USER  MOD reduce.3.24.130724 H: found=0, std=0, add=614, rem=0, adj=25
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 Single : A  25 MET CE  :methyl -171:sc=-0.00793   (180deg=-0.115)
USER  MOD Single : A  26 LYS NZ  :NH3+    166:sc= -0.0174   (180deg=-0.187)
USER  MOD Single : A  27 LYS NZ  :NH3+   -111:sc=   0.225   (180deg=-0.535)
USER  MOD Single : A  28 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  32 LYS NZ  :NH3+   -175:sc=   0.123   (180deg=0.102)
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   39:sc=  0.0479
USER  MOD Single : A  39 LYS NZ  :NH3+    137:sc=       1   (180deg=-0.421)
USER  MOD Single : A  42 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  44 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  45 THR OG1 :   rot   -8:sc=   0.513
USER  MOD Single : A  46 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  49 MET CE  :methyl -176:sc=  -0.352   (180deg=-0.421)
USER  MOD Single : A  50 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  60 LYS NZ  :NH3+   -113:sc=   -0.61   (180deg=-2.51!)
USER  MOD Single : A  61 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  73 THR OG1 :   rot -165:sc=   0.253
USER  MOD Single : A  74 SER OG  :   rot  180:sc=0.000804
USER  MOD Single : A  76 GLN     :      amide:sc=   -1.36  K(o=-1.4,f=-2.7!)
USER  MOD Single : A  77 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  79 ASN     :      amide:sc=   -0.23  K(o=-0.23,f=-0.9)
USER  MOD Single : A  80 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  82 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  84 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  88 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  89 LYS NZ  :NH3+    161:sc=    1.73   (180deg=0.755)
USER  MOD Single : A  90 LYS NZ  :NH3+    151:sc=    -2.2   (180deg=-3.76!)
USER  MOD Single : A  91 LYS NZ  :NH3+   -137:sc=  -0.133   (180deg=-1.14)
USER  MOD Single : A  94 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  95 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  96 HIS     :     no HE2:sc=  -0.015  X(o=-0.015,f=-0.46)
USER  MOD Single : A  97 HIS     :     no HD1:sc=  -0.348  X(o=-0.35,f=-0.16)
USER  MOD Single : A  98 HIS     :     no HD1:sc=  -0.135  X(o=-0.14,f=-0.14)
USER  MOD Single : A  99 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   ALA A  22      -0.271   3.526   7.648  1.00 13.11           N
ATOM      2  CA  ALA A  22      -0.205   2.689   6.432  1.00 63.23           C
ATOM      3  C   ALA A  22      -1.540   1.952   6.256  1.00  2.21           C
ATOM      4  O   ALA A  22      -1.694   0.816   6.711  1.00 65.24           O
ATOM      5  CB  ALA A  22       0.992   1.718   6.509  1.00 60.14           C
ATOM      0  HA  ALA A  22      -0.045   3.317   5.555  1.00 63.23           H   new
ATOM      0  HB1 ALA A  22       1.025   1.109   5.605  1.00 60.14           H   new
ATOM      0  HB2 ALA A  22       1.917   2.287   6.597  1.00 60.14           H   new
ATOM      0  HB3 ALA A  22       0.880   1.071   7.379  1.00 60.14           H   new
ATOM     13  N   GLU A  23      -2.523   2.627   5.622  1.00 73.33           N
ATOM     14  CA  GLU A  23      -3.906   2.120   5.504  1.00  3.52           C
ATOM     15  C   GLU A  23      -4.071   1.211   4.265  1.00 50.41           C
ATOM     16  O   GLU A  23      -3.659   1.561   3.157  1.00  0.04           O
ATOM     17  CB  GLU A  23      -4.930   3.291   5.472  1.00  2.43           C
ATOM     18  CG  GLU A  23      -4.736   4.300   4.328  1.00 71.21           C
ATOM     19  CD  GLU A  23      -5.830   5.380   4.272  1.00 61.43           C
ATOM     20  OE1 GLU A  23      -6.879   5.141   3.638  1.00 62.51           O
ATOM     21  OE2 GLU A  23      -5.653   6.466   4.869  1.00 50.52           O
ATOM      0  H   GLU A  23      -2.380   3.535   5.180  1.00 73.33           H   new
ATOM      0  HA  GLU A  23      -4.110   1.516   6.388  1.00  3.52           H   new
ATOM      0  HB2 GLU A  23      -5.934   2.873   5.399  1.00  2.43           H   new
ATOM      0  HB3 GLU A  23      -4.875   3.826   6.420  1.00  2.43           H   new
ATOM      0  HG2 GLU A  23      -3.765   4.783   4.440  1.00 71.21           H   new
ATOM      0  HG3 GLU A  23      -4.717   3.763   3.380  1.00 71.21           H   new
ATOM     28  N   ILE A  24      -4.685   0.042   4.483  1.00 12.43           N
ATOM     29  CA  ILE A  24      -4.950  -0.956   3.435  1.00 61.32           C
ATOM     30  C   ILE A  24      -6.150  -0.509   2.572  1.00 22.31           C
ATOM     31  O   ILE A  24      -7.288  -0.468   3.055  1.00 14.11           O
ATOM     32  CB  ILE A  24      -5.229  -2.366   4.095  1.00 54.25           C
ATOM     33  CG1 ILE A  24      -3.949  -2.911   4.805  1.00 43.31           C
ATOM     34  CG2 ILE A  24      -5.774  -3.403   3.079  1.00 25.43           C
ATOM     35  CD1 ILE A  24      -2.794  -3.262   3.878  1.00 35.45           C
ATOM      0  H   ILE A  24      -5.017  -0.243   5.404  1.00 12.43           H   new
ATOM      0  HA  ILE A  24      -4.076  -1.042   2.790  1.00 61.32           H   new
ATOM      0  HB  ILE A  24      -6.008  -2.213   4.842  1.00 54.25           H   new
ATOM      0 HG12 ILE A  24      -3.605  -2.165   5.522  1.00 43.31           H   new
ATOM      0 HG13 ILE A  24      -4.220  -3.800   5.375  1.00 43.31           H   new
ATOM      0 HG21 ILE A  24      -5.948  -4.352   3.586  1.00 25.43           H   new
ATOM      0 HG22 ILE A  24      -6.711  -3.041   2.656  1.00 25.43           H   new
ATOM      0 HG23 ILE A  24      -5.047  -3.546   2.280  1.00 25.43           H   new
ATOM      0 HD11 ILE A  24      -1.954  -3.631   4.467  1.00 35.45           H   new
ATOM      0 HD12 ILE A  24      -3.112  -4.033   3.177  1.00 35.45           H   new
ATOM      0 HD13 ILE A  24      -2.488  -2.374   3.326  1.00 35.45           H   new
ATOM     47  N   MET A  25      -5.870  -0.124   1.316  1.00 25.40           N
ATOM     48  CA  MET A  25      -6.900   0.150   0.287  1.00 10.32           C
ATOM     49  C   MET A  25      -6.456  -0.503  -1.019  1.00 74.45           C
ATOM     50  O   MET A  25      -5.267  -0.598  -1.280  1.00 63.10           O
ATOM     51  CB  MET A  25      -7.128   1.679   0.049  1.00 22.00           C
ATOM     52  CG  MET A  25      -7.672   2.465   1.257  1.00 14.51           C
ATOM     53  SD  MET A  25      -8.293   4.112   0.820  1.00  0.24           S
ATOM     54  CE  MET A  25      -6.859   4.861   0.048  1.00 54.31           C
ATOM      0  H   MET A  25      -4.917   0.008   0.979  1.00 25.40           H   new
ATOM      0  HA  MET A  25      -7.846  -0.261   0.640  1.00 10.32           H   new
ATOM      0  HB2 MET A  25      -6.182   2.126  -0.257  1.00 22.00           H   new
ATOM      0  HB3 MET A  25      -7.822   1.800  -0.783  1.00 22.00           H   new
ATOM      0  HG2 MET A  25      -8.475   1.893   1.722  1.00 14.51           H   new
ATOM      0  HG3 MET A  25      -6.882   2.568   2.001  1.00 14.51           H   new
ATOM      0  HE1 MET A  25      -7.049   5.921  -0.122  1.00 54.31           H   new
ATOM      0  HE2 MET A  25      -5.994   4.748   0.701  1.00 54.31           H   new
ATOM      0  HE3 MET A  25      -6.661   4.370  -0.905  1.00 54.31           H   new
ATOM     64  N   LYS A  26      -7.414  -0.952  -1.838  1.00 14.41           N
ATOM     65  CA  LYS A  26      -7.113  -1.518  -3.171  1.00 72.44           C
ATOM     66  C   LYS A  26      -6.924  -0.378  -4.178  1.00 52.33           C
ATOM     67  O   LYS A  26      -7.287   0.762  -3.887  1.00 63.30           O
ATOM     68  CB  LYS A  26      -8.250  -2.464  -3.628  1.00 32.12           C
ATOM     69  CG  LYS A  26      -8.628  -3.541  -2.588  1.00 40.41           C
ATOM     70  CD  LYS A  26      -9.807  -4.431  -3.043  1.00 42.32           C
ATOM     71  CE  LYS A  26     -10.388  -5.283  -1.902  1.00 64.53           C
ATOM     72  NZ  LYS A  26     -11.006  -4.449  -0.833  1.00 54.24           N
ATOM      0  H   LYS A  26      -8.407  -0.937  -1.607  1.00 14.41           H   new
ATOM      0  HA  LYS A  26      -6.193  -2.100  -3.113  1.00 72.44           H   new
ATOM      0  HB2 LYS A  26      -9.134  -1.869  -3.857  1.00 32.12           H   new
ATOM      0  HB3 LYS A  26      -7.949  -2.956  -4.553  1.00 32.12           H   new
ATOM      0  HG2 LYS A  26      -7.760  -4.170  -2.392  1.00 40.41           H   new
ATOM      0  HG3 LYS A  26      -8.888  -3.055  -1.648  1.00 40.41           H   new
ATOM      0  HD2 LYS A  26     -10.594  -3.800  -3.456  1.00 42.32           H   new
ATOM      0  HD3 LYS A  26      -9.471  -5.088  -3.846  1.00 42.32           H   new
ATOM      0  HE2 LYS A  26     -11.136  -5.966  -2.306  1.00 64.53           H   new
ATOM      0  HE3 LYS A  26      -9.597  -5.896  -1.470  1.00 64.53           H   new
ATOM      0  HZ1 LYS A  26     -11.585  -5.051  -0.214  1.00 54.24           H   new
ATOM      0  HZ2 LYS A  26     -10.258  -3.994  -0.272  1.00 54.24           H   new
ATOM      0  HZ3 LYS A  26     -11.607  -3.719  -1.266  1.00 54.24           H   new
ATOM     86  N   LYS A  27      -6.360  -0.697  -5.360  1.00 20.14           N
ATOM     87  CA  LYS A  27      -6.176   0.287  -6.451  1.00 31.10           C
ATOM     88  C   LYS A  27      -7.545   0.932  -6.816  1.00 20.41           C
ATOM     89  O   LYS A  27      -7.627   2.145  -7.002  1.00 62.40           O
ATOM     90  CB  LYS A  27      -5.508  -0.398  -7.695  1.00 34.40           C
ATOM     91  CG  LYS A  27      -4.646   0.523  -8.618  1.00 41.43           C
ATOM     92  CD  LYS A  27      -5.440   1.656  -9.331  1.00 50.30           C
ATOM     93  CE  LYS A  27      -6.487   1.133 -10.336  1.00 14.42           C
ATOM     94  NZ  LYS A  27      -7.263   2.236 -10.958  1.00 43.23           N
ATOM      0  H   LYS A  27      -6.022  -1.632  -5.586  1.00 20.14           H   new
ATOM      0  HA  LYS A  27      -5.508   1.080  -6.116  1.00 31.10           H   new
ATOM      0  HB2 LYS A  27      -4.876  -1.211  -7.338  1.00 34.40           H   new
ATOM      0  HB3 LYS A  27      -6.295  -0.848  -8.301  1.00 34.40           H   new
ATOM      0  HG2 LYS A  27      -3.854   0.974  -8.020  1.00 41.43           H   new
ATOM      0  HG3 LYS A  27      -4.162  -0.095  -9.375  1.00 41.43           H   new
ATOM      0  HD2 LYS A  27      -5.942   2.266  -8.580  1.00 50.30           H   new
ATOM      0  HD3 LYS A  27      -4.739   2.307  -9.854  1.00 50.30           H   new
ATOM      0  HE2 LYS A  27      -5.986   0.559 -11.115  1.00 14.42           H   new
ATOM      0  HE3 LYS A  27      -7.169   0.452  -9.827  1.00 14.42           H   new
ATOM      0  HZ1 LYS A  27      -8.245   2.204 -10.618  1.00 43.23           H   new
ATOM      0  HZ2 LYS A  27      -6.837   3.149 -10.700  1.00 43.23           H   new
ATOM      0  HZ3 LYS A  27      -7.251   2.128 -11.992  1.00 43.23           H   new
ATOM    108  N   THR A  28      -8.598   0.088  -6.868  1.00  2.10           N
ATOM    109  CA  THR A  28      -9.988   0.500  -7.162  1.00 31.33           C
ATOM    110  C   THR A  28     -10.458   1.691  -6.280  1.00 64.24           C
ATOM    111  O   THR A  28     -10.980   2.697  -6.789  1.00 72.34           O
ATOM    112  CB  THR A  28     -10.937  -0.726  -6.945  1.00 62.13           C
ATOM    113  OG1 THR A  28     -10.490  -1.830  -7.752  1.00  0.25           O
ATOM    114  CG2 THR A  28     -12.409  -0.409  -7.277  1.00 14.41           C
ATOM      0  H   THR A  28      -8.505  -0.914  -6.704  1.00  2.10           H   new
ATOM      0  HA  THR A  28     -10.024   0.838  -8.198  1.00 31.33           H   new
ATOM      0  HB  THR A  28     -10.893  -0.982  -5.886  1.00 62.13           H   new
ATOM      0  HG1 THR A  28     -11.084  -2.597  -7.614  1.00  0.25           H   new
ATOM      0 HG21 THR A  28     -13.019  -1.296  -7.108  1.00 14.41           H   new
ATOM      0 HG22 THR A  28     -12.760   0.401  -6.637  1.00 14.41           H   new
ATOM      0 HG23 THR A  28     -12.490  -0.107  -8.321  1.00 14.41           H   new
ATOM    122  N   ASP A  29     -10.237   1.562  -4.965  1.00  3.43           N
ATOM    123  CA  ASP A  29     -10.687   2.542  -3.956  1.00 23.33           C
ATOM    124  C   ASP A  29      -9.766   3.765  -3.952  1.00 52.32           C
ATOM    125  O   ASP A  29     -10.223   4.915  -3.954  1.00 54.02           O
ATOM    126  CB  ASP A  29     -10.689   1.886  -2.552  1.00 35.34           C
ATOM    127  CG  ASP A  29     -11.491   0.580  -2.511  1.00 55.11           C
ATOM    128  OD1 ASP A  29     -12.726   0.628  -2.318  1.00 50.45           O
ATOM    129  OD2 ASP A  29     -10.891  -0.505  -2.689  1.00 32.43           O
ATOM      0  H   ASP A  29      -9.737   0.769  -4.564  1.00  3.43           H   new
ATOM      0  HA  ASP A  29     -11.698   2.864  -4.208  1.00 23.33           H   new
