USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=18
USER  MOD reduce.3.24.130724 removed 586 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  22 THR OG1 :   rot  180:sc=  0.0233
USER  MOD Set 1.2: A  25 ASN     :      amide:sc= -0.0212  X(o=0.002,f=-0.17)
USER  MOD Set 2.1: A   6 LYS NZ  :NH3+   -165:sc=   0.773   (180deg=0)
USER  MOD Set 2.2: A  12 THR OG1 :   rot  180:sc=   0.698
USER  MOD Single : A   1 MET CE  :methyl  149:sc=  -0.023   (180deg=-0.634)
USER  MOD Single : A   1 MET N   :NH3+   -171:sc=    1.23   (180deg=1.17)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A   7 THR OG1 :   rot  180:sc=    0.94
USER  MOD Single : A   9 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  11 LYS NZ  :NH3+    143:sc=    1.22   (180deg=-0.24!)
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=  0.0202
USER  MOD Single : A  27 LYS NZ  :NH3+   -143:sc=    1.22   (180deg=-0.124!)
USER  MOD Single : A  29 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.409  X(o=-0.41,f=-0.41)
USER  MOD Single : A  33 LYS NZ  :NH3+    178:sc=       0   (180deg=-0.00584)
USER  MOD Single : A  40 GLN     :      amide:sc= -0.0304  K(o=-0.03,f=-1.8!)
USER  MOD Single : A  41 GLN     :      amide:sc= -0.0386  X(o=-0.039,f=-0.11)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=  -0.108  X(o=-0.11,f=-0.26)
USER  MOD Single : A  55 THR OG1 :   rot  180:sc=  -0.755
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  145:sc=   0.179
USER  MOD Single : A  60 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  62 GLN     :      amide:sc=   0.125  K(o=0.13,f=-0.91)
USER  MOD Single : A  63 LYS NZ  :NH3+    154:sc=    1.21   (180deg=0.8)
USER  MOD Single : A  65 SER OG  :   rot   79:sc=   0.808
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -12.849   2.599  -5.475  1.00  9.67           N
ATOM      2  CA  MET A   1     -12.593   3.092  -4.103  1.00 10.38           C
ATOM      3  C   MET A   1     -11.404   3.959  -3.868  1.00  9.62           C
ATOM      4  O   MET A   1     -10.374   3.689  -4.483  1.00  9.62           O
ATOM      5  CB  MET A   1     -12.462   1.915  -3.122  1.00 13.77           C
ATOM      6  CG  MET A   1     -11.196   1.055  -3.133  1.00 16.29           C
ATOM      7  SD  MET A   1     -11.304  -0.339  -1.971  1.00 17.17           S
ATOM      8  CE  MET A   1      -9.622  -0.897  -2.371  1.00 16.11           C
ATOM      0  H1  MET A   1     -13.782   2.142  -5.511  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -12.829   3.398  -6.140  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -12.116   1.910  -5.739  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.465   3.726  -3.942  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.574   2.317  -2.115  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.308   1.251  -3.296  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.026   0.674  -4.140  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.336   1.674  -2.877  1.00 16.29           H   new
ATOM      0  HE1 MET A   1      -9.177  -1.367  -1.494  1.00 16.11           H   new
ATOM      0  HE2 MET A   1      -9.662  -1.617  -3.188  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -9.017  -0.042  -2.671  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -11.510   4.950  -2.964  1.00  9.27           N
ATOM     21  CA  GLN A   2     -10.498   5.876  -2.559  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.919   5.195  -1.367  1.00  8.72           C
ATOM     23  O   GLN A   2     -10.589   4.988  -0.357  1.00  8.22           O
ATOM     24  CB  GLN A   2     -10.903   7.300  -2.142  1.00 14.46           C
ATOM     25  CG  GLN A   2     -11.447   8.002  -3.387  1.00 17.01           C
ATOM     26  CD  GLN A   2     -11.959   9.401  -3.076  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -11.194  10.268  -2.655  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -13.283   9.669  -3.236  1.00 19.49           N
ATOM      0  H   GLN A   2     -12.388   5.116  -2.472  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.861   6.072  -3.421  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -11.659   7.270  -1.357  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2     -10.046   7.841  -1.740  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2     -10.662   8.063  -4.141  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -12.254   7.407  -3.815  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -13.911   8.945  -3.585  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -13.648  10.594  -3.007  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -8.650   4.762  -1.476  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.956   4.275  -0.324  1.00  5.07           C
ATOM     39  C   ILE A   3      -6.777   5.177  -0.195  1.00  4.01           C
ATOM     40  O   ILE A   3      -6.285   5.755  -1.163  1.00  4.61           O
ATOM     41  CB  ILE A   3      -7.457   2.866  -0.449  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -6.776   2.448  -1.763  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -8.741   2.052  -0.220  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -6.110   1.074  -1.819  1.00 10.83           C
