USER  MOD reduce.3.24.130724 H: found=0, std=0, add=481, rem=0, adj=23
USER  MOD reduce.3.24.130724 removed 485 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  27 LYS NZ  :NH3+   -179:sc= 0.00249   (180deg=-0.00389)
USER  MOD Set 1.2: A  73 THR OG1 :   rot  180:sc= 0.00152
USER  MOD Set 2.1: A  46 THR OG1 :   rot   50:sc=    0.45
USER  MOD Set 2.2: A  61 LYS NZ  :NH3+   -149:sc=    0.69   (180deg=0.32)
USER  MOD Set 3.1: A  44 SER OG  :   rot  180:sc=   0.222
USER  MOD Set 3.2: A  84 THR OG1 :   rot  -89:sc=   0.233
USER  MOD Set 4.1: A  39 LYS NZ  :NH3+    134:sc=   0.947   (180deg=-0.00467)
USER  MOD Set 4.2: A  42 THR OG1 :   rot  -98:sc=    1.81
USER  MOD Single : A  25 MET CE  :methyl  149:sc=   -1.65   (180deg=-2.82!)
USER  MOD Single : A  26 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  28 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  32 LYS NZ  :NH3+    170:sc= -0.0134   (180deg=-0.145)
USER  MOD Single : A  35 SER OG  :   rot  180:sc=       0
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  45 THR OG1 :   rot   95:sc=   0.163
USER  MOD Single : A  49 MET CE  :methyl -148:sc=    -1.1   (180deg=-2.23)
USER  MOD Single : A  50 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  60 LYS NZ  :NH3+    166:sc=   0.413   (180deg=0.324)
USER  MOD Single : A  65 LYS NZ  :NH3+    175:sc=       0   (180deg=-0.0135)
USER  MOD Single : A  88 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  89 LYS NZ  :NH3+   -168:sc=  -0.015   (180deg=-0.188)
USER  MOD Single : A  90 LYS NZ  :NH3+    138:sc=  0.0707   (180deg=-0.0841)
USER  MOD Single : A  91 LYS NZ  :NH3+   -141:sc=  -0.589   (180deg=-2.46!)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   ALA A  22       0.411   3.143   7.824  1.00 71.32           N
ATOM      2  CA  ALA A  22       0.363   2.363   6.571  1.00 33.24           C
ATOM      3  C   ALA A  22      -1.051   1.783   6.380  1.00 42.31           C
ATOM      4  O   ALA A  22      -1.377   0.722   6.924  1.00 13.30           O
ATOM      5  CB  ALA A  22       1.447   1.272   6.583  1.00 71.11           C
ATOM      0  HA  ALA A  22       0.573   3.011   5.720  1.00 33.24           H   new
ATOM      0  HB1 ALA A  22       1.402   0.704   5.654  1.00 71.11           H   new
ATOM      0  HB2 ALA A  22       2.429   1.736   6.677  1.00 71.11           H   new
ATOM      0  HB3 ALA A  22       1.280   0.602   7.427  1.00 71.11           H   new
ATOM     13  N   GLU A  23      -1.898   2.521   5.632  1.00 72.31           N
ATOM     14  CA  GLU A  23      -3.336   2.227   5.480  1.00 61.54           C
ATOM     15  C   GLU A  23      -3.545   1.402   4.208  1.00 31.42           C
ATOM     16  O   GLU A  23      -3.216   1.873   3.118  1.00 42.25           O
ATOM     17  CB  GLU A  23      -4.175   3.546   5.402  1.00 44.43           C
ATOM     18  CG  GLU A  23      -3.712   4.685   6.338  1.00 24.20           C
ATOM     19  CD  GLU A  23      -3.606   4.293   7.824  1.00  2.50           C
ATOM     20  OE1 GLU A  23      -4.648   4.200   8.503  1.00 41.34           O
ATOM     21  OE2 GLU A  23      -2.470   4.088   8.326  1.00  2.02           O
ATOM      0  H   GLU A  23      -1.598   3.346   5.112  1.00 72.31           H   new
ATOM      0  HA  GLU A  23      -3.674   1.664   6.350  1.00 61.54           H   new
ATOM      0  HB2 GLU A  23      -4.151   3.911   4.375  1.00 44.43           H   new
ATOM      0  HB3 GLU A  23      -5.214   3.309   5.632  1.00 44.43           H   new
ATOM      0  HG2 GLU A  23      -2.739   5.042   6.000  1.00 24.20           H   new
ATOM      0  HG3 GLU A  23      -4.408   5.519   6.245  1.00 24.20           H   new
ATOM     28  N   ILE A  24      -4.091   0.188   4.338  1.00 73.12           N
ATOM     29  CA  ILE A  24      -4.275  -0.712   3.183  1.00 44.12           C
ATOM     30  C   ILE A  24      -5.560  -0.341   2.418  1.00  3.14           C
ATOM     31  O   ILE A  24      -6.672  -0.482   2.945  1.00 10.31           O
ATOM     32  CB  ILE A  24      -4.335  -2.233   3.587  1.00 63.12           C
ATOM     33  CG1 ILE A  24      -3.112  -2.642   4.455  1.00 11.50           C
ATOM     34  CG2 ILE A  24      -4.420  -3.139   2.329  1.00 35.53           C
ATOM     35  CD1 ILE A  24      -1.767  -2.583   3.744  1.00 53.52           C
ATOM      0  H   ILE A  24      -4.414  -0.197   5.226  1.00 73.12           H   new
ATOM      0  HA  ILE A  24      -3.400  -0.577   2.547  1.00 44.12           H   new
ATOM      0  HB  ILE A  24      -5.237  -2.373   4.183  1.00 63.12           H   new
ATOM      0 HG12 ILE A  24      -3.072  -1.992   5.329  1.00 11.50           H   new
ATOM      0 HG13 ILE A  24      -3.268  -3.657   4.820  1.00 11.50           H   new
ATOM      0 HG21 ILE A  24      -4.460  -4.184   2.635  1.00 35.53           H   new
ATOM      0 HG22 ILE A  24      -5.318  -2.892   1.763  1.00 35.53           H   new
ATOM      0 HG23 ILE A  24      -3.541  -2.978   1.704  1.00 35.53           H   new
ATOM      0 HD11 ILE A  24      -0.978  -2.886   4.432  1.00 53.52           H   new
ATOM      0 HD12 ILE A  24      -1.779  -3.256   2.887  1.00 53.52           H   new
ATOM      0 HD13 ILE A  24      -1.580  -1.565   3.403  1.00 53.52           H   new
ATOM     47  N   MET A  25      -5.388   0.165   1.190  1.00 62.15           N
ATOM     48  CA  MET A  25      -6.489   0.357   0.224  1.00 21.23           C
ATOM     49  C   MET A  25      -6.255  -0.560  -0.985  1.00 73.24           C
ATOM     50  O   MET A  25      -5.210  -1.196  -1.093  1.00 63.01           O
ATOM     51  CB  MET A  25      -6.620   1.844  -0.230  1.00  3.10           C
ATOM     52  CG  MET A  25      -7.033   2.824   0.881  1.00 32.20           C
ATOM     53  SD  MET A  25      -7.649   4.409   0.248  1.00  3.03           S
ATOM     54  CE  MET A  25      -6.286   4.996  -0.758  1.00 63.50           C
ATOM      0  H   MET A  25      -4.478   0.456   0.832  1.00 62.15           H   new
ATOM      0  HA  MET A  25      -7.427   0.097   0.714  1.00 21.23           H   new
ATOM      0  HB2 MET A  25      -5.665   2.168  -0.644  1.00  3.10           H   new
ATOM      0  HB3 MET A  25      -7.352   1.900  -1.035  1.00  3.10           H   new
ATOM      0  HG2 MET A  25      -7.805   2.361   1.495  1.00 32.20           H   new
ATOM      0  HG3 MET A  25      -6.177   3.008   1.530  1.00 32.20           H   new
ATOM      0  HE1 MET A  25      -6.674   5.591  -1.585  1.00 63.50           H   new
ATOM      0  HE2 MET A  25      -5.622   5.610  -0.149  1.00 63.50           H   new
ATOM      0  HE3 MET A  25      -5.732   4.144  -1.152  1.00 63.50           H   new
ATOM     64  N   LYS A  26      -7.259  -0.667  -1.853  1.00  3.32           N
ATOM     65  CA  LYS A  26      -7.162  -1.382  -3.143  1.00  0.01           C
ATOM     66  C   LYS A  26      -7.197  -0.352  -4.278  1.00  2.34           C
ATOM     67  O   LYS A  26      -7.630   0.781  -4.053  1.00 63.21           O
ATOM     68  CB  LYS A  26      -8.332  -2.381  -3.265  1.00 71.30           C
ATOM     69  CG  LYS A  26      -8.353  -3.468  -2.163  1.00 74.22           C
ATOM     70  CD  LYS A  26      -9.676  -4.266  -2.141  1.00 21.22           C
ATOM     71  CE  LYS A  26      -9.940  -5.060  -3.433  1.00 71.45           C
ATOM     72  NZ  LYS A  26     -11.362  -5.496  -3.516  1.00 60.34           N
ATOM      0  H   LYS A  26      -8.178  -0.258  -1.687  1.00  3.32           H   new
ATOM      0  HA  LYS A  26      -6.229  -1.942  -3.202  1.00  0.01           H   new
ATOM      0  HB2 LYS A  26      -9.271  -1.829  -3.234  1.00 71.30           H   new
ATOM      0  HB3 LYS A  26      -8.280  -2.867  -4.239  1.00 71.30           H   new
ATOM      0  HG2 LYS A  26      -7.521  -4.155  -2.319  1.00 74.22           H   new
ATOM      0  HG3 LYS A  26      -8.200  -2.998  -1.191  1.00 74.22           H   new
ATOM      0  HD2 LYS A  26      -9.660  -4.956  -1.298  1.00 21.22           H   new
ATOM      0  HD3 LYS A  26     -10.503  -3.577  -1.973  1.00 21.22           H   new
ATOM      0  HE2 LYS A  26      -9.695  -4.444  -4.298  1.00 71.45           H   new
ATOM      0  HE3 LYS A  26      -9.287  -5.932  -3.467  1.00 71.45           H   new
ATOM      0  HZ1 LYS A  26     -11.511  -6.029  -4.397  1.00 60.34           H   new
ATOM      0  HZ2 LYS A  26     -11.587  -6.103  -2.702  1.00 60.34           H   new
ATOM      0  HZ3 LYS A  26     -11.982  -4.661  -3.507  1.00 60.34           H   new
ATOM     86  N   LYS A  27      -6.743  -0.753  -5.487  1.00 63.42           N
ATOM     87  CA  LYS A  27      -6.610   0.152  -6.660  1.00 32.34           C
ATOM     88  C   LYS A  27      -7.923   0.864  -7.027  1.00 64.23           C
ATOM     89  O   LYS A  27      -7.918   2.071  -7.284  1.00 14.41           O
ATOM     90  CB  LYS A  27      -6.037  -0.621  -7.887  1.00 33.54           C
ATOM     91  CG  LYS A  27      -4.504  -0.807  -7.863  1.00 63.33           C
ATOM     92  CD  LYS A  27      -3.761   0.541  -8.032  1.00 23.43           C
ATOM     93  CE  LYS A  27      -2.241   0.401  -7.901  1.00 53.00           C
ATOM     94  NZ  LYS A  27      -1.644  -0.466  -8.952  1.00  1.24           N
ATOM      0  H   LYS A  27      -6.457  -1.713  -5.681  1.00 63.42           H   new
ATOM      0  HA  LYS A  27      -5.908   0.934  -6.371  1.00 32.34           H   new
ATOM      0  HB2 LYS A  27      -6.509  -1.602  -7.936  1.00 33.54           H   new
ATOM      0  HB3 LYS A  27      -6.312  -0.089  -8.798  1.00 33.54           H   new
ATOM      0  HG2 LYS A  27      -4.208  -1.270  -6.922  1.00 63.33           H   new
ATOM      0  HG3 LYS A  27      -4.208  -1.488  -8.660  1.00 63.33           H   new
ATOM      0  HD2 LYS A  27      -4.000   0.962  -9.008  1.00 23.43           H   new
ATOM      0  HD3 LYS A  27      -4.122   1.246  -7.284  1.00 23.43           H   new
ATOM      0  HE2 LYS A  27      -1.785   1.390  -7.951  1.00 53.00           H   new
