USER  MOD reduce.3.24.130724 H: found=0, std=0, add=269, rem=0, adj=7
USER  MOD reduce.3.24.130724 removed 265 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  15 THR OG1 :   rot  -73:sc=   -1.14
USER  MOD Set 1.2: A  16 HIS     :     no HD1:sc=       0  X(o=-1.1,f=-1.2)
USER  MOD Single : A   1 LYS N   :NH3+   -156:sc=   -1.75   (180deg=-3.23)
USER  MOD Single : A   1 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A   2 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A   5 THR OG1 :   rot   73:sc=   0.798
USER  MOD Single : A   6 THR OG1 :   rot   46:sc=   0.782
USER  MOD Single : A   8 HIS     :     no HD1:sc= -0.0913  X(o=-0.091,f=-0.1)
USER  MOD Single : A   9 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  13 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  22 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  25 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  26 THR OG1 :   rot   42:sc=   0.844
USER  MOD -----------------------------------------------------------------
ATOM      1  N   LYS A   1      -9.012   1.366  -1.517  1.00 12.44           N
ATOM      2  CA  LYS A   1      -9.995   1.419  -0.441  1.00 74.22           C
ATOM      3  C   LYS A   1     -10.938   0.221  -0.507  1.00  4.04           C
ATOM      4  O   LYS A   1     -11.780   0.033   0.372  1.00 63.33           O
ATOM      5  CB  LYS A   1     -10.799   2.719  -0.520  1.00 74.53           C
ATOM      6  CG  LYS A   1      -9.972   3.963  -0.249  1.00 50.00           C
ATOM      7  CD  LYS A   1      -9.583   4.065   1.216  1.00  4.31           C
ATOM      8  CE  LYS A   1      -8.965   5.418   1.536  1.00 54.33           C
ATOM      9  NZ  LYS A   1      -7.641   5.593   0.877  1.00 14.40           N
ATOM      0  H1  LYS A   1      -8.169   1.911  -1.244  1.00 12.44           H   new
ATOM      0  H2  LYS A   1      -8.743   0.377  -1.693  1.00 12.44           H   new
ATOM      0  H3  LYS A   1      -9.422   1.772  -2.382  1.00 12.44           H   new
ATOM      0  HA  LYS A   1      -9.460   1.387   0.508  1.00 74.22           H   new
ATOM      0  HB2 LYS A   1     -11.247   2.800  -1.510  1.00 74.53           H   new
ATOM      0  HB3 LYS A   1     -11.618   2.674   0.198  1.00 74.53           H   new
ATOM      0  HG2 LYS A   1      -9.073   3.945  -0.865  1.00 50.00           H   new
ATOM      0  HG3 LYS A   1     -10.539   4.848  -0.539  1.00 50.00           H   new
ATOM      0  HD2 LYS A   1     -10.464   3.910   1.839  1.00  4.31           H   new
ATOM      0  HD3 LYS A   1      -8.875   3.273   1.462  1.00  4.31           H   new
ATOM      0  HE2 LYS A   1      -9.639   6.211   1.212  1.00 54.33           H   new
ATOM      0  HE3 LYS A   1      -8.850   5.518   2.615  1.00 54.33           H   new
ATOM      0  HZ1 LYS A   1      -7.253   6.527   1.120  1.00 14.40           H   new
ATOM      0  HZ2 LYS A   1      -6.989   4.852   1.205  1.00 14.40           H   new
ATOM      0  HZ3 LYS A   1      -7.755   5.523  -0.154  1.00 14.40           H   new
ATOM     23  N   TYR A   2     -10.789  -0.586  -1.551  1.00 71.11           N
ATOM     24  CA  TYR A   2     -11.628  -1.765  -1.731  1.00 64.30           C
ATOM     25  C   TYR A   2     -10.781  -3.034  -1.776  1.00 53.12           C
ATOM     26  O   TYR A   2     -10.734  -3.796  -0.811  1.00 53.31           O
ATOM     27  CB  TYR A   2     -12.450  -1.641  -3.015  1.00 63.30           C
ATOM     28  CG  TYR A   2     -13.319  -2.846  -3.296  1.00 64.25           C
ATOM     29  CD1 TYR A   2     -14.048  -3.453  -2.281  1.00 60.44           C
ATOM     30  CD2 TYR A   2     -13.410  -3.378  -4.577  1.00 24.23           C
ATOM     31  CE1 TYR A   2     -14.843  -4.555  -2.534  1.00  3.14           C
ATOM     32  CE2 TYR A   2     -14.203  -4.478  -4.838  1.00 61.43           C
ATOM     33  CZ  TYR A   2     -14.917  -5.063  -3.814  1.00 33.34           C
ATOM     34  OH  TYR A   2     -15.708  -6.160  -4.070  1.00 24.32           O
ATOM      0  H   TYR A   2     -10.095  -0.446  -2.286  1.00 71.11           H   new
ATOM      0  HA  TYR A   2     -12.305  -1.831  -0.879  1.00 64.30           H   new
ATOM      0  HB2 TYR A   2     -13.082  -0.755  -2.948  1.00 63.30           H   new
ATOM      0  HB3 TYR A   2     -11.774  -1.487  -3.856  1.00 63.30           H   new
ATOM      0  HD1 TYR A   2     -13.993  -3.057  -1.278  1.00 60.44           H   new
ATOM      0  HD2 TYR A   2     -12.851  -2.923  -5.382  1.00 24.23           H   new
ATOM      0  HE1 TYR A   2     -15.403  -5.016  -1.734  1.00  3.14           H   new
ATOM      0  HE2 TYR A   2     -14.264  -4.878  -5.839  1.00 61.43           H   new
ATOM      0  HH  TYR A   2     -15.650  -6.390  -5.021  1.00 24.32           H   new
ATOM     44  N   GLU A   3     -10.114  -3.252  -2.905  1.00 22.20           N
ATOM     45  CA  GLU A   3      -9.269  -4.428  -3.077  1.00 20.33           C
ATOM     46  C   GLU A   3      -7.991  -4.305  -2.252  1.00 20.20           C
ATOM     47  O   GLU A   3      -7.224  -5.261  -2.130  1.00 72.00           O
ATOM     48  CB  GLU A   3      -8.919  -4.621  -4.554  1.00 32.12           C
ATOM     49  CG  GLU A   3      -9.666  -5.769  -5.211  1.00 73.24           C
ATOM     50  CD  GLU A   3     -10.506  -5.319  -6.391  1.00 70.21           C
ATOM     51  OE1 GLU A   3     -11.731  -5.564  -6.375  1.00 24.05           O
ATOM     52  OE2 GLU A   3      -9.939  -4.723  -7.330  1.00 53.24           O
ATOM      0  H   GLU A   3     -10.142  -2.630  -3.713  1.00 22.20           H   new