ATOM      0  H   ILE A   3      -8.113   4.748  -2.343  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -8.635   4.268   0.529  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -6.638   2.710   0.254  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -7.524   2.489  -2.555  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -6.019   3.196  -2.000  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -8.514   0.988  -0.286  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -9.143   2.277   0.768  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -9.478   2.313  -0.980  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -5.674   0.921  -2.806  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -5.326   1.019  -1.064  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -6.854   0.301  -1.627  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -6.302   5.398   1.043  1.00  4.55           N
ATOM     57  CA  PHE A   4      -5.287   6.360   1.343  1.00  4.68           C
ATOM     58  C   PHE A   4      -4.008   5.659   1.651  1.00  5.30           C
ATOM     59  O   PHE A   4      -3.856   4.937   2.635  1.00  5.58           O
ATOM     60  CB  PHE A   4      -5.555   7.117   2.655  1.00  4.83           C
ATOM     61  CG  PHE A   4      -6.936   7.676   2.620  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -7.340   8.518   1.611  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -7.856   7.525   3.630  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -8.624   8.969   1.417  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -9.115   8.076   3.589  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -9.490   8.777   2.467  1.00  8.90           C
ATOM      0  H   PHE A   4      -6.635   4.891   1.863  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -5.261   7.023   0.478  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -5.442   6.446   3.506  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -4.828   7.919   2.782  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -6.587   8.853   0.913  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -7.576   6.946   4.498  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -8.933   9.444   0.498  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4      -9.795   7.961   4.420  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4     -10.488   9.186   2.409  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -2.894   5.891   0.935  1.00  4.44           N
ATOM     77  CA  VAL A   5      -1.654   5.284   1.309  1.00  3.87           C
ATOM     78  C   VAL A   5      -0.966   6.394   2.027  1.00  4.93           C
ATOM     79  O   VAL A   5      -0.648   7.457   1.496  1.00  6.84           O
ATOM     80  CB  VAL A   5      -0.848   4.828   0.130  1.00  2.99           C
ATOM     81  CG1 VAL A   5       0.572   4.398   0.536  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.578   3.595  -0.429  1.00  9.13           C
ATOM      0  H   VAL A   5      -2.850   6.489   0.110  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -1.792   4.379   1.901  1.00  3.87           H   new
ATOM      0  HB  VAL A   5      -0.755   5.642  -0.589  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.121   4.075  -0.348  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.089   5.239   0.997  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       0.513   3.574   1.247  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -1.037   3.213  -1.295  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.626   2.822   0.338  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -2.589   3.874  -0.727  1.00  9.13           H   new
ATOM     92  N   LYS A   6      -0.677   6.211   3.328  1.00  6.04           N
ATOM     93  CA  LYS A   6       0.030   7.120   4.175  1.00  6.12           C
ATOM     94  C   LYS A   6       1.450   6.704   4.342  1.00  6.57           C
ATOM     95  O   LYS A   6       1.753   5.531   4.555  1.00  5.76           O
ATOM     96  CB  LYS A   6      -0.677   7.230   5.536  1.00  7.45           C
ATOM     97  CG  LYS A   6      -0.259   8.515   6.255  1.00 11.12           C
ATOM     98  CD  LYS A   6      -1.140   9.645   5.719  1.00 14.54           C
ATOM     99  CE  LYS A   6      -1.667  10.628   6.766  1.00 18.84           C
ATOM    100  NZ  LYS A   6      -2.936  11.245   6.318  1.00 20.55           N
ATOM      0  H   LYS A   6      -0.959   5.365   3.823  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       0.031   8.103   3.704  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6      -1.758   7.221   5.393  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6      -0.430   6.365   6.152  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6      -0.383   8.410   7.333  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       0.794   8.731   6.075  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6      -0.571  10.204   4.977  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6      -1.991   9.203   5.201  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6      -1.824  10.109   7.712  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6      -0.924  11.405   6.948  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6      -3.143  12.078   6.905  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -2.849  11.535   5.323  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6      -3.709  10.555   6.411  1.00 20.55           H   new
