612  CA  LYS A  61       7.080  -2.826   5.919  1.00 54.10           C
ATOM    613  C   LYS A  61       6.904  -1.382   5.399  1.00 71.14           C
ATOM    614  O   LYS A  61       7.842  -0.575   5.478  1.00 40.40           O
ATOM    615  CB  LYS A  61       7.245  -3.835   4.750  1.00 22.13           C
ATOM    616  CG  LYS A  61       7.700  -5.241   5.216  1.00 43.10           C
ATOM    617  CD  LYS A  61       7.706  -6.294   4.086  1.00 13.03           C
ATOM    618  CE  LYS A  61       8.241  -7.657   4.570  1.00 63.02           C
ATOM    619  NZ  LYS A  61       8.002  -8.734   3.578  1.00 22.00           N
ATOM      0  H   LYS A  61       5.432  -4.042   6.403  1.00 53.23           H   new
ATOM      0  HA  LYS A  61       7.989  -2.824   6.520  1.00 54.10           H   new
ATOM      0  HB2 LYS A  61       6.297  -3.924   4.219  1.00 22.13           H   new
ATOM      0  HB3 LYS A  61       7.972  -3.442   4.039  1.00 22.13           H   new
ATOM      0  HG2 LYS A  61       8.702  -5.168   5.639  1.00 43.10           H   new
ATOM      0  HG3 LYS A  61       7.041  -5.581   6.015  1.00 43.10           H   new
ATOM      0  HD2 LYS A  61       6.694  -6.418   3.700  1.00 13.03           H   new
ATOM      0  HD3 LYS A  61       8.320  -5.936   3.260  1.00 13.03           H   new
ATOM      0  HE2 LYS A  61       9.310  -7.577   4.767  1.00 63.02           H   new
ATOM      0  HE3 LYS A  61       7.762  -7.920   5.513  1.00 63.02           H   new
ATOM      0  HZ1 LYS A  61       8.188  -9.658   4.017  1.00 22.00           H   new
ATOM      0  HZ2 LYS A  61       7.014  -8.696   3.256  1.00 22.00           H   new
ATOM      0  HZ3 LYS A  61       8.637  -8.604   2.765  1.00 22.00           H   new
ATOM    633  N   ALA A  62       5.687  -1.047   4.920  1.00 23.41           N
ATOM    634  CA  ALA A  62       5.393   0.296   4.371  1.00 20.13           C
ATOM    635  C   ALA A  62       5.406   1.371   5.467  1.00 42.04           C
ATOM    636  O   ALA A  62       5.856   2.493   5.228  1.00 42.33           O
ATOM    637  CB  ALA A  62       4.053   0.305   3.644  1.00 70.25           C
ATOM      0  H   ALA A  62       4.893  -1.686   4.902  1.00 23.41           H   new
ATOM      0  HA  ALA A  62       6.182   0.532   3.657  1.00 20.13           H   new
ATOM      0  HB1 ALA A  62       3.860   1.303   3.250  1.00 70.25           H   new
ATOM      0  HB2 ALA A  62       4.080  -0.411   2.823  1.00 70.25           H   new
ATOM      0  HB3 ALA A  62       3.260   0.030   4.339  1.00 70.25           H   new
ATOM    643  N   ASP A  63       4.939   1.004   6.673  1.00 15.11           N
ATOM    644  CA  ASP A  63       4.883   1.926   7.824  1.00 72.10           C
ATOM    645  C   ASP A  63       6.302   2.305   8.259  1.00 52.20           C
ATOM    646  O   ASP A  63       6.605   3.487   8.467  1.00 21.13           O
ATOM    647  CB  ASP A  63       4.108   1.286   9.003  1.00 43.21           C
ATOM    648  CG  ASP A  63       3.860   2.258  10.172  1.00  0.14           C
ATOM    649  OD1 ASP A  63       2.955   3.119  10.049  1.00 21.43           O
ATOM    650  OD2 ASP A  63       4.542   2.158  11.217  1.00 14.12           O
ATOM      0  H   ASP A  63       4.592   0.067   6.878  1.00 15.11           H   new
ATOM      0  HA  ASP A  63       4.353   2.829   7.521  1.00 72.10           H   new
ATOM      0  HB2 ASP A  63       3.150   0.915   8.639  1.00 43.21           H   new
ATOM      0  HB3 ASP A  63       4.666   0.424   9.369  1.00 43.21           H   new
ATOM    655  N   GLU A  64       7.178   1.285   8.350  1.00 70.32           N
ATOM    656  CA  GLU A  64       8.605   1.482   8.674  1.00 61.04           C
ATOM    657  C   GLU A  64       9.355   2.203   7.529  1.00 54.24           C
ATOM    658  O   GLU A  64      10.378   2.854   7.771  1.00 55.01           O
ATOM    659  CB  GLU A  64       9.256   0.121   8.999  1.00  1.15           C
ATOM    660  CG  GLU A  64       8.636  -0.590  10.221  1.00 32.52           C
ATOM    661  CD  GLU A  64       9.264  -1.964  10.525  1.00 54.34           C
ATOM    662  OE1 GLU A  64       8.951  -2.944   9.816  1.00 71.31           O
ATOM    663  OE2 GLU A  64      10.085  -2.068  11.468  1.00 45.40           O
ATOM      0  H   GLU A  64       6.920   0.309   8.202  1.00 70.32           H   new
ATOM      0  HA  GLU A  64       8.675   2.125   9.551  1.00 61.04           H   new
ATOM      0  HB2 GLU A  64       9.169  -0.530   8.129  1.00  1.15           H   new
ATOM      0  HB3 GLU A  64      10.320   0.272   9.179  1.00  1.15           H   new
ATOM      0  HG2 GLU A  64       8.745   0.051  11.096  1.00 32.52           H   new
ATOM      0  HG3 GLU A  64       7.567  -0.719  10.051  1.00 32.52           H   new
ATOM    670  N   LYS A  65       8.846   2.072   6.281  1.00 42.34           N
ATOM    671  CA  LYS A  65       9.327   2.871   5.123  1.00 20.54           C
ATOM    672  C   LYS A  65       8.743   4.311   5.118  1.00 11.41           C
ATOM    673  O   LYS A  65       9.158   5.140   4.289  1.00 24.10           O
ATOM    674  CB  LYS A  65       8.997   2.151   3.782  1.00 61.53           C
ATOM    675  CG  LYS A  65       9.919   0.954   3.455  1.00  0.14           C
ATOM    676  CD  LYS A  65       9.581   0.311   2.087  1.00 50.21           C
ATOM    677  CE  LYS A  65      10.588  -0.768   1.653  1.00 41.10           C
ATOM    678  NZ  LYS A  65      10.663  -1.890   2.610  1.00 61.15           N
ATOM      0  H   LYS A  65       8.099   1.418   6.047  1.00 42.34           H   new
ATOM      0  HA  LYS A  65      10.409   2.958   5.224  1.00 20.54           H   new
ATOM      0  HB2 LYS A  65       7.966   1.800   3.816  1.00 61.53           H   new
ATOM      0  HB3 LYS A  65       9.061   2.875   2.970  1.00 61.53           H   new
ATOM      0  HG2 LYS A  65      10.957   1.287   3.451  1.00  0.14           H   new
ATOM      0  HG3 LYS A  65       9.828   0.203   4.240  1.00  0.14           H   new
ATOM      0  HD2 LYS A  65       8.586  -0.131   2.138  1.00 50.21           H   new
ATOM      0  HD3 LYS A  65       9.545   1.091   1.326  1.00 50.21           H   new
ATOM      0  HE2 LYS A  65      10.306  -1.150   0.672  1.00 41.10           H   new
ATOM      0  HE3 LYS A  65      11.575  -0.318   1.548  1.00 41.10           H   new