ATOM      0  HA  GLU A   3      -9.825  -5.297  -2.726  1.00 20.33           H   new
ATOM      0  HB2 GLU A   3      -9.138  -3.700  -5.094  1.00 32.12           H   new
ATOM      0  HB3 GLU A   3      -7.847  -4.797  -4.645  1.00 32.12           H   new
ATOM      0  HG2 GLU A   3      -8.950  -6.520  -5.545  1.00 73.24           H   new
ATOM      0  HG3 GLU A   3     -10.310  -6.248  -4.473  1.00 73.24           H   new
ATOM     59  N   ILE A   4      -7.769  -3.122  -1.689  1.00 21.42           N
ATOM     60  CA  ILE A   4      -6.585  -2.874  -0.876  1.00 20.33           C
ATOM     61  C   ILE A   4      -6.544  -3.802   0.334  1.00 74.12           C
ATOM     62  O   ILE A   4      -5.475  -4.098   0.868  1.00 32.24           O
ATOM     63  CB  ILE A   4      -6.532  -1.414  -0.390  1.00 45.31           C
ATOM     64  CG1 ILE A   4      -7.798  -1.068   0.396  1.00 22.11           C
ATOM     65  CG2 ILE A   4      -6.360  -0.469  -1.570  1.00 61.13           C
ATOM     66  CD1 ILE A   4      -7.709  -1.413   1.866  1.00 35.42           C
ATOM      0  H   ILE A   4      -8.393  -2.321  -1.781  1.00 21.42           H   new
ATOM      0  HA  ILE A   4      -5.720  -3.069  -1.510  1.00 20.33           H   new
ATOM      0  HB  ILE A   4      -5.674  -1.298   0.272  1.00 45.31           H   new
ATOM      0 HG12 ILE A   4      -8.000  -0.002   0.293  1.00 22.11           H   new
ATOM      0 HG13 ILE A   4      -8.644  -1.597  -0.043  1.00 22.11           H   new
ATOM      0 HG21 ILE A   4      -6.324   0.559  -1.210  1.00 61.13           H   new
ATOM      0 HG22 ILE A   4      -5.432  -0.703  -2.092  1.00 61.13           H   new
ATOM      0 HG23 ILE A   4      -7.200  -0.585  -2.255  1.00 61.13           H   new
ATOM      0 HD11 ILE A   4      -8.641  -1.141   2.361  1.00 35.42           H   new
ATOM      0 HD12 ILE A   4      -7.538  -2.484   1.979  1.00 35.42           H   new
ATOM      0 HD13 ILE A   4      -6.884  -0.864   2.319  1.00 35.42           H   new
ATOM     78  N   THR A   5      -7.717  -4.261   0.761  1.00 50.33           N
ATOM     79  CA  THR A   5      -7.816  -5.156   1.907  1.00 53.25           C
ATOM     80  C   THR A   5      -7.348  -6.562   1.548  1.00 11.43           C
ATOM     81  O   THR A   5      -6.820  -7.286   2.393  1.00 41.03           O
ATOM     82  CB  THR A   5      -9.260  -5.228   2.440  1.00 63.15           C
ATOM     83  OG1 THR A   5     -10.096  -4.320   1.714  1.00 60.12           O
ATOM     84  CG2 THR A   5      -9.306  -4.893   3.923  1.00 73.23           C
ATOM      0  H   THR A   5      -8.611  -4.027   0.330  1.00 50.33           H   new
ATOM      0  HA  THR A   5      -7.170  -4.748   2.684  1.00 53.25           H   new
ATOM      0  HB  THR A   5      -9.625  -6.246   2.302  1.00 63.15           H   new
ATOM      0  HG1 THR A   5     -10.255  -4.671   0.813  1.00 60.12           H   new
ATOM      0 HG21 THR A   5     -10.335  -4.950   4.277  1.00 73.23           H   new
ATOM      0 HG22 THR A   5      -8.692  -5.604   4.476  1.00 73.23           H   new
ATOM      0 HG23 THR A   5      -8.924  -3.884   4.080  1.00 73.23           H   new
ATOM     92  N   THR A   6      -7.544  -6.943   0.290  1.00 41.02           N
ATOM     93  CA  THR A   6      -7.142  -8.263  -0.180  1.00 50.42           C
ATOM     94  C   THR A   6      -5.715  -8.244  -0.716  1.00 72.34           C
ATOM     95  O   THR A   6      -5.425  -7.579  -1.711  1.00 64.01           O
ATOM     96  CB  THR A   6      -8.086  -8.778  -1.283  1.00 11.21           C
ATOM     97  OG1 THR A   6      -8.692  -7.674  -1.964  1.00 51.23           O
ATOM     98  CG2 THR A   6      -9.167  -9.673  -0.695  1.00 41.34           C
ATOM      0  H   THR A   6      -7.979  -6.356  -0.422  1.00 41.02           H   new
ATOM      0  HA  THR A   6      -7.197  -8.934   0.677  1.00 50.42           H   new
ATOM      0  HB  THR A   6      -7.498  -9.362  -1.991  1.00 11.21           H   new
ATOM      0  HG1 THR A   6      -8.007  -7.008  -2.181  1.00 51.23           H   new
ATOM      0 HG21 THR A   6      -9.822 -10.025  -1.492  1.00 41.34           H   new
ATOM      0 HG22 THR A   6      -8.704 -10.528  -0.202  1.00 41.34           H   new
ATOM      0 HG23 THR A   6      -9.751  -9.108   0.032  1.00 41.34           H   new
ATOM    106  N   ILE A   7      -4.829  -8.979  -0.052  1.00 51.34           N
ATOM    107  CA  ILE A   7      -3.433  -9.047  -0.464  1.00 64.53           C
ATOM    108  C   ILE A   7      -3.028 -10.479  -0.797  1.00 64.44           C
ATOM    109  O   ILE A   7      -2.909 -10.846  -1.967  1.00 25.42           O
ATOM    110  CB  ILE A   7      -2.495  -8.502   0.629  1.00 34.03           C
ATOM    111  CG1 ILE A   7      -2.858  -7.054   0.966  1.00 23.24           C
ATOM    112  CG2 ILE A   7      -1.045  -8.600   0.181  1.00 21.32           C
ATOM    113  CD1 ILE A   7      -2.921  -6.777   2.452  1.00 30.42           C
ATOM      0  H   ILE A   7      -5.053  -9.535   0.773  1.00 51.34           H   new
ATOM      0  HA  ILE A   7      -3.337  -8.427  -1.355  1.00 64.53           H   new
ATOM      0  HB  ILE A   7      -2.618  -9.107   1.527  1.00 34.03           H   new
ATOM      0 HG12 ILE A   7      -2.124  -6.389   0.511  1.00 23.24           H   new
ATOM      0 HG13 ILE A   7      -3.823  -6.816   0.519  1.00 23.24           H   new
ATOM      0 HG21 ILE A   7      -0.395  -8.211   0.965  1.00 21.32           H   new