ATOM    114  N   THR A   7       2.429   7.571   4.026  1.00  7.41           N
ATOM    115  CA  THR A   7       3.804   7.179   4.050  1.00  7.48           C
ATOM    116  C   THR A   7       4.342   7.356   5.428  1.00  8.75           C
ATOM    117  O   THR A   7       3.600   7.606   6.376  1.00  8.58           O
ATOM    118  CB  THR A   7       4.718   7.859   3.074  1.00  9.61           C
ATOM    119  OG1 THR A   7       4.624   9.276   3.094  1.00 11.78           O
ATOM    120  CG2 THR A   7       4.198   7.442   1.688  1.00  9.17           C
ATOM      0  H   THR A   7       2.269   8.541   3.755  1.00  7.41           H   new
ATOM      0  HA  THR A   7       3.793   6.136   3.733  1.00  7.48           H   new
ATOM      0  HB  THR A   7       5.745   7.582   3.314  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       5.245   9.654   2.437  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       4.815   7.900   0.915  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       4.243   6.357   1.594  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       3.166   7.773   1.572  1.00  9.17           H   new
ATOM    128  N   LEU A   8       5.644   7.111   5.660  1.00  9.84           N
ATOM    129  CA  LEU A   8       6.343   7.250   6.900  1.00 14.15           C
ATOM    130  C   LEU A   8       6.489   8.692   7.246  1.00 17.37           C
ATOM    131  O   LEU A   8       6.201   9.016   8.398  1.00 17.01           O
ATOM    132  CB  LEU A   8       7.771   6.682   6.832  1.00 16.63           C
ATOM    133  CG  LEU A   8       8.669   6.795   8.075  1.00 18.88           C
ATOM    134  CD1 LEU A   8       8.317   5.720   9.117  1.00 18.59           C
ATOM    135  CD2 LEU A   8      10.054   6.434   7.512  1.00 19.31           C
ATOM      0  H   LEU A   8       6.260   6.788   4.914  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       5.757   6.704   7.640  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       7.695   5.626   6.574  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       8.284   7.176   6.007  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       8.584   7.770   8.556  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       8.969   5.826   9.984  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       7.279   5.840   9.427  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8       8.453   4.731   8.680  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      10.794   6.478   8.311  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      10.027   5.426   7.098  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      10.324   7.141   6.728  1.00 19.31           H   new
ATOM    147  N   THR A   9       6.967   9.575   6.351  1.00 18.33           N
ATOM    148  CA  THR A   9       7.186  10.968   6.583  1.00 19.24           C
ATOM    149  C   THR A   9       5.838  11.600   6.630  1.00 19.48           C
ATOM    150  O   THR A   9       5.598  12.526   7.403  1.00 23.14           O
ATOM    151  CB  THR A   9       8.014  11.779   5.630  1.00 18.97           C
ATOM    152  OG1 THR A   9       7.593  11.552   4.293  1.00 20.24           O
ATOM    153  CG2 THR A   9       9.518  11.457   5.614  1.00 19.70           C
ATOM      0  H   THR A   9       7.217   9.296   5.402  1.00 18.33           H   new
ATOM      0  HA  THR A   9       7.787  10.980   7.492  1.00 19.24           H   new
ATOM      0  HB  THR A   9       7.869  12.799   5.985  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       8.140  12.088   3.682  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      10.020  12.100   4.891  1.00 19.70           H   new
ATOM      0 HG22 THR A   9       9.937  11.628   6.605  1.00 19.70           H   new
ATOM      0 HG23 THR A   9       9.664  10.414   5.334  1.00 19.70           H   new
ATOM    161  N   GLY A  10       4.824  11.071   5.921  1.00 19.43           N
ATOM    162  CA  GLY A  10       3.455  11.385   6.188  1.00 18.74           C
ATOM    163  C   GLY A  10       2.901  12.057   4.979  1.00 17.62           C
ATOM    164  O   GLY A  10       2.408  13.177   5.107  1.00 19.74           O
ATOM      0  H   GLY A  10       4.957  10.415   5.151  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       2.892  10.480   6.414  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       3.375  12.036   7.058  1.00 18.74           H   new
ATOM    168  N   LYS A  11       3.003  11.455   3.781  1.00 13.56           N
ATOM    169  CA  LYS A  11       2.335  11.967   2.625  1.00 11.91           C
ATOM    170  C   LYS A  11       1.191  11.080   2.275  1.00 10.18           C
ATOM    171  O   LYS A  11       1.228   9.850   2.302  1.00  9.10           O
ATOM    172  CB  LYS A  11       3.310  11.899   1.438  1.00 13.43           C
ATOM    173  CG  LYS A  11       2.709  12.476   0.154  1.00 16.69           C
ATOM    174  CD  LYS A  11       3.727  12.687  -0.968  1.00 17.92           C
ATOM    175  CE  LYS A  11       3.074  13.199  -2.254  1.00 20.81           C