ATOM      0  HZ1 LYS A  65      11.355  -2.589   2.272  1.00 61.15           H   new
ATOM      0  HZ2 LYS A  65      10.958  -1.533   3.541  1.00 61.15           H   new
ATOM      0  HZ3 LYS A  65       9.729  -2.339   2.692  1.00 61.15           H   new
ATOM    692  N   GLY A  66       7.773   4.589   6.018  1.00 15.20           N
ATOM    693  CA  GLY A  66       7.175   5.931   6.157  1.00 50.32           C
ATOM    694  C   GLY A  66       5.965   6.171   5.248  1.00 41.31           C
ATOM    695  O   GLY A  66       5.349   7.241   5.308  1.00  3.44           O
ATOM      0  H   GLY A  66       7.388   3.897   6.660  1.00 15.20           H   new
ATOM      0  HA2 GLY A  66       6.872   6.077   7.194  1.00 50.32           H   new
ATOM      0  HA3 GLY A  66       7.935   6.681   5.938  1.00 50.32           H   new
ATOM    699  N   ALA A  67       5.624   5.170   4.408  1.00 33.53           N
ATOM    700  CA  ALA A  67       4.508   5.257   3.445  1.00 11.31           C
ATOM    701  C   ALA A  67       3.153   5.315   4.162  1.00 74.42           C
ATOM    702  O   ALA A  67       2.888   4.508   5.063  1.00 11.44           O
ATOM    703  CB  ALA A  67       4.553   4.067   2.484  1.00  1.30           C
ATOM      0  H   ALA A  67       6.117   4.277   4.380  1.00 33.53           H   new
ATOM      0  HA  ALA A  67       4.621   6.180   2.877  1.00 11.31           H   new
ATOM      0  HB1 ALA A  67       3.726   4.139   1.777  1.00  1.30           H   new
ATOM      0  HB2 ALA A  67       5.498   4.074   1.940  1.00  1.30           H   new
ATOM      0  HB3 ALA A  67       4.467   3.139   3.050  1.00  1.30           H   new
ATOM    709  N   ASP A  68       2.295   6.255   3.727  1.00 42.55           N
ATOM    710  CA  ASP A  68       0.998   6.512   4.367  1.00 64.34           C
ATOM    711  C   ASP A  68      -0.011   5.414   3.982  1.00 52.45           C
ATOM    712  O   ASP A  68      -0.648   4.807   4.857  1.00 34.14           O
ATOM    713  CB  ASP A  68       0.463   7.920   3.971  1.00 15.33           C
ATOM    714  CG  ASP A  68       1.266   9.084   4.599  1.00 41.02           C
ATOM    715  OD1 ASP A  68       2.297   9.506   4.026  1.00 21.43           O
ATOM    716  OD2 ASP A  68       0.871   9.586   5.669  1.00  3.52           O
ATOM      0  H   ASP A  68       2.483   6.855   2.924  1.00 42.55           H   new
ATOM      0  HA  ASP A  68       1.131   6.493   5.449  1.00 64.34           H   new
ATOM      0  HB2 ASP A  68       0.486   8.017   2.886  1.00 15.33           H   new
ATOM      0  HB3 ASP A  68      -0.580   8.003   4.276  1.00 15.33           H   new
ATOM    721  N   VAL A  69      -0.136   5.141   2.664  1.00 24.33           N
ATOM    722  CA  VAL A  69      -1.130   4.178   2.137  1.00 74.40           C
ATOM    723  C   VAL A  69      -0.435   3.075   1.319  1.00 65.51           C
ATOM    724  O   VAL A  69       0.455   3.351   0.510  1.00 12.40           O
ATOM    725  CB  VAL A  69      -2.234   4.894   1.261  1.00 55.22           C
ATOM    726  CG1 VAL A  69      -3.269   3.887   0.681  1.00 35.51           C
ATOM    727  CG2 VAL A  69      -2.949   6.002   2.074  1.00 74.11           C
ATOM      0  H   VAL A  69       0.441   5.575   1.944  1.00 24.33           H   new
ATOM      0  HA  VAL A  69      -1.628   3.724   2.994  1.00 74.40           H   new
ATOM      0  HB  VAL A  69      -1.722   5.354   0.416  1.00 55.22           H   new
ATOM      0 HG11 VAL A  69      -4.007   4.426   0.087  1.00 35.51           H   new
ATOM      0 HG12 VAL A  69      -2.756   3.160   0.051  1.00 35.51           H   new
ATOM      0 HG13 VAL A  69      -3.770   3.369   1.499  1.00 35.51           H   new
ATOM      0 HG21 VAL A  69      -3.704   6.481   1.451  1.00 74.11           H   new
ATOM      0 HG22 VAL A  69      -3.427   5.561   2.949  1.00 74.11           H   new
ATOM      0 HG23 VAL A  69      -2.220   6.745   2.396  1.00 74.11           H   new
ATOM    737  N   VAL A  70      -0.872   1.830   1.561  1.00  0.34           N
ATOM    738  CA  VAL A  70      -0.414   0.623   0.857  1.00 14.33           C
ATOM    739  C   VAL A  70      -1.525   0.204  -0.131  1.00 23.52           C
ATOM    740  O   VAL A  70      -2.674  -0.047   0.281  1.00 73.20           O
ATOM    741  CB  VAL A  70      -0.119  -0.557   1.865  1.00 54.13           C
ATOM    742  CG1 VAL A  70       0.697  -1.683   1.193  1.00 31.52           C
ATOM    743  CG2 VAL A  70       0.574  -0.058   3.152  1.00 60.14           C
ATOM      0  H   VAL A  70      -1.574   1.629   2.273  1.00  0.34           H   new
ATOM      0  HA  VAL A  70       0.516   0.840   0.331  1.00 14.33           H   new
ATOM      0  HB  VAL A  70      -1.083  -0.973   2.158  1.00 54.13           H   new
ATOM      0 HG11 VAL A  70       0.882  -2.479   1.915  1.00 31.52           H   new
ATOM      0 HG12 VAL A  70       0.137  -2.083   0.348  1.00 31.52           H   new
ATOM      0 HG13 VAL A  70       1.648  -1.283   0.842  1.00 31.52           H   new
ATOM      0 HG21 VAL A  70       0.758  -0.902   3.817  1.00 60.14           H   new
ATOM      0 HG22 VAL A  70       1.522   0.415   2.895  1.00 60.14           H   new
ATOM      0 HG23 VAL A  70      -0.068   0.666   3.654  1.00 60.14           H   new
ATOM    753  N   VAL A  71      -1.177   0.148  -1.424  1.00  3.55           N
ATOM    754  CA  VAL A  71      -2.149   0.009  -2.526  1.00 22.30           C
ATOM    755  C   VAL A  71      -2.025  -1.366  -3.193  1.00 72.34           C
ATOM    756  O   VAL A  71      -1.097  -1.591  -3.986  1.00 30.42           O
ATOM    757  CB  VAL A  71      -1.919   1.149  -3.582  1.00  2.54           C
ATOM    758  CG1 VAL A  71      -2.956   1.101  -4.727  1.00 13.53           C
ATOM    759  CG2 VAL A  71      -1.895   2.525  -2.881  1.00 64.42           C
ATOM      0  H   VAL A  71      -0.209   0.198  -1.740  1.00  3.55           H   new
ATOM      0  HA  VAL A  71      -3.155   0.096  -2.116  1.00 22.30           H   new
ATOM      0  HB  VAL A  71      -0.948   0.986  -4.049  1.00  2.54           H   new
ATOM      0 HG11 VAL A  71      -2.757   1.908  -5.432  1.00 13.53           H   new
ATOM      0 HG12 VAL A  71      -2.885   0.143  -5.242  1.00 13.53           H   new