ATOM      0 HG22 ILE A   7      -0.794  -9.643  -0.014  1.00 21.32           H   new
ATOM      0 HG23 ILE A   7      -0.905  -8.017  -0.729  1.00 21.32           H   new
ATOM      0 HD11 ILE A   7      -3.183  -5.732   2.616  1.00 30.42           H   new
ATOM      0 HD12 ILE A   7      -3.675  -7.417   2.910  1.00 30.42           H   new
ATOM      0 HD13 ILE A   7      -1.950  -6.982   2.902  1.00 30.42           H   new
ATOM    125  N   HIS A   8      -2.819 -11.286   0.239  1.00 43.34           N
ATOM    126  CA  HIS A   8      -2.429 -12.680   0.056  1.00 13.53           C
ATOM    127  C   HIS A   8      -3.563 -13.482  -0.576  1.00  3.03           C
ATOM    128  O   HIS A   8      -3.361 -14.607  -1.031  1.00 45.44           O
ATOM    129  CB  HIS A   8      -2.035 -13.300   1.397  1.00 61.44           C
ATOM    130  CG  HIS A   8      -1.161 -12.417   2.232  1.00 45.31           C
ATOM    131  ND1 HIS A   8      -1.500 -12.009   3.505  1.00 43.43           N
ATOM    132  CD2 HIS A   8       0.047 -11.864   1.970  1.00 10.14           C
ATOM    133  CE1 HIS A   8      -0.539 -11.242   3.989  1.00 14.42           C
ATOM    134  NE2 HIS A   8       0.411 -11.138   3.078  1.00 21.40           N
ATOM      0  H   HIS A   8      -2.913 -10.999   1.213  1.00 43.34           H   new
ATOM      0  HA  HIS A   8      -1.570 -12.708  -0.615  1.00 13.53           H   new
ATOM      0  HB2 HIS A   8      -2.939 -13.537   1.958  1.00 61.44           H   new
ATOM      0  HB3 HIS A   8      -1.517 -14.242   1.214  1.00 61.44           H   new
ATOM      0  HD2 HIS A   8       0.618 -11.973   1.060  1.00 10.14           H   new
ATOM      0  HE1 HIS A   8      -0.532 -10.779   4.965  1.00 14.42           H   new
ATOM      0  HE2 HIS A   8       1.275 -10.605   3.180  1.00 21.40           H   new
ATOM    142  N   ASN A   9      -4.755 -12.896  -0.598  1.00 53.33           N
ATOM    143  CA  ASN A   9      -5.921 -13.557  -1.173  1.00 72.01           C
ATOM    144  C   ASN A   9      -5.882 -13.501  -2.697  1.00 52.22           C
ATOM    145  O   ASN A   9      -6.535 -14.295  -3.376  1.00 12.22           O
ATOM    146  CB  ASN A   9      -7.207 -12.906  -0.660  1.00 53.23           C
ATOM    147  CG  ASN A   9      -7.885 -13.733   0.415  1.00 10.42           C
ATOM    148  OD1 ASN A   9      -7.285 -14.046   1.443  1.00  1.14           O
ATOM    149  ND2 ASN A   9      -9.142 -14.090   0.182  1.00 74.53           N
ATOM      0  H   ASN A   9      -4.939 -11.965  -0.225  1.00 53.33           H   new
ATOM      0  HA  ASN A   9      -5.903 -14.603  -0.865  1.00 72.01           H   new
ATOM      0  HB2 ASN A   9      -6.977 -11.917  -0.263  1.00 53.23           H   new
ATOM      0  HB3 ASN A   9      -7.896 -12.763  -1.493  1.00 53.23           H   new
ATOM      0 HD21 ASN A   9      -9.650 -14.646   0.870  1.00 74.53           H   new
ATOM      0 HD22 ASN A   9      -9.600 -13.808  -0.685  1.00 74.53           H   new
ATOM    156  N   LEU A  10      -5.112 -12.558  -3.229  1.00 72.03           N
ATOM    157  CA  LEU A  10      -4.987 -12.398  -4.674  1.00  4.22           C
ATOM    158  C   LEU A  10      -3.563 -12.696  -5.133  1.00  1.30           C
ATOM    159  O   LEU A  10      -3.334 -13.052  -6.289  1.00 61.00           O
ATOM    160  CB  LEU A  10      -5.381 -10.978  -5.086  1.00 20.44           C
ATOM    161  CG  LEU A  10      -4.709  -9.844  -4.311  1.00 55.20           C
ATOM    162  CD1 LEU A  10      -3.288  -9.627  -4.807  1.00 30.55           C
ATOM    163  CD2 LEU A  10      -5.520  -8.562  -4.434  1.00  1.34           C
ATOM      0  H   LEU A  10      -4.565 -11.893  -2.682  1.00 72.03           H   new
ATOM      0  HA  LEU A  10      -5.660 -13.109  -5.153  1.00  4.22           H   new
ATOM      0  HB2 LEU A  10      -5.154 -10.852  -6.145  1.00 20.44           H   new
ATOM      0  HB3 LEU A  10      -6.461 -10.876  -4.977  1.00 20.44           H   new
ATOM      0  HG  LEU A  10      -4.665 -10.124  -3.259  1.00 55.20           H   new
ATOM      0 HD11 LEU A  10      -2.826  -8.816  -4.244  1.00 30.55           H   new
ATOM      0 HD12 LEU A  10      -2.710 -10.541  -4.668  1.00 30.55           H   new
ATOM      0 HD13 LEU A  10      -3.308  -9.368  -5.866  1.00 30.55           H   new
ATOM      0 HD21 LEU A  10      -5.028  -7.765  -3.877  1.00  1.34           H   new
ATOM      0 HD22 LEU A  10      -5.595  -8.278  -5.484  1.00  1.34           H   new
ATOM      0 HD23 LEU A  10      -6.519  -8.723  -4.030  1.00  1.34           H   new
ATOM    175  N   PHE A  11      -2.609 -12.549  -4.219  1.00 72.32           N
ATOM    176  CA  PHE A  11      -1.207 -12.804  -4.530  1.00 13.23           C
ATOM    177  C   PHE A  11      -0.927 -14.303  -4.592  1.00 55.52           C
ATOM    178  O   PHE A  11      -0.224 -14.849  -3.742  1.00 74.54           O
ATOM    179  CB  PHE A  11      -0.304 -12.148  -3.483  1.00 61.12           C
ATOM    180  CG  PHE A  11       0.049 -10.724  -3.804  1.00  4.00           C
ATOM    181  CD1 PHE A  11      -0.290  -9.700  -2.935  1.00  3.50           C
ATOM    182  CD2 PHE A  11       0.720 -10.410  -4.975  1.00  2.31           C
ATOM    183  CE1 PHE A  11       0.034  -8.388  -3.227  1.00  2.10           C
ATOM    184  CE2 PHE A  11       1.047  -9.100  -5.272  1.00 61.10           C
ATOM    185  CZ  PHE A  11       0.703  -8.088  -4.398  1.00 13.13           C
ATOM      0  H   PHE A  11      -2.781 -12.255  -3.258  1.00 72.32           H   new