ATOM      0  HB2 ASP A  29      -9.662   1.687  -2.247  1.00 35.34           H   new
ATOM      0  HB3 ASP A  29     -11.106   2.587  -1.829  1.00 35.34           H   new
ATOM    134  N   PHE A  30      -8.462   3.472  -3.974  1.00 71.22           N
ATOM    135  CA  PHE A  30      -7.386   4.467  -3.852  1.00 13.32           C
ATOM    136  C   PHE A  30      -7.365   5.462  -5.032  1.00  3.22           C
ATOM    137  O   PHE A  30      -7.091   6.653  -4.839  1.00  0.43           O
ATOM    138  CB  PHE A  30      -6.024   3.732  -3.749  1.00 70.53           C
ATOM    139  CG  PHE A  30      -4.822   4.659  -3.857  1.00 30.40           C
ATOM    140  CD1 PHE A  30      -4.441   5.449  -2.781  1.00 30.52           C
ATOM    141  CD2 PHE A  30      -4.105   4.770  -5.055  1.00 72.23           C
ATOM    142  CE1 PHE A  30      -3.383   6.308  -2.891  1.00 33.32           C
ATOM    143  CE2 PHE A  30      -3.047   5.629  -5.153  1.00 14.53           C
ATOM    144  CZ  PHE A  30      -2.694   6.399  -4.072  1.00 73.12           C
ATOM      0  H   PHE A  30      -8.116   2.518  -4.079  1.00 71.22           H   new
ATOM      0  HA  PHE A  30      -7.571   5.051  -2.950  1.00 13.32           H   new
ATOM      0  HB2 PHE A  30      -5.978   3.201  -2.798  1.00 70.53           H   new
ATOM      0  HB3 PHE A  30      -5.965   2.981  -4.537  1.00 70.53           H   new
ATOM      0  HD1 PHE A  30      -4.984   5.385  -1.850  1.00 30.52           H   new
ATOM      0  HD2 PHE A  30      -4.391   4.172  -5.908  1.00 72.23           H   new
ATOM      0  HE1 PHE A  30      -3.090   6.915  -2.047  1.00 33.32           H   new
ATOM      0  HE2 PHE A  30      -2.491   5.702  -6.076  1.00 14.53           H   new
ATOM      0  HZ  PHE A  30      -1.863   7.084  -4.154  1.00 73.12           H   new
ATOM    154  N   ASP A  31      -7.644   4.944  -6.239  1.00 44.14           N
ATOM    155  CA  ASP A  31      -7.535   5.688  -7.519  1.00 34.14           C
ATOM    156  C   ASP A  31      -8.239   7.064  -7.452  1.00 12.45           C
ATOM    157  O   ASP A  31      -7.680   8.090  -7.869  1.00 53.31           O
ATOM    158  CB  ASP A  31      -8.152   4.827  -8.644  1.00 61.41           C
ATOM    159  CG  ASP A  31      -8.058   5.449 -10.049  1.00 45.34           C
ATOM    160  OD1 ASP A  31      -7.010   5.286 -10.714  1.00  3.21           O
ATOM    161  OD2 ASP A  31      -9.039   6.082 -10.498  1.00 22.43           O
ATOM      0  H   ASP A  31      -7.957   3.981  -6.362  1.00 44.14           H   new
ATOM      0  HA  ASP A  31      -6.481   5.880  -7.721  1.00 34.14           H   new
ATOM      0  HB2 ASP A  31      -7.655   3.857  -8.656  1.00 61.41           H   new
ATOM      0  HB3 ASP A  31      -9.201   4.645  -8.411  1.00 61.41           H   new
ATOM    166  N   LYS A  32      -9.427   7.053  -6.827  1.00 20.22           N
ATOM    167  CA  LYS A  32     -10.310   8.229  -6.687  1.00 43.35           C
ATOM    168  C   LYS A  32      -9.605   9.409  -5.971  1.00 50.22           C
ATOM    169  O   LYS A  32      -9.835  10.576  -6.307  1.00 53.02           O
ATOM    170  CB  LYS A  32     -11.587   7.820  -5.902  1.00 45.03           C
ATOM    171  CG  LYS A  32     -12.362   6.623  -6.507  1.00 72.11           C
ATOM    172  CD  LYS A  32     -13.624   6.247  -5.690  1.00 54.50           C
ATOM    173  CE  LYS A  32     -14.376   5.033  -6.273  1.00  4.13           C
ATOM    174  NZ  LYS A  32     -13.558   3.789  -6.228  1.00 24.11           N
ATOM      0  H   LYS A  32      -9.811   6.212  -6.396  1.00 20.22           H   new
ATOM      0  HA  LYS A  32     -10.575   8.571  -7.688  1.00 43.35           H   new
ATOM      0  HB2 LYS A  32     -11.305   7.573  -4.879  1.00 45.03           H   new
ATOM      0  HB3 LYS A  32     -12.256   8.679  -5.849  1.00 45.03           H   new
ATOM      0  HG2 LYS A  32     -12.655   6.866  -7.528  1.00 72.11           H   new
ATOM      0  HG3 LYS A  32     -11.700   5.759  -6.562  1.00 72.11           H   new
ATOM      0  HD2 LYS A  32     -13.334   6.029  -4.662  1.00 54.50           H   new
ATOM      0  HD3 LYS A  32     -14.297   7.103  -5.656  1.00 54.50           H   new
ATOM      0  HE2 LYS A  32     -15.300   4.878  -5.716  1.00  4.13           H   new
ATOM      0  HE3 LYS A  32     -14.657   5.243  -7.305  1.00  4.13           H   new
ATOM      0  HZ1 LYS A  32     -14.069   3.020  -6.706  1.00 24.11           H   new
ATOM      0  HZ2 LYS A  32     -12.651   3.953  -6.709  1.00 24.11           H   new
ATOM      0  HZ3 LYS A  32     -13.382   3.525  -5.238  1.00 24.11           H   new
ATOM    188  N   VAL A  33      -8.723   9.085  -5.001  1.00 75.30           N
ATOM    189  CA  VAL A  33      -7.997  10.085  -4.184  1.00 42.43           C
ATOM    190  C   VAL A  33      -6.493  10.118  -4.527  1.00 60.30           C
ATOM    191  O   VAL A  33      -5.734  10.842  -3.868  1.00  5.53           O
ATOM    192  CB  VAL A  33      -8.190   9.815  -2.633  1.00 31.21           C
ATOM    193  CG1 VAL A  33      -9.664  10.026  -2.216  1.00 45.23           C
ATOM    194  CG2 VAL A  33      -7.709   8.394  -2.233  1.00 63.02           C
ATOM      0  H   VAL A  33      -8.493   8.121  -4.761  1.00 75.30           H   new
ATOM      0  HA  VAL A  33      -8.426  11.058  -4.425  1.00 42.43           H   new
ATOM      0  HB  VAL A  33      -7.572  10.536  -2.099  1.00 31.21           H   new
ATOM      0 HG11 VAL A  33      -9.771   9.835  -1.148  1.00 45.23           H   new
ATOM      0 HG12 VAL A  33      -9.960  11.052  -2.432  1.00 45.23           H   new
ATOM      0 HG13 VAL A  33     -10.302   9.339  -2.773  1.00 45.23           H   new
ATOM      0 HG21 VAL A  33      -7.858   8.247  -1.163  1.00 63.02           H   new
ATOM      0 HG22 VAL A  33      -8.281   7.648  -2.785  1.00 63.02           H   new
ATOM      0 HG23 VAL A  33      -6.650   8.288  -2.470  1.00 63.02           H   new
ATOM    204  N   ALA A  34      -6.080   9.388  -5.598  1.00 63.22           N
ATOM    205  CA  ALA A  34      -4.640   9.217  -5.962  1.00 12.14           C
ATOM    206  C   ALA A  34      -3.905  10.565  -6.200  1.00 24.14           C
ATOM    207  O   ALA A  34      -2.680  10.660  -6.033  1.00 60.22           O
ATOM    208  CB  ALA A  34      -4.517   8.327  -7.206  1.00 22.13           C
ATOM      0  H   ALA A  34      -6.722   8.907  -6.227  1.00 63.22           H   new
ATOM      0  HA  ALA A  34      -4.155   8.741  -5.110  1.00 12.14           H   new
ATOM      0  HB1 ALA A  34      -3.465   8.207  -7.465  1.00 22.13           H   new
ATOM      0  HB2 ALA A  34      -4.953   7.350  -6.999  1.00 22.13           H   new
ATOM      0  HB3 ALA A  34      -5.045   8.791  -8.039  1.00 22.13           H   new
ATOM    214  N   SER A  35      -4.691  11.596  -6.563  1.00  4.21           N
ATOM    215  CA  SER A  35      -4.216  12.967  -6.822  1.00 54.34           C
ATOM    216  C   SER A  35      -3.474  13.580  -5.609  1.00 61.32           C
ATOM    217  O   SER A  35      -2.605  14.444  -5.778  1.00 34.11           O
ATOM    218  CB  SER A  35      -5.428  13.842  -7.199  1.00 23.21           C
ATOM    219  OG  SER A  35      -6.148  13.267  -8.280  1.00 33.22           O
ATOM      0  H   SER A  35      -5.698  11.495  -6.687  1.00  4.21           H   new
ATOM      0  HA  SER A  35      -3.496  12.929  -7.640  1.00 54.34           H   new
ATOM      0  HB2 SER A  35      -6.085  13.952  -6.336  1.00 23.21           H   new
ATOM      0  HB3 SER A  35      -5.090  14.842  -7.472  1.00 23.21           H   new
ATOM      0  HG  SER A  35      -6.914  13.836  -8.503  1.00 33.22           H   new
ATOM    225  N   GLU A  36      -3.815  13.112  -4.392  1.00 53.44           N
ATOM    226  CA  GLU A  36      -3.212  13.606  -3.139  1.00 14.34           C
ATOM    227  C   GLU A  36      -2.170  12.635  -2.578  1.00 73.01           C
ATOM    228  O   GLU A  36      -1.827  12.718  -1.389  1.00 72.32           O
ATOM    229  CB  GLU A  36      -4.330  13.881  -2.102  1.00 10.43           C
ATOM    230  CG  GLU A  36      -5.172  15.129  -2.418  1.00 20.12           C
ATOM    231  CD  GLU A  36      -4.313  16.406  -2.553  1.00 12.24           C
ATOM    232  OE1 GLU A  36      -4.016  17.042  -1.518  1.00 71.15           O
ATOM    233  OE2 GLU A  36      -3.913  16.773  -3.686  1.00 61.12           O
ATOM      0  H   GLU A  36      -4.514  12.383  -4.251  1.00 53.44           H   new
ATOM      0  HA  GLU A  36      -2.685  14.535  -3.358  1.00 14.34           H   new
ATOM      0  HB2 GLU A  36      -4.988  13.013  -2.051  1.00 10.43           H   new
ATOM      0  HB3 GLU A  36      -3.879  13.998  -1.117  1.00 10.43           H   new
ATOM      0  HG2 GLU A  36      -5.723  14.966  -3.344  1.00 20.12           H   new
ATOM      0  HG3 GLU A  36      -5.910  15.274  -1.629  1.00 20.12           H   new
ATOM    240  N   TYR A  37      -1.641  11.726  -3.421  1.00 21.52           N
ATOM    241  CA  TYR A  37      -0.627  10.747  -2.984  1.00  4.42           C
ATOM    242  C   TYR A  37       0.525  10.627  -3.994  1.00 41.03           C
ATOM    243  O   TYR A  37       0.350  10.865  -5.196  1.00 22.31           O
ATOM    244  CB  TYR A  37      -1.283   9.378  -2.715  1.00 14.42           C
ATOM    245  CG  TYR A  37      -2.326   9.404  -1.590  1.00 32.44           C
ATOM    246  CD1 TYR A  37      -3.668   9.707  -1.838  1.00 54.42           C
ATOM    247  CD2 TYR A  37      -1.962   9.162  -0.270  1.00 53.11           C
ATOM    248  CE1 TYR A  37      -4.594   9.757  -0.821  1.00 63.44           C
ATOM    249  CE2 TYR A  37      -2.885   9.216   0.746  1.00 63.23           C
ATOM    250  CZ  TYR A  37      -4.198   9.515   0.472  1.00 71.55           C
ATOM    251  OH  TYR A  37      -5.122   9.563   1.495  1.00 43.13           O
ATOM      0  H   TYR A  37      -1.898  11.650  -4.405  1.00 21.52           H   new
ATOM      0  HA  TYR A  37      -0.193  11.109  -2.052  1.00  4.42           H   new
ATOM      0  HB2 TYR A  37      -1.758   9.027  -3.631  1.00 14.42           H   new
ATOM      0  HB3 TYR A  37      -0.506   8.656  -2.462  1.00 14.42           H   new
ATOM      0  HD1 TYR A  37      -3.985   9.906  -2.851  1.00 54.42           H   new
ATOM      0  HD2 TYR A  37      -0.934   8.927  -0.039  1.00 53.11           H   new
ATOM      0  HE1 TYR A  37      -5.627   9.985  -1.038  1.00 63.44           H   new
ATOM      0  HE2 TYR A  37      -2.578   9.023   1.763  1.00 63.23           H   new
ATOM      0  HH  TYR A  37      -4.678   9.367   2.346  1.00 43.13           H   new
ATOM    261  N   THR A  38       1.703  10.248  -3.465  1.00 42.23           N
ATOM    262  CA  THR A  38       2.969  10.142  -4.204  1.00 43.23           C
ATOM    263  C   THR A  38       3.535   8.716  -4.059  1.00 54.33           C
ATOM    264  O   THR A  38       3.786   8.263  -2.933  1.00  4.44           O
ATOM    265  CB  THR A  38       4.006  11.192  -3.671  1.00 42.54           C
ATOM    266  OG1 THR A  38       4.005  11.203  -2.229  1.00 62.45           O
ATOM    267  CG2 THR A  38       3.739  12.608  -4.201  1.00 11.51           C
ATOM      0  H   THR A  38       1.800  10.000  -2.480  1.00 42.23           H   new
ATOM      0  HA  THR A  38       2.781  10.349  -5.258  1.00 43.23           H   new
ATOM      0  HB  THR A  38       4.985  10.887  -4.040  1.00 42.54           H   new
ATOM      0  HG1 THR A  38       3.918  10.286  -1.895  1.00 62.45           H   new
ATOM      0 HG21 THR A  38       4.486  13.293  -3.800  1.00 11.51           H   new
ATOM      0 HG22 THR A  38       3.795  12.606  -5.290  1.00 11.51           H   new
ATOM      0 HG23 THR A  38       2.746  12.932  -3.890  1.00 11.51           H   new
ATOM    275  N   LYS A  39       3.702   8.014  -5.194  1.00 11.30           N
ATOM    276  CA  LYS A  39       4.231   6.642  -5.232  1.00 33.40           C
ATOM    277  C   LYS A  39       5.715   6.655  -4.853  1.00 62.11           C
ATOM    278  O   LYS A  39       6.552   7.158  -5.614  1.00  3.44           O
ATOM    279  CB  LYS A  39       3.989   6.026  -6.646  1.00 35.02           C
ATOM    280  CG  LYS A  39       4.264   4.499  -6.807  1.00 24.34           C
ATOM    281  CD  LYS A  39       5.733   4.165  -7.169  1.00 12.42           C
ATOM    282  CE  LYS A  39       5.910   2.720  -7.656  1.00 21.35           C
ATOM    283  NZ  LYS A  39       5.092   2.431  -8.865  1.00 64.00           N
ATOM      0  H   LYS A  39       3.472   8.386  -6.115  1.00 11.30           H   new
ATOM      0  HA  LYS A  39       3.711   6.016  -4.507  1.00 33.40           H   new
ATOM      0  HB2 LYS A  39       2.953   6.215  -6.926  1.00 35.02           H   new
ATOM      0  HB3 LYS A  39       4.615   6.561  -7.361  1.00 35.02           H   new