ATOM      0 HG13 VAL A  71      -3.958   1.218  -4.315  1.00 13.53           H   new
ATOM      0 HG21 VAL A  71      -1.735   3.308  -3.622  1.00 64.42           H   new
ATOM      0 HG22 VAL A  71      -2.846   2.693  -2.376  1.00 64.42           H   new
ATOM      0 HG23 VAL A  71      -1.087   2.547  -2.150  1.00 64.42           H   new
ATOM    769  N   LEU A  72      -2.966  -2.277  -2.865  1.00  3.32           N
ATOM    770  CA  LEU A  72      -2.961  -3.660  -3.382  1.00 53.53           C
ATOM    771  C   LEU A  72      -3.217  -3.693  -4.898  1.00 32.24           C
ATOM    772  O   LEU A  72      -4.370  -3.638  -5.355  1.00 24.02           O
ATOM    773  CB  LEU A  72      -3.998  -4.558  -2.650  1.00 13.24           C
ATOM    774  CG  LEU A  72      -3.811  -4.726  -1.110  1.00 61.51           C
ATOM    775  CD1 LEU A  72      -4.815  -5.746  -0.539  1.00 75.25           C
ATOM    776  CD2 LEU A  72      -2.357  -5.112  -0.743  1.00 71.00           C
ATOM      0  H   LEU A  72      -3.745  -2.075  -2.238  1.00  3.32           H   new
ATOM      0  HA  LEU A  72      -1.967  -4.061  -3.186  1.00 53.53           H   new
ATOM      0  HB2 LEU A  72      -4.992  -4.148  -2.830  1.00 13.24           H   new
ATOM      0  HB3 LEU A  72      -3.974  -5.548  -3.106  1.00 13.24           H   new
ATOM      0  HG  LEU A  72      -4.013  -3.757  -0.653  1.00 61.51           H   new
ATOM      0 HD11 LEU A  72      -4.663  -5.844   0.536  1.00 75.25           H   new
ATOM      0 HD12 LEU A  72      -5.832  -5.403  -0.732  1.00 75.25           H   new
ATOM      0 HD13 LEU A  72      -4.662  -6.714  -1.017  1.00 75.25           H   new
ATOM      0 HD21 LEU A  72      -2.271  -5.219   0.338  1.00 71.00           H   new
ATOM      0 HD22 LEU A  72      -2.099  -6.056  -1.223  1.00 71.00           H   new
ATOM      0 HD23 LEU A  72      -1.676  -4.333  -1.086  1.00 71.00           H   new
ATOM    788  N   THR A  73      -2.119  -3.738  -5.666  1.00 70.34           N
ATOM    789  CA  THR A  73      -2.160  -3.957  -7.117  1.00 62.51           C
ATOM    790  C   THR A  73      -2.421  -5.454  -7.423  1.00  0.11           C
ATOM    791  O   THR A  73      -2.982  -5.792  -8.476  1.00 65.31           O
ATOM    792  CB  THR A  73      -0.840  -3.460  -7.804  1.00  1.11           C
ATOM    793  OG1 THR A  73      -0.889  -3.703  -9.221  1.00 50.32           O
ATOM    794  CG2 THR A  73       0.421  -4.116  -7.208  1.00 30.24           C
ATOM      0  H   THR A  73      -1.175  -3.623  -5.296  1.00 70.34           H   new
ATOM      0  HA  THR A  73      -2.981  -3.372  -7.531  1.00 62.51           H   new
ATOM      0  HB  THR A  73      -0.773  -2.389  -7.615  1.00  1.11           H   new
ATOM      0  HG1 THR A  73      -0.060  -3.386  -9.636  1.00 50.32           H   new
ATOM      0 HG21 THR A  73       1.305  -3.736  -7.720  1.00 30.24           H   new
ATOM      0 HG22 THR A  73       0.487  -3.879  -6.146  1.00 30.24           H   new
ATOM      0 HG23 THR A  73       0.364  -5.197  -7.336  1.00 30.24           H   new
ATOM    802  N   SER A  74      -1.997  -6.343  -6.493  1.00 42.52           N
ATOM    803  CA  SER A  74      -2.312  -7.785  -6.540  1.00  2.23           C
ATOM    804  C   SER A  74      -3.733  -8.042  -6.014  1.00 53.45           C
ATOM    805  O   SER A  74      -4.302  -7.211  -5.290  1.00 13.13           O
ATOM    806  CB  SER A  74      -1.280  -8.590  -5.711  1.00 75.10           C
ATOM    807  OG  SER A  74       0.024  -8.490  -6.262  1.00 44.53           O
ATOM      0  H   SER A  74      -1.427  -6.077  -5.690  1.00 42.52           H   new
ATOM      0  HA  SER A  74      -2.260  -8.116  -7.577  1.00  2.23           H   new
ATOM      0  HB2 SER A  74      -1.271  -8.223  -4.685  1.00 75.10           H   new
ATOM      0  HB3 SER A  74      -1.580  -9.637  -5.673  1.00 75.10           H   new
ATOM      0  HG  SER A  74       0.221  -9.296  -6.784  1.00 44.53           H   new
ATOM    813  N   GLY A  75      -4.300  -9.200  -6.397  1.00 20.54           N
ATOM    814  CA  GLY A  75      -5.628  -9.602  -5.949  1.00 50.20           C
ATOM    815  C   GLY A  75      -5.575 -10.323  -4.607  1.00 74.41           C
ATOM    816  O   GLY A  75      -5.151 -11.472  -4.548  1.00 61.42           O
ATOM      0  H   GLY A  75      -3.849  -9.871  -7.019  1.00 20.54           H   new
ATOM      0  HA2 GLY A  75      -6.266  -8.722  -5.865  1.00 50.20           H   new
ATOM      0  HA3 GLY A  75      -6.082 -10.254  -6.695  1.00 50.20           H   new
ATOM    820  N   GLN A  76      -6.053  -9.655  -3.533  1.00  0.44           N
ATOM    821  CA  GLN A  76      -6.045 -10.194  -2.142  1.00 11.12           C
ATOM    822  C   GLN A  76      -6.992 -11.405  -1.973  1.00 73.23           C
ATOM    823  O   GLN A  76      -7.015 -12.026  -0.913  1.00  5.41           O
ATOM    824  CB  GLN A  76      -6.445  -9.080  -1.131  1.00 42.01           C
ATOM    825  CG  GLN A  76      -7.929  -8.649  -1.201  1.00 35.41           C
ATOM    826  CD  GLN A  76      -8.285  -7.552  -0.197  1.00 43.23           C
ATOM    827  OE1 GLN A  76      -8.643  -7.833   0.949  1.00 73.13           O
ATOM    828  NE2 GLN A  76      -8.184  -6.302  -0.618  1.00 72.32           N
ATOM      0  H   GLN A  76      -6.459  -8.722  -3.601  1.00  0.44           H   new
ATOM      0  HA  GLN A  76      -5.030 -10.535  -1.940  1.00 11.12           H   new
ATOM      0  HB2 GLN A  76      -6.229  -9.429  -0.121  1.00 42.01           H   new
ATOM      0  HB3 GLN A  76      -5.818  -8.206  -1.307  1.00 42.01           H   new
ATOM      0  HG2 GLN A  76      -8.151  -8.297  -2.208  1.00 35.41           H   new
ATOM      0  HG3 GLN A  76      -8.562  -9.518  -1.020  1.00 35.41           H   new
ATOM      0 HE21 GLN A  76      -7.884  -6.108  -1.574  1.00 72.32           H   new
ATOM      0 HE22 GLN A  76      -8.406  -5.532   0.013  1.00 72.32           H   new
ATOM    837  N   THR A  77      -7.753 -11.724  -3.037  1.00 10.34           N
ATOM    838  CA  THR A  77      -8.754 -12.809  -3.071  1.00 34.14           C
ATOM    839  C   THR A  77      -8.186 -14.212  -2.694  1.00 11.24           C
ATOM    840  O   THR A  77      -8.969 -15.161  -2.554  1.00  1.21           O
ATOM    841  CB  THR A  77      -9.414 -12.852  -4.494  1.00 51.25           C