ATOM      0  HA  PHE A  11      -0.993 -12.372  -5.508  1.00 13.23           H   new
ATOM      0  HB2 PHE A  11      -0.802 -12.181  -2.514  1.00 61.12           H   new
ATOM      0  HB3 PHE A  11       0.613 -12.729  -3.390  1.00 61.12           H   new
ATOM      0  HD1 PHE A  11      -0.814  -9.929  -2.019  1.00  3.50           H   new
ATOM      0  HD2 PHE A  11       0.990 -11.197  -5.663  1.00  2.31           H   new
ATOM      0  HE1 PHE A  11      -0.235  -7.599  -2.541  1.00  2.10           H   new
ATOM      0  HE2 PHE A  11       1.571  -8.868  -6.187  1.00 61.10           H   new
ATOM      0  HZ  PHE A  11       0.956  -7.064  -4.629  1.00 13.13           H   new
ATOM    195  N   ARG A  12      -1.484 -14.960  -5.604  1.00 65.43           N
ATOM    196  CA  ARG A  12      -1.296 -16.396  -5.777  1.00 40.24           C
ATOM    197  C   ARG A  12      -0.641 -16.700  -7.122  1.00 34.32           C
ATOM    198  O   ARG A  12       0.561 -16.953  -7.196  1.00 43.12           O
ATOM    199  CB  ARG A  12      -2.638 -17.123  -5.675  1.00 61.12           C
ATOM    200  CG  ARG A  12      -3.173 -17.218  -4.256  1.00  2.24           C
ATOM    201  CD  ARG A  12      -3.935 -18.515  -4.033  1.00  0.41           C
ATOM    202  NE  ARG A  12      -4.387 -18.653  -2.651  1.00 72.31           N
ATOM    203  CZ  ARG A  12      -5.397 -17.961  -2.135  1.00 44.12           C
ATOM    204  NH1 ARG A  12      -6.056 -17.086  -2.883  1.00 25.32           N
ATOM    205  NH2 ARG A  12      -5.749 -18.143  -0.869  1.00  0.10           N
ATOM      0  H   ARG A  12      -2.068 -14.522  -6.316  1.00 65.43           H   new
ATOM      0  HA  ARG A  12      -0.638 -16.750  -4.983  1.00 40.24           H   new
ATOM      0  HB2 ARG A  12      -3.370 -16.606  -6.296  1.00 61.12           H   new
ATOM      0  HB3 ARG A  12      -2.529 -18.129  -6.081  1.00 61.12           H   new
ATOM      0  HG2 ARG A  12      -2.346 -17.155  -3.549  1.00  2.24           H   new
ATOM      0  HG3 ARG A  12      -3.829 -16.371  -4.056  1.00  2.24           H   new
ATOM      0  HD2 ARG A  12      -4.796 -18.549  -4.701  1.00  0.41           H   new
ATOM      0  HD3 ARG A  12      -3.297 -19.360  -4.292  1.00  0.41           H   new
ATOM      0  HE  ARG A  12      -3.900 -19.317  -2.049  1.00 72.31           H   new
ATOM      0 HH11 ARG A  12      -5.788 -16.943  -3.857  1.00 25.32           H   new
ATOM      0 HH12 ARG A  12      -6.831 -16.556  -2.485  1.00 25.32           H   new
ATOM      0 HH21 ARG A  12      -5.244 -18.815  -0.291  1.00  0.10           H   new
ATOM      0 HH22 ARG A  12      -6.525 -17.611  -0.474  1.00  0.10           H   new
ATOM    219  N   LYS A  13      -1.441 -16.675  -8.183  1.00 31.15           N
ATOM    220  CA  LYS A  13      -0.941 -16.947  -9.525  1.00 32.41           C
ATOM    221  C   LYS A  13      -1.200 -15.764 -10.452  1.00 74.53           C
ATOM    222  O   LYS A  13      -0.355 -15.411 -11.276  1.00 31.13           O
ATOM    223  CB  LYS A  13      -1.600 -18.207 -10.091  1.00 74.11           C
ATOM    224  CG  LYS A  13      -3.112 -18.107 -10.198  1.00 12.14           C
ATOM    225  CD  LYS A  13      -3.724 -19.409 -10.685  1.00 73.35           C
ATOM    226  CE  LYS A  13      -4.824 -19.160 -11.706  1.00 70.34           C
ATOM    227  NZ  LYS A  13      -5.992 -20.059 -11.494  1.00 31.13           N
ATOM      0  H   LYS A  13      -2.439 -16.469  -8.139  1.00 31.15           H   new
ATOM      0  HA  LYS A  13       0.135 -17.106  -9.460  1.00 32.41           H   new
ATOM      0  HB2 LYS A  13      -1.187 -18.410 -11.079  1.00 74.11           H   new
ATOM      0  HB3 LYS A  13      -1.344 -19.056  -9.458  1.00 74.11           H   new
ATOM      0  HG2 LYS A  13      -3.530 -17.849  -9.225  1.00 12.14           H   new
ATOM      0  HG3 LYS A  13      -3.377 -17.301 -10.883  1.00 12.14           H   new
ATOM      0  HD2 LYS A  13      -2.949 -20.033 -11.129  1.00 73.35           H   new
ATOM      0  HD3 LYS A  13      -4.131 -19.961  -9.837  1.00 73.35           H   new
ATOM      0  HE2 LYS A  13      -5.149 -18.121 -11.643  1.00 70.34           H   new
ATOM      0  HE3 LYS A  13      -4.428 -19.310 -12.710  1.00 70.34           H   new
ATOM      0  HZ1 LYS A  13      -6.719 -19.858 -12.210  1.00 31.13           H   new
ATOM      0  HZ2 LYS A  13      -5.687 -21.050 -11.579  1.00 31.13           H   new
ATOM      0  HZ3 LYS A  13      -6.386 -19.898 -10.545  1.00 31.13           H   new
ATOM    241  N   LEU A  14      -2.373 -15.155 -10.313  1.00 24.20           N
ATOM    242  CA  LEU A  14      -2.742 -14.010 -11.138  1.00 35.14           C
ATOM    243  C   LEU A  14      -1.745 -12.869 -10.964  1.00 32.11           C
ATOM    244  O   LEU A  14      -1.656 -11.974 -11.805  1.00 64.12           O
ATOM    245  CB  LEU A  14      -4.150 -13.531 -10.778  1.00 72.44           C
ATOM    246  CG  LEU A  14      -4.459 -13.416  -9.285  1.00 73.13           C
ATOM    247  CD1 LEU A  14      -5.069 -12.059  -8.970  1.00  3.14           C
ATOM    248  CD2 LEU A  14      -5.391 -14.536  -8.845  1.00 65.33           C
ATOM      0  H   LEU A  14      -3.084 -15.435  -9.637  1.00 24.20           H   new
ATOM      0  HA  LEU A  14      -2.727 -14.325 -12.181  1.00 35.14           H   new
ATOM      0  HB2 LEU A  14      -4.309 -12.555 -11.238  1.00 72.44           H   new
ATOM      0  HB3 LEU A  14      -4.870 -14.215 -11.226  1.00 72.44           H   new
ATOM      0  HG  LEU A  14      -3.524 -13.510  -8.732  1.00 73.13           H   new