ATOM      0  HG2 LYS A  39       4.004   3.992  -5.878  1.00 24.34           H   new
ATOM      0  HG3 LYS A  39       3.609   4.101  -7.582  1.00 24.34           H   new
ATOM      0  HD2 LYS A  39       6.076   4.850  -7.944  1.00 12.42           H   new
ATOM      0  HD3 LYS A  39       6.364   4.330  -6.296  1.00 12.42           H   new
ATOM      0  HE2 LYS A  39       6.962   2.540  -7.879  1.00 21.35           H   new
ATOM      0  HE3 LYS A  39       5.631   2.032  -6.858  1.00 21.35           H   new
ATOM      0  HZ1 LYS A  39       5.659   1.885  -9.545  1.00 64.00           H   new
ATOM      0  HZ2 LYS A  39       4.253   1.880  -8.593  1.00 64.00           H   new
ATOM      0  HZ3 LYS A  39       4.792   3.325  -9.303  1.00 64.00           H   new
ATOM    297  N   ILE A  40       6.031   6.117  -3.665  1.00 54.42           N
ATOM    298  CA  ILE A  40       7.409   6.090  -3.151  1.00 12.22           C
ATOM    299  C   ILE A  40       8.068   4.722  -3.425  1.00 42.30           C
ATOM    300  O   ILE A  40       9.279   4.564  -3.224  1.00 72.24           O
ATOM    301  CB  ILE A  40       7.471   6.446  -1.618  1.00 71.35           C
ATOM    302  CG1 ILE A  40       6.758   5.373  -0.731  1.00 23.55           C
ATOM    303  CG2 ILE A  40       6.867   7.854  -1.363  1.00 74.24           C
ATOM    304  CD1 ILE A  40       6.996   5.533   0.766  1.00 34.23           C
ATOM      0  H   ILE A  40       5.346   5.693  -3.039  1.00 54.42           H   new
ATOM      0  HA  ILE A  40       7.971   6.857  -3.684  1.00 12.22           H   new
ATOM      0  HB  ILE A  40       8.522   6.453  -1.330  1.00 71.35           H   new
ATOM      0 HG12 ILE A  40       5.686   5.416  -0.922  1.00 23.55           H   new
ATOM      0 HG13 ILE A  40       7.097   4.383  -1.037  1.00 23.55           H   new
ATOM      0 HG21 ILE A  40       6.918   8.084  -0.299  1.00 74.24           H   new
ATOM      0 HG22 ILE A  40       7.432   8.599  -1.923  1.00 74.24           H   new
ATOM      0 HG23 ILE A  40       5.827   7.868  -1.688  1.00 74.24           H   new
ATOM      0 HD11 ILE A  40       6.465   4.748   1.305  1.00 34.23           H   new
ATOM      0 HD12 ILE A  40       8.063   5.459   0.975  1.00 34.23           H   new
ATOM      0 HD13 ILE A  40       6.630   6.507   1.091  1.00 34.23           H   new
ATOM    316  N   GLY A  41       7.259   3.745  -3.894  1.00  4.34           N
ATOM    317  CA  GLY A  41       7.762   2.420  -4.248  1.00 22.34           C
ATOM    318  C   GLY A  41       6.657   1.388  -4.393  1.00 52.21           C
ATOM    319  O   GLY A  41       5.465   1.729  -4.384  1.00 22.40           O
ATOM      0  H   GLY A  41       6.255   3.861  -4.032  1.00  4.34           H   new
ATOM      0  HA2 GLY A  41       8.316   2.485  -5.184  1.00 22.34           H   new
ATOM      0  HA3 GLY A  41       8.465   2.088  -3.484  1.00 22.34           H   new
ATOM    323  N   THR A  42       7.064   0.128  -4.593  1.00 71.21           N
ATOM    324  CA  THR A  42       6.170  -1.042  -4.550  1.00 54.53           C
ATOM    325  C   THR A  42       6.828  -2.117  -3.668  1.00 23.44           C
ATOM    326  O   THR A  42       8.051  -2.294  -3.708  1.00 11.31           O
ATOM    327  CB  THR A  42       5.883  -1.628  -5.983  1.00 52.40           C
ATOM    328  OG1 THR A  42       5.541  -0.557  -6.884  1.00  3.21           O
ATOM    329  CG2 THR A  42       4.724  -2.656  -5.972  1.00 65.31           C
ATOM      0  H   THR A  42       8.035  -0.113  -4.792  1.00 71.21           H   new
ATOM      0  HA  THR A  42       5.210  -0.730  -4.138  1.00 54.53           H   new
ATOM      0  HB  THR A  42       6.789  -2.138  -6.312  1.00 52.40           H   new
ATOM      0  HG1 THR A  42       5.364  -0.923  -7.776  1.00  3.21           H   new
ATOM      0 HG21 THR A  42       4.562  -3.033  -6.982  1.00 65.31           H   new
ATOM      0 HG22 THR A  42       4.979  -3.485  -5.312  1.00 65.31           H   new
ATOM      0 HG23 THR A  42       3.814  -2.174  -5.614  1.00 65.31           H   new
ATOM    337  N   ILE A  43       6.018  -2.802  -2.850  1.00  1.44           N
ATOM    338  CA  ILE A  43       6.464  -3.914  -1.988  1.00 23.32           C
ATOM    339  C   ILE A  43       5.735  -5.212  -2.390  1.00 31.11           C
ATOM    340  O   ILE A  43       4.785  -5.177  -3.181  1.00 44.24           O
ATOM    341  CB  ILE A  43       6.225  -3.592  -0.462  1.00 42.31           C
ATOM    342  CG1 ILE A  43       4.724  -3.252  -0.201  1.00 74.21           C
ATOM    343  CG2 ILE A  43       7.157  -2.449   0.019  1.00 25.03           C
ATOM    344  CD1 ILE A  43       4.382  -2.944   1.241  1.00 32.31           C
ATOM      0  H   ILE A  43       5.022  -2.600  -2.764  1.00  1.44           H   new
ATOM      0  HA  ILE A  43       7.536  -4.048  -2.130  1.00 23.32           H   new
ATOM      0  HB  ILE A  43       6.473  -4.481   0.118  1.00 42.31           H   new
ATOM      0 HG12 ILE A  43       4.448  -2.395  -0.816  1.00 74.21           H   new
ATOM      0 HG13 ILE A  43       4.113  -4.092  -0.533  1.00 74.21           H   new
ATOM      0 HG21 ILE A  43       6.971  -2.248   1.074  1.00 25.03           H   new
ATOM      0 HG22 ILE A  43       8.197  -2.746  -0.116  1.00 25.03           H   new
ATOM      0 HG23 ILE A  43       6.959  -1.549  -0.563  1.00 25.03           H   new
ATOM      0 HD11 ILE A  43       3.318  -2.720   1.323  1.00 32.31           H   new
ATOM      0 HD12 ILE A  43       4.620  -3.806   1.864  1.00 32.31           H   new
ATOM      0 HD13 ILE A  43       4.961  -2.083   1.576  1.00 32.31           H   new
ATOM    356  N   SER A  44       6.188  -6.345  -1.834  1.00 42.02           N
ATOM    357  CA  SER A  44       5.651  -7.683  -2.145  1.00 62.23           C
ATOM    358  C   SER A  44       5.874  -8.632  -0.954  1.00 74.21           C
ATOM    359  O   SER A  44       6.895  -8.530  -0.265  1.00 74.21           O
ATOM    360  CB  SER A  44       6.314  -8.233  -3.430  1.00 71.21           C
ATOM    361  OG  SER A  44       7.728  -8.176  -3.344  1.00 42.50           O
ATOM      0  H   SER A  44       6.944  -6.361  -1.149  1.00 42.02           H   new
ATOM      0  HA  SER A  44       4.578  -7.609  -2.321  1.00 62.23           H   new
ATOM      0  HB2 SER A  44       5.998  -9.264  -3.592  1.00 71.21           H   new
ATOM      0  HB3 SER A  44       5.976  -7.657  -4.291  1.00 71.21           H   new
ATOM      0  HG  SER A  44       8.120  -8.531  -4.169  1.00 42.50           H   new
ATOM    367  N   THR A  45       4.921  -9.548  -0.722  1.00 20.14           N
ATOM    368  CA  THR A  45       4.952 -10.465   0.425  1.00 12.32           C
ATOM    369  C   THR A  45       5.930 -11.632   0.183  1.00 50.44           C
ATOM    370  O   THR A  45       5.825 -12.335  -0.833  1.00 73.03           O
ATOM    371  CB  THR A  45       3.520 -11.012   0.737  1.00 32.24           C
ATOM    372  OG1 THR A  45       2.961 -11.670  -0.414  1.00 41.42           O
ATOM    373  CG2 THR A  45       2.566  -9.891   1.176  1.00  0.22           C
ATOM      0  H   THR A  45       4.108  -9.673  -1.325  1.00 20.14           H   new
ATOM      0  HA  THR A  45       5.305  -9.901   1.288  1.00 12.32           H   new
ATOM      0  HB  THR A  45       3.628 -11.725   1.555  1.00 32.24           H   new
ATOM      0  HG1 THR A  45       3.540 -11.519  -1.190  1.00 41.42           H   new
ATOM      0 HG21 THR A  45       1.582 -10.311   1.383  1.00  0.22           H   new
ATOM      0 HG22 THR A  45       2.954  -9.415   2.076  1.00  0.22           H   new
ATOM      0 HG23 THR A  45       2.484  -9.151   0.380  1.00  0.22           H   new
ATOM    381  N   THR A  46       6.883 -11.815   1.119  1.00 61.33           N
ATOM    382  CA  THR A  46       7.871 -12.894   1.067  1.00 70.02           C
ATOM    383  C   THR A  46       7.178 -14.245   1.310  1.00 23.03           C
ATOM    384  O   THR A  46       6.566 -14.465   2.366  1.00 43.15           O
ATOM    385  CB  THR A  46       9.007 -12.665   2.118  1.00  1.31           C
ATOM    386  OG1 THR A  46       9.619 -11.388   1.875  1.00  1.25           O
ATOM    387  CG2 THR A  46      10.095 -13.768   2.073  1.00 53.34           C
ATOM      0  H   THR A  46       6.983 -11.211   1.935  1.00 61.33           H   new
ATOM      0  HA  THR A  46       8.328 -12.900   0.077  1.00 70.02           H   new
ATOM      0  HB  THR A  46       8.550 -12.700   3.107  1.00  1.31           H   new
ATOM      0  HG1 THR A  46      10.331 -11.236   2.531  1.00  1.25           H   new
ATOM      0 HG21 THR A  46      10.857 -13.558   2.823  1.00 53.34           H   new
ATOM      0 HG22 THR A  46       9.640 -14.737   2.280  1.00 53.34           H   new
ATOM      0 HG23 THR A  46      10.554 -13.786   1.085  1.00 53.34           H   new
ATOM    395  N   GLY A  47       7.255 -15.120   0.309  1.00 32.53           N
ATOM    396  CA  GLY A  47       6.636 -16.436   0.373  1.00 32.35           C
ATOM    397  C   GLY A  47       5.167 -16.400  -0.034  1.00 31.45           C
ATOM    398  O   GLY A  47       4.822 -15.800  -1.062  1.00  1.40           O
ATOM      0  H   GLY A  47       7.747 -14.935  -0.565  1.00 32.53           H   new
ATOM      0  HA2 GLY A  47       7.176 -17.122  -0.280  1.00 32.35           H   new
ATOM      0  HA3 GLY A  47       6.721 -16.827   1.387  1.00 32.35           H   new
ATOM    402  N   GLU A  48       4.298 -17.028   0.780  1.00 13.42           N
ATOM    403  CA  GLU A  48       2.859 -17.124   0.503  1.00 15.33           C
ATOM    404  C   GLU A  48       2.082 -17.374   1.814  1.00 70.53           C
ATOM    405  O   GLU A  48       2.427 -18.266   2.597  1.00 33.03           O
ATOM    406  CB  GLU A  48       2.571 -18.247  -0.546  1.00 52.24           C
ATOM    407  CG  GLU A  48       3.165 -19.630  -0.190  1.00 41.02           C
ATOM    408  CD  GLU A  48       2.806 -20.726  -1.208  1.00 41.43           C
ATOM    409  OE1 GLU A  48       1.695 -21.292  -1.117  1.00 31.41           O
ATOM    410  OE2 GLU A  48       3.624 -21.026  -2.106  1.00  3.25           O
ATOM      0  H   GLU A  48       4.578 -17.483   1.649  1.00 13.42           H   new
ATOM      0  HA  GLU A  48       2.520 -16.179   0.078  1.00 15.33           H   new
ATOM      0  HB2 GLU A  48       1.492 -18.349  -0.662  1.00 52.24           H   new
ATOM      0  HB3 GLU A  48       2.968 -17.934  -1.512  1.00 52.24           H   new
ATOM      0  HG2 GLU A  48       4.250 -19.546  -0.124  1.00 41.02           H   new
ATOM      0  HG3 GLU A  48       2.808 -19.928   0.796  1.00 41.02           H   new
ATOM    417  N   MET A  49       1.074 -16.524   2.070  1.00 33.11           N
ATOM    418  CA  MET A  49       0.080 -16.715   3.147  1.00 22.10           C
ATOM    419  C   MET A  49      -1.270 -16.132   2.705  1.00  5.42           C
ATOM    420  O   MET A  49      -1.421 -15.658   1.564  1.00 63.32           O
ATOM    421  CB  MET A  49       0.544 -16.128   4.545  1.00 70.11           C
ATOM    422  CG  MET A  49       1.667 -15.078   4.525  1.00 24.51           C
ATOM    423  SD  MET A  49       1.249 -13.577   3.621  1.00 22.42           S
ATOM    424  CE  MET A  49       2.699 -12.576   3.961  1.00 32.53           C
ATOM      0  H   MET A  49       0.922 -15.673   1.529  1.00 33.11           H   new
ATOM      0  HA  MET A  49      -0.025 -17.787   3.312  1.00 22.10           H   new
ATOM      0  HB2 MET A  49      -0.325 -15.685   5.031  1.00 70.11           H   new
ATOM      0  HB3 MET A  49       0.869 -16.960   5.170  1.00 70.11           H   new
ATOM      0  HG2 MET A  49       1.921 -14.813   5.551  1.00 24.51           H   new
ATOM      0  HG3 MET A  49       2.558 -15.522   4.080  1.00 24.51           H   new
ATOM      0  HE1 MET A  49       2.566 -11.584   3.529  1.00 32.53           H   new
ATOM      0  HE2 MET A  49       2.835 -12.487   5.039  1.00 32.53           H   new
ATOM      0  HE3 MET A  49       3.578 -13.048   3.522  1.00 32.53           H   new
ATOM    434  N   SER A  50      -2.261 -16.229   3.600  1.00 74.43           N
ATOM    435  CA  SER A  50      -3.595 -15.658   3.394  1.00 52.25           C
ATOM    436  C   SER A  50      -3.494 -14.121   3.243  1.00 44.25           C
ATOM    437  O   SER A  50      -2.808 -13.495   4.047  1.00 23.12           O
ATOM    438  CB  SER A  50      -4.492 -16.039   4.596  1.00 13.01           C
ATOM    439  OG  SER A  50      -3.921 -15.624   5.830  1.00 53.33           O
ATOM      0  H   SER A  50      -2.157 -16.710   4.494  1.00 74.43           H   new
ATOM      0  HA  SER A  50      -4.036 -16.056   2.480  1.00 52.25           H   new
ATOM      0  HB2 SER A  50      -5.474 -15.581   4.477  1.00 13.01           H   new
ATOM      0  HB3 SER A  50      -4.643 -17.118   4.610  1.00 13.01           H   new