ATOM      0  HE3 LYS A  27      -2.003  -0.010  -6.920  1.00 53.00           H   new
ATOM      0  HZ1 LYS A  27      -0.617  -0.537  -8.802  1.00  1.24           H   new
ATOM      0  HZ2 LYS A  27      -2.067  -1.415  -8.901  1.00  1.24           H   new
ATOM      0  HZ3 LYS A  27      -1.829  -0.054  -9.889  1.00  1.24           H   new
ATOM    108  N   THR A  28      -9.039   0.120  -7.008  1.00  3.53           N
ATOM    109  CA  THR A  28     -10.365   0.647  -7.383  1.00 50.44           C
ATOM    110  C   THR A  28     -10.784   1.825  -6.464  1.00  4.23           C
ATOM    111  O   THR A  28     -11.421   2.777  -6.914  1.00 45.50           O
ATOM    112  CB  THR A  28     -11.436  -0.496  -7.339  1.00 70.12           C
ATOM    113  OG1 THR A  28     -10.914  -1.671  -7.982  1.00 52.41           O
ATOM    114  CG2 THR A  28     -12.756  -0.098  -8.029  1.00 22.34           C
ATOM      0  H   THR A  28      -9.051  -0.862  -6.733  1.00  3.53           H   new
ATOM      0  HA  THR A  28     -10.301   1.029  -8.402  1.00 50.44           H   new
ATOM      0  HB  THR A  28     -11.653  -0.690  -6.288  1.00 70.12           H   new
ATOM      0  HG1 THR A  28     -11.584  -2.385  -7.952  1.00 52.41           H   new
ATOM      0 HG21 THR A  28     -13.462  -0.926  -7.969  1.00 22.34           H   new
ATOM      0 HG22 THR A  28     -13.178   0.775  -7.531  1.00 22.34           H   new
ATOM      0 HG23 THR A  28     -12.563   0.139  -9.075  1.00 22.34           H   new
ATOM    122  N   ASP A  29     -10.396   1.736  -5.179  1.00 22.34           N
ATOM    123  CA  ASP A  29     -10.635   2.793  -4.168  1.00 31.24           C
ATOM    124  C   ASP A  29      -9.573   3.902  -4.247  1.00 71.21           C
ATOM    125  O   ASP A  29      -9.874   5.077  -4.006  1.00 31.21           O
ATOM    126  CB  ASP A  29     -10.628   2.181  -2.746  1.00 63.11           C
ATOM    127  CG  ASP A  29     -11.708   1.112  -2.562  1.00 43.22           C
ATOM    128  OD1 ASP A  29     -12.855   1.457  -2.200  1.00 54.31           O
ATOM    129  OD2 ASP A  29     -11.425  -0.078  -2.813  1.00 33.43           O
ATOM      0  H   ASP A  29      -9.904   0.924  -4.806  1.00 22.34           H   new
ATOM      0  HA  ASP A  29     -11.610   3.234  -4.378  1.00 31.24           H   new
ATOM      0  HB2 ASP A  29      -9.650   1.743  -2.548  1.00 63.11           H   new
ATOM      0  HB3 ASP A  29     -10.777   2.973  -2.012  1.00 63.11           H   new
ATOM    134  N   PHE A  30      -8.329   3.499  -4.567  1.00 43.11           N
ATOM    135  CA  PHE A  30      -7.173   4.399  -4.586  1.00 55.33           C
ATOM    136  C   PHE A  30      -7.311   5.468  -5.667  1.00 50.23           C
ATOM    137  O   PHE A  30      -7.165   6.640  -5.365  1.00 75.23           O
ATOM    138  CB  PHE A  30      -5.841   3.623  -4.785  1.00  4.50           C
ATOM    139  CG  PHE A  30      -4.652   4.533  -5.115  1.00 21.31           C
ATOM    140  CD1 PHE A  30      -4.146   5.423  -4.161  1.00 34.02           C
ATOM    141  CD2 PHE A  30      -4.088   4.547  -6.398  1.00 54.43           C
ATOM    142  CE1 PHE A  30      -3.128   6.291  -4.480  1.00 63.41           C
ATOM    143  CE2 PHE A  30      -3.062   5.413  -6.707  1.00 14.11           C
ATOM    144  CZ  PHE A  30      -2.586   6.288  -5.749  1.00 41.40           C
ATOM      0  H   PHE A  30      -8.103   2.537  -4.819  1.00 43.11           H   new
ATOM      0  HA  PHE A  30      -7.146   4.888  -3.612  1.00 55.33           H   new
ATOM      0  HB2 PHE A  30      -5.618   3.060  -3.879  1.00  4.50           H   new
ATOM      0  HB3 PHE A  30      -5.968   2.897  -5.588  1.00  4.50           H   new
ATOM      0  HD1 PHE A  30      -4.559   5.428  -3.163  1.00 34.02           H   new
ATOM      0  HD2 PHE A  30      -4.462   3.871  -7.153  1.00 54.43           H   new
ATOM      0  HE1 PHE A  30      -2.752   6.977  -3.735  1.00 63.41           H   new
ATOM      0  HE2 PHE A  30      -2.630   5.408  -7.697  1.00 14.11           H   new
ATOM      0  HZ  PHE A  30      -1.787   6.972  -5.994  1.00 41.40           H   new
ATOM    154  N   ASP A  31      -7.556   5.039  -6.922  1.00  0.30           N
ATOM    155  CA  ASP A  31      -7.611   5.948  -8.087  1.00 53.23           C
ATOM    156  C   ASP A  31      -8.626   7.089  -7.880  1.00 13.00           C
ATOM    157  O   ASP A  31      -8.365   8.236  -8.280  1.00 31.42           O
ATOM    158  CB  ASP A  31      -7.887   5.157  -9.396  1.00 23.01           C
ATOM    159  CG  ASP A  31      -6.653   4.361  -9.876  1.00 73.04           C
ATOM    160  OD1 ASP A  31      -6.391   3.259  -9.349  1.00 45.33           O
ATOM    161  OD2 ASP A  31      -5.925   4.852 -10.767  1.00 62.41           O
ATOM      0  H   ASP A  31      -7.720   4.060  -7.156  1.00  0.30           H   new
ATOM      0  HA  ASP A  31      -6.632   6.418  -8.185  1.00 53.23           H   new
ATOM      0  HB2 ASP A  31      -8.718   4.470  -9.234  1.00 23.01           H   new
ATOM      0  HB3 ASP A  31      -8.195   5.851 -10.178  1.00 23.01           H   new
ATOM    166  N   LYS A  32      -9.718   6.771  -7.156  1.00 72.11           N
ATOM    167  CA  LYS A  32     -10.765   7.740  -6.777  1.00 53.14           C
ATOM    168  C   LYS A  32     -10.164   8.954  -6.028  1.00 62.05           C
ATOM    169  O   LYS A  32     -10.611  10.088  -6.202  1.00 33.41           O
ATOM    170  CB  LYS A  32     -11.828   7.055  -5.873  1.00 61.13           C
ATOM    171  CG  LYS A  32     -12.453   5.762  -6.446  1.00 22.24           C
ATOM    172  CD  LYS A  32     -13.121   5.967  -7.824  1.00 64.02           C
ATOM    173  CE  LYS A  32     -13.806   4.693  -8.353  1.00 61.41           C
ATOM    174  NZ  LYS A  32     -14.895   4.232  -7.454  1.00 73.24           N
ATOM      0  H   LYS A  32      -9.899   5.827  -6.815  1.00 72.11           H   new
ATOM      0  HA  LYS A  32     -11.234   8.095  -7.694  1.00 53.14           H   new
ATOM      0  HB2 LYS A  32     -11.367   6.821  -4.913  1.00 61.13           H   new
ATOM      0  HB3 LYS A  32     -12.628   7.769  -5.677  1.00 61.13           H   new
ATOM      0  HG2 LYS A  32     -11.678   5.000  -6.535  1.00 22.24           H   new
ATOM      0  HG3 LYS A  32     -13.194   5.382  -5.743  1.00 22.24           H   new
ATOM      0  HD2 LYS A  32     -13.859   6.766  -7.749  1.00 64.02           H   new
ATOM      0  HD3 LYS A  32     -12.369   6.294  -8.542  1.00 64.02           H   new
ATOM      0  HE2 LYS A  32     -14.213   4.886  -9.346  1.00 61.41           H   new
ATOM      0  HE3 LYS A  32     -13.065   3.901  -8.460  1.00 61.41           H   new
ATOM      0  HZ1 LYS A  32     -15.438   3.480  -7.924  1.00 73.24           H   new
ATOM      0  HZ2 LYS A  32     -14.485   3.864  -6.572  1.00 73.24           H   new
ATOM      0  HZ3 LYS A  32     -15.526   5.029  -7.236  1.00 73.24           H   new
ATOM    188  N   VAL A  33      -9.137   8.681  -5.207  1.00 31.41           N
ATOM    189  CA  VAL A  33      -8.413   9.686  -4.394  1.00  1.43           C
ATOM    190  C   VAL A  33      -6.902   9.712  -4.756  1.00 24.25           C
ATOM    191  O   VAL A  33      -6.081  10.157  -3.946  1.00 21.24           O
ATOM    192  CB  VAL A  33      -8.604   9.388  -2.847  1.00 23.13           C
ATOM    193  CG1 VAL A  33     -10.086   9.542  -2.424  1.00 33.20           C
ATOM    194  CG2 VAL A  33      -8.058   7.986  -2.471  1.00 31.44           C
ATOM      0  H   VAL A  33      -8.775   7.736  -5.083  1.00 31.41           H   new
ATOM      0  HA  VAL A  33      -8.833  10.667  -4.617  1.00  1.43           H   new
ATOM      0  HB  VAL A  33      -8.023  10.128  -2.296  1.00 23.13           H   new
ATOM      0 HG11 VAL A  33     -10.184   9.331  -1.359  1.00 33.20           H   new
ATOM      0 HG12 VAL A  33     -10.418  10.561  -2.624  1.00 33.20           H   new
ATOM      0 HG13 VAL A  33     -10.701   8.842  -2.990  1.00 33.20           H   new
ATOM      0 HG21 VAL A  33      -8.204   7.813  -1.405  1.00 31.44           H   new
ATOM      0 HG22 VAL A  33      -8.591   7.224  -3.039  1.00 31.44           H   new
ATOM      0 HG23 VAL A  33      -6.995   7.935  -2.705  1.00 31.44           H   new
ATOM    204  N   ALA A  34      -6.549   9.266  -5.997  1.00 53.13           N
ATOM    205  CA  ALA A  34      -5.130   9.111  -6.442  1.00 31.31           C
ATOM    206  C   ALA A  34      -4.300  10.401  -6.273  1.00 52.35           C
ATOM    207  O   ALA A  34      -3.125  10.346  -5.882  1.00  1.41           O
ATOM    208  CB  ALA A  34      -5.067   8.638  -7.904  1.00 65.14           C
ATOM      0  H   ALA A  34      -7.231   9.006  -6.710  1.00 53.13           H   new
ATOM      0  HA  ALA A  34      -4.688   8.356  -5.792  1.00 31.31           H   new
ATOM      0  HB1 ALA A  34      -4.026   8.532  -8.207  1.00 65.14           H   new
ATOM      0  HB2 ALA A  34      -5.572   7.677  -7.997  1.00 65.14           H   new
ATOM      0  HB3 ALA A  34      -5.559   9.370  -8.545  1.00 65.14           H   new
ATOM    214  N   SER A  35      -4.950  11.553  -6.528  1.00 45.31           N
ATOM    215  CA  SER A  35      -4.309  12.886  -6.491  1.00 34.24           C
ATOM    216  C   SER A  35      -3.818  13.269  -5.071  1.00 64.40           C
ATOM    217  O   SER A  35      -2.983  14.166  -4.919  1.00 33.22           O
ATOM    218  CB  SER A  35      -5.308  13.942  -7.010  1.00 31.11           C
ATOM    219  OG  SER A  35      -5.838  13.567  -8.273  1.00 31.21           O
ATOM      0  H   SER A  35      -5.941  11.587  -6.767  1.00 45.31           H   new
ATOM      0  HA  SER A  35      -3.427  12.851  -7.131  1.00 34.24           H   new
ATOM      0  HB2 SER A  35      -6.120  14.063  -6.293  1.00 31.11           H   new
ATOM      0  HB3 SER A  35      -4.810  14.908  -7.093  1.00 31.11           H   new
ATOM      0  HG  SER A  35      -6.469  14.251  -8.579  1.00 31.21           H   new