ATOM    842  OG1 THR A  77     -10.525 -13.760  -4.520  1.00 63.02           O
ATOM    843  CG2 THR A  77      -8.406 -13.249  -5.595  1.00 34.04           C
ATOM      0  H   THR A  77      -7.687 -11.221  -3.922  1.00 10.34           H   new
ATOM      0  HA  THR A  77      -9.495 -12.580  -2.305  1.00 34.14           H   new
ATOM      0  HB  THR A  77      -9.765 -11.841  -4.700  1.00 51.25           H   new
ATOM      0  HG1 THR A  77     -10.355 -14.503  -3.904  1.00 63.02           H   new
ATOM      0 HG21 THR A  77      -8.910 -13.265  -6.561  1.00 34.04           H   new
ATOM      0 HG22 THR A  77      -7.592 -12.524  -5.622  1.00 34.04           H   new
ATOM      0 HG23 THR A  77      -8.003 -14.239  -5.380  1.00 34.04           H   new
ATOM    851  N   GLU A  78      -6.827 -14.326  -2.594  1.00 54.13           N
ATOM    852  CA  GLU A  78      -6.084 -15.527  -2.124  1.00 20.14           C
ATOM    853  C   GLU A  78      -5.937 -16.577  -3.243  1.00 65.54           C
ATOM    854  O   GLU A  78      -4.870 -17.180  -3.395  1.00 71.01           O
ATOM    855  CB  GLU A  78      -6.696 -16.148  -0.836  1.00 40.21           C
ATOM    856  CG  GLU A  78      -5.893 -17.307  -0.210  1.00 43.41           C
ATOM    857  CD  GLU A  78      -6.608 -17.946   0.999  1.00 34.33           C
ATOM    858  OE1 GLU A  78      -7.665 -18.587   0.796  1.00 23.42           O
ATOM    859  OE2 GLU A  78      -6.146 -17.783   2.151  1.00 54.13           O
ATOM      0  H   GLU A  78      -6.204 -13.559  -2.847  1.00 54.13           H   new
ATOM      0  HA  GLU A  78      -5.085 -15.184  -1.856  1.00 20.14           H   new
ATOM      0  HB2 GLU A  78      -6.805 -15.360  -0.090  1.00 40.21           H   new
ATOM      0  HB3 GLU A  78      -7.698 -16.508  -1.068  1.00 40.21           H   new
ATOM      0  HG2 GLU A  78      -5.716 -18.071  -0.967  1.00 43.41           H   new
ATOM      0  HG3 GLU A  78      -4.917 -16.938   0.104  1.00 43.41           H   new
ATOM    866  N   ASN A  79      -7.024 -16.768  -4.017  1.00 22.11           N
ATOM    867  CA  ASN A  79      -7.081 -17.640  -5.207  1.00  4.12           C
ATOM    868  C   ASN A  79      -5.936 -17.318  -6.196  1.00 24.33           C
ATOM    869  O   ASN A  79      -5.368 -18.220  -6.830  1.00  1.41           O
ATOM    870  CB  ASN A  79      -8.465 -17.438  -5.881  1.00 21.41           C
ATOM    871  CG  ASN A  79      -8.692 -18.302  -7.124  1.00 22.35           C
ATOM    872  OD1 ASN A  79      -9.173 -19.433  -7.032  1.00 14.13           O
ATOM    873  ND2 ASN A  79      -8.361 -17.776  -8.297  1.00 41.21           N
ATOM      0  H   ASN A  79      -7.913 -16.306  -3.825  1.00 22.11           H   new
ATOM      0  HA  ASN A  79      -6.955 -18.680  -4.907  1.00  4.12           H   new
ATOM      0  HB2 ASN A  79      -9.246 -17.657  -5.153  1.00 21.41           H   new
ATOM      0  HB3 ASN A  79      -8.572 -16.389  -6.157  1.00 21.41           H   new
ATOM      0 HD21 ASN A  79      -8.503 -18.311  -9.154  1.00 41.21           H   new
ATOM      0 HD22 ASN A  79      -7.965 -16.837  -8.341  1.00 41.21           H   new
ATOM    880  N   LYS A  80      -5.613 -16.017  -6.303  1.00  1.41           N
ATOM    881  CA  LYS A  80      -4.502 -15.524  -7.118  1.00 13.55           C
ATOM    882  C   LYS A  80      -3.956 -14.235  -6.475  1.00 52.41           C
ATOM    883  O   LYS A  80      -4.387 -13.123  -6.801  1.00 14.45           O
ATOM    884  CB  LYS A  80      -4.955 -15.327  -8.594  1.00 25.43           C
ATOM    885  CG  LYS A  80      -3.821 -14.921  -9.562  1.00  3.50           C
ATOM    886  CD  LYS A  80      -4.269 -14.917 -11.044  1.00 44.44           C
ATOM    887  CE  LYS A  80      -3.137 -14.529 -12.014  1.00 72.25           C
ATOM    888  NZ  LYS A  80      -1.933 -15.378 -11.856  1.00  3.01           N
ATOM      0  H   LYS A  80      -6.123 -15.277  -5.820  1.00  1.41           H   new
ATOM      0  HA  LYS A  80      -3.692 -16.253  -7.148  1.00 13.55           H   new
ATOM      0  HB2 LYS A  80      -5.405 -16.254  -8.950  1.00 25.43           H   new
ATOM      0  HB3 LYS A  80      -5.732 -14.563  -8.624  1.00 25.43           H   new
ATOM      0  HG2 LYS A  80      -3.459 -13.928  -9.294  1.00  3.50           H   new
ATOM      0  HG3 LYS A  80      -2.984 -15.609  -9.442  1.00  3.50           H   new
ATOM      0  HD2 LYS A  80      -4.643 -15.906 -11.308  1.00 44.44           H   new
ATOM      0  HD3 LYS A  80      -5.099 -14.220 -11.165  1.00 44.44           H   new
ATOM      0  HE2 LYS A  80      -3.500 -14.607 -13.039  1.00 72.25           H   new
ATOM      0  HE3 LYS A  80      -2.865 -13.486 -11.850  1.00 72.25           H   new
ATOM      0  HZ1 LYS A  80      -1.264 -15.179 -12.627  1.00  3.01           H   new
ATOM      0  HZ2 LYS A  80      -1.480 -15.172 -10.943  1.00  3.01           H   new
ATOM      0  HZ3 LYS A  80      -2.209 -16.380 -11.887  1.00  3.01           H   new
ATOM    902  N   ILE A  81      -3.061 -14.422  -5.484  1.00  0.34           N
ATOM    903  CA  ILE A  81      -2.392 -13.334  -4.760  1.00 15.33           C
ATOM    904  C   ILE A  81      -0.866 -13.535  -4.851  1.00 41.34           C
ATOM    905  O   ILE A  81      -0.374 -14.649  -4.697  1.00 33.33           O
ATOM    906  CB  ILE A  81      -2.860 -13.273  -3.245  1.00 43.21           C
ATOM    907  CG1 ILE A  81      -2.223 -12.048  -2.508  1.00 31.22           C
ATOM    908  CG2 ILE A  81      -2.575 -14.601  -2.490  1.00 14.12           C
ATOM    909  CD1 ILE A  81      -2.667 -11.852  -1.061  1.00 13.24           C
ATOM      0  H   ILE A  81      -2.782 -15.349  -5.163  1.00  0.34           H   new
ATOM      0  HA  ILE A  81      -2.665 -12.384  -5.219  1.00 15.33           H   new
ATOM      0  HB  ILE A  81      -3.942 -13.138  -3.247  1.00 43.21           H   new
ATOM      0 HG12 ILE A  81      -1.139 -12.158  -2.526  1.00 31.22           H   new
ATOM      0 HG13 ILE A  81      -2.461 -11.144  -3.069  1.00 31.22           H   new
ATOM      0 HG21 ILE A  81      -2.912 -14.512  -1.457  1.00 14.12           H   new
ATOM      0 HG22 ILE A  81      -3.108 -15.418  -2.977  1.00 14.12           H   new
ATOM      0 HG23 ILE A  81      -1.505 -14.806  -2.506  1.00 14.12           H   new