ATOM      0  HG  SER A  50      -4.514 -15.879   6.567  1.00 53.33           H   new
ATOM    445  N   PRO A  51      -4.140 -13.501   2.189  1.00 42.03           N
ATOM    446  CA  PRO A  51      -4.203 -12.020   2.001  1.00 42.00           C
ATOM    447  C   PRO A  51      -4.519 -11.206   3.282  1.00 23.40           C
ATOM    448  O   PRO A  51      -4.080 -10.068   3.397  1.00 62.41           O
ATOM    449  CB  PRO A  51      -5.320 -11.849   0.950  1.00 34.34           C
ATOM    450  CG  PRO A  51      -5.215 -13.075   0.105  1.00 51.23           C
ATOM    451  CD  PRO A  51      -4.790 -14.199   1.043  1.00 60.34           C
ATOM      0  HA  PRO A  51      -3.230 -11.630   1.703  1.00 42.00           H   new
ATOM      0  HB2 PRO A  51      -6.301 -11.771   1.419  1.00 34.34           H   new
ATOM      0  HB3 PRO A  51      -5.177 -10.944   0.359  1.00 34.34           H   new
ATOM      0  HG2 PRO A  51      -6.169 -13.304  -0.370  1.00 51.23           H   new
ATOM      0  HG3 PRO A  51      -4.486 -12.937  -0.693  1.00 51.23           H   new
ATOM      0  HD2 PRO A  51      -5.647 -14.788   1.371  1.00 60.34           H   new
ATOM      0  HD3 PRO A  51      -4.100 -14.886   0.553  1.00 60.34           H   new
ATOM    459  N   LEU A  52      -5.270 -11.814   4.227  1.00 33.51           N
ATOM    460  CA  LEU A  52      -5.602 -11.198   5.532  1.00 21.51           C
ATOM    461  C   LEU A  52      -4.312 -10.980   6.356  1.00 74.12           C
ATOM    462  O   LEU A  52      -4.071  -9.880   6.866  1.00 73.41           O
ATOM    463  CB  LEU A  52      -6.633 -12.098   6.290  1.00 44.10           C
ATOM    464  CG  LEU A  52      -7.412 -11.489   7.512  1.00 53.05           C
ATOM    465  CD1 LEU A  52      -6.567 -11.399   8.801  1.00 23.53           C
ATOM    466  CD2 LEU A  52      -8.028 -10.124   7.143  1.00 72.11           C
ATOM      0  H   LEU A  52      -5.664 -12.747   4.106  1.00 33.51           H   new
ATOM      0  HA  LEU A  52      -6.061 -10.222   5.376  1.00 21.51           H   new
ATOM      0  HB2 LEU A  52      -7.371 -12.438   5.564  1.00 44.10           H   new
ATOM      0  HB3 LEU A  52      -6.103 -12.982   6.644  1.00 44.10           H   new
ATOM      0  HG  LEU A  52      -8.219 -12.186   7.740  1.00 53.05           H   new
ATOM      0 HD11 LEU A  52      -7.169 -10.970   9.602  1.00 23.53           H   new
ATOM      0 HD12 LEU A  52      -6.237 -12.397   9.090  1.00 23.53           H   new
ATOM      0 HD13 LEU A  52      -5.697 -10.767   8.622  1.00 23.53           H   new
ATOM      0 HD21 LEU A  52      -8.562  -9.721   8.004  1.00 72.11           H   new
ATOM      0 HD22 LEU A  52      -7.236  -9.434   6.852  1.00 72.11           H   new
ATOM      0 HD23 LEU A  52      -8.722 -10.251   6.312  1.00 72.11           H   new
ATOM    478  N   ASP A  53      -3.469 -12.030   6.445  1.00 62.24           N
ATOM    479  CA  ASP A  53      -2.160 -11.955   7.140  1.00  1.10           C
ATOM    480  C   ASP A  53      -1.169 -11.099   6.321  1.00 40.31           C
ATOM    481  O   ASP A  53      -0.352 -10.362   6.887  1.00 41.22           O
ATOM    482  CB  ASP A  53      -1.578 -13.378   7.361  1.00 71.45           C
ATOM    483  CG  ASP A  53      -0.262 -13.381   8.164  1.00 72.23           C
ATOM    484  OD1 ASP A  53      -0.318 -13.358   9.416  1.00 31.45           O
ATOM    485  OD2 ASP A  53       0.828 -13.395   7.552  1.00 42.21           O
ATOM      0  H   ASP A  53      -3.670 -12.946   6.043  1.00 62.24           H   new
ATOM      0  HA  ASP A  53      -2.312 -11.487   8.112  1.00  1.10           H   new
ATOM      0  HB2 ASP A  53      -2.315 -13.987   7.883  1.00 71.45           H   new
ATOM      0  HB3 ASP A  53      -1.405 -13.847   6.392  1.00 71.45           H   new
ATOM    490  N   ALA A  54      -1.287 -11.200   4.991  1.00  3.54           N
ATOM    491  CA  ALA A  54      -0.440 -10.475   4.029  1.00 25.31           C
ATOM    492  C   ALA A  54      -0.593  -8.951   4.172  1.00 62.22           C
ATOM    493  O   ALA A  54       0.383  -8.225   3.994  1.00 34.33           O
ATOM    494  CB  ALA A  54      -0.762 -10.935   2.594  1.00 14.43           C
ATOM      0  H   ALA A  54      -1.984 -11.796   4.544  1.00  3.54           H   new
ATOM      0  HA  ALA A  54       0.602 -10.711   4.247  1.00 25.31           H   new
ATOM      0  HB1 ALA A  54      -0.131 -10.394   1.888  1.00 14.43           H   new
ATOM      0  HB2 ALA A  54      -0.573 -12.005   2.504  1.00 14.43           H   new
ATOM      0  HB3 ALA A  54      -1.810 -10.732   2.373  1.00 14.43           H   new
ATOM    500  N   ARG A  55      -1.823  -8.499   4.535  1.00 33.34           N
ATOM    501  CA  ARG A  55      -2.115  -7.077   4.844  1.00 55.44           C
ATOM    502  C   ARG A  55      -1.125  -6.538   5.878  1.00  3.00           C
ATOM    503  O   ARG A  55      -0.525  -5.504   5.665  1.00 55.13           O
ATOM    504  CB  ARG A  55      -3.559  -6.885   5.389  1.00  1.25           C
ATOM    505  CG  ARG A  55      -4.684  -7.145   4.368  1.00 73.43           C
ATOM    506  CD  ARG A  55      -6.080  -7.043   5.008  1.00 55.04           C
ATOM    507  NE  ARG A  55      -7.154  -7.415   4.076  1.00 73.10           N
ATOM    508  CZ  ARG A  55      -8.466  -7.421   4.370  1.00 62.53           C
ATOM    509  NH1 ARG A  55      -8.902  -7.060   5.572  1.00 64.20           N
ATOM    510  NH2 ARG A  55      -9.336  -7.804   3.459  1.00 74.22           N
ATOM      0  H   ARG A  55      -2.636  -9.109   4.621  1.00 33.34           H   new
ATOM      0  HA  ARG A  55      -2.018  -6.526   3.909  1.00 55.44           H   new
ATOM      0  HB2 ARG A  55      -3.701  -7.551   6.240  1.00  1.25           H   new
ATOM      0  HB3 ARG A  55      -3.657  -5.866   5.762  1.00  1.25           H   new
ATOM      0  HG2 ARG A  55      -4.606  -6.426   3.552  1.00 73.43           H   new
ATOM      0  HG3 ARG A  55      -4.556  -8.136   3.933  1.00 73.43           H   new
ATOM      0  HD2 ARG A  55      -6.123  -7.690   5.884  1.00 55.04           H   new
ATOM      0  HD3 ARG A  55      -6.243  -6.023   5.357  1.00 55.04           H   new
ATOM      0  HE  ARG A  55      -6.883  -7.690   3.132  1.00 73.10           H   new
ATOM      0 HH11 ARG A  55      -8.238  -6.772   6.290  1.00 64.20           H   new
ATOM      0 HH12 ARG A  55      -9.901  -7.071   5.777  1.00 64.20           H   new
ATOM      0 HH21 ARG A  55      -9.013  -8.094   2.536  1.00 74.22           H   new
ATOM      0 HH22 ARG A  55     -10.333  -7.811   3.676  1.00 74.22           H   new
ATOM    524  N   GLU A  56      -0.930  -7.319   6.957  1.00 75.55           N
ATOM    525  CA  GLU A  56      -0.095  -6.942   8.115  1.00 31.15           C
ATOM    526  C   GLU A  56       1.388  -6.818   7.726  1.00 21.50           C
ATOM    527  O   GLU A  56       2.096  -5.926   8.218  1.00 63.44           O
ATOM    528  CB  GLU A  56      -0.284  -7.991   9.242  1.00 63.40           C
ATOM    529  CG  GLU A  56      -1.759  -8.241   9.634  1.00 13.50           C
ATOM    530  CD  GLU A  56      -2.501  -6.956  10.050  1.00 71.13           C
ATOM    531  OE1 GLU A  56      -2.331  -6.509  11.202  1.00 74.05           O
ATOM    532  OE2 GLU A  56      -3.255  -6.390   9.222  1.00 15.42           O
ATOM      0  H   GLU A  56      -1.353  -8.242   7.051  1.00 75.55           H   new
ATOM      0  HA  GLU A  56      -0.414  -5.963   8.472  1.00 31.15           H   new
ATOM      0  HB2 GLU A  56       0.161  -8.934   8.924  1.00 63.40           H   new
ATOM      0  HB3 GLU A  56       0.264  -7.662  10.125  1.00 63.40           H   new
ATOM      0  HG2 GLU A  56      -2.280  -8.698   8.792  1.00 13.50           H   new
ATOM      0  HG3 GLU A  56      -1.794  -8.956  10.456  1.00 13.50           H   new
ATOM    539  N   ASP A  57       1.839  -7.708   6.823  1.00 24.33           N
ATOM    540  CA  ASP A  57       3.213  -7.688   6.290  1.00 21.34           C
ATOM    541  C   ASP A  57       3.436  -6.423   5.453  1.00 34.22           C
ATOM    542  O   ASP A  57       4.440  -5.717   5.628  1.00 12.15           O
ATOM    543  CB  ASP A  57       3.476  -8.958   5.442  1.00 45.31           C
ATOM    544  CG  ASP A  57       4.889  -9.028   4.835  1.00 53.31           C
ATOM    545  OD1 ASP A  57       5.872  -8.694   5.535  1.00 11.01           O
ATOM    546  OD2 ASP A  57       5.027  -9.448   3.671  1.00 74.24           O
ATOM      0  H   ASP A  57       1.263  -8.459   6.443  1.00 24.33           H   new
ATOM      0  HA  ASP A  57       3.916  -7.679   7.123  1.00 21.34           H   new
ATOM      0  HB2 ASP A  57       3.316  -9.838   6.066  1.00 45.31           H   new
ATOM      0  HB3 ASP A  57       2.744  -9.002   4.636  1.00 45.31           H   new
ATOM    551  N   LEU A  58       2.456  -6.135   4.584  1.00 51.43           N
ATOM    552  CA  LEU A  58       2.464  -4.951   3.717  1.00 15.21           C
ATOM    553  C   LEU A  58       2.387  -3.644   4.549  1.00  1.42           C
ATOM    554  O   LEU A  58       3.019  -2.649   4.198  1.00 20.33           O
ATOM    555  CB  LEU A  58       1.297  -5.049   2.700  1.00 51.42           C
ATOM    556  CG  LEU A  58       1.361  -6.249   1.695  1.00 34.20           C
ATOM    557  CD1 LEU A  58       0.049  -6.391   0.903  1.00  5.21           C
ATOM    558  CD2 LEU A  58       2.571  -6.130   0.737  1.00 61.12           C
ATOM      0  H   LEU A  58       1.631  -6.722   4.463  1.00 51.43           H   new
ATOM      0  HA  LEU A  58       3.405  -4.919   3.168  1.00 15.21           H   new
ATOM      0  HB2 LEU A  58       0.362  -5.116   3.256  1.00 51.42           H   new
ATOM      0  HB3 LEU A  58       1.262  -4.122   2.127  1.00 51.42           H   new
ATOM      0  HG  LEU A  58       1.496  -7.154   2.288  1.00 34.20           H   new
ATOM      0 HD11 LEU A  58       0.128  -7.233   0.215  1.00  5.21           H   new
ATOM      0 HD12 LEU A  58      -0.776  -6.563   1.594  1.00  5.21           H   new
ATOM      0 HD13 LEU A  58      -0.136  -5.477   0.338  1.00  5.21           H   new
ATOM      0 HD21 LEU A  58       2.581  -6.981   0.056  1.00 61.12           H   new
ATOM      0 HD22 LEU A  58       2.491  -5.207   0.163  1.00 61.12           H   new
ATOM      0 HD23 LEU A  58       3.494  -6.119   1.316  1.00 61.12           H   new
ATOM    570  N   ILE A  59       1.625  -3.679   5.668  1.00 50.23           N
ATOM    571  CA  ILE A  59       1.537  -2.559   6.635  1.00 33.13           C
ATOM    572  C   ILE A  59       2.902  -2.318   7.299  1.00 74.14           C
ATOM    573  O   ILE A  59       3.331  -1.172   7.423  1.00 21.12           O
ATOM    574  CB  ILE A  59       0.439  -2.824   7.750  1.00 55.11           C
ATOM    575  CG1 ILE A  59      -0.995  -2.812   7.130  1.00 32.12           C
ATOM    576  CG2 ILE A  59       0.529  -1.812   8.927  1.00 53.33           C
ATOM    577  CD1 ILE A  59      -2.104  -3.267   8.070  1.00 64.44           C
ATOM      0  H   ILE A  59       1.054  -4.484   5.926  1.00 50.23           H   new
ATOM      0  HA  ILE A  59       1.241  -1.671   6.076  1.00 33.13           H   new
ATOM      0  HB  ILE A  59       0.641  -3.813   8.160  1.00 55.11           H   new
ATOM      0 HG12 ILE A  59      -1.219  -1.801   6.789  1.00 32.12           H   new
ATOM      0 HG13 ILE A  59      -0.999  -3.454   6.249  1.00 32.12           H   new
ATOM      0 HG21 ILE A  59      -0.244  -2.038   9.661  1.00 53.33           H   new
ATOM      0 HG22 ILE A  59       1.509  -1.887   9.397  1.00 53.33           H   new
ATOM      0 HG23 ILE A  59       0.385  -0.800   8.549  1.00 53.33           H   new
ATOM      0 HD11 ILE A  59      -3.061  -3.224   7.551  1.00 64.44           H   new
ATOM      0 HD12 ILE A  59      -1.911  -4.290   8.392  1.00 64.44           H   new
ATOM      0 HD13 ILE A  59      -2.134  -2.612   8.941  1.00 64.44           H   new
ATOM    589  N   LYS A  60       3.570  -3.417   7.718  1.00 14.01           N
ATOM    590  CA  LYS A  60       4.887  -3.354   8.388  1.00 44.24           C
ATOM    591  C   LYS A  60       5.940  -2.714   7.461  1.00 23.20           C
ATOM    592  O   LYS A  60       6.643  -1.775   7.868  1.00 44.32           O
ATOM    593  CB  LYS A  60       5.355  -4.774   8.824  1.00  4.03           C
ATOM    594  CG  LYS A  60       6.738  -4.797   9.525  1.00 24.20           C
ATOM    595  CD  LYS A  60       7.251  -6.211   9.906  1.00 33.50           C
ATOM    596  CE  LYS A  60       7.500  -7.149   8.697  1.00 24.21           C
ATOM    597  NZ  LYS A  60       6.243  -7.730   8.162  1.00 75.22           N
ATOM      0  H   LYS A  60       3.214  -4.366   7.602  1.00 14.01           H   new
ATOM      0  HA  LYS A  60       4.780  -2.734   9.278  1.00 44.24           H   new