ATOM    225  N   GLU A  36      -4.344  12.570  -4.047  1.00 71.22           N
ATOM    226  CA  GLU A  36      -3.980  12.789  -2.637  1.00 43.14           C
ATOM    227  C   GLU A  36      -2.647  12.118  -2.280  1.00 54.24           C
ATOM    228  O   GLU A  36      -2.097  12.400  -1.215  1.00 22.42           O
ATOM    229  CB  GLU A  36      -5.094  12.237  -1.701  1.00 12.25           C
ATOM    230  CG  GLU A  36      -6.446  12.969  -1.804  1.00 52.45           C
ATOM    231  CD  GLU A  36      -6.370  14.429  -1.333  1.00 31.03           C
ATOM    232  OE1 GLU A  36      -6.079  14.653  -0.139  1.00 45.31           O
ATOM    233  OE2 GLU A  36      -6.608  15.360  -2.138  1.00 73.54           O
ATOM      0  H   GLU A  36      -5.037  11.833  -4.177  1.00 71.22           H   new
ATOM      0  HA  GLU A  36      -3.872  13.864  -2.496  1.00 43.14           H   new
ATOM      0  HB2 GLU A  36      -5.250  11.182  -1.928  1.00 12.25           H   new
ATOM      0  HB3 GLU A  36      -4.744  12.293  -0.670  1.00 12.25           H   new
ATOM      0  HG2 GLU A  36      -6.790  12.943  -2.838  1.00 52.45           H   new
ATOM      0  HG3 GLU A  36      -7.188  12.438  -1.208  1.00 52.45           H   new
ATOM    240  N   TYR A  37      -2.140  11.211  -3.152  1.00 33.32           N
ATOM    241  CA  TYR A  37      -0.980  10.346  -2.814  1.00 65.13           C
ATOM    242  C   TYR A  37       0.089  10.352  -3.917  1.00 71.44           C
ATOM    243  O   TYR A  37      -0.220  10.556  -5.094  1.00 41.35           O
ATOM    244  CB  TYR A  37      -1.459   8.902  -2.520  1.00 13.24           C
ATOM    245  CG  TYR A  37      -2.503   8.841  -1.396  1.00 21.12           C
ATOM    246  CD1 TYR A  37      -2.142   9.134  -0.084  1.00 43.32           C
ATOM    247  CD2 TYR A  37      -3.848   8.561  -1.653  1.00 24.43           C
ATOM    248  CE1 TYR A  37      -3.070   9.145   0.932  1.00 22.21           C
ATOM    249  CE2 TYR A  37      -4.782   8.559  -0.633  1.00  2.32           C
ATOM    250  CZ  TYR A  37      -4.389   8.855   0.656  1.00 61.41           C
ATOM    251  OH  TYR A  37      -5.319   8.859   1.675  1.00 40.44           O
ATOM      0  H   TYR A  37      -2.513  11.059  -4.089  1.00 33.32           H   new
ATOM      0  HA  TYR A  37      -0.513  10.756  -1.918  1.00 65.13           H   new
ATOM      0  HB2 TYR A  37      -1.883   8.472  -3.428  1.00 13.24           H   new
ATOM      0  HB3 TYR A  37      -0.601   8.288  -2.247  1.00 13.24           H   new
ATOM      0  HD1 TYR A  37      -1.110   9.358   0.142  1.00 43.32           H   new
ATOM      0  HD2 TYR A  37      -4.163   8.343  -2.663  1.00 24.43           H   new
ATOM      0  HE1 TYR A  37      -2.766   9.380   1.941  1.00 22.21           H   new
ATOM      0  HE2 TYR A  37      -5.815   8.327  -0.845  1.00  2.32           H   new
ATOM      0  HH  TYR A  37      -6.202   8.636   1.313  1.00 40.44           H   new
ATOM    261  N   THR A  38       1.355  10.143  -3.501  1.00 12.25           N
ATOM    262  CA  THR A  38       2.529  10.097  -4.388  1.00 22.23           C
ATOM    263  C   THR A  38       3.206   8.715  -4.265  1.00  1.23           C
ATOM    264  O   THR A  38       3.442   8.221  -3.147  1.00 14.44           O
ATOM    265  CB  THR A  38       3.547  11.260  -4.074  1.00 24.24           C
ATOM    266  OG1 THR A  38       4.652  11.227  -4.991  1.00 50.14           O
ATOM    267  CG2 THR A  38       4.085  11.229  -2.631  1.00 24.02           C
ATOM      0  H   THR A  38       1.591   9.999  -2.519  1.00 12.25           H   new
ATOM      0  HA  THR A  38       2.195  10.244  -5.415  1.00 22.23           H   new
ATOM      0  HB  THR A  38       2.985  12.187  -4.192  1.00 24.24           H   new
ATOM      0  HG1 THR A  38       5.272  11.956  -4.782  1.00 50.14           H   new
ATOM      0 HG21 THR A  38       4.779  12.056  -2.484  1.00 24.02           H   new
ATOM      0 HG22 THR A  38       3.255  11.323  -1.931  1.00 24.02           H   new
ATOM      0 HG23 THR A  38       4.602  10.286  -2.456  1.00 24.02           H   new
ATOM    275  N   LYS A  39       3.474   8.086  -5.424  1.00 54.40           N
ATOM    276  CA  LYS A  39       4.024   6.726  -5.511  1.00 71.24           C
ATOM    277  C   LYS A  39       5.534   6.761  -5.255  1.00 35.25           C
ATOM    278  O   LYS A  39       6.298   7.253  -6.097  1.00 32.32           O
ATOM    279  CB  LYS A  39       3.702   6.124  -6.910  1.00 74.44           C
ATOM    280  CG  LYS A  39       3.970   4.610  -7.055  1.00 44.12           C
ATOM    281  CD  LYS A  39       3.599   4.092  -8.466  1.00 75.03           C
ATOM    282  CE  LYS A  39       3.762   2.573  -8.615  1.00 43.33           C
ATOM    283  NZ  LYS A  39       5.158   2.122  -8.398  1.00 23.24           N
ATOM      0  H   LYS A  39       3.312   8.515  -6.335  1.00 54.40           H   new
ATOM      0  HA  LYS A  39       3.567   6.092  -4.751  1.00 71.24           H   new
ATOM      0  HB2 LYS A  39       2.653   6.314  -7.136  1.00 74.44           H   new
ATOM      0  HB3 LYS A  39       4.290   6.654  -7.659  1.00 74.44           H   new
ATOM      0  HG2 LYS A  39       5.023   4.407  -6.859  1.00 44.12           H   new
ATOM      0  HG3 LYS A  39       3.395   4.066  -6.306  1.00 44.12           H   new
ATOM      0  HD2 LYS A  39       2.566   4.363  -8.686  1.00 75.03           H   new
ATOM      0  HD3 LYS A  39       4.224   4.592  -9.206  1.00 75.03           H   new
ATOM      0  HE2 LYS A  39       3.108   2.070  -7.903  1.00 43.33           H   new
ATOM      0  HE3 LYS A  39       3.439   2.273  -9.612  1.00 43.33           H   new
ATOM      0  HZ1 LYS A  39       5.161   1.291  -7.773  1.00 23.24           H   new
ATOM      0  HZ2 LYS A  39       5.587   1.870  -9.311  1.00 23.24           H   new
ATOM      0  HZ3 LYS A  39       5.706   2.888  -7.957  1.00 23.24           H   new
ATOM    297  N   ILE A  40       5.958   6.269  -4.077  1.00 33.05           N
ATOM    298  CA  ILE A  40       7.385   6.285  -3.670  1.00 65.42           C
ATOM    299  C   ILE A  40       8.054   4.918  -3.931  1.00 10.11           C
ATOM    300  O   ILE A  40       9.261   4.759  -3.705  1.00 53.24           O
ATOM    301  CB  ILE A  40       7.558   6.700  -2.156  1.00 23.33           C
ATOM    302  CG1 ILE A  40       6.775   5.727  -1.215  1.00 11.05           C
ATOM    303  CG2 ILE A  40       7.124   8.172  -1.937  1.00 53.24           C
ATOM    304  CD1 ILE A  40       7.051   5.892   0.270  1.00 23.14           C
ATOM      0  H   ILE A  40       5.335   5.853  -3.385  1.00 33.05           H   new
ATOM      0  HA  ILE A  40       7.882   7.037  -4.282  1.00 65.42           H   new
ATOM      0  HB  ILE A  40       8.615   6.623  -1.900  1.00 23.33           H   new
ATOM      0 HG12 ILE A  40       5.707   5.864  -1.386  1.00 11.05           H   new
ATOM      0 HG13 ILE A  40       7.014   4.702  -1.500  1.00 11.05           H   new
ATOM      0 HG21 ILE A  40       7.251   8.437  -0.887  1.00 53.24           H   new
ATOM      0 HG22 ILE A  40       7.738   8.828  -2.554  1.00 53.24           H   new
ATOM      0 HG23 ILE A  40       6.077   8.288  -2.216  1.00 53.24           H   new
ATOM      0 HD11 ILE A  40       6.459   5.170   0.833  1.00 23.14           H   new
ATOM      0 HD12 ILE A  40       8.110   5.722   0.464  1.00 23.14           H   new
ATOM      0 HD13 ILE A  40       6.783   6.902   0.580  1.00 23.14           H   new
ATOM    316  N   GLY A  41       7.256   3.939  -4.396  1.00  1.32           N
ATOM    317  CA  GLY A  41       7.762   2.607  -4.728  1.00 44.41           C
ATOM    318  C   GLY A  41       6.651   1.571  -4.794  1.00 24.52           C
ATOM    319  O   GLY A  41       5.462   1.919  -4.713  1.00 74.13           O
ATOM      0  H   GLY A  41       6.254   4.053  -4.549  1.00  1.32           H   new
ATOM      0  HA2 GLY A  41       8.279   2.645  -5.687  1.00 44.41           H   new
ATOM      0  HA3 GLY A  41       8.496   2.303  -3.982  1.00 44.41           H   new
ATOM    323  N   THR A  42       7.045   0.304  -4.963  1.00 71.04           N
ATOM    324  CA  THR A  42       6.148  -0.856  -4.863  1.00 12.54           C
ATOM    325  C   THR A  42       6.847  -1.937  -4.028  1.00 64.12           C
ATOM    326  O   THR A  42       8.023  -2.233  -4.262  1.00 33.53           O
ATOM    327  CB  THR A  42       5.803  -1.433  -6.278  1.00 45.24           C
ATOM    328  OG1 THR A  42       5.370  -0.369  -7.140  1.00 61.14           O
ATOM    329  CG2 THR A  42       4.712  -2.524  -6.216  1.00 54.21           C
ATOM      0  H   THR A  42       8.010   0.050  -5.176  1.00 71.04           H   new
ATOM      0  HA  THR A  42       5.216  -0.543  -4.392  1.00 12.54           H   new
ATOM      0  HB  THR A  42       6.708  -1.895  -6.672  1.00 45.24           H   new
ATOM      0  HG1 THR A  42       4.391  -0.344  -7.162  1.00 61.14           H   new
ATOM      0 HG21 THR A  42       4.508  -2.892  -7.221  1.00 54.21           H   new
ATOM      0 HG22 THR A  42       5.056  -3.348  -5.591  1.00 54.21           H   new
ATOM      0 HG23 THR A  42       3.800  -2.103  -5.792  1.00 54.21           H   new
ATOM    337  N   ILE A  43       6.129  -2.527  -3.062  1.00  4.11           N
ATOM    338  CA  ILE A  43       6.664  -3.612  -2.213  1.00 35.05           C
ATOM    339  C   ILE A  43       5.846  -4.893  -2.423  1.00 64.32           C
ATOM    340  O   ILE A  43       4.685  -4.844  -2.824  1.00 41.43           O
ATOM    341  CB  ILE A  43       6.694  -3.218  -0.680  1.00 21.34           C
ATOM    342  CG1 ILE A  43       5.254  -3.006  -0.096  1.00 60.31           C
ATOM    343  CG2 ILE A  43       7.572  -1.959  -0.457  1.00  4.22           C
ATOM    344  CD1 ILE A  43       5.196  -2.785   1.417  1.00 23.20           C
ATOM      0  H   ILE A  43       5.166  -2.271  -2.844  1.00  4.11           H   new