ATOM    176  NZ  LYS A  11       4.087  13.235  -3.333  1.00 21.93           N
ATOM      0  H   LYS A  11       3.550  10.611   3.612  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       1.996  12.983   2.827  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       4.220  12.445   1.687  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       3.598  10.862   1.267  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       1.925  11.807  -0.201  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       2.234  13.430   0.384  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       4.485  13.398  -0.639  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       4.240  11.747  -1.172  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       2.245  12.551  -2.538  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       2.660  14.194  -2.094  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       3.645  12.961  -4.234  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       4.472  14.197  -3.415  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       4.856  12.572  -3.109  1.00 21.93           H   new
ATOM    190  N   THR A  12       0.041  11.704   1.963  1.00  9.63           N
ATOM    191  CA  THR A  12      -1.158  10.958   1.739  1.00  9.85           C
ATOM    192  C   THR A  12      -1.262  10.779   0.264  1.00 11.66           C
ATOM    193  O   THR A  12      -1.392  11.736  -0.499  1.00 12.33           O
ATOM    194  CB  THR A  12      -2.434  11.642   2.133  1.00 10.85           C
ATOM    195  OG1 THR A  12      -2.495  12.005   3.504  1.00 10.91           O
ATOM    196  CG2 THR A  12      -3.518  10.553   2.058  1.00  9.63           C
ATOM      0  H   THR A  12      -0.059  12.715   1.867  1.00  9.63           H   new
ATOM      0  HA  THR A  12      -1.072  10.054   2.341  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -2.534  12.523   1.498  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -3.351  12.446   3.688  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -4.482  10.980   2.334  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -3.571  10.162   1.042  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -3.269   9.744   2.745  1.00  9.63           H   new
ATOM    204  N   ILE A  13      -1.070   9.555  -0.260  1.00 10.42           N
ATOM    205  CA  ILE A  13      -1.157   9.209  -1.645  1.00 11.84           C
ATOM    206  C   ILE A  13      -2.480   8.543  -1.807  1.00 10.55           C
ATOM    207  O   ILE A  13      -2.735   7.361  -1.582  1.00 11.92           O
ATOM    208  CB  ILE A  13      -0.030   8.327  -2.093  1.00 14.86           C
ATOM    209  CG1 ILE A  13       1.294   8.945  -1.614  1.00 14.87           C
ATOM    210  CG2 ILE A  13      -0.092   8.158  -3.621  1.00 17.08           C
ATOM    211  CD1 ILE A  13       2.417   8.183  -2.315  1.00 16.46           C
ATOM      0  H   ILE A  13      -0.838   8.753   0.325  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -1.072  10.096  -2.272  1.00 11.84           H   new
ATOM      0  HB  ILE A  13      -0.108   7.330  -1.659  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       1.336  10.006  -1.859  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       1.389   8.864  -0.531  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       0.726   7.517  -3.950  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -1.043   7.703  -3.898  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13      -0.003   9.134  -4.099  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       3.380   8.588  -2.005  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.364   7.128  -2.047  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       2.310   8.289  -3.395  1.00 16.46           H   new
ATOM    223  N   THR A  14      -3.489   9.322  -2.233  1.00  9.39           N
ATOM    224  CA  THR A  14      -4.841   8.860  -2.294  1.00  9.63           C
ATOM    225  C   THR A  14      -5.079   8.231  -3.624  1.00 11.20           C
ATOM    226  O   THR A  14      -5.077   8.846  -4.689  1.00 11.63           O
ATOM    227  CB  THR A  14      -5.821   9.975  -2.078  1.00 10.38           C
ATOM    228  OG1 THR A  14      -5.519  10.577  -0.829  1.00 16.30           O
ATOM    229  CG2 THR A  14      -7.312   9.606  -1.985  1.00 11.66           C
ATOM      0  H   THR A  14      -3.365  10.287  -2.540  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -4.991   8.132  -1.497  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -5.706  10.598  -2.965  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -6.144  11.313  -0.661  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -7.901  10.509  -1.829  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -7.626   9.124  -2.911  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -7.466   8.923  -1.150  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -5.394   6.923  -3.629  1.00  8.29           N
ATOM    238  CA  LEU A  15      -5.412   6.083  -4.786  1.00  9.03           C
ATOM    239  C   LEU A  15      -6.795   5.692  -5.178  1.00  8.59           C
ATOM    240  O   LEU A  15      -7.573   5.202  -4.360  1.00  7.79           O