ATOM      0  HB2 LYS A  60       4.611  -5.199   9.498  1.00  4.03           H   new
ATOM      0  HB3 LYS A  60       5.394  -5.418   7.945  1.00  4.03           H   new
ATOM      0  HG2 LYS A  60       7.470  -4.325   8.870  1.00 24.20           H   new
ATOM      0  HG3 LYS A  60       6.682  -4.191  10.429  1.00 24.20           H   new
ATOM      0  HD2 LYS A  60       8.179  -6.108  10.468  1.00 33.50           H   new
ATOM      0  HD3 LYS A  60       6.526  -6.680  10.571  1.00 33.50           H   new
ATOM      0  HE2 LYS A  60       8.005  -6.593   7.907  1.00 24.21           H   new
ATOM      0  HE3 LYS A  60       8.170  -7.954   8.998  1.00 24.21           H   new
ATOM      0  HZ1 LYS A  60       6.235  -8.756   8.332  1.00 75.22           H   new
ATOM      0  HZ2 LYS A  60       5.428  -7.293   8.639  1.00 75.22           H   new
ATOM      0  HZ3 LYS A  60       6.184  -7.548   7.140  1.00 75.22           H   new
ATOM    611  N   LYS A  61       6.015  -3.218   6.205  1.00 22.20           N
ATOM    612  CA  LYS A  61       6.965  -2.711   5.190  1.00 50.11           C
ATOM    613  C   LYS A  61       6.688  -1.231   4.882  1.00 55.42           C
ATOM    614  O   LYS A  61       7.595  -0.396   4.944  1.00 42.52           O
ATOM    615  CB  LYS A  61       6.888  -3.538   3.877  1.00 64.34           C
ATOM    616  CG  LYS A  61       7.227  -5.037   4.019  1.00  2.23           C
ATOM    617  CD  LYS A  61       7.221  -5.762   2.650  1.00 54.43           C
ATOM    618  CE  LYS A  61       7.393  -7.283   2.762  1.00 61.32           C
ATOM    619  NZ  LYS A  61       8.649  -7.674   3.449  1.00 24.03           N
ATOM      0  H   LYS A  61       5.424  -3.980   5.871  1.00 22.20           H   new
ATOM      0  HA  LYS A  61       7.968  -2.812   5.604  1.00 50.11           H   new
ATOM      0  HB2 LYS A  61       5.881  -3.447   3.469  1.00 64.34           H   new
ATOM      0  HB3 LYS A  61       7.568  -3.096   3.149  1.00 64.34           H   new
ATOM      0  HG2 LYS A  61       8.207  -5.145   4.483  1.00  2.23           H   new
ATOM      0  HG3 LYS A  61       6.505  -5.511   4.684  1.00  2.23           H   new
ATOM      0  HD2 LYS A  61       6.283  -5.547   2.138  1.00 54.43           H   new
ATOM      0  HD3 LYS A  61       8.022  -5.358   2.031  1.00 54.43           H   new
ATOM      0  HE2 LYS A  61       6.544  -7.701   3.303  1.00 61.32           H   new
ATOM      0  HE3 LYS A  61       7.380  -7.719   1.763  1.00 61.32           H   new
ATOM      0  HZ1 LYS A  61       8.711  -8.711   3.495  1.00 24.03           H   new
ATOM      0  HZ2 LYS A  61       9.464  -7.302   2.921  1.00 24.03           H   new
ATOM      0  HZ3 LYS A  61       8.653  -7.284   4.413  1.00 24.03           H   new
ATOM    633  N   ALA A  62       5.407  -0.918   4.596  1.00 33.11           N
ATOM    634  CA  ALA A  62       4.969   0.444   4.231  1.00 31.34           C
ATOM    635  C   ALA A  62       5.215   1.450   5.364  1.00 53.04           C
ATOM    636  O   ALA A  62       5.591   2.582   5.111  1.00 65.32           O
ATOM    637  CB  ALA A  62       3.488   0.441   3.838  1.00 21.50           C
ATOM      0  H   ALA A  62       4.650  -1.601   4.612  1.00 33.11           H   new
ATOM      0  HA  ALA A  62       5.567   0.760   3.376  1.00 31.34           H   new
ATOM      0  HB1 ALA A  62       3.180   1.452   3.572  1.00 21.50           H   new
ATOM      0  HB2 ALA A  62       3.339  -0.220   2.984  1.00 21.50           H   new
ATOM      0  HB3 ALA A  62       2.889   0.089   4.678  1.00 21.50           H   new
ATOM    643  N   ASP A  63       5.021   1.010   6.617  1.00 42.20           N
ATOM    644  CA  ASP A  63       5.252   1.855   7.810  1.00 20.20           C
ATOM    645  C   ASP A  63       6.752   2.128   7.971  1.00  5.32           C
ATOM    646  O   ASP A  63       7.162   3.256   8.263  1.00 74.20           O
ATOM    647  CB  ASP A  63       4.696   1.166   9.081  1.00 63.42           C
ATOM    648  CG  ASP A  63       4.827   2.029  10.351  1.00 12.01           C
ATOM    649  OD1 ASP A  63       3.943   2.876  10.595  1.00 45.34           O
ATOM    650  OD2 ASP A  63       5.817   1.871  11.095  1.00 34.02           O
ATOM      0  H   ASP A  63       4.702   0.066   6.836  1.00 42.20           H   new
ATOM      0  HA  ASP A  63       4.728   2.801   7.675  1.00 20.20           H   new
ATOM      0  HB2 ASP A  63       3.645   0.922   8.923  1.00 63.42           H   new
ATOM      0  HB3 ASP A  63       5.222   0.224   9.235  1.00 63.42           H   new
ATOM    655  N   GLU A  64       7.556   1.079   7.738  1.00  5.52           N
ATOM    656  CA  GLU A  64       9.028   1.164   7.721  1.00 42.14           C
ATOM    657  C   GLU A  64       9.521   2.107   6.595  1.00 30.22           C
ATOM    658  O   GLU A  64      10.573   2.740   6.721  1.00 23.43           O
ATOM    659  CB  GLU A  64       9.621  -0.260   7.558  1.00 14.42           C
ATOM    660  CG  GLU A  64      11.159  -0.344   7.512  1.00 54.24           C
ATOM    661  CD  GLU A  64      11.671  -1.793   7.542  1.00 43.14           C
ATOM    662  OE1 GLU A  64      11.661  -2.467   6.485  1.00 14.24           O
ATOM    663  OE2 GLU A  64      12.056  -2.277   8.632  1.00 41.24           O
ATOM      0  H   GLU A  64       7.202   0.140   7.555  1.00  5.52           H   new
ATOM      0  HA  GLU A  64       9.371   1.587   8.665  1.00 42.14           H   new
ATOM      0  HB2 GLU A  64       9.267  -0.877   8.383  1.00 14.42           H   new
ATOM      0  HB3 GLU A  64       9.224  -0.696   6.641  1.00 14.42           H   new
ATOM      0  HG2 GLU A  64      11.519   0.147   6.608  1.00 54.24           H   new
ATOM      0  HG3 GLU A  64      11.575   0.202   8.359  1.00 54.24           H   new
ATOM    670  N   LYS A  65       8.737   2.193   5.503  1.00 64.03           N
ATOM    671  CA  LYS A  65       9.001   3.136   4.388  1.00 30.25           C
ATOM    672  C   LYS A  65       8.325   4.510   4.625  1.00 21.21           C
ATOM    673  O   LYS A  65       8.560   5.447   3.860  1.00 40.44           O
ATOM    674  CB  LYS A  65       8.499   2.522   3.056  1.00 14.20           C
ATOM    675  CG  LYS A  65       9.134   1.160   2.699  1.00 44.53           C
ATOM    676  CD  LYS A  65      10.668   1.230   2.531  1.00 72.31           C
ATOM    677  CE  LYS A  65      11.280  -0.127   2.147  1.00 22.35           C
ATOM    678  NZ  LYS A  65      12.742  -0.027   1.929  1.00 40.22           N
ATOM      0  H   LYS A  65       7.907   1.617   5.365  1.00 64.03           H   new
ATOM      0  HA  LYS A  65      10.077   3.302   4.336  1.00 30.25           H   new
ATOM      0  HB2 LYS A  65       7.417   2.401   3.111  1.00 14.20           H   new
ATOM      0  HB3 LYS A  65       8.700   3.225   2.248  1.00 14.20           H   new
ATOM      0  HG2 LYS A  65       8.893   0.438   3.479  1.00 44.53           H   new
ATOM      0  HG3 LYS A  65       8.690   0.790   1.775  1.00 44.53           H   new
ATOM      0  HD2 LYS A  65      10.913   1.966   1.765  1.00 72.31           H   new
ATOM      0  HD3 LYS A  65      11.117   1.577   3.462  1.00 72.31           H   new
ATOM      0  HE2 LYS A  65      11.078  -0.853   2.935  1.00 22.35           H   new
ATOM      0  HE3 LYS A  65      10.802  -0.499   1.241  1.00 22.35           H   new
ATOM      0  HZ1 LYS A  65      13.119  -0.961   1.672  1.00 40.22           H   new
ATOM      0  HZ2 LYS A  65      12.933   0.647   1.160  1.00 40.22           H   new
ATOM      0  HZ3 LYS A  65      13.201   0.304   2.802  1.00 40.22           H   new
ATOM    692  N   GLY A  66       7.476   4.603   5.672  1.00 62.20           N
ATOM    693  CA  GLY A  66       6.751   5.842   6.012  1.00 32.44           C
ATOM    694  C   GLY A  66       5.526   6.119   5.131  1.00 22.11           C
ATOM    695  O   GLY A  66       4.930   7.193   5.222  1.00 54.13           O
ATOM      0  H   GLY A  66       7.276   3.825   6.300  1.00 62.20           H   new
ATOM      0  HA2 GLY A  66       6.431   5.788   7.052  1.00 32.44           H   new
ATOM      0  HA3 GLY A  66       7.438   6.684   5.934  1.00 32.44           H   new
ATOM    699  N   ALA A  67       5.164   5.146   4.276  1.00 34.42           N
ATOM    700  CA  ALA A  67       4.017   5.239   3.353  1.00 23.42           C
ATOM    701  C   ALA A  67       2.674   5.302   4.100  1.00 40.15           C
ATOM    702  O   ALA A  67       2.399   4.462   4.960  1.00 60.23           O
ATOM    703  CB  ALA A  67       4.017   4.055   2.391  1.00  3.15           C
ATOM      0  H   ALA A  67       5.666   4.261   4.205  1.00 34.42           H   new
ATOM      0  HA  ALA A  67       4.128   6.168   2.794  1.00 23.42           H   new
ATOM      0  HB1 ALA A  67       3.166   4.135   1.715  1.00  3.15           H   new
ATOM      0  HB2 ALA A  67       4.941   4.056   1.813  1.00  3.15           H   new
ATOM      0  HB3 ALA A  67       3.944   3.126   2.957  1.00  3.15           H   new
ATOM    709  N   ASP A  68       1.834   6.275   3.713  1.00 33.42           N
ATOM    710  CA  ASP A  68       0.536   6.539   4.359  1.00  3.41           C
ATOM    711  C   ASP A  68      -0.541   5.564   3.872  1.00 63.22           C
ATOM    712  O   ASP A  68      -1.462   5.241   4.624  1.00 24.15           O
ATOM    713  CB  ASP A  68       0.100   8.001   4.116  1.00  1.30           C
ATOM    714  CG  ASP A  68       0.984   9.007   4.865  1.00 32.44           C
ATOM    715  OD1 ASP A  68       0.705   9.286   6.052  1.00 64.14           O
ATOM    716  OD2 ASP A  68       1.974   9.506   4.280  1.00 54.34           O
ATOM      0  H   ASP A  68       2.037   6.906   2.938  1.00 33.42           H   new
ATOM      0  HA  ASP A  68       0.658   6.385   5.431  1.00  3.41           H   new
ATOM      0  HB2 ASP A  68       0.135   8.215   3.048  1.00  1.30           H   new
ATOM      0  HB3 ASP A  68      -0.936   8.126   4.432  1.00  1.30           H   new
ATOM    721  N   VAL A  69      -0.427   5.093   2.613  1.00 40.51           N
ATOM    722  CA  VAL A  69      -1.372   4.113   2.039  1.00 15.52           C
ATOM    723  C   VAL A  69      -0.610   2.923   1.433  1.00 42.20           C
ATOM    724  O   VAL A  69       0.413   3.098   0.751  1.00 51.11           O
ATOM    725  CB  VAL A  69      -2.311   4.742   0.933  1.00 30.32           C
ATOM    726  CG1 VAL A  69      -3.308   3.696   0.359  1.00 10.05           C
ATOM    727  CG2 VAL A  69      -3.083   5.961   1.477  1.00 11.33           C
ATOM      0  H   VAL A  69       0.314   5.377   1.972  1.00 40.51           H   new
ATOM      0  HA  VAL A  69      -2.004   3.778   2.862  1.00 15.52           H   new
ATOM      0  HB  VAL A  69      -1.661   5.074   0.123  1.00 30.32           H   new
ATOM      0 HG11 VAL A  69      -3.935   4.168  -0.398  1.00 10.05           H   new
ATOM      0 HG12 VAL A  69      -2.753   2.873  -0.091  1.00 10.05           H   new
ATOM      0 HG13 VAL A  69      -3.936   3.313   1.163  1.00 10.05           H   new
ATOM      0 HG21 VAL A  69      -3.719   6.369   0.691  1.00 11.33           H   new
ATOM      0 HG22 VAL A  69      -3.701   5.653   2.321  1.00 11.33           H   new
ATOM      0 HG23 VAL A  69      -2.376   6.723   1.804  1.00 11.33           H   new
ATOM    737  N   VAL A  70      -1.143   1.727   1.706  1.00 54.13           N
ATOM    738  CA  VAL A  70      -0.762   0.471   1.060  1.00 65.52           C
ATOM    739  C   VAL A  70      -1.834   0.159   0.000  1.00 21.21           C
ATOM    740  O   VAL A  70      -2.990  -0.160   0.350  1.00 30.32           O
ATOM    741  CB  VAL A  70      -0.702  -0.719   2.085  1.00 72.04           C
ATOM    742  CG1 VAL A  70      -0.068  -1.974   1.444  1.00 43.35           C
ATOM    743  CG2 VAL A  70       0.024  -0.323   3.390  1.00 62.45           C
ATOM      0  H   VAL A  70      -1.875   1.605   2.406  1.00 54.13           H   new
ATOM      0  HA  VAL A  70       0.230   0.580   0.622  1.00 65.52           H   new
ATOM      0  HB  VAL A  70      -1.729  -0.964   2.356  1.00 72.04           H   new
ATOM      0 HG11 VAL A  70      -0.039  -2.781   2.176  1.00 43.35           H   new
ATOM      0 HG12 VAL A  70      -0.663  -2.284   0.585  1.00 43.35           H   new
ATOM      0 HG13 VAL A  70       0.946  -1.743   1.118  1.00 43.35           H   new
ATOM      0 HG21 VAL A  70       0.042  -1.175   4.069  1.00 62.45           H   new
ATOM      0 HG22 VAL A  70       1.046  -0.020   3.160  1.00 62.45           H   new
ATOM      0 HG23 VAL A  70      -0.503   0.506   3.862  1.00 62.45           H   new
ATOM    753  N   VAL A  71      -1.458   0.286  -1.275  1.00 32.42           N
ATOM    754  CA  VAL A  71      -2.380   0.147  -2.414  1.00 31.13           C
ATOM    755  C   VAL A  71      -2.264  -1.258  -3.002  1.00 24.34           C