ATOM      0  HA  ILE A  43       7.696  -3.787  -2.516  1.00 35.05           H   new
ATOM      0  HB  ILE A  43       7.138  -4.053  -0.139  1.00 21.34           H   new
ATOM      0 HG12 ILE A  43       4.800  -2.147  -0.591  1.00 60.31           H   new
ATOM      0 HG13 ILE A  43       4.646  -3.876  -0.345  1.00 60.31           H   new
ATOM      0 HG21 ILE A  43       7.580  -1.704   0.603  1.00  4.22           H   new
ATOM      0 HG22 ILE A  43       8.590  -2.162  -0.789  1.00  4.22           H   new
ATOM      0 HG23 ILE A  43       7.164  -1.125  -1.028  1.00  4.22           H   new
ATOM      0 HD11 ILE A  43       4.159  -2.648   1.725  1.00 23.20           H   new
ATOM      0 HD12 ILE A  43       5.615  -3.652   1.928  1.00 23.20           H   new
ATOM      0 HD13 ILE A  43       5.772  -1.897   1.677  1.00 23.20           H   new
ATOM    356  N   SER A  44       6.473  -6.034  -2.150  1.00 14.14           N
ATOM    357  CA  SER A  44       5.841  -7.354  -2.253  1.00  1.30           C
ATOM    358  C   SER A  44       5.985  -8.065  -0.910  1.00 52.40           C
ATOM    359  O   SER A  44       6.918  -7.774  -0.154  1.00 64.13           O
ATOM    360  CB  SER A  44       6.495  -8.176  -3.384  1.00 34.24           C
ATOM    361  OG  SER A  44       6.356  -7.522  -4.639  1.00 40.43           O
ATOM      0  H   SER A  44       7.446  -6.073  -1.847  1.00 14.14           H   new
ATOM      0  HA  SER A  44       4.784  -7.244  -2.495  1.00  1.30           H   new
ATOM      0  HB2 SER A  44       7.552  -8.326  -3.164  1.00 34.24           H   new
ATOM      0  HB3 SER A  44       6.036  -9.163  -3.432  1.00 34.24           H   new
ATOM      0  HG  SER A  44       6.780  -8.062  -5.338  1.00 40.43           H   new
ATOM    367  N   THR A  45       5.066  -8.987  -0.617  1.00 71.52           N
ATOM    368  CA  THR A  45       5.071  -9.741   0.636  1.00  0.22           C
ATOM    369  C   THR A  45       6.205 -10.778   0.627  1.00 72.35           C
ATOM    370  O   THR A  45       6.434 -11.441  -0.395  1.00  3.12           O
ATOM    371  CB  THR A  45       3.700 -10.451   0.848  1.00  2.21           C
ATOM    372  OG1 THR A  45       3.412 -11.310  -0.262  1.00 52.31           O
ATOM    373  CG2 THR A  45       2.562  -9.437   1.008  1.00 14.41           C
ATOM      0  H   THR A  45       4.298  -9.231  -1.242  1.00 71.52           H   new
ATOM      0  HA  THR A  45       5.235  -9.045   1.459  1.00  0.22           H   new
ATOM      0  HB  THR A  45       3.772 -11.039   1.763  1.00  2.21           H   new
ATOM      0  HG1 THR A  45       3.697 -12.224  -0.051  1.00 52.31           H   new
ATOM      0 HG21 THR A  45       1.621  -9.967   1.154  1.00 14.41           H   new
ATOM      0 HG22 THR A  45       2.759  -8.802   1.872  1.00 14.41           H   new
ATOM      0 HG23 THR A  45       2.496  -8.820   0.112  1.00 14.41           H   new
ATOM    381  N   THR A  46       6.933 -10.886   1.752  1.00 22.30           N
ATOM    382  CA  THR A  46       7.992 -11.889   1.915  1.00 15.23           C
ATOM    383  C   THR A  46       7.361 -13.283   2.126  1.00 62.12           C
ATOM    384  O   THR A  46       7.031 -13.672   3.254  1.00  3.32           O
ATOM    385  CB  THR A  46       8.974 -11.498   3.080  1.00 31.21           C
ATOM    386  OG1 THR A  46       8.233 -11.039   4.231  1.00 10.34           O
ATOM    387  CG2 THR A  46       9.966 -10.399   2.643  1.00 44.25           C
ATOM      0  H   THR A  46       6.803 -10.285   2.566  1.00 22.30           H   new
ATOM      0  HA  THR A  46       8.592 -11.924   1.006  1.00 15.23           H   new
ATOM      0  HB  THR A  46       9.541 -12.392   3.339  1.00 31.21           H   new
ATOM      0  HG1 THR A  46       7.525 -11.683   4.443  1.00 10.34           H   new
ATOM      0 HG21 THR A  46      10.628 -10.155   3.474  1.00 44.25           H   new
ATOM      0 HG22 THR A  46      10.558 -10.757   1.801  1.00 44.25           H   new
ATOM      0 HG23 THR A  46       9.414  -9.508   2.346  1.00 44.25           H   new
ATOM    395  N   GLY A  47       7.135 -13.984   0.993  1.00 43.04           N
ATOM    396  CA  GLY A  47       6.502 -15.304   0.969  1.00 11.02           C
ATOM    397  C   GLY A  47       5.029 -15.242   0.570  1.00 10.33           C
ATOM    398  O   GLY A  47       4.402 -14.170   0.642  1.00 74.33           O
ATOM      0  H   GLY A  47       7.392 -13.640   0.068  1.00 43.04           H   new
ATOM      0  HA2 GLY A  47       7.037 -15.947   0.270  1.00 11.02           H   new
ATOM      0  HA3 GLY A  47       6.589 -15.762   1.954  1.00 11.02           H   new
ATOM    402  N   GLU A  48       4.486 -16.394   0.127  1.00 54.34           N
ATOM    403  CA  GLU A  48       3.054 -16.544  -0.190  1.00 75.52           C
ATOM    404  C   GLU A  48       2.261 -16.610   1.131  1.00 32.44           C
ATOM    405  O   GLU A  48       2.355 -17.598   1.871  1.00 41.55           O
ATOM    406  CB  GLU A  48       2.792 -17.825  -1.036  1.00 61.03           C
ATOM    407  CG  GLU A  48       3.505 -17.864  -2.402  1.00 50.51           C
ATOM    408  CD  GLU A  48       3.208 -19.160  -3.186  1.00 20.11           C
ATOM    409  OE1 GLU A  48       2.092 -19.292  -3.732  1.00 23.42           O
ATOM    410  OE2 GLU A  48       4.076 -20.059  -3.248  1.00 13.35           O
ATOM      0  H   GLU A  48       5.029 -17.245  -0.020  1.00 54.34           H   new
ATOM      0  HA  GLU A  48       2.730 -15.688  -0.782  1.00 75.52           H   new
ATOM      0  HB2 GLU A  48       3.103 -18.694  -0.456  1.00 61.03           H   new
ATOM      0  HB3 GLU A  48       1.719 -17.919  -1.201  1.00 61.03           H   new
ATOM      0  HG2 GLU A  48       3.194 -17.004  -2.996  1.00 50.51           H   new
ATOM      0  HG3 GLU A  48       4.581 -17.773  -2.250  1.00 50.51           H   new
ATOM    417  N   MET A  49       1.527 -15.536   1.442  1.00 21.04           N
ATOM    418  CA  MET A  49       0.732 -15.424   2.683  1.00 33.53           C
ATOM    419  C   MET A  49      -0.731 -15.123   2.342  1.00  2.33           C
ATOM    420  O   MET A  49      -1.009 -14.504   1.308  1.00 55.42           O
ATOM    421  CB  MET A  49       1.347 -14.335   3.610  1.00 31.23           C
ATOM    422  CG  MET A  49       2.700 -14.747   4.223  1.00  3.34           C
ATOM    423  SD  MET A  49       3.477 -13.452   5.212  1.00 64.14           S
ATOM    424  CE  MET A  49       3.986 -12.293   3.954  1.00 72.12           C
ATOM      0  H   MET A  49       1.463 -14.714   0.842  1.00 21.04           H   new
ATOM      0  HA  MET A  49       0.757 -16.371   3.222  1.00 33.53           H   new
ATOM      0  HB2 MET A  49       1.480 -13.416   3.040  1.00 31.23           H   new
ATOM      0  HB3 MET A  49       0.645 -14.113   4.414  1.00 31.23           H   new
ATOM      0  HG2 MET A  49       2.552 -15.628   4.847  1.00  3.34           H   new
ATOM      0  HG3 MET A  49       3.379 -15.035   3.421  1.00  3.34           H   new
ATOM      0  HE1 MET A  49       4.900 -11.791   4.270  1.00 72.12           H   new
ATOM      0  HE2 MET A  49       4.169 -12.826   3.021  1.00 72.12           H   new
ATOM      0  HE3 MET A  49       3.200 -11.553   3.801  1.00 72.12           H   new
ATOM    434  N   SER A  50      -1.652 -15.587   3.215  1.00 43.13           N
ATOM    435  CA  SER A  50      -3.108 -15.436   3.037  1.00 51.20           C
ATOM    436  C   SER A  50      -3.471 -13.937   2.923  1.00 44.14           C
ATOM    437  O   SER A  50      -2.968 -13.159   3.723  1.00 42.42           O
ATOM    438  CB  SER A  50      -3.839 -16.084   4.243  1.00 23.31           C
ATOM    439  OG  SER A  50      -3.440 -17.437   4.433  1.00 41.25           O
ATOM      0  H   SER A  50      -1.400 -16.081   4.071  1.00 43.13           H   new
ATOM      0  HA  SER A  50      -3.421 -15.936   2.120  1.00 51.20           H   new
ATOM      0  HB2 SER A  50      -3.629 -15.512   5.147  1.00 23.31           H   new
ATOM      0  HB3 SER A  50      -4.916 -16.041   4.082  1.00 23.31           H   new
ATOM      0  HG  SER A  50      -3.918 -17.814   5.201  1.00 41.25           H   new
ATOM    445  N   PRO A  51      -4.362 -13.532   1.939  1.00 33.01           N
ATOM    446  CA  PRO A  51      -4.634 -12.108   1.559  1.00  1.22           C
ATOM    447  C   PRO A  51      -4.607 -11.087   2.721  1.00 11.42           C
ATOM    448  O   PRO A  51      -3.955 -10.051   2.620  1.00  5.52           O
ATOM    449  CB  PRO A  51      -6.047 -12.204   0.946  1.00 25.44           C
ATOM    450  CG  PRO A  51      -6.056 -13.532   0.250  1.00 53.21           C
ATOM    451  CD  PRO A  51      -5.196 -14.456   1.105  1.00 72.25           C
ATOM      0  HA  PRO A  51      -3.855 -11.725   0.899  1.00  1.22           H   new
ATOM      0  HB2 PRO A  51      -6.819 -12.152   1.714  1.00 25.44           H   new
ATOM      0  HB3 PRO A  51      -6.235 -11.388   0.249  1.00 25.44           H   new
ATOM      0  HG2 PRO A  51      -7.071 -13.918   0.157  1.00 53.21           H   new
ATOM      0  HG3 PRO A  51      -5.654 -13.447  -0.760  1.00 53.21           H   new
ATOM      0  HD2 PRO A  51      -5.811 -15.106   1.728  1.00 72.25           H   new
ATOM      0  HD3 PRO A  51      -4.573 -15.103   0.487  1.00 72.25           H   new
ATOM    459  N   LEU A  52      -5.277 -11.433   3.836  1.00 70.13           N
ATOM    460  CA  LEU A  52      -5.398 -10.555   5.019  1.00 73.52           C
ATOM    461  C   LEU A  52      -4.054 -10.440   5.780  1.00 10.43           C
ATOM    462  O   LEU A  52      -3.620  -9.333   6.110  1.00 13.22           O
ATOM    463  CB  LEU A  52      -6.536 -11.054   5.961  1.00 45.41           C
ATOM    464  CG  LEU A  52      -8.013 -10.841   5.461  1.00 72.54           C
ATOM    465  CD1 LEU A  52      -8.304  -9.350   5.167  1.00 14.20           C
ATOM    466  CD2 LEU A  52      -8.362 -11.740   4.244  1.00 73.21           C