ATOM      0 HD11 ILE A  81      -2.168 -10.978  -0.643  1.00 13.24           H   new
ATOM      0 HD12 ILE A  81      -3.746 -11.704  -1.028  1.00 13.24           H   new
ATOM      0 HD13 ILE A  81      -2.404 -12.734  -0.477  1.00 13.24           H   new
ATOM    921  N   HIS A  82      -0.125 -12.466  -5.163  1.00 71.44           N
ATOM    922  CA  HIS A  82       1.345 -12.464  -5.093  1.00 32.13           C
ATOM    923  C   HIS A  82       1.781 -11.599  -3.893  1.00 72.14           C
ATOM    924  O   HIS A  82       2.922 -11.692  -3.425  1.00 42.44           O
ATOM    925  CB  HIS A  82       1.922 -11.942  -6.432  1.00 14.35           C
ATOM    926  CG  HIS A  82       3.410 -12.127  -6.593  1.00 24.42           C
ATOM    927  ND1 HIS A  82       3.977 -13.191  -7.266  1.00  4.41           N
ATOM    928  CD2 HIS A  82       4.435 -11.362  -6.180  1.00  0.43           C
ATOM    929  CE1 HIS A  82       5.288 -13.063  -7.258  1.00 21.42           C
ATOM    930  NE2 HIS A  82       5.592 -11.960  -6.608  1.00 70.30           N
ATOM      0  H   HIS A  82      -0.524 -11.579  -5.471  1.00 71.44           H   new
ATOM      0  HA  HIS A  82       1.731 -13.472  -4.942  1.00 32.13           H   new
ATOM      0  HB2 HIS A  82       1.416 -12.450  -7.253  1.00 14.35           H   new
ATOM      0  HB3 HIS A  82       1.690 -10.881  -6.523  1.00 14.35           H   new
ATOM      0  HD2 HIS A  82       4.361 -10.445  -5.615  1.00  0.43           H   new
ATOM      0  HE1 HIS A  82       5.993 -13.746  -7.708  1.00 21.42           H   new
ATOM      0  HE2 HIS A  82       6.536 -11.607  -6.448  1.00 70.30           H   new
ATOM    939  N   GLY A  83       0.834 -10.766  -3.409  1.00 25.01           N
ATOM    940  CA  GLY A  83       1.043  -9.918  -2.241  1.00 34.22           C
ATOM    941  C   GLY A  83       1.863  -8.681  -2.550  1.00 22.53           C
ATOM    942  O   GLY A  83       2.612  -8.199  -1.706  1.00 35.12           O
ATOM      0  H   GLY A  83      -0.092 -10.671  -3.825  1.00 25.01           H   new
ATOM      0  HA2 GLY A  83       0.076  -9.616  -1.840  1.00 34.22           H   new
ATOM      0  HA3 GLY A  83       1.544 -10.495  -1.464  1.00 34.22           H   new
ATOM    946  N   THR A  84       1.678  -8.136  -3.754  1.00 62.01           N
ATOM    947  CA  THR A  84       2.392  -6.942  -4.213  1.00 74.02           C
ATOM    948  C   THR A  84       1.472  -5.729  -4.049  1.00 14.11           C
ATOM    949  O   THR A  84       0.258  -5.811  -4.306  1.00 12.14           O
ATOM    950  CB  THR A  84       2.830  -7.079  -5.710  1.00 34.54           C
ATOM    951  OG1 THR A  84       3.604  -8.277  -5.879  1.00 41.44           O
ATOM    952  CG2 THR A  84       3.646  -5.863  -6.198  1.00 73.43           C
ATOM      0  H   THR A  84       1.025  -8.512  -4.442  1.00 62.01           H   new
ATOM      0  HA  THR A  84       3.295  -6.819  -3.615  1.00 74.02           H   new
ATOM      0  HB  THR A  84       1.922  -7.126  -6.312  1.00 34.54           H   new
ATOM      0  HG1 THR A  84       4.175  -8.411  -5.094  1.00 41.44           H   new
ATOM      0 HG21 THR A  84       3.925  -6.007  -7.242  1.00 73.43           H   new
ATOM      0 HG22 THR A  84       3.043  -4.960  -6.105  1.00 73.43           H   new
ATOM      0 HG23 THR A  84       4.546  -5.762  -5.592  1.00 73.43           H   new
ATOM    960  N   ALA A  85       2.066  -4.611  -3.620  1.00 24.25           N
ATOM    961  CA  ALA A  85       1.356  -3.373  -3.336  1.00 65.22           C
ATOM    962  C   ALA A  85       2.273  -2.168  -3.577  1.00 14.35           C
ATOM    963  O   ALA A  85       3.422  -2.151  -3.109  1.00 13.40           O
ATOM    964  CB  ALA A  85       0.844  -3.385  -1.892  1.00 41.02           C
ATOM      0  H   ALA A  85       3.071  -4.546  -3.460  1.00 24.25           H   new
ATOM      0  HA  ALA A  85       0.501  -3.290  -4.007  1.00 65.22           H   new
ATOM      0  HB1 ALA A  85       0.314  -2.455  -1.686  1.00 41.02           H   new
ATOM      0  HB2 ALA A  85       0.167  -4.228  -1.753  1.00 41.02           H   new
ATOM      0  HB3 ALA A  85       1.687  -3.481  -1.208  1.00 41.02           H   new
ATOM    970  N   ASP A  86       1.759  -1.168  -4.309  1.00 45.11           N
ATOM    971  CA  ASP A  86       2.472   0.100  -4.544  1.00 53.33           C
ATOM    972  C   ASP A  86       2.302   0.974  -3.297  1.00 20.25           C
ATOM    973  O   ASP A  86       1.176   1.168  -2.833  1.00 74.33           O
ATOM    974  CB  ASP A  86       1.915   0.847  -5.788  1.00 34.21           C
ATOM    975  CG  ASP A  86       2.037   0.057  -7.100  1.00 32.10           C
ATOM    976  OD1 ASP A  86       3.075   0.177  -7.793  1.00 74.43           O
ATOM    977  OD2 ASP A  86       1.090  -0.677  -7.453  1.00 64.30           O
ATOM      0  H   ASP A  86       0.842  -1.213  -4.753  1.00 45.11           H   new
ATOM      0  HA  ASP A  86       3.524  -0.110  -4.735  1.00 53.33           H   new
ATOM      0  HB2 ASP A  86       0.865   1.085  -5.616  1.00 34.21           H   new
ATOM      0  HB3 ASP A  86       2.443   1.794  -5.896  1.00 34.21           H   new
ATOM    982  N   ILE A  87       3.403   1.482  -2.737  1.00 62.35           N
ATOM    983  CA  ILE A  87       3.347   2.313  -1.522  1.00 54.40           C
ATOM    984  C   ILE A  87       3.419   3.813  -1.869  1.00  1.00           C
ATOM    985  O   ILE A  87       4.230   4.267  -2.710  1.00 51.40           O
ATOM    986  CB  ILE A  87       4.451   1.909  -0.479  1.00 11.34           C
ATOM    987  CG1 ILE A  87       5.898   2.033  -1.054  1.00  1.11           C
ATOM    988  CG2 ILE A  87       4.195   0.478   0.036  1.00  0.32           C
ATOM    989  CD1 ILE A  87       7.016   1.808  -0.048  1.00 33.23           C
ATOM      0  H   ILE A  87       4.344   1.335  -3.101  1.00 62.35           H   new
ATOM      0  HA  ILE A  87       2.383   2.127  -1.049  1.00 54.40           H   new
ATOM      0  HB  ILE A  87       4.382   2.612   0.351  1.00 11.34           H   new
ATOM      0 HG12 ILE A  87       6.012   1.315  -1.866  1.00  1.11           H   new
ATOM      0 HG13 ILE A  87       6.016   3.026  -1.488  1.00  1.11           H   new
ATOM      0 HG21 ILE A  87       4.966   0.208   0.758  1.00  0.32           H   new