ATOM      0 HD11 LEU A  14      -5.282 -11.995  -7.903  1.00  3.14           H   new
ATOM      0 HD12 LEU A  14      -4.368 -11.272  -9.248  1.00  3.14           H   new
ATOM      0 HD13 LEU A  14      -5.994 -11.936  -9.533  1.00  3.14           H   new
ATOM      0 HD21 LEU A  14      -5.600 -14.438  -7.780  1.00 65.33           H   new
ATOM      0 HD22 LEU A  14      -6.324 -14.474  -9.405  1.00 65.33           H   new
ATOM      0 HD23 LEU A  14      -4.917 -15.499  -9.035  1.00 65.33           H   new
ATOM    260  N   THR A  15      -0.995 -12.908  -9.867  1.00 44.32           N
ATOM    261  CA  THR A  15      -0.003 -11.878  -9.583  1.00 62.33           C
ATOM    262  C   THR A  15       1.391 -12.326 -10.007  1.00 62.13           C
ATOM    263  O   THR A  15       2.048 -11.666 -10.814  1.00 31.25           O
ATOM    264  CB  THR A  15       0.019 -11.517  -8.086  1.00 25.50           C
ATOM    265  OG1 THR A  15       0.355 -12.672  -7.309  1.00 22.33           O
ATOM    266  CG2 THR A  15      -1.330 -10.974  -7.640  1.00 63.40           C
ATOM      0  H   THR A  15      -1.056 -13.642  -9.161  1.00 44.32           H   new
ATOM      0  HA  THR A  15      -0.289 -10.997 -10.157  1.00 62.33           H   new
ATOM      0  HB  THR A  15       0.772 -10.744  -7.932  1.00 25.50           H   new
ATOM      0  HG1 THR A  15      -0.406 -13.289  -7.294  1.00 22.33           H   new
ATOM      0 HG21 THR A  15      -1.290 -10.726  -6.579  1.00 63.40           H   new
ATOM      0 HG22 THR A  15      -1.569 -10.078  -8.213  1.00 63.40           H   new
ATOM      0 HG23 THR A  15      -2.099 -11.728  -7.807  1.00 63.40           H   new
ATOM    274  N   HIS A  16       1.838 -13.452  -9.460  1.00  2.11           N
ATOM    275  CA  HIS A  16       3.155 -13.989  -9.783  1.00 43.21           C
ATOM    276  C   HIS A  16       3.261 -14.310 -11.271  1.00  1.50           C
ATOM    277  O   HIS A  16       4.360 -14.449 -11.809  1.00 54.21           O
ATOM    278  CB  HIS A  16       3.434 -15.245  -8.958  1.00 32.34           C
ATOM    279  CG  HIS A  16       4.172 -14.973  -7.683  1.00 64.33           C
ATOM    280  ND1 HIS A  16       3.783 -14.008  -6.779  1.00 50.21           N
ATOM    281  CD2 HIS A  16       5.282 -15.548  -7.163  1.00 71.22           C
ATOM    282  CE1 HIS A  16       4.622 -13.999  -5.759  1.00 30.32           C
ATOM    283  NE2 HIS A  16       5.541 -14.925  -5.967  1.00 73.11           N
ATOM      0  H   HIS A  16       1.308 -14.010  -8.791  1.00  2.11           H   new
ATOM      0  HA  HIS A  16       3.899 -13.231  -9.539  1.00 43.21           H   new
ATOM      0  HB2 HIS A  16       2.488 -15.733  -8.724  1.00 32.34           H   new
ATOM      0  HB3 HIS A  16       4.013 -15.945  -9.561  1.00 32.34           H   new
ATOM      0  HD2 HIS A  16       5.857 -16.348  -7.606  1.00 71.22           H   new
ATOM      0  HE1 HIS A  16       4.566 -13.346  -4.901  1.00 30.32           H   new
ATOM      0  HE2 HIS A  16       6.317 -15.142  -5.341  1.00 73.11           H   new
ATOM    291  N   ARG A  17       2.113 -14.426 -11.929  1.00 75.13           N
ATOM    292  CA  ARG A  17       2.076 -14.732 -13.354  1.00 64.43           C
ATOM    293  C   ARG A  17       2.964 -13.771 -14.140  1.00 31.23           C
ATOM    294  O   ARG A  17       3.665 -14.175 -15.069  1.00 12.13           O
ATOM    295  CB  ARG A  17       0.640 -14.660 -13.877  1.00 25.11           C
ATOM    296  CG  ARG A  17       0.008 -16.022 -14.110  1.00 33.34           C
ATOM    297  CD  ARG A  17      -1.473 -15.901 -14.436  1.00  4.44           C
ATOM    298  NE  ARG A  17      -1.830 -16.640 -15.644  1.00  4.44           N
ATOM    299  CZ  ARG A  17      -3.082 -16.890 -16.009  1.00 10.03           C
ATOM    300  NH1 ARG A  17      -4.092 -16.462 -15.263  1.00 64.22           N
ATOM    301  NH2 ARG A  17      -3.327 -17.569 -17.122  1.00 64.02           N
ATOM      0  H   ARG A  17       1.195 -14.313 -11.498  1.00 75.13           H   new
ATOM      0  HA  ARG A  17       2.455 -15.745 -13.492  1.00 64.43           H   new
ATOM      0  HB2 ARG A  17       0.031 -14.103 -13.165  1.00 25.11           H   new
ATOM      0  HB3 ARG A  17       0.630 -14.100 -14.812  1.00 25.11           H   new
ATOM      0  HG2 ARG A  17       0.522 -16.527 -14.928  1.00 33.34           H   new
ATOM      0  HG3 ARG A  17       0.137 -16.641 -13.222  1.00 33.34           H   new
ATOM      0  HD2 ARG A  17      -2.060 -16.273 -13.597  1.00  4.44           H   new
ATOM      0  HD3 ARG A  17      -1.731 -14.850 -14.565  1.00  4.44           H   new
ATOM      0  HE  ARG A  17      -1.076 -16.983 -16.240  1.00  4.44           H   new
ATOM      0 HH11 ARG A  17      -3.908 -15.939 -14.407  1.00 64.22           H   new
ATOM      0 HH12 ARG A  17      -5.053 -16.655 -15.546  1.00 64.22           H   new
ATOM      0 HH21 ARG A  17      -2.553 -17.900 -17.698  1.00 64.02           H   new
ATOM      0 HH22 ARG A  17      -4.289 -17.760 -17.401  1.00 64.02           H   new
ATOM    315  N   LEU A  18       2.929 -12.498 -13.761  1.00 74.41           N
ATOM    316  CA  LEU A  18       3.729 -11.479 -14.430  1.00  2.31           C
ATOM    317  C   LEU A  18       4.685 -10.807 -13.449  1.00 53.41           C
ATOM    318  O   LEU A  18       5.791 -10.410 -13.817  1.00 31.45           O
ATOM    319  CB  LEU A  18       2.821 -10.430 -15.074  1.00 73.22           C
ATOM    320  CG  LEU A  18       1.839  -9.726 -14.137  1.00 42.40           C