ATOM      0  H   LEU A  52      -5.751 -12.330   3.944  1.00 70.13           H   new
ATOM      0  HA  LEU A  52      -5.659  -9.557   4.668  1.00 73.52           H   new
ATOM      0  HB2 LEU A  52      -6.388 -12.119   6.139  1.00 45.41           H   new
ATOM      0  HB3 LEU A  52      -6.427 -10.552   6.922  1.00 45.41           H   new
ATOM      0  HG  LEU A  52      -8.666 -11.151   6.277  1.00 72.54           H   new
ATOM      0 HD11 LEU A  52      -9.333  -9.241   4.824  1.00 14.20           H   new
ATOM      0 HD12 LEU A  52      -8.160  -8.765   6.076  1.00 14.20           H   new
ATOM      0 HD13 LEU A  52      -7.624  -8.992   4.394  1.00 14.20           H   new
ATOM      0 HD21 LEU A  52      -9.392 -11.555   3.938  1.00 73.21           H   new
ATOM      0 HD22 LEU A  52      -7.691 -11.509   3.417  1.00 73.21           H   new
ATOM      0 HD23 LEU A  52      -8.249 -12.788   4.522  1.00 73.21           H   new
ATOM    478  N   ASP A  53      -3.397 -11.587   6.021  1.00 21.54           N
ATOM    479  CA  ASP A  53      -2.069 -11.647   6.689  1.00 31.12           C
ATOM    480  C   ASP A  53      -0.988 -10.957   5.826  1.00 54.42           C
ATOM    481  O   ASP A  53      -0.049 -10.352   6.349  1.00 53.55           O
ATOM    482  CB  ASP A  53      -1.693 -13.128   6.960  1.00 43.02           C
ATOM    483  CG  ASP A  53      -0.323 -13.308   7.650  1.00 13.30           C
ATOM    484  OD1 ASP A  53      -0.203 -12.967   8.846  1.00 34.23           O
ATOM    485  OD2 ASP A  53       0.626 -13.816   7.015  1.00 72.44           O
ATOM      0  H   ASP A  53      -3.764 -12.503   5.762  1.00 21.54           H   new
ATOM      0  HA  ASP A  53      -2.125 -11.114   7.638  1.00 31.12           H   new
ATOM      0  HB2 ASP A  53      -2.465 -13.581   7.582  1.00 43.02           H   new
ATOM      0  HB3 ASP A  53      -1.687 -13.670   6.014  1.00 43.02           H   new
ATOM    490  N   ALA A  54      -1.176 -11.037   4.497  1.00 52.34           N
ATOM    491  CA  ALA A  54      -0.303 -10.404   3.500  1.00 44.32           C
ATOM    492  C   ALA A  54      -0.378  -8.871   3.620  1.00 43.23           C
ATOM    493  O   ALA A  54       0.655  -8.189   3.607  1.00 62.20           O
ATOM    494  CB  ALA A  54      -0.698 -10.876   2.087  1.00 12.02           C
ATOM      0  H   ALA A  54      -1.952 -11.552   4.082  1.00 52.34           H   new
ATOM      0  HA  ALA A  54       0.730 -10.701   3.684  1.00 44.32           H   new
ATOM      0  HB1 ALA A  54      -0.048 -10.404   1.351  1.00 12.02           H   new
ATOM      0  HB2 ALA A  54      -0.593 -11.959   2.023  1.00 12.02           H   new
ATOM      0  HB3 ALA A  54      -1.733 -10.599   1.887  1.00 12.02           H   new
ATOM    500  N   ARG A  55      -1.623  -8.355   3.788  1.00 32.22           N
ATOM    501  CA  ARG A  55      -1.895  -6.915   4.005  1.00 44.14           C
ATOM    502  C   ARG A  55      -1.128  -6.391   5.233  1.00 70.01           C
ATOM    503  O   ARG A  55      -0.627  -5.276   5.215  1.00 23.42           O
ATOM    504  CB  ARG A  55      -3.426  -6.662   4.187  1.00 12.23           C
ATOM    505  CG  ARG A  55      -4.291  -6.971   2.940  1.00  5.20           C
ATOM    506  CD  ARG A  55      -5.813  -6.975   3.229  1.00  4.12           C
ATOM    507  NE  ARG A  55      -6.365  -5.621   3.461  1.00 41.33           N
ATOM    508  CZ  ARG A  55      -6.712  -5.100   4.657  1.00 60.42           C
ATOM    509  NH1 ARG A  55      -6.582  -5.791   5.782  1.00 32.10           N
ATOM    510  NH2 ARG A  55      -7.205  -3.872   4.707  1.00 41.52           N
ATOM      0  H   ARG A  55      -2.466  -8.929   3.776  1.00 32.22           H   new
ATOM      0  HA  ARG A  55      -1.552  -6.375   3.122  1.00 44.14           H   new
ATOM      0  HB2 ARG A  55      -3.783  -7.269   5.019  1.00 12.23           H   new
ATOM      0  HB3 ARG A  55      -3.576  -5.619   4.466  1.00 12.23           H   new
ATOM      0  HG2 ARG A  55      -4.078  -6.232   2.168  1.00  5.20           H   new
ATOM      0  HG3 ARG A  55      -4.003  -7.943   2.539  1.00  5.20           H   new
ATOM      0  HD2 ARG A  55      -6.335  -7.434   2.389  1.00  4.12           H   new
ATOM      0  HD3 ARG A  55      -6.009  -7.595   4.104  1.00  4.12           H   new
ATOM      0  HE  ARG A  55      -6.495  -5.027   2.642  1.00 41.33           H   new
ATOM      0 HH11 ARG A  55      -6.212  -6.741   5.757  1.00 32.10           H   new
ATOM      0 HH12 ARG A  55      -6.852  -5.372   6.672  1.00 32.10           H   new
ATOM      0 HH21 ARG A  55      -7.318  -3.333   3.849  1.00 41.52           H   new
ATOM      0 HH22 ARG A  55      -7.471  -3.466   5.604  1.00 41.52           H   new
ATOM    524  N   GLU A  56      -1.016  -7.238   6.272  1.00 14.51           N
ATOM    525  CA  GLU A  56      -0.363  -6.878   7.550  1.00  3.13           C
ATOM    526  C   GLU A  56       1.174  -6.828   7.416  1.00 34.42           C
ATOM    527  O   GLU A  56       1.836  -6.050   8.117  1.00 23.22           O
ATOM    528  CB  GLU A  56      -0.790  -7.870   8.656  1.00 11.30           C
ATOM    529  CG  GLU A  56      -2.322  -7.976   8.829  1.00 43.24           C
ATOM    530  CD  GLU A  56      -2.745  -8.858  10.010  1.00 13.45           C
ATOM    531  OE1 GLU A  56      -2.777 -10.093   9.862  1.00 23.31           O
ATOM    532  OE2 GLU A  56      -3.058  -8.315  11.092  1.00 20.20           O
ATOM      0  H   GLU A  56      -1.375  -8.193   6.252  1.00 14.51           H   new
ATOM      0  HA  GLU A  56      -0.690  -5.876   7.826  1.00  3.13           H   new
ATOM      0  HB2 GLU A  56      -0.389  -8.857   8.423  1.00 11.30           H   new
ATOM      0  HB3 GLU A  56      -0.346  -7.561   9.602  1.00 11.30           H   new
ATOM      0  HG2 GLU A  56      -2.734  -6.976   8.967  1.00 43.24           H   new
ATOM      0  HG3 GLU A  56      -2.756  -8.376   7.913  1.00 43.24           H   new
ATOM    539  N   ASP A  57       1.731  -7.662   6.517  1.00 10.10           N
ATOM    540  CA  ASP A  57       3.173  -7.629   6.179  1.00 64.41           C
ATOM    541  C   ASP A  57       3.493  -6.357   5.366  1.00 71.53           C
ATOM    542  O   ASP A  57       4.536  -5.718   5.555  1.00 60.05           O
ATOM    543  CB  ASP A  57       3.579  -8.896   5.384  1.00 54.42           C
ATOM    544  CG  ASP A  57       5.100  -8.996   5.129  1.00 34.12           C
ATOM    545  OD1 ASP A  57       5.846  -9.280   6.092  1.00 41.15           O
ATOM    546  OD2 ASP A  57       5.557  -8.803   3.974  1.00 34.22           O
ATOM      0  H   ASP A  57       1.204  -8.371   6.008  1.00 10.10           H   new
ATOM      0  HA  ASP A  57       3.748  -7.611   7.105  1.00 64.41           H   new
ATOM      0  HB2 ASP A  57       3.250  -9.780   5.930  1.00 54.42           H   new
ATOM      0  HB3 ASP A  57       3.056  -8.899   4.428  1.00 54.42           H   new
ATOM    551  N   LEU A  58       2.556  -5.999   4.475  1.00  1.24           N
ATOM    552  CA  LEU A  58       2.624  -4.755   3.690  1.00 15.41           C
ATOM    553  C   LEU A  58       2.562  -3.519   4.618  1.00 53.44           C
ATOM    554  O   LEU A  58       3.313  -2.557   4.413  1.00 23.52           O
ATOM    555  CB  LEU A  58       1.485  -4.756   2.637  1.00 34.33           C
ATOM    556  CG  LEU A  58       1.585  -5.906   1.577  1.00 63.20           C
ATOM    557  CD1 LEU A  58       0.274  -6.082   0.787  1.00 43.44           C
ATOM    558  CD2 LEU A  58       2.797  -5.703   0.635  1.00 15.01           C
ATOM      0  H   LEU A  58       1.729  -6.563   4.278  1.00  1.24           H   new
ATOM      0  HA  LEU A  58       3.576  -4.701   3.163  1.00 15.41           H   new
ATOM      0  HB2 LEU A  58       0.529  -4.837   3.154  1.00 34.33           H   new
ATOM      0  HB3 LEU A  58       1.486  -3.798   2.117  1.00 34.33           H   new
ATOM      0  HG  LEU A  58       1.748  -6.833   2.126  1.00 63.20           H   new
ATOM      0 HD11 LEU A  58       0.390  -6.890   0.064  1.00 43.44           H   new
ATOM      0 HD12 LEU A  58      -0.536  -6.325   1.475  1.00 43.44           H   new
ATOM      0 HD13 LEU A  58       0.039  -5.156   0.262  1.00 43.44           H   new
ATOM      0 HD21 LEU A  58       2.837  -6.518  -0.088  1.00 15.01           H   new
ATOM      0 HD22 LEU A  58       2.693  -4.755   0.107  1.00 15.01           H   new
ATOM      0 HD23 LEU A  58       3.716  -5.693   1.221  1.00 15.01           H   new
ATOM    570  N   ILE A  59       1.700  -3.592   5.670  1.00 51.34           N
ATOM    571  CA  ILE A  59       1.648  -2.577   6.748  1.00 14.31           C
ATOM    572  C   ILE A  59       3.026  -2.471   7.415  1.00 72.50           C
ATOM    573  O   ILE A  59       3.565  -1.389   7.520  1.00 22.30           O
ATOM    574  CB  ILE A  59       0.572  -2.905   7.867  1.00 10.01           C
ATOM    575  CG1 ILE A  59      -0.873  -2.891   7.292  1.00 35.43           C
ATOM    576  CG2 ILE A  59       0.679  -1.926   9.074  1.00 71.23           C
ATOM    577  CD1 ILE A  59      -1.952  -3.369   8.256  1.00 11.15           C
ATOM      0  H   ILE A  59       1.029  -4.351   5.790  1.00 51.34           H   new
ATOM      0  HA  ILE A  59       1.357  -1.638   6.277  1.00 14.31           H   new
ATOM      0  HB  ILE A  59       0.789  -3.911   8.225  1.00 10.01           H   new
ATOM      0 HG12 ILE A  59      -1.113  -1.876   6.976  1.00 35.43           H   new
ATOM      0 HG13 ILE A  59      -0.900  -3.517   6.400  1.00 35.43           H   new
ATOM      0 HG21 ILE A  59      -0.074  -2.183   9.819  1.00 71.23           H   new
ATOM      0 HG22 ILE A  59       1.671  -2.004   9.519  1.00 71.23           H   new
ATOM      0 HG23 ILE A  59       0.515  -0.905   8.730  1.00 71.23           H   new
ATOM      0 HD11 ILE A  59      -2.924  -3.323   7.766  1.00 11.15           H   new
ATOM      0 HD12 ILE A  59      -1.744  -4.397   8.554  1.00 11.15           H   new