ATOM    756  O   VAL A  71      -1.301  -1.554  -3.724  1.00 30.51           O
ATOM    757  CB  VAL A  71      -2.082   1.220  -3.517  1.00  1.01           C
ATOM    758  CG1 VAL A  71      -3.087   1.148  -4.693  1.00 11.35           C
ATOM    759  CG2 VAL A  71      -2.050   2.632  -2.897  1.00 63.42           C
ATOM      0  H   VAL A  71      -0.498   0.490  -1.552  1.00 32.42           H   new
ATOM      0  HA  VAL A  71      -3.397   0.307  -2.055  1.00 31.13           H   new
ATOM      0  HB  VAL A  71      -1.099   0.999  -3.933  1.00  1.01           H   new
ATOM      0 HG11 VAL A  71      -2.839   1.911  -5.431  1.00 11.35           H   new
ATOM      0 HG12 VAL A  71      -3.034   0.163  -5.157  1.00 11.35           H   new
ATOM      0 HG13 VAL A  71      -4.097   1.319  -4.320  1.00 11.35           H   new
ATOM      0 HG21 VAL A  71      -1.842   3.366  -3.675  1.00 63.42           H   new
ATOM      0 HG22 VAL A  71      -3.015   2.851  -2.440  1.00 63.42           H   new
ATOM      0 HG23 VAL A  71      -1.270   2.678  -2.137  1.00 63.42           H   new
ATOM    769  N   LEU A  72      -3.239  -2.116  -2.658  1.00 12.22           N
ATOM    770  CA  LEU A  72      -3.315  -3.503  -3.122  1.00 54.33           C
ATOM    771  C   LEU A  72      -3.535  -3.532  -4.646  1.00 54.21           C
ATOM    772  O   LEU A  72      -4.675  -3.466  -5.138  1.00 22.54           O
ATOM    773  CB  LEU A  72      -4.444  -4.266  -2.378  1.00 73.32           C
ATOM    774  CG  LEU A  72      -4.410  -4.181  -0.815  1.00 22.00           C
ATOM    775  CD1 LEU A  72      -5.591  -4.942  -0.189  1.00 14.45           C
ATOM    776  CD2 LEU A  72      -3.063  -4.679  -0.241  1.00 65.55           C
ATOM      0  H   LEU A  72      -4.007  -1.857  -2.039  1.00 12.22           H   new
ATOM      0  HA  LEU A  72      -2.374  -4.006  -2.899  1.00 54.33           H   new
ATOM      0  HB2 LEU A  72      -5.404  -3.882  -2.723  1.00 73.32           H   new
ATOM      0  HB3 LEU A  72      -4.398  -5.316  -2.667  1.00 73.32           H   new
ATOM      0  HG  LEU A  72      -4.508  -3.129  -0.549  1.00 22.00           H   new
ATOM      0 HD11 LEU A  72      -5.539  -4.864   0.897  1.00 14.45           H   new
ATOM      0 HD12 LEU A  72      -6.529  -4.511  -0.539  1.00 14.45           H   new
ATOM      0 HD13 LEU A  72      -5.543  -5.991  -0.480  1.00 14.45           H   new
ATOM      0 HD21 LEU A  72      -3.081  -4.603   0.846  1.00 65.55           H   new
ATOM      0 HD22 LEU A  72      -2.906  -5.718  -0.530  1.00 65.55           H   new
ATOM      0 HD23 LEU A  72      -2.251  -4.067  -0.634  1.00 65.55           H   new
ATOM    788  N   THR A  73      -2.410  -3.532  -5.365  1.00 75.23           N
ATOM    789  CA  THR A  73      -2.369  -3.603  -6.830  1.00 13.42           C
ATOM    790  C   THR A  73      -2.322  -5.072  -7.303  1.00 13.22           C
ATOM    791  O   THR A  73      -2.424  -5.343  -8.505  1.00 74.01           O
ATOM    792  CB  THR A  73      -1.133  -2.807  -7.353  1.00 25.11           C
ATOM    793  OG1 THR A  73       0.038  -3.215  -6.616  1.00  0.22           O
ATOM    794  CG2 THR A  73      -1.334  -1.284  -7.201  1.00 43.04           C
ATOM      0  H   THR A  73      -1.485  -3.482  -4.939  1.00 75.23           H   new
ATOM      0  HA  THR A  73      -3.275  -3.155  -7.237  1.00 13.42           H   new
ATOM      0  HB  THR A  73      -1.009  -3.024  -8.414  1.00 25.11           H   new
ATOM      0  HG1 THR A  73       0.757  -2.565  -6.759  1.00  0.22           H   new
ATOM      0 HG21 THR A  73      -0.454  -0.762  -7.575  1.00 43.04           H   new
ATOM      0 HG22 THR A  73      -2.210  -0.974  -7.771  1.00 43.04           H   new
ATOM      0 HG23 THR A  73      -1.481  -1.040  -6.149  1.00 43.04           H   new
ATOM    802  N   SER A  74      -2.143  -6.005  -6.340  1.00 41.22           N
ATOM    803  CA  SER A  74      -2.221  -7.459  -6.581  1.00 12.42           C
ATOM    804  C   SER A  74      -3.628  -7.862  -7.062  1.00 61.02           C
ATOM    805  O   SER A  74      -4.634  -7.226  -6.690  1.00 63.33           O
ATOM    806  CB  SER A  74      -1.866  -8.226  -5.282  1.00 10.44           C
ATOM    807  OG  SER A  74      -1.957  -9.638  -5.446  1.00 11.51           O
ATOM      0  H   SER A  74      -1.939  -5.766  -5.370  1.00 41.22           H   new
ATOM      0  HA  SER A  74      -1.506  -7.718  -7.362  1.00 12.42           H   new
ATOM      0  HB2 SER A  74      -0.855  -7.963  -4.972  1.00 10.44           H   new
ATOM      0  HB3 SER A  74      -2.536  -7.911  -4.482  1.00 10.44           H   new
ATOM      0  HG  SER A  74      -1.723 -10.081  -4.604  1.00 11.51           H   new
ATOM    813  N   GLY A  75      -3.679  -8.931  -7.882  1.00  2.41           N
ATOM    814  CA  GLY A  75      -4.946  -9.536  -8.312  1.00 14.52           C
ATOM    815  C   GLY A  75      -5.793 -10.038  -7.148  1.00 64.52           C
ATOM    816  O   GLY A  75      -7.026 -10.113  -7.257  1.00  3.31           O
ATOM      0  H   GLY A  75      -2.851  -9.392  -8.259  1.00  2.41           H   new
ATOM      0  HA2 GLY A  75      -5.518  -8.802  -8.880  1.00 14.52           H   new
ATOM      0  HA3 GLY A  75      -4.735 -10.367  -8.985  1.00 14.52           H   new
ATOM    820  N   GLN A  76      -5.103 -10.408  -6.040  1.00 54.11           N
ATOM    821  CA  GLN A  76      -5.726 -10.695  -4.723  1.00 23.12           C
ATOM    822  C   GLN A  76      -6.712 -11.890  -4.825  1.00 62.14           C
ATOM    823  O   GLN A  76      -7.630 -12.042  -4.016  1.00 64.21           O
ATOM    824  CB  GLN A  76      -6.406  -9.392  -4.191  1.00 61.14           C
ATOM    825  CG  GLN A  76      -6.877  -9.424  -2.726  1.00 13.13           C
ATOM    826  CD  GLN A  76      -7.708  -8.207  -2.352  1.00 42.51           C
ATOM    827  OE1 GLN A  76      -8.929  -8.208  -2.495  1.00 41.42           O
ATOM    828  NE2 GLN A  76      -7.055  -7.147  -1.917  1.00 44.21           N
ATOM      0  H   GLN A  76      -4.089 -10.517  -6.036  1.00 54.11           H   new
ATOM      0  HA  GLN A  76      -4.963 -10.997  -4.005  1.00 23.12           H   new
ATOM      0  HB2 GLN A  76      -5.704  -8.566  -4.308  1.00 61.14           H   new
ATOM      0  HB3 GLN A  76      -7.266  -9.171  -4.823  1.00 61.14           H   new
ATOM      0  HG2 GLN A  76      -7.465 -10.326  -2.557  1.00 13.13           H   new
ATOM      0  HG3 GLN A  76      -6.008  -9.482  -2.070  1.00 13.13           H   new
ATOM      0 HE21 GLN A  76      -6.041  -7.181  -1.810  1.00 44.21           H   new
ATOM      0 HE22 GLN A  76      -7.564  -6.293  -1.688  1.00 44.21           H   new
ATOM    837  N   THR A  77      -6.457 -12.776  -5.804  1.00  1.31           N
ATOM    838  CA  THR A  77      -7.359 -13.894  -6.145  1.00 51.51           C
ATOM    839  C   THR A  77      -7.468 -14.932  -5.010  1.00 61.33           C
ATOM    840  O   THR A  77      -8.444 -15.684  -4.953  1.00 22.30           O
ATOM    841  CB  THR A  77      -6.896 -14.592  -7.467  1.00 21.24           C
ATOM    842  OG1 THR A  77      -7.891 -15.527  -7.919  1.00 34.05           O
ATOM    843  CG2 THR A  77      -5.540 -15.322  -7.325  1.00 53.22           C
ATOM      0  H   THR A  77      -5.618 -12.738  -6.383  1.00  1.31           H   new
ATOM      0  HA  THR A  77      -8.350 -13.465  -6.290  1.00 51.51           H   new
ATOM      0  HB  THR A  77      -6.765 -13.796  -8.200  1.00 21.24           H   new
ATOM      0  HG1 THR A  77      -7.587 -15.954  -8.747  1.00 34.05           H   new
ATOM      0 HG21 THR A  77      -5.275 -15.785  -8.275  1.00 53.22           H   new
ATOM      0 HG22 THR A  77      -4.769 -14.605  -7.043  1.00 53.22           H   new
ATOM      0 HG23 THR A  77      -5.619 -16.091  -6.556  1.00 53.22           H   new
ATOM    851  N   GLU A  78      -6.436 -14.953  -4.138  1.00  1.32           N
ATOM    852  CA  GLU A  78      -6.340 -15.857  -2.983  1.00 15.55           C
ATOM    853  C   GLU A  78      -6.360 -17.329  -3.451  1.00 64.11           C
ATOM    854  O   GLU A  78      -7.338 -18.065  -3.257  1.00 15.10           O
ATOM    855  CB  GLU A  78      -7.442 -15.545  -1.935  1.00  4.54           C
ATOM    856  CG  GLU A  78      -7.284 -16.306  -0.607  1.00 53.20           C
ATOM    857  CD  GLU A  78      -8.352 -15.959   0.434  1.00 14.44           C
ATOM    858  OE1 GLU A  78      -8.333 -14.819   0.942  1.00 70.13           O
ATOM    859  OE2 GLU A  78      -9.211 -16.816   0.744  1.00 31.53           O
ATOM      0  H   GLU A  78      -5.634 -14.328  -4.224  1.00  1.32           H   new
ATOM      0  HA  GLU A  78      -5.386 -15.691  -2.482  1.00 15.55           H   new
ATOM      0  HB2 GLU A  78      -7.440 -14.475  -1.730  1.00  4.54           H   new
ATOM      0  HB3 GLU A  78      -8.415 -15.785  -2.365  1.00  4.54           H   new
ATOM      0  HG2 GLU A  78      -7.318 -17.377  -0.806  1.00 53.20           H   new
ATOM      0  HG3 GLU A  78      -6.300 -16.091  -0.190  1.00 53.20           H   new
ATOM    866  N   ASN A  79      -5.272 -17.697  -4.134  1.00 33.13           N
ATOM    867  CA  ASN A  79      -5.054 -19.037  -4.697  1.00 43.25           C
ATOM    868  C   ASN A  79      -3.581 -19.133  -5.102  1.00 35.05           C
ATOM    869  O   ASN A  79      -2.835 -19.985  -4.618  1.00 51.14           O
ATOM    870  CB  ASN A  79      -5.999 -19.291  -5.912  1.00 30.05           C
ATOM    871  CG  ASN A  79      -5.802 -20.661  -6.580  1.00 23.11           C
ATOM    872  OD1 ASN A  79      -5.055 -20.789  -7.554  1.00 34.21           O
ATOM    873  ND2 ASN A  79      -6.460 -21.688  -6.055  1.00 14.14           N
ATOM      0  H   ASN A  79      -4.499 -17.058  -4.316  1.00 33.13           H   new
ATOM      0  HA  ASN A  79      -5.287 -19.804  -3.959  1.00 43.25           H   new
ATOM      0  HB2 ASN A  79      -7.033 -19.206  -5.579  1.00 30.05           H   new
ATOM      0  HB3 ASN A  79      -5.838 -18.509  -6.654  1.00 30.05           H   new
ATOM      0 HD21 ASN A  79      -6.356 -22.620  -6.457  1.00 14.14           H   new
ATOM      0 HD22 ASN A  79      -7.069 -21.545  -5.249  1.00 14.14           H   new
ATOM    880  N   LYS A  80      -3.174 -18.198  -5.979  1.00 64.14           N
ATOM    881  CA  LYS A  80      -1.776 -18.024  -6.411  1.00 52.34           C
ATOM    882  C   LYS A  80      -1.494 -16.519  -6.540  1.00 74.44           C
ATOM    883  O   LYS A  80      -1.931 -15.882  -7.511  1.00 10.22           O
ATOM    884  CB  LYS A  80      -1.490 -18.743  -7.770  1.00 34.23           C
ATOM    885  CG  LYS A  80      -1.642 -20.281  -7.747  1.00 13.10           C
ATOM    886  CD  LYS A  80      -1.324 -20.946  -9.105  1.00 12.44           C
ATOM    887  CE  LYS A  80       0.139 -20.744  -9.546  1.00  1.21           C
ATOM    888  NZ  LYS A  80       0.432 -21.425 -10.831  1.00 20.24           N
ATOM      0  H   LYS A  80      -3.815 -17.534  -6.413  1.00 64.14           H   new
ATOM      0  HA  LYS A  80      -1.120 -18.477  -5.668  1.00 52.34           H   new
ATOM      0  HB2 LYS A  80      -2.164 -18.339  -8.525  1.00 34.23           H   new
ATOM      0  HB3 LYS A  80      -0.475 -18.499  -8.085  1.00 34.23           H   new
ATOM      0  HG2 LYS A  80      -0.981 -20.693  -6.985  1.00 13.10           H   new
ATOM      0  HG3 LYS A  80      -2.661 -20.534  -7.456  1.00 13.10           H   new
ATOM      0  HD2 LYS A  80      -1.534 -22.014  -9.039  1.00 12.44           H   new
ATOM      0  HD3 LYS A  80      -1.987 -20.538  -9.868  1.00 12.44           H   new
ATOM      0  HE2 LYS A  80       0.343 -19.678  -9.646  1.00  1.21           H   new
ATOM      0  HE3 LYS A  80       0.806 -21.125  -8.773  1.00  1.21           H   new
ATOM      0  HZ1 LYS A  80       1.426 -21.264 -11.091  1.00 20.24           H   new
ATOM      0  HZ2 LYS A  80       0.262 -22.446 -10.729  1.00 20.24           H   new
ATOM      0  HZ3 LYS A  80      -0.186 -21.043 -11.575  1.00 20.24           H   new
ATOM    902  N   ILE A  81      -0.817 -15.943  -5.533  1.00 10.44           N
ATOM    903  CA  ILE A  81      -0.440 -14.516  -5.510  1.00 21.15           C
ATOM    904  C   ILE A  81       1.001 -14.358  -4.992  1.00 64.40           C
ATOM    905  O   ILE A  81       1.469 -15.152  -4.164  1.00  1.44           O
ATOM    906  CB  ILE A  81      -1.411 -13.634  -4.618  1.00 10.34           C
ATOM    907  CG1 ILE A  81      -1.529 -14.227  -3.172  1.00 60.34           C
ATOM    908  CG2 ILE A  81      -2.804 -13.456  -5.281  1.00 13.02           C
ATOM    909  CD1 ILE A  81      -2.319 -13.374  -2.192  1.00 42.43           C
ATOM      0  H   ILE A  81      -0.513 -16.456  -4.706  1.00 10.44           H   new
ATOM      0  HA  ILE A  81      -0.520 -14.158  -6.536  1.00 21.15           H   new