ATOM    321  CD1 LEU A  18       2.339  -8.332 -13.790  1.00  4.00           C
ATOM    322  CD2 LEU A  18       0.456  -9.656 -14.768  1.00 20.13           C
ATOM      0  H   LEU A  18       2.355 -12.147 -12.994  1.00 74.41           H   new
ATOM      0  HA  LEU A  18       4.318 -11.967 -15.207  1.00  2.31           H   new
ATOM      0  HB2 LEU A  18       3.450  -9.674 -15.544  1.00 73.22           H   new
ATOM      0  HB3 LEU A  18       2.252 -10.911 -15.870  1.00 73.22           H   new
ATOM      0  HG  LEU A  18       1.767 -10.304 -13.216  1.00 42.40           H   new
ATOM      0 HD11 LEU A  18       1.627  -7.846 -13.122  1.00  4.00           H   new
ATOM      0 HD12 LEU A  18       3.308  -8.405 -13.296  1.00  4.00           H   new
ATOM      0 HD13 LEU A  18       2.440  -7.744 -14.702  1.00  4.00           H   new
ATOM      0 HD21 LEU A  18      -0.230  -9.152 -14.087  1.00 20.13           H   new
ATOM      0 HD22 LEU A  18       0.511  -9.101 -15.704  1.00 20.13           H   new
ATOM      0 HD23 LEU A  18       0.095 -10.665 -14.965  1.00 20.13           H   new
ATOM    334  N   PHE A  19       4.251 -10.683 -12.199  1.00 70.20           N
ATOM    335  CA  PHE A  19       5.068 -10.060 -11.164  1.00 62.23           C
ATOM    336  C   PHE A  19       6.375 -10.823 -10.971  1.00 24.22           C
ATOM    337  O   PHE A  19       7.408 -10.235 -10.650  1.00 42.13           O
ATOM    338  CB  PHE A  19       4.298 -10.002  -9.843  1.00 45.52           C
ATOM    339  CG  PHE A  19       4.740  -8.884  -8.941  1.00 72.44           C
ATOM    340  CD1 PHE A  19       3.903  -7.809  -8.688  1.00 62.40           C
ATOM    341  CD2 PHE A  19       5.991  -8.909  -8.348  1.00 24.14           C
ATOM    342  CE1 PHE A  19       4.306  -6.780  -7.858  1.00 41.24           C
ATOM    343  CE2 PHE A  19       6.399  -7.883  -7.517  1.00  5.32           C
ATOM    344  CZ  PHE A  19       5.556  -6.816  -7.273  1.00 24.21           C
ATOM      0  H   PHE A  19       3.338 -11.006 -11.878  1.00 70.20           H   new
ATOM      0  HA  PHE A  19       5.304  -9.045 -11.484  1.00 62.23           H   new
ATOM      0  HB2 PHE A  19       3.235  -9.888 -10.056  1.00 45.52           H   new
ATOM      0  HB3 PHE A  19       4.418 -10.950  -9.319  1.00 45.52           H   new
ATOM      0  HD1 PHE A  19       2.925  -7.775  -9.145  1.00 62.40           H   new
ATOM      0  HD2 PHE A  19       6.655  -9.739  -8.537  1.00 24.14           H   new
ATOM      0  HE1 PHE A  19       3.644  -5.949  -7.667  1.00 41.24           H   new
ATOM      0  HE2 PHE A  19       7.376  -7.915  -7.059  1.00  5.32           H   new
ATOM      0  HZ  PHE A  19       5.874  -6.012  -6.626  1.00 24.21           H   new
ATOM    354  N   ARG A  20       6.322 -12.136 -11.168  1.00 33.55           N
ATOM    355  CA  ARG A  20       7.500 -12.981 -11.013  1.00 40.12           C
ATOM    356  C   ARG A  20       8.083 -13.354 -12.373  1.00 22.31           C
ATOM    357  O   ARG A  20       8.587 -14.462 -12.560  1.00 51.13           O
ATOM    358  CB  ARG A  20       7.147 -14.248 -10.232  1.00 71.24           C
ATOM    359  CG  ARG A  20       8.256 -14.723  -9.308  1.00 61.12           C
ATOM    360  CD  ARG A  20       8.416 -16.234  -9.361  1.00 20.44           C
ATOM    361  NE  ARG A  20       9.463 -16.642 -10.293  1.00 64.02           N
ATOM    362  CZ  ARG A  20       9.914 -17.888 -10.394  1.00 55.31           C
ATOM    363  NH1 ARG A  20       9.410 -18.842  -9.624  1.00 70.52           N
ATOM    364  NH2 ARG A  20      10.869 -18.181 -11.267  1.00 50.51           N
ATOM      0  H   ARG A  20       5.475 -12.638 -11.435  1.00 33.55           H   new
ATOM      0  HA  ARG A  20       8.250 -12.418 -10.457  1.00 40.12           H   new
ATOM      0  HB2 ARG A  20       6.249 -14.063  -9.643  1.00 71.24           H   new
ATOM      0  HB3 ARG A  20       6.907 -15.044 -10.937  1.00 71.24           H   new
ATOM      0  HG2 ARG A  20       9.195 -14.246  -9.590  1.00 61.12           H   new
ATOM      0  HG3 ARG A  20       8.036 -14.415  -8.286  1.00 61.12           H   new
ATOM      0  HD2 ARG A  20       8.652 -16.609  -8.365  1.00 20.44           H   new
ATOM      0  HD3 ARG A  20       7.470 -16.688  -9.657  1.00 20.44           H   new
ATOM      0  HE  ARG A  20       9.871 -15.931 -10.900  1.00 64.02           H   new
ATOM      0 HH11 ARG A  20       8.675 -18.620  -8.953  1.00 70.52           H   new
ATOM      0 HH12 ARG A  20       9.757 -19.798  -9.703  1.00 70.52           H   new
ATOM      0 HH21 ARG A  20      11.258 -17.449 -11.862  1.00 50.51           H   new
ATOM      0 HH22 ARG A  20      11.214 -19.138 -11.343  1.00 50.51           H   new
ATOM    378  N   ARG A  21       8.010 -12.423 -13.318  1.00 45.11           N
ATOM    379  CA  ARG A  21       8.529 -12.655 -14.661  1.00  3.33           C
ATOM    380  C   ARG A  21       9.685 -11.707 -14.968  1.00 61.11           C
ATOM    381  O   ARG A  21      10.847 -12.110 -14.970  1.00 63.33           O
ATOM    382  CB  ARG A  21       7.419 -12.475 -15.698  1.00 30.24           C
ATOM    383  CG  ARG A  21       7.915 -12.516 -17.134  1.00 14.41           C
ATOM    384  CD  ARG A  21       7.144 -13.533 -17.961  1.00 10.03           C
ATOM    385  NE  ARG A  21       6.907 -13.064 -19.324  1.00 24.35           N
ATOM    386  CZ  ARG A  21       6.129 -13.697 -20.194  1.00 35.54           C
ATOM    387  NH1 ARG A  21       5.514 -14.819 -19.844  1.00 60.24           N