ATOM      0 HG22 ILE A  87       3.217   0.433   0.515  1.00  0.32           H   new
ATOM      0 HG23 ILE A  87       4.221  -0.220  -0.801  1.00  0.32           H   new
ATOM      0 HD11 ILE A  87       7.980   1.916  -0.545  1.00 33.23           H   new
ATOM      0 HD12 ILE A  87       6.937   2.542   0.754  1.00 33.23           H   new
ATOM      0 HD13 ILE A  87       6.933   0.805   0.369  1.00 33.23           H   new
ATOM   1001  N   TYR A  88       2.528   4.572  -1.216  1.00  2.24           N
ATOM   1002  CA  TYR A  88       2.319   6.000  -1.452  1.00 41.41           C
ATOM   1003  C   TYR A  88       2.411   6.778  -0.135  1.00 60.34           C
ATOM   1004  O   TYR A  88       2.094   6.255   0.945  1.00 63.41           O
ATOM   1005  CB  TYR A  88       0.924   6.256  -2.095  1.00 33.34           C
ATOM   1006  CG  TYR A  88       0.781   5.848  -3.577  1.00  2.54           C
ATOM   1007  CD1 TYR A  88       0.765   4.512  -3.973  1.00 61.45           C
ATOM   1008  CD2 TYR A  88       0.621   6.812  -4.580  1.00 11.42           C
ATOM   1009  CE1 TYR A  88       0.607   4.156  -5.299  1.00 74.00           C
ATOM   1010  CE2 TYR A  88       0.459   6.459  -5.904  1.00 32.12           C
ATOM   1011  CZ  TYR A  88       0.449   5.129  -6.260  1.00 51.42           C
ATOM   1012  OH  TYR A  88       0.288   4.768  -7.579  1.00 62.01           O
ATOM      0  H   TYR A  88       1.918   4.196  -0.490  1.00  2.24           H   new
ATOM      0  HA  TYR A  88       3.097   6.342  -2.135  1.00 41.41           H   new
ATOM      0  HB2 TYR A  88       0.174   5.718  -1.516  1.00 33.34           H   new
ATOM      0  HB3 TYR A  88       0.694   7.318  -2.006  1.00 33.34           H   new
ATOM      0  HD1 TYR A  88       0.878   3.738  -3.228  1.00 61.45           H   new
ATOM      0  HD2 TYR A  88       0.624   7.858  -4.311  1.00 11.42           H   new
ATOM      0  HE1 TYR A  88       0.607   3.114  -5.582  1.00 74.00           H   new
ATOM      0  HE2 TYR A  88       0.341   7.223  -6.658  1.00 32.12           H   new
ATOM      0  HH  TYR A  88       0.188   5.573  -8.129  1.00 62.01           H   new
ATOM   1022  N   LYS A  89       2.823   8.041  -0.254  1.00 13.21           N
ATOM   1023  CA  LYS A  89       2.780   9.022   0.830  1.00 40.25           C
ATOM   1024  C   LYS A  89       1.764  10.110   0.483  1.00 52.35           C
ATOM   1025  O   LYS A  89       1.552  10.401  -0.696  1.00 61.10           O
ATOM   1026  CB  LYS A  89       4.176   9.644   1.068  1.00 70.41           C
ATOM   1027  CG  LYS A  89       5.172   8.705   1.786  1.00 41.43           C
ATOM   1028  CD  LYS A  89       6.423   9.436   2.351  1.00 61.50           C
ATOM   1029  CE  LYS A  89       6.184  10.075   3.744  1.00 62.11           C
ATOM   1030  NZ  LYS A  89       5.069  11.061   3.769  1.00  0.23           N
ATOM      0  H   LYS A  89       3.203   8.417  -1.123  1.00 13.21           H   new
ATOM      0  HA  LYS A  89       2.478   8.521   1.750  1.00 40.25           H   new
ATOM      0  HB2 LYS A  89       4.599   9.939   0.108  1.00 70.41           H   new
ATOM      0  HB3 LYS A  89       4.061  10.553   1.658  1.00 70.41           H   new
ATOM      0  HG2 LYS A  89       4.657   8.200   2.603  1.00 41.43           H   new
ATOM      0  HG3 LYS A  89       5.497   7.933   1.089  1.00 41.43           H   new
ATOM      0  HD2 LYS A  89       7.248   8.727   2.421  1.00 61.50           H   new
ATOM      0  HD3 LYS A  89       6.728  10.213   1.650  1.00 61.50           H   new
ATOM      0  HE2 LYS A  89       5.974   9.285   4.465  1.00 62.11           H   new
ATOM      0  HE3 LYS A  89       7.100  10.568   4.069  1.00 62.11           H   new
ATOM      0  HZ1 LYS A  89       5.075  11.568   4.677  1.00  0.23           H   new
ATOM      0  HZ2 LYS A  89       5.189  11.741   2.991  1.00  0.23           H   new
ATOM      0  HZ3 LYS A  89       4.163  10.563   3.656  1.00  0.23           H   new
ATOM   1044  N   LYS A  90       1.135  10.712   1.507  1.00 54.25           N
ATOM   1045  CA  LYS A  90       0.099  11.735   1.296  1.00 32.02           C
ATOM   1046  C   LYS A  90       0.723  13.126   1.101  1.00 11.32           C
ATOM   1047  O   LYS A  90       1.760  13.444   1.695  1.00 63.32           O
ATOM   1048  CB  LYS A  90      -0.928  11.743   2.471  1.00 71.51           C
ATOM   1049  CG  LYS A  90      -2.228  12.518   2.135  1.00 51.01           C
ATOM   1050  CD  LYS A  90      -3.346  12.385   3.195  1.00 23.23           C
ATOM   1051  CE  LYS A  90      -4.613  13.174   2.791  1.00 34.51           C
ATOM   1052  NZ  LYS A  90      -5.718  13.023   3.772  1.00 14.15           N
ATOM      0  H   LYS A  90       1.326  10.507   2.488  1.00 54.25           H   new
ATOM      0  HA  LYS A  90      -0.438  11.480   0.382  1.00 32.02           H   new
ATOM      0  HB2 LYS A  90      -1.181  10.715   2.732  1.00 71.51           H   new
ATOM      0  HB3 LYS A  90      -0.463  12.189   3.350  1.00 71.51           H   new
ATOM      0  HG2 LYS A  90      -1.985  13.573   2.012  1.00 51.01           H   new
ATOM      0  HG3 LYS A  90      -2.609  12.165   1.177  1.00 51.01           H   new
ATOM      0  HD2 LYS A  90      -3.599  11.333   3.327  1.00 23.23           H   new
ATOM      0  HD3 LYS A  90      -2.982  12.748   4.156  1.00 23.23           H   new
ATOM      0  HE2 LYS A  90      -4.362  14.230   2.692  1.00 34.51           H   new
ATOM      0  HE3 LYS A  90      -4.952  12.833   1.813  1.00 34.51           H   new
ATOM      0  HZ1 LYS A  90      -6.542  13.571   3.454  1.00 14.15           H   new
ATOM      0  HZ2 LYS A  90      -5.979  12.019   3.849  1.00 14.15           H   new
ATOM      0  HZ3 LYS A  90      -5.408  13.373   4.701  1.00 14.15           H   new
ATOM   1066  N   LYS A  91       0.087  13.928   0.228  1.00 74.11           N
ATOM   1067  CA  LYS A  91       0.423  15.344   0.002  1.00 13.03           C
ATOM   1068  C   LYS A  91       0.048  16.206   1.224  1.00 65.33           C
ATOM   1069  O   LYS A  91      -0.662  15.750   2.131  1.00 55.33           O
ATOM   1070  CB  LYS A  91      -0.332  15.863  -1.260  1.00 60.15           C
ATOM   1071  CG  LYS A  91       0.063  15.166  -2.580  1.00 71.21           C