ATOM      0 HD13 ILE A  59      -1.960  -2.730   9.139  1.00 11.15           H   new
ATOM    589  N   LYS A  60       3.568  -3.637   7.818  1.00 24.11           N
ATOM    590  CA  LYS A  60       4.857  -3.765   8.533  1.00 44.33           C
ATOM    591  C   LYS A  60       5.992  -3.000   7.805  1.00 55.41           C
ATOM    592  O   LYS A  60       6.541  -2.021   8.343  1.00 33.41           O
ATOM    593  CB  LYS A  60       5.189  -5.282   8.636  1.00  3.53           C
ATOM    594  CG  LYS A  60       6.458  -5.669   9.428  1.00 62.40           C
ATOM    595  CD  LYS A  60       6.852  -7.157   9.212  1.00 30.44           C
ATOM    596  CE  LYS A  60       5.709  -8.153   9.506  1.00  1.14           C
ATOM    597  NZ  LYS A  60       6.075  -9.549   9.129  1.00 44.41           N
ATOM      0  H   LYS A  60       3.114  -4.535   7.653  1.00 24.11           H   new
ATOM      0  HA  LYS A  60       4.774  -3.323   9.526  1.00 44.33           H   new
ATOM      0  HB2 LYS A  60       4.337  -5.785   9.094  1.00  3.53           H   new
ATOM      0  HB3 LYS A  60       5.287  -5.677   7.625  1.00  3.53           H   new
ATOM      0  HG2 LYS A  60       7.285  -5.028   9.123  1.00 62.40           H   new
ATOM      0  HG3 LYS A  60       6.291  -5.489  10.490  1.00 62.40           H   new
ATOM      0  HD2 LYS A  60       7.181  -7.290   8.182  1.00 30.44           H   new
ATOM      0  HD3 LYS A  60       7.702  -7.395   9.852  1.00 30.44           H   new
ATOM      0  HE2 LYS A  60       5.460  -8.117  10.567  1.00  1.14           H   new
ATOM      0  HE3 LYS A  60       4.816  -7.852   8.959  1.00  1.14           H   new
ATOM      0  HZ1 LYS A  60       5.394 -10.212   9.551  1.00 44.41           H   new
ATOM      0  HZ2 LYS A  60       6.056  -9.645   8.094  1.00 44.41           H   new
ATOM      0  HZ3 LYS A  60       7.030  -9.764   9.479  1.00 44.41           H   new
ATOM    611  N   LYS A  61       6.246  -3.393   6.539  1.00 13.34           N
ATOM    612  CA  LYS A  61       7.354  -2.835   5.732  1.00 72.31           C
ATOM    613  C   LYS A  61       7.109  -1.350   5.385  1.00 14.10           C
ATOM    614  O   LYS A  61       8.019  -0.511   5.526  1.00 44.13           O
ATOM    615  CB  LYS A  61       7.587  -3.679   4.435  1.00 13.21           C
ATOM    616  CG  LYS A  61       8.379  -5.003   4.634  1.00 62.41           C
ATOM    617  CD  LYS A  61       7.671  -6.011   5.561  1.00  0.03           C
ATOM    618  CE  LYS A  61       8.484  -7.292   5.827  1.00 72.22           C
ATOM    619  NZ  LYS A  61       8.467  -8.215   4.668  1.00 53.31           N
ATOM      0  H   LYS A  61       5.695  -4.099   6.050  1.00 13.34           H   new
ATOM      0  HA  LYS A  61       8.258  -2.889   6.338  1.00 72.31           H   new
ATOM      0  HB2 LYS A  61       6.617  -3.918   3.998  1.00 13.21           H   new
ATOM      0  HB3 LYS A  61       8.120  -3.062   3.711  1.00 13.21           H   new
ATOM      0  HG2 LYS A  61       8.543  -5.469   3.662  1.00 62.41           H   new
ATOM      0  HG3 LYS A  61       9.361  -4.771   5.046  1.00 62.41           H   new
ATOM      0  HD2 LYS A  61       7.455  -5.525   6.513  1.00  0.03           H   new
ATOM      0  HD3 LYS A  61       6.713  -6.286   5.119  1.00  0.03           H   new
ATOM      0  HE2 LYS A  61       9.514  -7.025   6.061  1.00 72.22           H   new
ATOM      0  HE3 LYS A  61       8.080  -7.802   6.702  1.00 72.22           H   new
ATOM      0  HZ1 LYS A  61       8.532  -9.197   5.005  1.00 53.31           H   new
ATOM      0  HZ2 LYS A  61       7.582  -8.089   4.137  1.00 53.31           H   new
ATOM      0  HZ3 LYS A  61       9.275  -8.008   4.047  1.00 53.31           H   new
ATOM    633  N   ALA A  62       5.873  -1.025   4.958  1.00 74.04           N
ATOM    634  CA  ALA A  62       5.522   0.349   4.553  1.00 12.45           C
ATOM    635  C   ALA A  62       5.550   1.322   5.742  1.00 20.42           C
ATOM    636  O   ALA A  62       5.923   2.471   5.577  1.00 34.23           O
ATOM    637  CB  ALA A  62       4.161   0.371   3.881  1.00 30.32           C
ATOM      0  H   ALA A  62       5.105  -1.692   4.885  1.00 74.04           H   new
ATOM      0  HA  ALA A  62       6.276   0.683   3.840  1.00 12.45           H   new
ATOM      0  HB1 ALA A  62       3.916   1.392   3.588  1.00 30.32           H   new
ATOM      0  HB2 ALA A  62       4.182  -0.265   2.996  1.00 30.32           H   new
ATOM      0  HB3 ALA A  62       3.406   0.002   4.576  1.00 30.32           H   new
ATOM    643  N   ASP A  63       5.181   0.831   6.938  1.00 13.42           N
ATOM    644  CA  ASP A  63       5.168   1.642   8.172  1.00 61.31           C
ATOM    645  C   ASP A  63       6.610   1.943   8.595  1.00 24.11           C
ATOM    646  O   ASP A  63       6.935   3.085   8.940  1.00 23.43           O
ATOM    647  CB  ASP A  63       4.401   0.924   9.314  1.00 23.21           C
ATOM    648  CG  ASP A  63       4.250   1.784  10.583  1.00 14.34           C
ATOM    649  OD1 ASP A  63       3.308   2.605  10.652  1.00 14.22           O
ATOM    650  OD2 ASP A  63       5.066   1.645  11.523  1.00 33.40           O
ATOM      0  H   ASP A  63       4.884  -0.135   7.078  1.00 13.42           H   new
ATOM      0  HA  ASP A  63       4.646   2.577   7.970  1.00 61.31           H   new
ATOM      0  HB2 ASP A  63       3.411   0.641   8.955  1.00 23.21           H   new
ATOM      0  HB3 ASP A  63       4.923   0.002   9.569  1.00 23.21           H   new
ATOM    655  N   GLU A  64       7.479   0.908   8.515  1.00 44.43           N
ATOM    656  CA  GLU A  64       8.933   1.068   8.749  1.00 50.54           C
ATOM    657  C   GLU A  64       9.558   2.089   7.768  1.00 35.42           C
ATOM    658  O   GLU A  64      10.495   2.811   8.133  1.00  2.25           O
ATOM    659  CB  GLU A  64       9.655  -0.295   8.645  1.00 25.41           C
ATOM    660  CG  GLU A  64       9.267  -1.294   9.748  1.00 32.52           C
ATOM    661  CD  GLU A  64       9.971  -2.647   9.601  1.00 52.01           C
ATOM    662  OE1 GLU A  64      11.102  -2.795  10.111  1.00 64.34           O
ATOM    663  OE2 GLU A  64       9.403  -3.568   8.967  1.00  0.10           O
ATOM      0  H   GLU A  64       7.198  -0.046   8.290  1.00 44.43           H   new
ATOM      0  HA  GLU A  64       9.063   1.456   9.759  1.00 50.54           H   new
ATOM      0  HB2 GLU A  64       9.435  -0.738   7.674  1.00 25.41           H   new
ATOM      0  HB3 GLU A  64      10.732  -0.128   8.682  1.00 25.41           H   new
ATOM      0  HG2 GLU A  64       9.511  -0.867  10.721  1.00 32.52           H   new
ATOM      0  HG3 GLU A  64       8.188  -1.447   9.729  1.00 32.52           H   new
ATOM    670  N   LYS A  65       9.042   2.128   6.523  1.00 52.31           N
ATOM    671  CA  LYS A  65       9.440   3.145   5.519  1.00 13.23           C
ATOM    672  C   LYS A  65       8.718   4.496   5.734  1.00  4.34           C
ATOM    673  O   LYS A  65       9.155   5.513   5.199  1.00 30.34           O
ATOM    674  CB  LYS A  65       9.188   2.614   4.079  1.00  2.14           C
ATOM    675  CG  LYS A  65      10.181   1.518   3.634  1.00 74.43           C
ATOM    676  CD  LYS A  65       9.882   0.980   2.217  1.00 53.13           C
ATOM    677  CE  LYS A  65      10.982   0.037   1.695  1.00 31.03           C
ATOM    678  NZ  LYS A  65      11.221  -1.119   2.602  1.00 13.44           N
ATOM      0  H   LYS A  65       8.345   1.465   6.184  1.00 52.31           H   new
ATOM      0  HA  LYS A  65      10.507   3.328   5.650  1.00 13.23           H   new
ATOM      0  HB2 LYS A  65       8.174   2.218   4.021  1.00  2.14           H   new
ATOM      0  HB3 LYS A  65       9.245   3.448   3.379  1.00  2.14           H   new
ATOM      0  HG2 LYS A  65      11.194   1.920   3.659  1.00 74.43           H   new
ATOM      0  HG3 LYS A  65      10.148   0.693   4.346  1.00 74.43           H   new
ATOM      0  HD2 LYS A  65       8.930   0.450   2.228  1.00 53.13           H   new
ATOM      0  HD3 LYS A  65       9.772   1.819   1.530  1.00 53.13           H   new
ATOM      0  HE2 LYS A  65      10.702  -0.332   0.708  1.00 31.03           H   new
ATOM      0  HE3 LYS A  65      11.909   0.597   1.574  1.00 31.03           H   new
ATOM      0  HZ1 LYS A  65      11.908  -1.766   2.166  1.00 13.44           H   new
ATOM      0  HZ2 LYS A  65      11.596  -0.776   3.510  1.00 13.44           H   new
ATOM      0  HZ3 LYS A  65      10.326  -1.623   2.765  1.00 13.44           H   new
ATOM    692  N   GLY A  66       7.631   4.502   6.526  1.00 14.15           N
ATOM    693  CA  GLY A  66       6.848   5.721   6.786  1.00 11.12           C
ATOM    694  C   GLY A  66       5.747   5.994   5.756  1.00 20.21           C
ATOM    695  O   GLY A  66       5.072   7.023   5.842  1.00 54.54           O
ATOM      0  H   GLY A  66       7.274   3.671   6.999  1.00 14.15           H   new
ATOM      0  HA2 GLY A  66       6.394   5.644   7.774  1.00 11.12           H   new
ATOM      0  HA3 GLY A  66       7.525   6.575   6.812  1.00 11.12           H   new
ATOM    699  N   ALA A  67       5.571   5.072   4.784  1.00 75.42           N
ATOM    700  CA  ALA A  67       4.545   5.169   3.723  1.00 52.01           C
ATOM    701  C   ALA A  67       3.122   5.249   4.317  1.00 54.32           C
ATOM    702  O   ALA A  67       2.729   4.376   5.098  1.00 53.03           O
ATOM    703  CB  ALA A  67       4.669   3.985   2.753  1.00 34.14           C
ATOM      0  H   ALA A  67       6.144   4.231   4.714  1.00 75.42           H   new
ATOM      0  HA  ALA A  67       4.718   6.092   3.170  1.00 52.01           H   new
ATOM      0  HB1 ALA A  67       3.908   4.069   1.977  1.00 34.14           H   new
ATOM      0  HB2 ALA A  67       5.658   3.993   2.294  1.00 34.14           H   new
ATOM      0  HB3 ALA A  67       4.530   3.052   3.298  1.00 34.14           H   new