ATOM    388  NH2 ARG A  21       5.963 -13.208 -21.416  1.00 34.32           N
ATOM      0  H   ARG A  21       7.597 -11.501 -13.179  1.00 45.11           H   new
ATOM      0  HA  ARG A  21       8.899 -13.679 -14.709  1.00  3.33           H   new
ATOM      0  HB2 ARG A  21       6.672 -13.257 -15.558  1.00 30.24           H   new
ATOM      0  HB3 ARG A  21       6.920 -11.522 -15.522  1.00 30.24           H   new
ATOM      0  HG2 ARG A  21       7.814 -11.528 -17.583  1.00 14.41           H   new
ATOM      0  HG3 ARG A  21       8.976 -12.765 -17.147  1.00 14.41           H   new
ATOM      0  HD2 ARG A  21       7.699 -14.471 -17.992  1.00 10.03           H   new
ATOM      0  HD3 ARG A  21       6.189 -13.743 -17.479  1.00 10.03           H   new
ATOM      0  HE  ARG A  21       7.364 -12.203 -19.624  1.00 24.35           H   new
ATOM      0 HH11 ARG A  21       5.638 -15.197 -18.905  1.00 60.24           H   new
ATOM      0 HH12 ARG A  21       4.917 -15.304 -20.514  1.00 60.24           H   new
ATOM      0 HH21 ARG A  21       6.433 -12.345 -21.688  1.00 34.32           H   new
ATOM      0 HH22 ARG A  21       5.365 -13.695 -22.083  1.00 34.32           H   new
ATOM    402  N   ASN A  22       9.356 -10.446 -15.228  1.00  4.34           N
ATOM    403  CA  ASN A  22      10.367  -9.441 -15.538  1.00 12.25           C
ATOM    404  C   ASN A  22      10.709  -8.614 -14.302  1.00 31.24           C
ATOM    405  O   ASN A  22      11.841  -8.159 -14.140  1.00 43.20           O
ATOM    406  CB  ASN A  22       9.876  -8.523 -16.659  1.00  1.10           C
ATOM    407  CG  ASN A  22      10.500  -8.862 -17.999  1.00 24.23           C
ATOM    408  OD1 ASN A  22      11.644  -8.497 -18.274  1.00 34.34           O
ATOM    409  ND2 ASN A  22       9.750  -9.564 -18.840  1.00 61.01           N
ATOM      0  H   ASN A  22       8.398 -10.096 -15.230  1.00  4.34           H   new
ATOM      0  HA  ASN A  22      11.268  -9.958 -15.868  1.00 12.25           H   new
ATOM      0  HB2 ASN A  22       8.791  -8.598 -16.737  1.00  1.10           H   new
ATOM      0  HB3 ASN A  22      10.107  -7.488 -16.405  1.00  1.10           H   new
ATOM      0 HD21 ASN A  22      10.116  -9.822 -19.756  1.00 61.01           H   new
ATOM      0 HD22 ASN A  22       8.807  -9.845 -18.570  1.00 61.01           H   new
ATOM    416  N   PHE A  23       9.722  -8.425 -13.432  1.00  4.14           N
ATOM    417  CA  PHE A  23       9.918  -7.653 -12.210  1.00  2.01           C
ATOM    418  C   PHE A  23      10.995  -8.286 -11.333  1.00 75.21           C
ATOM    419  O   PHE A  23      11.641  -7.607 -10.536  1.00 54.04           O
ATOM    420  CB  PHE A  23       8.605  -7.550 -11.431  1.00  4.31           C
ATOM    421  CG  PHE A  23       7.930  -6.215 -11.569  1.00 30.23           C
ATOM    422  CD1 PHE A  23       8.187  -5.197 -10.664  1.00 74.34           C
ATOM    423  CD2 PHE A  23       7.038  -5.979 -12.602  1.00 51.13           C
ATOM    424  CE1 PHE A  23       7.567  -3.968 -10.789  1.00  0.14           C
ATOM    425  CE2 PHE A  23       6.416  -4.752 -12.732  1.00 12.42           C
ATOM    426  CZ  PHE A  23       6.680  -3.745 -11.823  1.00 73.31           C
ATOM      0  H   PHE A  23       8.779  -8.796 -13.550  1.00  4.14           H   new
ATOM      0  HA  PHE A  23      10.246  -6.652 -12.491  1.00  2.01           H   new
ATOM      0  HB2 PHE A  23       7.925  -8.329 -11.775  1.00  4.31           H   new
ATOM      0  HB3 PHE A  23       8.801  -7.742 -10.376  1.00  4.31           H   new
ATOM      0  HD1 PHE A  23       8.879  -5.366  -9.852  1.00 74.34           H   new
ATOM      0  HD2 PHE A  23       6.826  -6.763 -13.314  1.00 51.13           H   new
ATOM      0  HE1 PHE A  23       7.776  -3.182 -10.078  1.00  0.14           H   new
ATOM      0  HE2 PHE A  23       5.724  -4.580 -13.543  1.00 12.42           H   new
ATOM      0  HZ  PHE A  23       6.193  -2.786 -11.921  1.00 73.31           H   new
ATOM    436  N   GLY A  24      11.181  -9.594 -11.486  1.00 52.22           N
ATOM    437  CA  GLY A  24      12.179 -10.298 -10.702  1.00 55.11           C
ATOM    438  C   GLY A  24      13.557  -9.679 -10.827  1.00 14.13           C
ATOM    439  O   GLY A  24      14.384  -9.802  -9.923  1.00 62.25           O
ATOM      0  H   GLY A  24      10.658 -10.178 -12.139  1.00 52.22           H   new
ATOM      0  HA2 GLY A  24      11.879 -10.300  -9.654  1.00 55.11           H   new
ATOM      0  HA3 GLY A  24      12.221 -11.339 -11.023  1.00 55.11           H   new
ATOM    443  N   TYR A  25      13.805  -9.013 -11.949  1.00 13.21           N
ATOM    444  CA  TYR A  25      15.094  -8.376 -12.190  1.00 52.25           C
ATOM    445  C   TYR A  25      15.192  -7.046 -11.450  1.00 15.33           C
ATOM    446  O   TYR A  25      16.277  -6.618 -11.056  1.00 22.24           O
ATOM    447  CB  TYR A  25      15.304  -8.154 -13.689  1.00 71.23           C
ATOM    448  CG  TYR A  25      15.934  -9.334 -14.393  1.00 64.53           C
ATOM    449  CD1 TYR A  25      15.487 -10.629 -14.158  1.00  2.25           C
ATOM    450  CD2 TYR A  25      16.978  -9.156 -15.293  1.00 54.34           C
ATOM    451  CE1 TYR A  25      16.061 -11.710 -14.798  1.00 34.41           C
ATOM    452  CE2 TYR A  25      17.556 -10.231 -15.939  1.00 72.13           C
ATOM    453  CZ  TYR A  25      17.094 -11.506 -15.688  1.00 61.32           C
ATOM    454  OH  TYR A  25      17.668 -12.580 -16.329  1.00 25.44           O