ATOM   1072  CD  LYS A  91      -0.742  15.681  -3.799  1.00  1.14           C
ATOM   1073  CE  LYS A  91      -0.215  15.125  -5.134  1.00 12.30           C
ATOM   1074  NZ  LYS A  91       1.183  15.561  -5.401  1.00 33.55           N
ATOM      0  H   LYS A  91      -0.688  13.604  -0.350  1.00 74.11           H   new
ATOM      0  HA  LYS A  91       1.499  15.422  -0.152  1.00 13.03           H   new
ATOM      0  HB2 LYS A  91      -1.403  15.735  -1.104  1.00 60.15           H   new
ATOM      0  HB3 LYS A  91      -0.150  16.933  -1.361  1.00 60.15           H   new
ATOM      0  HG2 LYS A  91       1.127  15.320  -2.762  1.00 71.21           H   new
ATOM      0  HG3 LYS A  91      -0.090  14.092  -2.478  1.00 71.21           H   new
ATOM      0  HD2 LYS A  91      -1.789  15.403  -3.682  1.00  1.14           H   new
ATOM      0  HD3 LYS A  91      -0.702  16.770  -3.822  1.00  1.14           H   new
ATOM      0  HE2 LYS A  91      -0.259  14.036  -5.117  1.00 12.30           H   new
ATOM      0  HE3 LYS A  91      -0.861  15.458  -5.947  1.00 12.30           H   new
ATOM      0  HZ1 LYS A  91       1.421  15.374  -6.396  1.00 33.55           H   new
ATOM      0  HZ2 LYS A  91       1.272  16.579  -5.210  1.00 33.55           H   new
ATOM      0  HZ3 LYS A  91       1.834  15.035  -4.784  1.00 33.55           H   new
ATOM   1088  N   LEU A  92       0.550  17.454   1.237  1.00 71.31           N
ATOM   1089  CA  LEU A  92       0.122  18.480   2.208  1.00 71.11           C
ATOM   1090  C   LEU A  92      -1.319  18.910   1.870  1.00 10.42           C
ATOM   1091  O   LEU A  92      -1.662  18.992   0.680  1.00 12.35           O
ATOM   1092  CB  LEU A  92       1.073  19.724   2.193  1.00 20.21           C
ATOM   1093  CG  LEU A  92       2.499  19.553   2.833  1.00 51.23           C
ATOM   1094  CD1 LEU A  92       3.396  18.584   2.035  1.00 32.42           C
ATOM   1095  CD2 LEU A  92       3.198  20.925   3.011  1.00 25.10           C
ATOM      0  H   LEU A  92       1.259  17.779   0.580  1.00 71.31           H   new
ATOM      0  HA  LEU A  92       0.165  18.053   3.210  1.00 71.11           H   new
ATOM      0  HB2 LEU A  92       1.204  20.035   1.157  1.00 20.21           H   new
ATOM      0  HB3 LEU A  92       0.568  20.540   2.709  1.00 20.21           H   new
ATOM      0  HG  LEU A  92       2.347  19.108   3.817  1.00 51.23           H   new
ATOM      0 HD11 LEU A  92       4.368  18.504   2.522  1.00 32.42           H   new
ATOM      0 HD12 LEU A  92       2.927  17.601   1.998  1.00 32.42           H   new
ATOM      0 HD13 LEU A  92       3.528  18.962   1.021  1.00 32.42           H   new
ATOM      0 HD21 LEU A  92       4.182  20.777   3.456  1.00 25.10           H   new
ATOM      0 HD22 LEU A  92       3.307  21.406   2.039  1.00 25.10           H   new
ATOM      0 HD23 LEU A  92       2.597  21.558   3.664  1.00 25.10           H   new
ATOM   1107  N   GLU A  93      -2.140  19.173   2.923  1.00 13.30           N
ATOM   1108  CA  GLU A  93      -3.585  19.520   2.797  1.00 70.14           C
ATOM   1109  C   GLU A  93      -4.390  18.284   2.288  1.00 12.40           C
ATOM   1110  O   GLU A  93      -3.863  17.162   2.241  1.00  0.20           O
ATOM   1111  CB  GLU A  93      -3.769  20.788   1.881  1.00  3.40           C
ATOM   1112  CG  GLU A  93      -5.093  21.573   2.041  1.00 43.11           C
ATOM   1113  CD  GLU A  93      -5.234  22.699   1.004  1.00 34.01           C
ATOM   1114  OE1 GLU A  93      -5.729  22.437  -0.109  1.00 43.23           O
ATOM   1115  OE2 GLU A  93      -4.813  23.847   1.290  1.00 73.24           O
ATOM      0  H   GLU A  93      -1.816  19.150   3.890  1.00 13.30           H   new
ATOM      0  HA  GLU A  93      -3.985  19.781   3.777  1.00 70.14           H   new
ATOM      0  HB2 GLU A  93      -2.942  21.471   2.075  1.00  3.40           H   new
ATOM      0  HB3 GLU A  93      -3.684  20.472   0.841  1.00  3.40           H   new
ATOM      0  HG2 GLU A  93      -5.934  20.886   1.944  1.00 43.11           H   new
ATOM      0  HG3 GLU A  93      -5.142  21.998   3.044  1.00 43.11           H   new
ATOM   1122  N   HIS A  94      -5.681  18.476   1.971  1.00 60.15           N
ATOM   1123  CA  HIS A  94      -6.516  17.460   1.303  1.00 12.54           C
ATOM   1124  C   HIS A  94      -7.332  18.151   0.191  1.00 55.13           C
ATOM   1125  O   HIS A  94      -7.965  19.188   0.446  1.00 35.50           O
ATOM   1126  CB  HIS A  94      -7.450  16.734   2.316  1.00 34.34           C
ATOM   1127  CG  HIS A  94      -8.508  17.610   2.947  1.00 33.25           C
ATOM   1128  ND1 HIS A  94      -9.857  17.464   2.694  1.00 14.34           N
ATOM   1129  CD2 HIS A  94      -8.407  18.646   3.812  1.00 34.22           C
ATOM   1130  CE1 HIS A  94     -10.534  18.362   3.373  1.00 71.33           C
ATOM   1131  NE2 HIS A  94      -9.681  19.094   4.060  1.00 73.03           N
ATOM      0  H   HIS A  94      -6.178  19.344   2.171  1.00 60.15           H   new
ATOM      0  HA  HIS A  94      -5.874  16.695   0.867  1.00 12.54           H   new
ATOM      0  HB2 HIS A  94      -7.942  15.906   1.805  1.00 34.34           H   new
ATOM      0  HB3 HIS A  94      -6.837  16.302   3.107  1.00 34.34           H   new
ATOM      0  HD2 HIS A  94      -7.495  19.046   4.229  1.00 34.22           H   new
ATOM      0  HE1 HIS A  94     -11.608  18.480   3.369  1.00 71.33           H   new
ATOM      0  HE2 HIS A  94      -9.927  19.868   4.677  1.00 73.03           H   new
ATOM   1140  N   HIS A  95      -7.277  17.577  -1.029  1.00 64.13           N
ATOM   1141  CA  HIS A  95      -7.972  18.083  -2.227  1.00 11.31           C
ATOM   1142  C   HIS A  95      -7.543  19.537  -2.517  1.00  5.44           C
ATOM   1143  O   HIS A  95      -8.235  20.496  -2.157  1.00 45.40           O
ATOM   1144  CB  HIS A  95      -9.520  17.920  -2.086  1.00 75.50           C
ATOM   1145  CG  HIS A  95     -10.286  18.051  -3.380  1.00 34.20           C
ATOM   1146  ND1 HIS A  95     -10.318  17.055  -4.326  1.00  1.50           N
ATOM   1147  CD2 HIS A  95     -11.057  19.048  -3.868  1.00 24.12           C
ATOM   1148  CE1 HIS A  95     -11.071  17.431  -5.336  1.00 21.44           C
ATOM   1149  NE2 HIS A  95     -11.534  18.641  -5.086  1.00 61.44           N