ATOM    241  CB  LEU A  15      -4.454   4.895  -4.594  1.00 11.08           C
ATOM    242  CG  LEU A  15      -2.988   5.225  -4.266  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -2.274   3.936  -3.826  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -2.147   5.691  -5.466  1.00 15.88           C
ATOM      0  H   LEU A  15      -5.650   6.424  -2.777  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -5.040   6.651  -5.638  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -4.847   4.269  -3.793  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -4.471   4.296  -5.505  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -3.049   6.016  -3.519  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -1.233   4.159  -3.591  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -2.767   3.531  -2.942  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -2.315   3.204  -4.632  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -1.129   5.900  -5.138  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -2.130   4.908  -6.224  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -2.585   6.595  -5.888  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -7.123   5.709  -6.482  1.00 11.04           N
ATOM    257  CA  GLU A  16      -8.416   5.290  -6.924  1.00 11.50           C
ATOM    258  C   GLU A  16      -8.307   3.961  -7.589  1.00 10.13           C
ATOM    259  O   GLU A  16      -7.960   3.870  -8.766  1.00  9.83           O
ATOM    260  CB  GLU A  16      -9.155   6.329  -7.785  1.00 17.22           C
ATOM    261  CG  GLU A  16      -9.664   7.451  -6.878  1.00 23.33           C
ATOM    262  CD  GLU A  16     -10.413   8.549  -7.620  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -11.555   8.299  -8.089  1.00 28.86           O
ATOM    264  OE2 GLU A  16      -9.841   9.639  -7.889  1.00 28.90           O
ATOM      0  H   GLU A  16      -6.496   6.012  -7.227  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -9.047   5.193  -6.040  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -8.486   6.733  -8.545  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -9.988   5.861  -8.309  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16     -10.321   7.023  -6.121  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -8.817   7.893  -6.352  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -8.660   2.843  -6.929  1.00  8.99           N
ATOM    272  CA  VAL A  17      -8.513   1.508  -7.421  1.00  8.85           C
ATOM    273  C   VAL A  17      -9.807   0.783  -7.279  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.689   1.170  -6.514  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.440   0.713  -6.738  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -6.072   1.310  -7.108  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -7.617   0.812  -5.213  1.00 10.54           C
ATOM      0  H   VAL A  17      -9.072   2.874  -5.997  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -8.214   1.605  -8.465  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.503  -0.329  -7.051  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.282   0.741  -6.618  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -5.935   1.264  -8.188  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -6.028   2.349  -6.781  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -6.837   0.234  -4.718  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -7.546   1.855  -4.905  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -8.594   0.417  -4.934  1.00 10.54           H   new
ATOM    287  N   GLU A  18     -10.013  -0.351  -7.973  1.00  7.29           N
ATOM    288  CA  GLU A  18     -11.148  -1.208  -7.826  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.906  -2.167  -6.711  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.749  -2.417  -6.379  1.00  5.28           O
ATOM    291  CB  GLU A  18     -11.445  -1.978  -9.124  1.00 10.28           C
ATOM    292  CG  GLU A  18     -11.969  -1.148 -10.297  1.00 12.65           C
ATOM    293  CD  GLU A  18     -13.389  -0.626 -10.132  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -14.252  -1.485  -9.809  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -13.579   0.615 -10.242  1.00 18.17           O
ATOM      0  H   GLU A  18      -9.352  -0.687  -8.674  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -12.016  -0.589  -7.600  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -10.531  -2.480  -9.441  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -12.175  -2.756  -8.901  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -11.302  -0.300 -10.449  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -11.924  -1.755 -11.201  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.836  -2.879  -6.146  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.603  -3.709  -5.001  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.272  -5.107  -5.396  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.993  -5.963  -4.558  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.920  -3.652  -4.230  1.00  7.61           C