ATOM    709  N   ASP A  68       2.364   6.299   3.924  1.00 62.45           N
ATOM    710  CA  ASP A  68       1.034   6.602   4.490  1.00  4.23           C
ATOM    711  C   ASP A  68       0.011   5.547   4.085  1.00 30.23           C
ATOM    712  O   ASP A  68      -0.747   5.070   4.924  1.00 31.31           O
ATOM    713  CB  ASP A  68       0.530   8.010   4.056  1.00 51.35           C
ATOM    714  CG  ASP A  68       1.243   9.156   4.791  1.00 72.33           C
ATOM    715  OD1 ASP A  68       0.871   9.450   5.947  1.00 31.23           O
ATOM    716  OD2 ASP A  68       2.159   9.772   4.218  1.00 23.24           O
ATOM      0  H   ASP A  68       2.660   6.959   3.205  1.00 62.45           H   new
ATOM      0  HA  ASP A  68       1.144   6.594   5.574  1.00  4.23           H   new
ATOM      0  HB2 ASP A  68       0.677   8.127   2.982  1.00 51.35           H   new
ATOM      0  HB3 ASP A  68      -0.542   8.079   4.240  1.00 51.35           H   new
ATOM    721  N   VAL A  69      -0.008   5.192   2.790  1.00 64.11           N
ATOM    722  CA  VAL A  69      -0.997   4.242   2.227  1.00 61.31           C
ATOM    723  C   VAL A  69      -0.294   3.162   1.390  1.00 63.24           C
ATOM    724  O   VAL A  69       0.633   3.456   0.636  1.00 60.14           O
ATOM    725  CB  VAL A  69      -2.104   4.981   1.368  1.00 24.23           C
ATOM    726  CG1 VAL A  69      -3.024   3.991   0.616  1.00 41.34           C
ATOM    727  CG2 VAL A  69      -2.953   5.926   2.252  1.00 60.41           C
ATOM      0  H   VAL A  69       0.655   5.550   2.103  1.00 64.11           H   new
ATOM      0  HA  VAL A  69      -1.502   3.762   3.066  1.00 61.31           H   new
ATOM      0  HB  VAL A  69      -1.574   5.572   0.621  1.00 24.23           H   new
ATOM      0 HG11 VAL A  69      -3.765   4.547   0.042  1.00 41.34           H   new
ATOM      0 HG12 VAL A  69      -2.426   3.380  -0.060  1.00 41.34           H   new
ATOM      0 HG13 VAL A  69      -3.530   3.347   1.335  1.00 41.34           H   new
ATOM      0 HG21 VAL A  69      -3.705   6.421   1.638  1.00 60.41           H   new
ATOM      0 HG22 VAL A  69      -3.446   5.348   3.034  1.00 60.41           H   new
ATOM      0 HG23 VAL A  69      -2.307   6.676   2.708  1.00 60.41           H   new
ATOM    737  N   VAL A  70      -0.739   1.907   1.562  1.00 24.03           N
ATOM    738  CA  VAL A  70      -0.271   0.748   0.785  1.00 64.40           C
ATOM    739  C   VAL A  70      -1.474   0.232  -0.033  1.00 53.24           C
ATOM    740  O   VAL A  70      -2.510  -0.104   0.548  1.00 14.45           O
ATOM    741  CB  VAL A  70       0.291  -0.404   1.716  1.00 43.21           C
ATOM    742  CG1 VAL A  70       1.358  -1.257   0.993  1.00 62.42           C
ATOM    743  CG2 VAL A  70       0.825   0.152   3.055  1.00 72.45           C
ATOM      0  H   VAL A  70      -1.446   1.665   2.256  1.00 24.03           H   new
ATOM      0  HA  VAL A  70       0.551   1.051   0.137  1.00 64.40           H   new
ATOM      0  HB  VAL A  70      -0.546  -1.062   1.948  1.00 43.21           H   new
ATOM      0 HG11 VAL A  70       1.718  -2.036   1.665  1.00 62.42           H   new
ATOM      0 HG12 VAL A  70       0.918  -1.717   0.108  1.00 62.42           H   new
ATOM      0 HG13 VAL A  70       2.192  -0.621   0.695  1.00 62.42           H   new
ATOM      0 HG21 VAL A  70       1.202  -0.669   3.665  1.00 72.45           H   new
ATOM      0 HG22 VAL A  70       1.632   0.859   2.860  1.00 72.45           H   new
ATOM      0 HG23 VAL A  70       0.019   0.659   3.586  1.00 72.45           H   new
ATOM    753  N   VAL A  71      -1.350   0.203  -1.368  1.00 74.13           N
ATOM    754  CA  VAL A  71      -2.469  -0.109  -2.275  1.00 54.40           C
ATOM    755  C   VAL A  71      -2.238  -1.432  -3.018  1.00 31.51           C
ATOM    756  O   VAL A  71      -1.290  -1.546  -3.805  1.00 41.34           O
ATOM    757  CB  VAL A  71      -2.698   1.059  -3.295  1.00 10.45           C
ATOM    758  CG1 VAL A  71      -3.742   0.694  -4.368  1.00 71.13           C
ATOM    759  CG2 VAL A  71      -3.100   2.349  -2.547  1.00 15.13           C
ATOM      0  H   VAL A  71      -0.472   0.395  -1.851  1.00 74.13           H   new
ATOM      0  HA  VAL A  71      -3.366  -0.220  -1.665  1.00 54.40           H   new
ATOM      0  HB  VAL A  71      -1.757   1.233  -3.817  1.00 10.45           H   new
ATOM      0 HG11 VAL A  71      -3.868   1.533  -5.053  1.00 71.13           H   new
ATOM      0 HG12 VAL A  71      -3.402  -0.180  -4.924  1.00 71.13           H   new
ATOM      0 HG13 VAL A  71      -4.695   0.471  -3.888  1.00 71.13           H   new
ATOM      0 HG21 VAL A  71      -3.256   3.153  -3.266  1.00 15.13           H   new
ATOM      0 HG22 VAL A  71      -4.021   2.175  -1.991  1.00 15.13           H   new
ATOM      0 HG23 VAL A  71      -2.306   2.631  -1.855  1.00 15.13           H   new
ATOM    769  N   LEU A  72      -3.131  -2.409  -2.749  1.00 20.33           N
ATOM    770  CA  LEU A  72      -3.125  -3.748  -3.354  1.00 44.41           C
ATOM    771  C   LEU A  72      -3.255  -3.660  -4.890  1.00 11.02           C
ATOM    772  O   LEU A  72      -4.354  -3.453  -5.424  1.00 12.23           O
ATOM    773  CB  LEU A  72      -4.281  -4.607  -2.746  1.00 74.44           C
ATOM    774  CG  LEU A  72      -4.274  -4.788  -1.190  1.00 71.12           C
ATOM    775  CD1 LEU A  72      -5.519  -5.570  -0.696  1.00 54.33           C
ATOM    776  CD2 LEU A  72      -2.969  -5.458  -0.710  1.00 41.22           C
ATOM      0  H   LEU A  72      -3.895  -2.279  -2.086  1.00 20.33           H   new
ATOM      0  HA  LEU A  72      -2.173  -4.230  -3.131  1.00 44.41           H   new
ATOM      0  HB2 LEU A  72      -5.230  -4.153  -3.032  1.00 74.44           H   new
ATOM      0  HB3 LEU A  72      -4.249  -5.595  -3.204  1.00 74.44           H   new
ATOM      0  HG  LEU A  72      -4.320  -3.792  -0.750  1.00 71.12           H   new
ATOM      0 HD11 LEU A  72      -5.477  -5.674   0.388  1.00 54.33           H   new
ATOM      0 HD12 LEU A  72      -6.423  -5.028  -0.973  1.00 54.33           H   new
ATOM      0 HD13 LEU A  72      -5.534  -6.558  -1.155  1.00 54.33           H   new
ATOM      0 HD21 LEU A  72      -2.995  -5.570   0.374  1.00 41.22           H   new
ATOM      0 HD22 LEU A  72      -2.872  -6.440  -1.174  1.00 41.22           H   new
ATOM      0 HD23 LEU A  72      -2.117  -4.838  -0.991  1.00 41.22           H   new
ATOM    788  N   THR A  73      -2.101  -3.735  -5.577  1.00 13.44           N
ATOM    789  CA  THR A  73      -2.042  -3.839  -7.045  1.00  5.45           C
ATOM    790  C   THR A  73      -2.309  -5.288  -7.470  1.00 60.25           C
ATOM    791  O   THR A  73      -2.898  -5.540  -8.527  1.00 65.44           O
ATOM    792  CB  THR A  73      -0.676  -3.339  -7.614  1.00 60.41           C
ATOM    793  OG1 THR A  73      -0.698  -3.353  -9.050  1.00 61.13           O
ATOM    794  CG2 THR A  73       0.535  -4.140  -7.102  1.00 34.13           C
ATOM      0  H   THR A  73      -1.184  -3.725  -5.130  1.00 13.44           H   new
ATOM      0  HA  THR A  73      -2.814  -3.191  -7.460  1.00  5.45           H   new
ATOM      0  HB  THR A  73      -0.552  -2.319  -7.250  1.00 60.41           H   new
ATOM      0  HG1 THR A  73       0.163  -3.036  -9.393  1.00 61.13           H   new
ATOM      0 HG21 THR A  73       1.449  -3.737  -7.539  1.00 34.13           H   new
ATOM      0 HG22 THR A  73       0.588  -4.065  -6.016  1.00 34.13           H   new
ATOM      0 HG23 THR A  73       0.427  -5.186  -7.388  1.00 34.13           H   new
ATOM    939  N   GLY A  83       0.965 -11.745  -3.497  1.00 14.43           N
ATOM    940  CA  GLY A  83       0.867 -10.601  -2.584  1.00 22.34           C
ATOM    941  C   GLY A  83       1.838  -9.478  -2.951  1.00 22.12           C
ATOM    942  O   GLY A  83       3.056  -9.643  -2.819  1.00 64.12           O
ATOM      0  HA2 GLY A  83      -0.152 -10.215  -2.597  1.00 22.34           H   new
ATOM      0  HA3 GLY A  83       1.069 -10.934  -1.566  1.00 22.34           H   new
ATOM    946  N   THR A  84       1.293  -8.344  -3.438  1.00 51.34           N
ATOM    947  CA  THR A  84       2.071  -7.140  -3.811  1.00 33.03           C
ATOM    948  C   THR A  84       1.174  -5.892  -3.697  1.00 23.21           C
ATOM    949  O   THR A  84      -0.005  -5.923  -4.083  1.00 31.01           O
ATOM    950  CB  THR A  84       2.647  -7.243  -5.269  1.00  3.42           C
ATOM    951  OG1 THR A  84       3.466  -8.409  -5.389  1.00 43.32           O
ATOM    952  CG2 THR A  84       3.492  -6.025  -5.684  1.00 41.44           C
ATOM      0  H   THR A  84       0.290  -8.235  -3.586  1.00 51.34           H   new
ATOM      0  HA  THR A  84       2.915  -7.062  -3.125  1.00 33.03           H   new
ATOM      0  HB  THR A  84       1.780  -7.290  -5.928  1.00  3.42           H   new
ATOM      0  HG1 THR A  84       4.389  -8.186  -5.148  1.00 43.32           H   new
ATOM      0 HG21 THR A  84       3.857  -6.165  -6.702  1.00 41.44           H   new
ATOM      0 HG22 THR A  84       2.879  -5.125  -5.639  1.00 41.44           H   new
ATOM      0 HG23 THR A  84       4.339  -5.922  -5.006  1.00 41.44           H   new
ATOM    960  N   ALA A  85       1.749  -4.801  -3.172  1.00 23.14           N
ATOM    961  CA  ALA A  85       1.062  -3.521  -3.016  1.00 40.03           C
ATOM    962  C   ALA A  85       2.059  -2.364  -3.140  1.00 44.22           C
ATOM    963  O   ALA A  85       3.187  -2.451  -2.642  1.00 40.12           O
ATOM    964  CB  ALA A  85       0.330  -3.470  -1.671  1.00  2.40           C
ATOM      0  H   ALA A  85       2.714  -4.787  -2.842  1.00 23.14           H   new
ATOM      0  HA  ALA A  85       0.322  -3.420  -3.810  1.00 40.03           H   new