ATOM      0  HB  ILE A  81      -0.974 -12.639  -4.537  1.00 10.34           H   new
ATOM      0 HG12 ILE A  81      -1.997 -15.209  -3.235  1.00 60.34           H   new
ATOM      0 HG13 ILE A  81      -0.526 -14.377  -2.774  1.00 60.34           H   new
ATOM      0 HG21 ILE A  81      -3.438 -12.846  -4.638  1.00 13.02           H   new
ATOM      0 HG22 ILE A  81      -2.687 -12.964  -6.247  1.00 13.02           H   new
ATOM      0 HG23 ILE A  81      -3.266 -14.433  -5.425  1.00 13.02           H   new
ATOM      0 HD11 ILE A  81      -2.345 -13.866  -1.220  1.00 42.43           H   new
ATOM      0 HD12 ILE A  81      -1.842 -12.399  -2.092  1.00 42.43           H   new
ATOM      0 HD13 ILE A  81      -3.337 -13.244  -2.561  1.00 42.43           H   new
ATOM    921  N   HIS A  82       1.699 -13.343  -5.520  1.00 51.24           N
ATOM    922  CA  HIS A  82       3.007 -12.895  -4.998  1.00  3.41           C
ATOM    923  C   HIS A  82       2.788 -11.822  -3.908  1.00 33.13           C
ATOM    924  O   HIS A  82       3.690 -11.545  -3.106  1.00 23.13           O
ATOM    925  CB  HIS A  82       3.881 -12.330  -6.141  1.00 23.30           C
ATOM    926  CG  HIS A  82       4.070 -13.279  -7.291  1.00 41.12           C
ATOM    927  ND1 HIS A  82       4.874 -14.397  -7.227  1.00 71.35           N
ATOM    928  CD2 HIS A  82       3.542 -13.271  -8.534  1.00 70.22           C
ATOM    929  CE1 HIS A  82       4.832 -15.031  -8.382  1.00  4.25           C
ATOM    930  NE2 HIS A  82       4.029 -14.371  -9.194  1.00 14.43           N
ATOM      0  H   HIS A  82       1.375 -12.805  -6.324  1.00 51.24           H   new
ATOM      0  HA  HIS A  82       3.527 -13.748  -4.562  1.00  3.41           H   new
ATOM      0  HB2 HIS A  82       3.427 -11.411  -6.512  1.00 23.30           H   new
ATOM      0  HB3 HIS A  82       4.858 -12.063  -5.739  1.00 23.30           H   new
ATOM      0  HD2 HIS A  82       2.862 -12.534  -8.935  1.00 70.22           H   new
ATOM      0  HE1 HIS A  82       5.366 -15.939  -8.623  1.00  4.25           H   new
ATOM      0  HE2 HIS A  82       3.807 -14.635 -10.154  1.00 14.43           H   new
ATOM    939  N   GLY A  83       1.584 -11.203  -3.939  1.00 72.20           N
ATOM    940  CA  GLY A  83       1.137 -10.265  -2.906  1.00 62.21           C
ATOM    941  C   GLY A  83       1.828  -8.914  -2.996  1.00 21.43           C
ATOM    942  O   GLY A  83       2.510  -8.497  -2.055  1.00 45.23           O
ATOM      0  H   GLY A  83       0.903 -11.346  -4.684  1.00 72.20           H   new
ATOM      0  HA2 GLY A  83       0.060 -10.123  -2.993  1.00 62.21           H   new
ATOM      0  HA3 GLY A  83       1.324 -10.698  -1.923  1.00 62.21           H   new
ATOM    946  N   THR A  84       1.617  -8.208  -4.120  1.00 43.22           N
ATOM    947  CA  THR A  84       2.269  -6.912  -4.378  1.00 60.15           C
ATOM    948  C   THR A  84       1.310  -5.755  -4.065  1.00  4.41           C
ATOM    949  O   THR A  84       0.096  -5.852  -4.294  1.00  3.25           O
ATOM    950  CB  THR A  84       2.739  -6.781  -5.867  1.00 72.31           C
ATOM    951  OG1 THR A  84       1.619  -6.950  -6.757  1.00 24.12           O
ATOM    952  CG2 THR A  84       3.849  -7.785  -6.229  1.00 32.31           C
ATOM      0  H   THR A  84       0.996  -8.515  -4.869  1.00 43.22           H   new
ATOM      0  HA  THR A  84       3.142  -6.864  -3.728  1.00 60.15           H   new
ATOM      0  HB  THR A  84       3.157  -5.781  -5.981  1.00 72.31           H   new
ATOM      0  HG1 THR A  84       1.923  -6.865  -7.685  1.00 24.12           H   new
ATOM      0 HG21 THR A  84       4.136  -7.650  -7.272  1.00 32.31           H   new
ATOM      0 HG22 THR A  84       4.715  -7.616  -5.589  1.00 32.31           H   new
ATOM      0 HG23 THR A  84       3.482  -8.801  -6.083  1.00 32.31           H   new
ATOM    960  N   ALA A  85       1.873  -4.653  -3.556  1.00  3.25           N
ATOM    961  CA  ALA A  85       1.118  -3.445  -3.216  1.00 34.13           C
ATOM    962  C   ALA A  85       2.001  -2.208  -3.413  1.00 31.52           C
ATOM    963  O   ALA A  85       3.116  -2.152  -2.881  1.00  2.02           O
ATOM    964  CB  ALA A  85       0.601  -3.530  -1.772  1.00 13.33           C
ATOM      0  H   ALA A  85       2.872  -4.576  -3.368  1.00  3.25           H   new
ATOM      0  HA  ALA A  85       0.256  -3.362  -3.878  1.00 34.13           H   new
ATOM      0  HB1 ALA A  85       0.042  -2.626  -1.532  1.00 13.33           H   new
ATOM      0  HB2 ALA A  85      -0.050  -4.398  -1.669  1.00 13.33           H   new
ATOM      0  HB3 ALA A  85       1.445  -3.627  -1.089  1.00 13.33           H   new
ATOM    970  N   ASP A  86       1.507  -1.230  -4.182  1.00 24.01           N
ATOM    971  CA  ASP A  86       2.209   0.048  -4.403  1.00 72.32           C
ATOM    972  C   ASP A  86       2.037   0.932  -3.171  1.00 31.32           C
ATOM    973  O   ASP A  86       0.921   1.134  -2.709  1.00 35.52           O
ATOM    974  CB  ASP A  86       1.671   0.764  -5.669  1.00 60.32           C
ATOM    975  CG  ASP A  86       2.263   0.230  -6.980  1.00 44.35           C
ATOM    976  OD1 ASP A  86       2.049  -0.950  -7.305  1.00  4.11           O
ATOM    977  OD2 ASP A  86       2.938   0.992  -7.699  1.00 22.20           O
ATOM      0  H   ASP A  86       0.613  -1.298  -4.669  1.00 24.01           H   new
ATOM      0  HA  ASP A  86       3.269  -0.150  -4.563  1.00 72.32           H   new
ATOM      0  HB2 ASP A  86       0.587   0.659  -5.701  1.00 60.32           H   new
ATOM      0  HB3 ASP A  86       1.886   1.830  -5.591  1.00 60.32           H   new
ATOM    982  N   ILE A  87       3.141   1.434  -2.626  1.00 32.03           N
ATOM    983  CA  ILE A  87       3.109   2.249  -1.412  1.00 32.33           C
ATOM    984  C   ILE A  87       3.206   3.744  -1.761  1.00  2.41           C
ATOM    985  O   ILE A  87       4.039   4.169  -2.589  1.00  5.05           O
ATOM    986  CB  ILE A  87       4.229   1.803  -0.405  1.00 24.10           C
ATOM    987  CG1 ILE A  87       5.639   1.787  -1.079  1.00 24.04           C
ATOM    988  CG2 ILE A  87       3.881   0.424   0.195  1.00 22.13           C
ATOM    989  CD1 ILE A  87       6.788   1.387  -0.173  1.00 25.25           C
ATOM      0  H   ILE A  87       4.076   1.290  -3.008  1.00 32.03           H   new
ATOM      0  HA  ILE A  87       2.152   2.092  -0.913  1.00 32.33           H   new
ATOM      0  HB  ILE A  87       4.272   2.534   0.402  1.00 24.10           H   new
ATOM      0 HG12 ILE A  87       5.611   1.101  -1.926  1.00 24.04           H   new
ATOM      0 HG13 ILE A  87       5.843   2.780  -1.480  1.00 24.04           H   new
ATOM      0 HG21 ILE A  87       4.663   0.123   0.892  1.00 22.13           H   new
ATOM      0 HG22 ILE A  87       2.929   0.486   0.722  1.00 22.13           H   new
ATOM      0 HG23 ILE A  87       3.805  -0.312  -0.605  1.00 22.13           H   new
ATOM      0 HD11 ILE A  87       7.720   1.408  -0.737  1.00 25.25           H   new
ATOM      0 HD12 ILE A  87       6.853   2.085   0.662  1.00 25.25           H   new
ATOM      0 HD13 ILE A  87       6.617   0.380   0.208  1.00 25.25           H   new
ATOM   1001  N   TYR A  88       2.322   4.529  -1.130  1.00 53.00           N
ATOM   1002  CA  TYR A  88       2.154   5.960  -1.399  1.00 24.15           C
ATOM   1003  C   TYR A  88       2.195   6.750  -0.099  1.00 31.14           C
ATOM   1004  O   TYR A  88       1.804   6.244   0.960  1.00 71.14           O
ATOM   1005  CB  TYR A  88       0.799   6.237  -2.107  1.00 42.34           C
ATOM   1006  CG  TYR A  88       0.709   5.817  -3.584  1.00 34.11           C
ATOM   1007  CD1 TYR A  88       0.669   4.478  -3.961  1.00 24.24           C
ATOM   1008  CD2 TYR A  88       0.630   6.770  -4.609  1.00 44.34           C
ATOM   1009  CE1 TYR A  88       0.551   4.105  -5.280  1.00 32.31           C
ATOM   1010  CE2 TYR A  88       0.503   6.396  -5.931  1.00  4.24           C
ATOM   1011  CZ  TYR A  88       0.470   5.062  -6.264  1.00 61.31           C
ATOM   1012  OH  TYR A  88       0.350   4.676  -7.584  1.00  1.31           O
ATOM      0  H   TYR A  88       1.694   4.179  -0.406  1.00 53.00           H   new
ATOM      0  HA  TYR A  88       2.971   6.272  -2.050  1.00 24.15           H   new
ATOM      0  HB2 TYR A  88       0.012   5.722  -1.555  1.00 42.34           H   new
ATOM      0  HB3 TYR A  88       0.589   7.305  -2.040  1.00 42.34           H   new
ATOM      0  HD1 TYR A  88       0.732   3.714  -3.200  1.00 24.24           H   new
ATOM      0  HD2 TYR A  88       0.669   7.820  -4.358  1.00 44.34           H   new
ATOM      0  HE1 TYR A  88       0.522   3.058  -5.543  1.00 32.31           H   new
ATOM      0  HE2 TYR A  88       0.430   7.149  -6.702  1.00  4.24           H   new
ATOM      0  HH  TYR A  88       0.303   5.471  -8.155  1.00  1.31           H   new
ATOM   1022  N   LYS A  89       2.638   8.002  -0.194  1.00 63.34           N
ATOM   1023  CA  LYS A  89       2.587   8.961   0.913  1.00 35.20           C
ATOM   1024  C   LYS A  89       1.597  10.073   0.603  1.00 23.43           C
ATOM   1025  O   LYS A  89       1.465  10.488  -0.555  1.00  4.31           O
ATOM   1026  CB  LYS A  89       3.983   9.557   1.199  1.00 20.43           C
ATOM   1027  CG  LYS A  89       4.924   8.583   1.926  1.00 13.34           C
ATOM   1028  CD  LYS A  89       6.172   9.264   2.513  1.00  1.10           C
ATOM   1029  CE  LYS A  89       5.821  10.372   3.534  1.00 11.53           C
ATOM   1030  NZ  LYS A  89       4.935   9.877   4.627  1.00 64.14           N
ATOM      0  H   LYS A  89       3.046   8.385  -1.047  1.00 63.34           H   new
ATOM      0  HA  LYS A  89       2.256   8.428   1.804  1.00 35.20           H   new
ATOM      0  HB2 LYS A  89       4.441   9.859   0.257  1.00 20.43           H   new
ATOM      0  HB3 LYS A  89       3.869  10.458   1.801  1.00 20.43           H   new
ATOM      0  HG2 LYS A  89       4.376   8.091   2.729  1.00 13.34           H   new
ATOM      0  HG3 LYS A  89       5.237   7.804   1.230  1.00 13.34           H   new
ATOM      0  HD2 LYS A  89       6.797   8.514   2.997  1.00  1.10           H   new
ATOM      0  HD3 LYS A  89       6.761   9.695   1.703  1.00  1.10           H   new
ATOM      0  HE2 LYS A  89       6.740  10.769   3.966  1.00 11.53           H   new
ATOM      0  HE3 LYS A  89       5.330  11.197   3.017  1.00 11.53           H   new
ATOM      0  HZ1 LYS A  89       4.985  10.528   5.436  1.00 64.14           H   new
ATOM      0  HZ2 LYS A  89       3.955   9.826   4.283  1.00 64.14           H   new
ATOM      0  HZ3 LYS A  89       5.247   8.931   4.925  1.00 64.14           H   new
ATOM   1044  N   LYS A  90       0.918  10.552   1.653  1.00 72.43           N
ATOM   1045  CA  LYS A  90      -0.071  11.626   1.547  1.00 52.01           C
ATOM   1046  C   LYS A  90       0.690  12.946   1.348  1.00 32.32           C
ATOM   1047  O   LYS A  90       1.425  13.369   2.251  1.00 11.41           O
ATOM   1048  CB  LYS A  90      -0.987  11.660   2.826  1.00 31.33           C
ATOM   1049  CG  LYS A  90      -2.454  12.148   2.606  1.00 75.30           C
ATOM   1050  CD  LYS A  90      -2.609  13.607   2.104  1.00  4.23           C
ATOM   1051  CE  LYS A  90      -2.301  14.676   3.175  1.00 73.10           C
ATOM   1052  NZ  LYS A  90      -0.867  14.719   3.578  1.00 22.41           N
ATOM      0  H   LYS A  90       1.042  10.202   2.603  1.00 72.43           H   new
ATOM      0  HA  LYS A  90      -0.733  11.461   0.697  1.00 52.01           H   new
ATOM      0  HB2 LYS A  90      -1.019  10.657   3.252  1.00 31.33           H   new
ATOM      0  HB3 LYS A  90      -0.518  12.307   3.567  1.00 31.33           H   new
ATOM      0  HG2 LYS A  90      -2.935  11.483   1.888  1.00 75.30           H   new
ATOM      0  HG3 LYS A  90      -2.996  12.047   3.546  1.00 75.30           H   new
ATOM      0  HD2 LYS A  90      -1.946  13.760   1.252  1.00  4.23           H   new
ATOM      0  HD3 LYS A  90      -3.628  13.750   1.745  1.00  4.23           H   new
ATOM      0  HE2 LYS A  90      -2.592  15.655   2.794  1.00 73.10           H   new
ATOM      0  HE3 LYS A  90      -2.912  14.482   4.057  1.00 73.10           H   new
ATOM      0  HZ1 LYS A  90      -0.619  15.684   3.877  1.00 22.41           H   new
ATOM      0  HZ2 LYS A  90      -0.708  14.060   4.367  1.00 22.41           H   new
ATOM      0  HZ3 LYS A  90      -0.271  14.443   2.771  1.00 22.41           H   new
ATOM   1066  N   LYS A  91       0.518  13.553   0.166  1.00  2.21           N
ATOM   1067  CA  LYS A  91       1.120  14.841  -0.210  1.00  5.45           C
ATOM   1068  C   LYS A  91       0.872  15.904   0.878  1.00 23.44           C