ATOM    307  CG  PRO A  19     -14.027  -3.476  -5.282  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.263  -2.740  -6.395  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.753  -3.368  -4.409  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -13.073  -4.564  -3.653  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.921  -2.823  -3.522  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.429  -4.431  -5.620  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -14.866  -2.893  -4.903  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.520  -3.156  -7.369  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -13.543  -1.687  -6.414  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.317  -5.448  -6.697  1.00  6.80           N
ATOM    317  CA  SER A  20     -10.964  -6.688  -7.315  1.00  6.28           C
ATOM    318  C   SER A  20      -9.518  -6.738  -7.671  1.00  8.45           C
ATOM    319  O   SER A  20      -8.932  -7.734  -8.092  1.00  7.26           O
ATOM    320  CB  SER A  20     -11.815  -6.953  -8.568  1.00  8.57           C
ATOM    321  OG  SER A  20     -12.015  -5.818  -9.398  1.00 11.13           O
ATOM      0  H   SER A  20     -11.638  -4.774  -7.392  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.165  -7.469  -6.581  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -11.338  -7.737  -9.156  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -12.787  -7.335  -8.257  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -12.562  -6.070 -10.171  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -8.790  -5.619  -7.504  1.00  7.50           N
ATOM    328  CA  ASP A  21      -7.399  -5.533  -7.821  1.00  7.70           C
ATOM    329  C   ASP A  21      -6.488  -5.921  -6.708  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.881  -5.957  -5.543  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.095  -4.082  -8.230  1.00 11.00           C
ATOM    332  CG  ASP A  21      -7.078  -3.850  -9.734  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -5.987  -4.090 -10.318  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -8.033  -3.344 -10.382  1.00 14.36           O
ATOM      0  H   ASP A  21      -9.180  -4.750  -7.138  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -7.211  -6.245  -8.625  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.840  -3.426  -7.781  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.127  -3.795  -7.818  1.00 11.00           H   new
ATOM    339  N   THR A  22      -5.242  -6.275  -7.072  1.00  5.37           N
ATOM    340  CA  THR A  22      -4.269  -6.795  -6.162  1.00  6.01           C
ATOM    341  C   THR A  22      -3.441  -5.715  -5.553  1.00  8.01           C
ATOM    342  O   THR A  22      -3.307  -4.600  -6.055  1.00  8.11           O
ATOM    343  CB  THR A  22      -3.393  -7.798  -6.851  1.00  8.92           C
ATOM    344  OG1 THR A  22      -2.822  -7.103  -7.950  1.00 10.22           O
ATOM    345  CG2 THR A  22      -4.201  -9.035  -7.280  1.00  9.65           C
ATOM      0  H   THR A  22      -4.901  -6.197  -8.030  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -4.809  -7.288  -5.354  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -2.613  -8.189  -6.197  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -2.231  -7.706  -8.447  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -3.541  -9.746  -7.777  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -4.643  -9.504  -6.401  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -4.992  -8.733  -7.966  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -2.710  -6.056  -4.477  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.745  -5.175  -3.895  1.00  9.92           C
ATOM    355  C   ILE A  23      -0.546  -4.953  -4.751  1.00 10.01           C
ATOM    356  O   ILE A  23       0.212  -3.984  -4.739  1.00  8.71           O
ATOM    357  CB  ILE A  23      -1.360  -5.582  -2.504  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -2.419  -6.296  -1.647  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.843  -4.315  -1.801  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -3.645  -5.432  -1.354  1.00 12.30           C
ATOM      0  H   ILE A  23      -2.790  -6.956  -4.004  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.250  -4.212  -3.825  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -0.606  -6.362  -2.611  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -2.738  -7.204  -2.158  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -1.966  -6.603  -0.704  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23      -0.549  -4.560  -0.780  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.018  -3.924  -2.343  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -1.631  -3.563  -1.781  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -4.351  -5.997  -0.746  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -3.338  -4.536  -0.815  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -4.121  -5.146  -2.292  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -0.270  -5.853  -5.712  1.00  9.54           N
ATOM    373  CA  GLU A  24       0.779  -5.677  -6.668  1.00 11.81           C
ATOM    374  C   GLU A  24       0.529  -4.537  -7.595  1.00 11.14           C
ATOM    375  O   GLU A  24       1.439  -3.773  -7.912  1.00 10.62           O