ATOM      0  HB1 ALA A  85      -0.177  -2.511  -1.569  1.00  2.40           H   new
ATOM      0  HB2 ALA A  85      -0.404  -4.275  -1.625  1.00  2.40           H   new
ATOM      0  HB3 ALA A  85       1.049  -3.588  -0.861  1.00  2.40           H   new
ATOM    970  N   ASP A  86       1.631  -1.281  -3.806  1.00 25.11           N
ATOM    971  CA  ASP A  86       2.464  -0.078  -3.998  1.00 50.30           C
ATOM    972  C   ASP A  86       2.448   0.766  -2.719  1.00 31.25           C
ATOM    973  O   ASP A  86       1.457   0.765  -1.990  1.00 43.12           O
ATOM    974  CB  ASP A  86       1.948   0.781  -5.178  1.00 72.22           C
ATOM    975  CG  ASP A  86       1.636  -0.027  -6.437  1.00 62.11           C
ATOM    976  OD1 ASP A  86       0.513  -0.541  -6.548  1.00 74.31           O
ATOM    977  OD2 ASP A  86       2.494  -0.142  -7.324  1.00 52.43           O
ATOM      0  H   ASP A  86       0.704  -1.211  -4.225  1.00 25.11           H   new
ATOM      0  HA  ASP A  86       3.480  -0.403  -4.224  1.00 50.30           H   new
ATOM      0  HB2 ASP A  86       1.048   1.310  -4.864  1.00 72.22           H   new
ATOM      0  HB3 ASP A  86       2.695   1.538  -5.419  1.00 72.22           H   new
ATOM    982  N   ILE A  87       3.536   1.498  -2.459  1.00 45.14           N
ATOM    983  CA  ILE A  87       3.645   2.366  -1.270  1.00 72.23           C
ATOM    984  C   ILE A  87       3.533   3.851  -1.672  1.00 35.41           C
ATOM    985  O   ILE A  87       4.144   4.308  -2.662  1.00  0.33           O
ATOM    986  CB  ILE A  87       4.959   2.079  -0.446  1.00 31.32           C
ATOM    987  CG1 ILE A  87       6.225   2.108  -1.355  1.00 54.50           C
ATOM    988  CG2 ILE A  87       4.837   0.730   0.297  1.00  2.33           C
ATOM    989  CD1 ILE A  87       7.550   1.895  -0.640  1.00 11.24           C
ATOM      0  H   ILE A  87       4.362   1.510  -3.057  1.00 45.14           H   new
ATOM      0  HA  ILE A  87       2.810   2.132  -0.609  1.00 72.23           H   new
ATOM      0  HB  ILE A  87       5.077   2.873   0.291  1.00 31.32           H   new
ATOM      0 HG12 ILE A  87       6.118   1.340  -2.121  1.00 54.50           H   new
ATOM      0 HG13 ILE A  87       6.260   3.069  -1.869  1.00 54.50           H   new
ATOM      0 HG21 ILE A  87       5.750   0.542   0.862  1.00  2.33           H   new
ATOM      0 HG22 ILE A  87       3.988   0.766   0.980  1.00  2.33           H   new
ATOM      0 HG23 ILE A  87       4.687  -0.071  -0.426  1.00  2.33           H   new
ATOM      0 HD11 ILE A  87       8.364   1.934  -1.364  1.00 11.24           H   new
ATOM      0 HD12 ILE A  87       7.690   2.677   0.107  1.00 11.24           H   new
ATOM      0 HD13 ILE A  87       7.547   0.921  -0.150  1.00 11.24           H   new
ATOM   1001  N   TYR A  88       2.730   4.591  -0.884  1.00  1.20           N
ATOM   1002  CA  TYR A  88       2.321   5.971  -1.178  1.00 14.40           C
ATOM   1003  C   TYR A  88       2.466   6.855   0.058  1.00 13.41           C
ATOM   1004  O   TYR A  88       2.293   6.395   1.199  1.00 42.05           O
ATOM   1005  CB  TYR A  88       0.841   6.023  -1.652  1.00 42.40           C
ATOM   1006  CG  TYR A  88       0.579   5.307  -2.978  1.00 10.43           C
ATOM   1007  CD1 TYR A  88       0.818   5.940  -4.194  1.00 54.04           C
ATOM   1008  CD2 TYR A  88       0.111   3.997  -3.016  1.00 52.22           C
ATOM   1009  CE1 TYR A  88       0.599   5.295  -5.393  1.00  3.31           C
ATOM   1010  CE2 TYR A  88      -0.110   3.357  -4.213  1.00  3.41           C
ATOM   1011  CZ  TYR A  88       0.136   4.003  -5.398  1.00 54.04           C
ATOM   1012  OH  TYR A  88      -0.091   3.355  -6.594  1.00 53.05           O
ATOM      0  H   TYR A  88       2.342   4.237  -0.010  1.00  1.20           H   new
ATOM      0  HA  TYR A  88       2.972   6.339  -1.971  1.00 14.40           H   new
ATOM      0  HB2 TYR A  88       0.209   5.580  -0.882  1.00 42.40           H   new
ATOM      0  HB3 TYR A  88       0.540   7.066  -1.750  1.00 42.40           H   new
ATOM      0  HD1 TYR A  88       1.182   6.957  -4.199  1.00 54.04           H   new
ATOM      0  HD2 TYR A  88      -0.082   3.475  -2.091  1.00 52.22           H   new
ATOM      0  HE1 TYR A  88       0.791   5.805  -6.325  1.00  3.31           H   new
ATOM      0  HE2 TYR A  88      -0.479   2.342  -4.220  1.00  3.41           H   new
ATOM      0  HH  TYR A  88      -0.416   2.447  -6.418  1.00 53.05           H   new
ATOM   1022  N   LYS A  89       2.760   8.135  -0.199  1.00 13.05           N
ATOM   1023  CA  LYS A  89       2.776   9.192   0.825  1.00 50.20           C
ATOM   1024  C   LYS A  89       1.641  10.174   0.545  1.00  0.34           C
ATOM   1025  O   LYS A  89       1.395  10.514  -0.613  1.00  5.24           O
ATOM   1026  CB  LYS A  89       4.134   9.936   0.813  1.00 25.23           C
ATOM   1027  CG  LYS A  89       5.343   9.061   1.178  1.00 43.04           C
ATOM   1028  CD  LYS A  89       5.257   8.477   2.605  1.00 24.24           C
ATOM   1029  CE  LYS A  89       5.454   9.522   3.711  1.00 11.34           C
ATOM   1030  NZ  LYS A  89       6.805  10.121   3.658  1.00 30.30           N
ATOM      0  H   LYS A  89       2.996   8.472  -1.132  1.00 13.05           H   new
ATOM      0  HA  LYS A  89       2.640   8.742   1.809  1.00 50.20           H   new
ATOM      0  HB2 LYS A  89       4.294  10.359  -0.179  1.00 25.23           H   new
ATOM      0  HB3 LYS A  89       4.082  10.772   1.511  1.00 25.23           H   new
ATOM      0  HG2 LYS A  89       5.422   8.244   0.461  1.00 43.04           H   new
ATOM      0  HG3 LYS A  89       6.254   9.653   1.088  1.00 43.04           H   new
ATOM      0  HD2 LYS A  89       4.285   8.001   2.736  1.00 24.24           H   new
ATOM      0  HD3 LYS A  89       6.011   7.697   2.715  1.00 24.24           H   new
ATOM      0  HE2 LYS A  89       4.703  10.306   3.610  1.00 11.34           H   new
ATOM      0  HE3 LYS A  89       5.300   9.056   4.684  1.00 11.34           H   new
ATOM      0  HZ1 LYS A  89       6.978  10.665   4.527  1.00 30.30           H   new
ATOM      0  HZ2 LYS A  89       7.516   9.367   3.574  1.00 30.30           H   new
ATOM      0  HZ3 LYS A  89       6.872  10.753   2.835  1.00 30.30           H   new
ATOM   1044  N   LYS A  90       0.951  10.622   1.600  1.00  1.54           N
ATOM   1045  CA  LYS A  90      -0.135  11.592   1.468  1.00 44.41           C
ATOM   1046  C   LYS A  90       0.460  12.978   1.213  1.00 53.50           C
ATOM   1047  O   LYS A  90       1.169  13.518   2.073  1.00 12.21           O
ATOM   1048  CB  LYS A  90      -1.053  11.595   2.714  1.00 62.21           C
ATOM   1049  CG  LYS A  90      -2.314  12.475   2.542  1.00 15.03           C
ATOM   1050  CD  LYS A  90      -3.268  12.434   3.757  1.00 53.45           C
ATOM   1051  CE  LYS A  90      -4.454  13.408   3.602  1.00 32.41           C
ATOM   1052  NZ  LYS A  90      -5.207  13.193   2.331  1.00 13.14           N
ATOM      0  H   LYS A  90       1.129  10.324   2.559  1.00  1.54           H   new
ATOM      0  HA  LYS A  90      -0.760  11.308   0.622  1.00 44.41           H   new
ATOM      0  HB2 LYS A  90      -1.359  10.572   2.934  1.00 62.21           H   new
ATOM      0  HB3 LYS A  90      -0.485  11.950   3.574  1.00 62.21           H   new
ATOM      0  HG2 LYS A  90      -2.006  13.506   2.367  1.00 15.03           H   new
ATOM      0  HG3 LYS A  90      -2.856  12.149   1.654  1.00 15.03           H   new
ATOM      0  HD2 LYS A  90      -3.647  11.420   3.884  1.00 53.45           H   new
ATOM      0  HD3 LYS A  90      -2.712  12.682   4.661  1.00 53.45           H   new
ATOM      0  HE2 LYS A  90      -5.132  13.288   4.447  1.00 32.41           H   new
ATOM      0  HE3 LYS A  90      -4.085  14.433   3.633  1.00 32.41           H   new
ATOM      0  HZ1 LYS A  90      -6.228  13.256   2.518  1.00 13.14           H   new
ATOM      0  HZ2 LYS A  90      -4.936  13.921   1.640  1.00 13.14           H   new
ATOM      0  HZ3 LYS A  90      -4.982  12.252   1.949  1.00 13.14           H   new
ATOM   1066  N   LYS A  91       0.219  13.490  -0.006  1.00 61.41           N
ATOM   1067  CA  LYS A  91       0.680  14.806  -0.460  1.00 20.43           C
ATOM   1068  C   LYS A  91       0.048  15.919   0.396  1.00 50.41           C
ATOM   1069  O   LYS A  91      -1.012  16.460   0.061  1.00 33.13           O
ATOM   1070  CB  LYS A  91       0.348  14.998  -1.971  1.00 14.13           C
ATOM   1071  CG  LYS A  91       0.926  13.899  -2.892  1.00 51.30           C
ATOM   1072  CD  LYS A  91       0.498  14.022  -4.386  1.00 12.14           C
ATOM   1073  CE  LYS A  91       1.200  15.153  -5.165  1.00 40.02           C
ATOM   1074  NZ  LYS A  91       0.807  16.513  -4.712  1.00 30.42           N
ATOM      0  H   LYS A  91      -0.313  12.987  -0.716  1.00 61.41           H   new
ATOM      0  HA  LYS A  91       1.762  14.865  -0.340  1.00 20.43           H   new
ATOM      0  HB2 LYS A  91      -0.735  15.026  -2.093  1.00 14.13           H   new
ATOM      0  HB3 LYS A  91       0.730  15.966  -2.295  1.00 14.13           H   new
ATOM      0  HG2 LYS A  91       2.014  13.929  -2.835  1.00 51.30           H   new
ATOM      0  HG3 LYS A  91       0.613  12.925  -2.516  1.00 51.30           H   new
ATOM      0  HD2 LYS A  91       0.699  13.075  -4.887  1.00 12.14           H   new
ATOM      0  HD3 LYS A  91      -0.579  14.183  -4.429  1.00 12.14           H   new
ATOM      0  HE2 LYS A  91       2.279  15.041  -5.060  1.00 40.02           H   new
ATOM      0  HE3 LYS A  91       0.970  15.051  -6.226  1.00 40.02           H   new
ATOM      0  HZ1 LYS A  91       0.719  17.141  -5.536  1.00 30.42           H   new
ATOM      0  HZ2 LYS A  91      -0.106  16.463  -4.216  1.00 30.42           H   new
ATOM      0  HZ3 LYS A  91       1.532  16.887  -4.067  1.00 30.42           H   new