ATOM   1069  O   LYS A  91      -0.247  16.401   1.025  1.00 61.32           O
ATOM   1070  CB  LYS A  91       0.541  15.291  -1.577  1.00 53.15           C
ATOM   1071  CG  LYS A  91       1.050  14.456  -2.764  1.00 71.21           C
ATOM   1072  CD  LYS A  91       0.352  14.734  -4.122  1.00 71.10           C
ATOM   1073  CE  LYS A  91       0.331  16.222  -4.550  1.00 75.44           C
ATOM   1074  NZ  LYS A  91      -0.736  17.020  -3.871  1.00 52.14           N
ATOM      0  H   LYS A  91      -0.058  13.152  -0.574  1.00  2.21           H   new
ATOM      0  HA  LYS A  91       2.200  14.722  -0.302  1.00  5.45           H   new
ATOM      0  HB2 LYS A  91      -0.547  15.230  -1.540  1.00 53.15           H   new
ATOM      0  HB3 LYS A  91       0.796  16.338  -1.744  1.00 53.15           H   new
ATOM      0  HG2 LYS A  91       2.119  14.636  -2.881  1.00 71.21           H   new
ATOM      0  HG3 LYS A  91       0.929  13.400  -2.522  1.00 71.21           H   new
ATOM      0  HD2 LYS A  91       0.854  14.155  -4.897  1.00 71.10           H   new
ATOM      0  HD3 LYS A  91      -0.675  14.372  -4.067  1.00 71.10           H   new
ATOM      0  HE2 LYS A  91       1.302  16.668  -4.334  1.00 75.44           H   new
ATOM      0  HE3 LYS A  91       0.187  16.280  -5.629  1.00 75.44           H   new
ATOM      0  HZ1 LYS A  91      -1.198  17.642  -4.564  1.00 52.14           H   new
ATOM      0  HZ2 LYS A  91      -1.441  16.377  -3.459  1.00 52.14           H   new
ATOM      0  HZ3 LYS A  91      -0.311  17.597  -3.117  1.00 52.14           H   new
ATOM   1088  N   LEU A  92       1.911  16.144   1.704  1.00 55.43           N
ATOM   1089  CA  LEU A  92       1.865  17.117   2.804  1.00 75.01           C
ATOM   1090  C   LEU A  92       1.613  18.519   2.241  1.00 30.44           C
ATOM   1091  O   LEU A  92       2.402  19.018   1.428  1.00 61.03           O
ATOM   1092  CB  LEU A  92       3.180  17.077   3.626  1.00 35.02           C
ATOM   1093  CG  LEU A  92       3.500  15.722   4.337  1.00 71.44           C
ATOM   1094  CD1 LEU A  92       4.838  15.787   5.105  1.00  3.25           C
ATOM   1095  CD2 LEU A  92       2.343  15.291   5.271  1.00 14.13           C
ATOM      0  H   LEU A  92       2.807  15.664   1.623  1.00 55.43           H   new
ATOM      0  HA  LEU A  92       1.047  16.857   3.475  1.00 75.01           H   new
ATOM      0  HB2 LEU A  92       4.009  17.321   2.961  1.00 35.02           H   new
ATOM      0  HB3 LEU A  92       3.137  17.861   4.382  1.00 35.02           H   new
ATOM      0  HG  LEU A  92       3.603  14.964   3.560  1.00 71.44           H   new
ATOM      0 HD11 LEU A  92       5.028  14.828   5.587  1.00  3.25           H   new
ATOM      0 HD12 LEU A  92       5.647  16.010   4.409  1.00  3.25           H   new
ATOM      0 HD13 LEU A  92       4.785  16.569   5.862  1.00  3.25           H   new
ATOM      0 HD21 LEU A  92       2.596  14.345   5.751  1.00 14.13           H   new
ATOM      0 HD22 LEU A  92       2.187  16.054   6.033  1.00 14.13           H   new
ATOM      0 HD23 LEU A  92       1.430  15.169   4.687  1.00 14.13           H   new
ATOM   1107  N   GLU A  93       0.515  19.132   2.683  1.00 24.42           N
ATOM   1108  CA  GLU A  93       0.015  20.391   2.131  1.00 31.00           C
ATOM   1109  C   GLU A  93      -0.923  21.049   3.143  1.00 13.53           C
ATOM   1110  O   GLU A  93      -1.564  20.356   3.948  1.00 64.20           O
ATOM   1111  CB  GLU A  93      -0.726  20.107   0.792  1.00 75.43           C
ATOM   1112  CG  GLU A  93      -1.199  21.351   0.022  1.00 24.23           C
ATOM   1113  CD  GLU A  93      -1.771  21.007  -1.361  1.00 53.12           C
ATOM   1114  OE1 GLU A  93      -0.973  20.766  -2.293  1.00  3.24           O
ATOM   1115  OE2 GLU A  93      -3.007  20.976  -1.523  1.00  4.55           O
ATOM      0  H   GLU A  93      -0.058  18.765   3.442  1.00 24.42           H   new
ATOM      0  HA  GLU A  93       0.844  21.070   1.932  1.00 31.00           H   new
ATOM      0  HB2 GLU A  93      -0.064  19.531   0.146  1.00 75.43           H   new
ATOM      0  HB3 GLU A  93      -1.592  19.480   1.002  1.00 75.43           H   new
ATOM      0  HG2 GLU A  93      -1.959  21.869   0.607  1.00 24.23           H   new
ATOM      0  HG3 GLU A  93      -0.363  22.041  -0.096  1.00 24.23           H   new
ATOM   1122  N   HIS A  94      -0.975  22.391   3.118  1.00 24.10           N
ATOM   1123  CA  HIS A  94      -1.968  23.167   3.874  1.00 63.22           C
ATOM   1124  C   HIS A  94      -3.355  22.954   3.231  1.00 14.22           C
ATOM   1125  O   HIS A  94      -3.830  23.774   2.442  1.00 54.41           O
ATOM   1126  CB  HIS A  94      -1.586  24.667   3.934  1.00 73.33           C
ATOM   1127  CG  HIS A  94      -0.284  24.961   4.634  1.00 12.24           C
ATOM   1128  ND1 HIS A  94      -0.094  24.753   5.983  1.00 62.44           N
ATOM   1129  CD2 HIS A  94       0.892  25.455   4.168  1.00 50.33           C
ATOM   1130  CE1 HIS A  94       1.134  25.111   6.315  1.00 64.45           C
ATOM   1131  NE2 HIS A  94       1.751  25.539   5.232  1.00 55.04           N
ATOM      0  H   HIS A  94      -0.331  22.966   2.574  1.00 24.10           H   new
ATOM      0  HA  HIS A  94      -1.995  22.817   4.906  1.00 63.22           H   new
ATOM      0  HB2 HIS A  94      -1.531  25.054   2.917  1.00 73.33           H   new
ATOM      0  HB3 HIS A  94      -2.384  25.211   4.439  1.00 73.33           H   new
ATOM      0  HD2 HIS A  94       1.110  25.731   3.147  1.00 50.33           H   new
ATOM      0  HE1 HIS A  94       1.560  25.061   7.306  1.00 64.45           H   new
ATOM      0  HE2 HIS A  94       2.712  25.878   5.192  1.00 55.04           H   new
ATOM   1140  N   HIS A  95      -3.953  21.790   3.548  1.00 31.04           N
ATOM   1141  CA  HIS A  95      -5.172  21.287   2.894  1.00 25.13           C
ATOM   1142  C   HIS A  95      -6.395  22.025   3.468  1.00 72.54           C
ATOM   1143  O   HIS A  95      -7.257  22.514   2.732  1.00 72.20           O
ATOM   1144  CB  HIS A  95      -5.261  19.744   3.118  1.00 71.30           C
ATOM   1145  CG  HIS A  95      -5.977  18.993   2.027  1.00 34.23           C
ATOM   1146  ND1 HIS A  95      -7.073  18.185   2.237  1.00 22.13           N
ATOM   1147  CD2 HIS A  95      -5.690  18.891   0.710  1.00  3.34           C
ATOM   1148  CE1 HIS A  95      -7.418  17.621   1.095  1.00 12.44           C
ATOM   1149  NE2 HIS A  95      -6.594  18.032   0.153  1.00 24.14           N
ATOM      0  H   HIS A  95      -3.598  21.167   4.273  1.00 31.04           H   new
ATOM      0  HA  HIS A  95      -5.146  21.474   1.820  1.00 25.13           H   new
ATOM      0  HB2 HIS A  95      -4.251  19.345   3.213  1.00 71.30           H   new
ATOM      0  HB3 HIS A  95      -5.769  19.556   4.064  1.00 71.30           H   new
ATOM      0  HD2 HIS A  95      -4.890  19.398   0.191  1.00  3.34           H   new
ATOM      0  HE1 HIS A  95      -8.241  16.935   0.956  1.00 12.44           H   new
ATOM      0  HE2 HIS A  95      -6.626  17.755  -0.828  1.00 24.14           H   new
ATOM   1158  N   HIS A  96      -6.434  22.087   4.806  1.00 20.11           N
ATOM   1159  CA  HIS A  96      -7.375  22.917   5.577  1.00 32.43           C
ATOM   1160  C   HIS A  96      -6.594  23.618   6.701  1.00 41.14           C
ATOM   1161  O   HIS A  96      -5.819  22.970   7.412  1.00 21.10           O
ATOM   1162  CB  HIS A  96      -8.546  22.073   6.160  1.00 73.33           C
ATOM   1163  CG  HIS A  96      -9.627  21.711   5.170  1.00 20.34           C
ATOM   1164  ND1 HIS A  96     -10.822  22.394   5.077  1.00 24.25           N
ATOM   1165  CD2 HIS A  96      -9.702  20.727   4.241  1.00 73.45           C
ATOM   1166  CE1 HIS A  96     -11.572  21.845   4.143  1.00 30.44           C
ATOM   1167  NE2 HIS A  96     -10.916  20.831   3.619  1.00 52.20           N
ATOM      0  H   HIS A  96      -5.799  21.550   5.397  1.00 20.11           H   new
ATOM      0  HA  HIS A  96      -7.824  23.657   4.915  1.00 32.43           H   new
ATOM      0  HB2 HIS A  96      -8.137  21.154   6.581  1.00 73.33           H   new
ATOM      0  HB3 HIS A  96      -8.998  22.627   6.983  1.00 73.33           H   new
ATOM      0  HD1 HIS A  96     -11.085  23.200   5.644  1.00 24.25           H   new
ATOM      0  HD2 HIS A  96      -8.939  19.992   4.030  1.00 73.45           H   new
ATOM      0  HE1 HIS A  96     -12.560  22.172   3.855  1.00 30.44           H   new
ATOM   1176  N   HIS A  97      -6.791  24.943   6.834  1.00 20.13           N
ATOM   1177  CA  HIS A  97      -6.074  25.785   7.831  1.00 12.44           C
ATOM   1178  C   HIS A  97      -6.880  25.955   9.134  1.00 71.12           C
ATOM   1179  O   HIS A  97      -6.316  26.282  10.182  1.00 41.21           O
ATOM   1180  CB  HIS A  97      -5.725  27.177   7.224  1.00 42.21           C
ATOM   1181  CG  HIS A  97      -6.860  27.871   6.505  1.00 21.44           C
ATOM   1182  ND1 HIS A  97      -6.928  27.954   5.130  1.00 11.34           N
ATOM   1183  CD2 HIS A  97      -7.967  28.509   6.968  1.00 33.45           C
ATOM   1184  CE1 HIS A  97      -8.018  28.611   4.783  1.00 24.32           C
ATOM   1185  NE2 HIS A  97      -8.663  28.955   5.878  1.00 50.24           N
ATOM      0  H   HIS A  97      -7.449  25.467   6.258  1.00 20.13           H   new
ATOM      0  HA  HIS A  97      -5.150  25.266   8.084  1.00 12.44           H   new
ATOM      0  HB2 HIS A  97      -5.373  27.827   8.025  1.00 42.21           H   new
ATOM      0  HB3 HIS A  97      -4.896  27.054   6.527  1.00 42.21           H   new
ATOM      0  HD2 HIS A  97      -8.245  28.640   8.003  1.00 33.45           H   new
ATOM      0  HE1 HIS A  97      -8.329  28.830   3.772  1.00 24.32           H   new
ATOM      0  HE2 HIS A  97      -9.542  29.472   5.909  1.00 50.24           H   new
ATOM   1194  N   HIS A  98      -8.196  25.719   9.061  1.00 24.23           N
ATOM   1195  CA  HIS A  98      -9.123  25.935  10.196  1.00 44.04           C
ATOM   1196  C   HIS A  98     -10.015  24.695  10.402  1.00 62.41           C
ATOM   1197  O   HIS A  98     -11.038  24.764  11.086  1.00  2.33           O
ATOM   1198  CB  HIS A  98      -9.967  27.216   9.932  1.00 21.32           C
ATOM   1199  CG  HIS A  98     -10.747  27.723  11.119  1.00 41.43           C
ATOM   1200  ND1 HIS A  98     -12.116  27.901  11.116  1.00  4.22           N
ATOM   1201  CD2 HIS A  98     -10.330  28.091  12.356  1.00 71.42           C
ATOM   1202  CE1 HIS A  98     -12.500  28.356  12.293  1.00 74.31           C
ATOM   1203  NE2 HIS A  98     -11.437  28.476  13.065  1.00 31.23           N
ATOM      0  H   HIS A  98      -8.655  25.373   8.218  1.00 24.23           H   new
ATOM      0  HA  HIS A  98      -8.556  26.081  11.115  1.00 44.04           H   new
ATOM      0  HB2 HIS A  98      -9.300  28.008   9.590  1.00 21.32           H   new
ATOM      0  HB3 HIS A  98     -10.664  27.012   9.119  1.00 21.32           H   new
ATOM      0  HD2 HIS A  98      -9.312  28.082  12.716  1.00 71.42           H   new
ATOM      0  HE1 HIS A  98     -13.515  28.591  12.577  1.00 74.31           H   new
ATOM      0  HE2 HIS A  98     -11.439  28.802  14.031  1.00 31.23           H   new
ATOM   1212  N   HIS A  99      -9.576  23.551   9.832  1.00 53.44           N
ATOM   1213  CA  HIS A  99     -10.336  22.281   9.809  1.00 51.25           C
ATOM   1214  C   HIS A  99     -11.700  22.478   9.082  1.00 51.24           C
ATOM   1215  O   HIS A  99     -12.756  22.594   9.742  1.00 14.55           O
ATOM   1216  CB  HIS A  99     -10.507  21.701  11.252  1.00  3.30           C
ATOM   1217  CG  HIS A  99      -9.218  21.456  11.992  1.00 22.14           C
ATOM   1218  ND1 HIS A  99      -8.646  22.388  12.832  1.00 31.33           N
ATOM   1219  CD2 HIS A  99      -8.392  20.378  12.021  1.00 44.04           C
ATOM   1220  CE1 HIS A  99      -7.532  21.900  13.340  1.00 73.13           C
ATOM   1221  NE2 HIS A  99      -7.350  20.682  12.860  1.00 72.32           N
ATOM   1222  OXT HIS A  99     -11.688  22.597   7.841  1.00 36.82           O
ATOM      0  H   HIS A  99      -8.670  23.483   9.368  1.00 53.44           H   new
ATOM      0  HA  HIS A  99      -9.769  21.543   9.242  1.00 51.25           H   new
ATOM      0  HB2 HIS A  99     -11.119  22.390  11.835  1.00  3.30           H   new
ATOM      0  HB3 HIS A  99     -11.057  20.762  11.188  1.00  3.30           H   new
ATOM      0  HD2 HIS A  99      -8.530  19.452  11.483  1.00 44.04           H   new
ATOM      0  HE1 HIS A  99      -6.878  22.410  14.032  1.00 73.13           H   new
ATOM      0  HE2 HIS A  99      -6.564  20.069  13.078  1.00 72.32           H   new
TER    1231      HIS A  99