ATOM      0  H   HIS A  95      -6.736  16.731  -1.210  1.00 64.13           H   new
ATOM      0  HA  HIS A  95      -7.681  17.485  -3.091  1.00 11.31           H   new
ATOM      0  HB2 HIS A  95      -9.731  16.943  -1.651  1.00 75.50           H   new
ATOM      0  HB3 HIS A  95      -9.888  18.668  -1.384  1.00 75.50           H   new
ATOM      0  HD1 HIS A  95      -9.832  16.161  -4.255  1.00  1.50           H   new
ATOM      0  HD2 HIS A  95     -11.260  19.993  -3.386  1.00 24.12           H   new
ATOM      0  HE1 HIS A  95     -11.276  16.848  -6.221  1.00 21.44           H   new
ATOM   1158  N   HIS A  96      -6.375  19.679  -3.164  1.00  5.23           N
ATOM   1159  CA  HIS A  96      -5.697  20.983  -3.341  1.00 34.21           C
ATOM   1160  C   HIS A  96      -6.290  21.795  -4.528  1.00 74.54           C
ATOM   1161  O   HIS A  96      -5.682  22.752  -5.012  1.00 45.40           O
ATOM   1162  CB  HIS A  96      -4.166  20.736  -3.497  1.00 44.44           C
ATOM   1163  CG  HIS A  96      -3.325  21.977  -3.328  1.00 14.20           C
ATOM   1164  ND1 HIS A  96      -2.869  22.732  -4.384  1.00 52.23           N
ATOM   1165  CD2 HIS A  96      -2.875  22.593  -2.212  1.00 62.00           C
ATOM   1166  CE1 HIS A  96      -2.175  23.752  -3.928  1.00 33.11           C
ATOM   1167  NE2 HIS A  96      -2.163  23.693  -2.612  1.00 24.05           N
ATOM      0  H   HIS A  96      -5.871  18.896  -3.581  1.00  5.23           H   new
ATOM      0  HA  HIS A  96      -5.867  21.598  -2.457  1.00 34.21           H   new
ATOM      0  HB2 HIS A  96      -3.851  19.993  -2.764  1.00 44.44           H   new
ATOM      0  HB3 HIS A  96      -3.975  20.311  -4.483  1.00 44.44           H   new
ATOM      0  HD2 HIS A  96      -3.045  22.277  -1.194  1.00 62.00           H   new
ATOM      0  HE1 HIS A  96      -1.696  24.510  -4.530  1.00 33.11           H   new
ATOM      0  HE2 HIS A  96      -1.699  24.358  -1.992  1.00 24.05           H   new
ATOM   1176  N   HIS A  97      -7.496  21.416  -4.984  1.00 64.10           N
ATOM   1177  CA  HIS A  97      -8.273  22.167  -5.991  1.00 33.42           C
ATOM   1178  C   HIS A  97      -9.737  22.261  -5.520  1.00  5.14           C
ATOM   1179  O   HIS A  97     -10.046  21.890  -4.383  1.00  4.42           O
ATOM   1180  CB  HIS A  97      -8.189  21.477  -7.379  1.00 31.35           C
ATOM   1181  CG  HIS A  97      -6.799  21.383  -7.959  1.00 10.14           C
ATOM   1182  ND1 HIS A  97      -6.196  20.187  -8.289  1.00 72.54           N
ATOM   1183  CD2 HIS A  97      -5.913  22.349  -8.299  1.00 20.13           C
ATOM   1184  CE1 HIS A  97      -5.001  20.422  -8.795  1.00 72.00           C
ATOM   1185  NE2 HIS A  97      -4.806  21.725  -8.817  1.00 24.24           N
ATOM      0  H   HIS A  97      -7.966  20.570  -4.661  1.00 64.10           H   new
ATOM      0  HA  HIS A  97      -7.857  23.169  -6.096  1.00 33.42           H   new
ATOM      0  HB2 HIS A  97      -8.600  20.471  -7.294  1.00 31.35           H   new
ATOM      0  HB3 HIS A  97      -8.823  22.022  -8.078  1.00 31.35           H   new
ATOM      0  HD2 HIS A  97      -6.052  23.414  -8.184  1.00 20.13           H   new
ATOM      0  HE1 HIS A  97      -4.301  19.673  -9.134  1.00 72.00           H   new
ATOM      0  HE2 HIS A  97      -3.969  22.194  -9.163  1.00 24.24           H   new
ATOM   1194  N   HIS A  98     -10.632  22.791  -6.373  1.00 14.13           N
ATOM   1195  CA  HIS A  98     -12.093  22.761  -6.117  1.00 54.13           C
ATOM   1196  C   HIS A  98     -12.712  21.536  -6.816  1.00 11.44           C
ATOM   1197  O   HIS A  98     -13.441  20.758  -6.185  1.00 65.10           O
ATOM   1198  CB  HIS A  98     -12.781  24.076  -6.583  1.00 11.52           C
ATOM   1199  CG  HIS A  98     -12.369  25.298  -5.797  1.00 50.25           C
ATOM   1200  ND1 HIS A  98     -11.801  26.414  -6.371  1.00 53.10           N
ATOM   1201  CD2 HIS A  98     -12.466  25.573  -4.472  1.00 30.44           C
ATOM   1202  CE1 HIS A  98     -11.563  27.318  -5.441  1.00 62.13           C
ATOM   1203  NE2 HIS A  98     -11.956  26.834  -4.282  1.00 73.13           N
ATOM      0  H   HIS A  98     -10.374  23.247  -7.248  1.00 14.13           H   new
ATOM      0  HA  HIS A  98     -12.256  22.679  -5.042  1.00 54.13           H   new
ATOM      0  HB2 HIS A  98     -12.552  24.240  -7.636  1.00 11.52           H   new
ATOM      0  HB3 HIS A  98     -13.862  23.955  -6.507  1.00 11.52           H   new
ATOM      0  HD2 HIS A  98     -12.869  24.922  -3.710  1.00 30.44           H   new
ATOM      0  HE1 HIS A  98     -11.121  28.290  -5.603  1.00 62.13           H   new
ATOM      0  HE2 HIS A  98     -11.892  27.318  -3.386  1.00 73.13           H   new
ATOM   1212  N   HIS A  99     -12.381  21.388  -8.119  1.00 21.24           N
ATOM   1213  CA  HIS A  99     -12.807  20.274  -8.988  1.00 11.20           C
ATOM   1214  C   HIS A  99     -14.359  20.246  -9.154  1.00 25.53           C
ATOM   1215  O   HIS A  99     -15.054  19.556  -8.369  1.00 71.03           O
ATOM   1216  CB  HIS A  99     -12.225  18.917  -8.487  1.00 44.21           C
ATOM   1217  CG  HIS A  99     -12.535  17.741  -9.386  1.00 72.03           C
ATOM   1218  ND1 HIS A  99     -13.698  17.011  -9.276  1.00 50.41           N
ATOM   1219  CD2 HIS A  99     -11.846  17.187 -10.420  1.00  2.12           C
ATOM   1220  CE1 HIS A  99     -13.719  16.070 -10.196  1.00 43.51           C
ATOM   1221  NE2 HIS A  99     -12.611  16.152 -10.903  1.00  2.32           N
ATOM   1222  OXT HIS A  99     -14.874  20.934 -10.061  1.00 36.88           O
ATOM      0  H   HIS A  99     -11.792  22.063  -8.607  1.00 21.24           H   new
ATOM      0  HA  HIS A  99     -12.395  20.439  -9.984  1.00 11.20           H   new
ATOM      0  HB2 HIS A  99     -11.143  19.012  -8.391  1.00 44.21           H   new
ATOM      0  HB3 HIS A  99     -12.617  18.712  -7.491  1.00 44.21           H   new
ATOM      0  HD2 HIS A  99     -10.881  17.501 -10.791  1.00  2.12           H   new
ATOM      0  HE1 HIS A  99     -14.511  15.352 -10.346  1.00 43.51           H   new
ATOM      0  HE2 HIS A  99     -12.361  15.545 -11.684  1.00  2.32           H   new
TER    1231      HIS A  99