ATOM      0  H   TYR A  25      13.131  -8.900 -12.706  1.00 13.21           H   new
ATOM      0  HA  TYR A  25      15.874  -9.039 -11.814  1.00 52.25           H   new
ATOM      0  HB2 TYR A  25      14.343  -7.935 -14.154  1.00 71.23           H   new
ATOM      0  HB3 TYR A  25      15.935  -7.277 -13.833  1.00 71.23           H   new
ATOM      0  HD1 TYR A  25      14.677 -10.793 -13.463  1.00  2.25           H   new
ATOM      0  HD2 TYR A  25      17.344  -8.159 -15.491  1.00 54.34           H   new
ATOM      0  HE1 TYR A  25      15.703 -12.710 -14.602  1.00 34.41           H   new
ATOM      0  HE2 TYR A  25      18.365 -10.074 -16.637  1.00 72.13           H   new
ATOM      0  HH  TYR A  25      18.381 -12.264 -16.923  1.00 25.44           H   new
ATOM    464  N   THR A  26      14.048  -6.394 -11.263  1.00 34.44           N
ATOM    465  CA  THR A  26      14.002  -5.113 -10.570  1.00 42.11           C
ATOM    466  C   THR A  26      13.929  -5.306  -9.060  1.00 30.42           C
ATOM    467  O   THR A  26      14.434  -4.485  -8.293  1.00 72.11           O
ATOM    468  CB  THR A  26      12.797  -4.270 -11.027  1.00 52.22           C
ATOM    469  OG1 THR A  26      11.741  -5.127 -11.476  1.00 21.15           O
ATOM    470  CG2 THR A  26      13.195  -3.319 -12.146  1.00 73.11           C
ATOM      0  H   THR A  26      13.141  -6.733 -11.582  1.00 34.44           H   new
ATOM      0  HA  THR A  26      14.922  -4.585 -10.822  1.00 42.11           H   new
ATOM      0  HB  THR A  26      12.451  -3.682 -10.177  1.00 52.22           H   new
ATOM      0  HG1 THR A  26      11.660  -5.892 -10.869  1.00 21.15           H   new
ATOM      0 HG21 THR A  26      12.328  -2.734 -12.452  1.00 73.11           H   new
ATOM      0 HG22 THR A  26      13.978  -2.648 -11.792  1.00 73.11           H   new
ATOM      0 HG23 THR A  26      13.565  -3.892 -12.996  1.00 73.11           H   new
ATOM    478  N   LEU A  27      13.298  -6.397  -8.638  1.00  5.23           N
ATOM    479  CA  LEU A  27      13.160  -6.699  -7.217  1.00 51.03           C
ATOM    480  C   LEU A  27      14.521  -6.967  -6.582  1.00 54.03           C
ATOM    481  O   LEU A  27      14.737  -6.671  -5.407  1.00 22.50           O
ATOM    482  CB  LEU A  27      12.245  -7.909  -7.020  1.00  1.00           C
ATOM    483  CG  LEU A  27      10.754  -7.670  -7.263  1.00 24.11           C
ATOM    484  CD1 LEU A  27       9.995  -8.988  -7.257  1.00 52.44           C
ATOM    485  CD2 LEU A  27      10.189  -6.722  -6.216  1.00 13.12           C
ATOM      0  H   LEU A  27      12.874  -7.086  -9.259  1.00  5.23           H   new
ATOM      0  HA  LEU A  27      12.716  -5.832  -6.728  1.00 51.03           H   new
ATOM      0  HB2 LEU A  27      12.579  -8.704  -7.687  1.00  1.00           H   new
ATOM      0  HB3 LEU A  27      12.373  -8.274  -6.001  1.00  1.00           H   new
ATOM      0  HG  LEU A  27      10.634  -7.210  -8.244  1.00 24.11           H   new
ATOM      0 HD11 LEU A  27       8.936  -8.799  -7.431  1.00 52.44           H   new
ATOM      0 HD12 LEU A  27      10.382  -9.635  -8.044  1.00 52.44           H   new
ATOM      0 HD13 LEU A  27      10.122  -9.477  -6.291  1.00 52.44           H   new
ATOM      0 HD21 LEU A  27       9.127  -6.563  -6.404  1.00 13.12           H   new
ATOM      0 HD22 LEU A  27      10.321  -7.155  -5.224  1.00 13.12           H   new
ATOM      0 HD23 LEU A  27      10.713  -5.768  -6.268  1.00 13.12           H   new
ATOM    497  N   ARG A  28      15.435  -7.526  -7.368  1.00 73.42           N
ATOM    498  CA  ARG A  28      16.775  -7.833  -6.883  1.00 71.11           C
ATOM    499  C   ARG A  28      17.437  -6.591  -6.293  1.00 31.41           C
ATOM    500  O   ARG A  28      17.599  -6.481  -5.078  1.00 14.34           O
ATOM    501  CB  ARG A  28      17.635  -8.393  -8.017  1.00 44.55           C
ATOM    502  CG  ARG A  28      18.885  -9.112  -7.536  1.00 73.23           C
ATOM    503  CD  ARG A  28      20.114  -8.677  -8.318  1.00 62.34           C
ATOM    504  NE  ARG A  28      21.246  -9.575  -8.103  1.00 74.32           N
ATOM    505  CZ  ARG A  28      22.440  -9.398  -8.656  1.00 44.30           C
ATOM    506  NH1 ARG A  28      22.658  -8.360  -9.452  1.00 63.45           N
ATOM    507  NH2 ARG A  28      23.420 -10.258  -8.412  1.00 63.40           N
ATOM      0  H   ARG A  28      15.272  -7.776  -8.343  1.00 73.42           H   new
ATOM      0  HA  ARG A  28      16.687  -8.584  -6.098  1.00 71.11           H   new
ATOM      0  HB2 ARG A  28      17.035  -9.083  -8.610  1.00 44.55           H   new
ATOM      0  HB3 ARG A  28      17.927  -7.576  -8.677  1.00 44.55           H   new
ATOM      0  HG2 ARG A  28      19.037  -8.910  -6.476  1.00 73.23           H   new
ATOM      0  HG3 ARG A  28      18.749 -10.189  -7.639  1.00 73.23           H   new
ATOM      0  HD2 ARG A  28      19.874  -8.644  -9.381  1.00 62.34           H   new
ATOM      0  HD3 ARG A  28      20.392  -7.665  -8.022  1.00 62.34           H   new
ATOM      0  HE  ARG A  28      21.112 -10.383  -7.494  1.00 74.32           H   new
ATOM      0 HH11 ARG A  28      21.908  -7.695  -9.641  1.00 63.45           H   new
ATOM      0 HH12 ARG A  28      23.576  -8.226  -9.876  1.00 63.45           H   new
ATOM      0 HH21 ARG A  28      23.257 -11.057  -7.799  1.00 63.40           H   new
ATOM      0 HH22 ARG A  28      24.337 -10.121  -8.838  1.00 63.40           H   new
TER     521      ARG A  28