ATOM    376  CB  GLU A  24       1.056  -6.952  -7.482  1.00 19.24           C
ATOM    377  CG  GLU A  24       2.260  -6.909  -8.426  1.00 27.76           C
ATOM    378  CD  GLU A  24       2.611  -8.263  -9.025  1.00 32.92           C
ATOM    379  OE1 GLU A  24       1.688  -8.996  -9.471  1.00 34.80           O
ATOM    380  OE2 GLU A  24       3.783  -8.686  -8.841  1.00 36.51           O
ATOM      0  H   GLU A  24      -0.788  -6.724  -5.827  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       1.664  -5.447  -6.075  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       1.198  -7.778  -6.785  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24       0.168  -7.181  -8.071  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       2.054  -6.206  -9.233  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       3.124  -6.526  -7.883  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -0.719  -4.422  -8.084  1.00  9.43           N
ATOM    388  CA  ASN A  25      -1.139  -3.370  -8.957  1.00 10.96           C
ATOM    389  C   ASN A  25      -1.239  -2.042  -8.290  1.00  9.68           C
ATOM    390  O   ASN A  25      -0.834  -1.067  -8.921  1.00  9.33           O
ATOM    391  CB  ASN A  25      -2.441  -3.694  -9.708  1.00 16.78           C
ATOM    392  CG  ASN A  25      -2.165  -4.548 -10.937  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -1.368  -4.165 -11.791  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -2.758  -5.767 -11.048  1.00 24.70           N
ATOM      0  H   ASN A  25      -1.462  -5.085  -7.864  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -0.338  -3.299  -9.693  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -3.127  -4.219  -9.043  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -2.932  -2.768 -10.007  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -2.542  -6.369 -11.843  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -3.418  -6.080 -10.336  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -1.595  -1.953  -6.996  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.580  -0.848  -6.088  1.00  5.53           C
ATOM    403  C   VAL A  26      -0.205  -0.311  -5.888  1.00  4.42           C
ATOM    404  O   VAL A  26      -0.005   0.902  -5.850  1.00  3.40           O
ATOM    405  CB  VAL A  26      -2.130  -1.221  -4.743  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -2.091  -0.009  -3.796  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -3.617  -1.565  -4.928  1.00  8.12           C
ATOM      0  H   VAL A  26      -1.945  -2.785  -6.522  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -2.210  -0.085  -6.545  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -1.546  -2.046  -4.335  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -2.493  -0.294  -2.824  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -1.061   0.328  -3.678  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -2.691   0.799  -4.214  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -4.049  -1.842  -3.966  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -4.144  -0.698  -5.327  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.714  -2.400  -5.622  1.00  8.12           H   new
ATOM    417  N   LYS A  27       0.809  -1.192  -5.822  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.172  -0.776  -5.941  1.00  4.14           C
ATOM    419  C   LYS A  27       2.542  -0.255  -7.287  1.00  5.58           C
ATOM    420  O   LYS A  27       3.191   0.789  -7.317  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.078  -1.927  -5.471  1.00  3.97           C
ATOM    422  CG  LYS A  27       3.097  -2.292  -3.986  1.00  7.45           C
ATOM    423  CD  LYS A  27       4.098  -3.422  -3.739  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.188  -4.024  -2.335  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.035  -5.230  -2.198  1.00 15.47           N
ATOM      0  H   LYS A  27       0.684  -2.195  -5.686  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.317   0.090  -5.295  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       2.792  -2.820  -6.026  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.099  -1.683  -5.764  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.367  -1.419  -3.392  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.102  -2.600  -3.666  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.863  -4.230  -4.432  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       5.088  -3.052  -4.005  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       4.567  -3.259  -1.657  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.180  -4.273  -2.003  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       4.599  -5.885  -1.518  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.124  -5.699  -3.122  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       5.978  -4.955  -1.857  1.00 15.47           H   new
ATOM    439  N   ALA A  28       2.132  -0.849  -8.422  1.00  6.61           N
ATOM    440  CA  ALA A  28       2.367  -0.224  -9.687  1.00  7.74           C
ATOM    441  C   ALA A  28       1.810   1.141  -9.895  1.00  9.17           C
ATOM    442  O   ALA A  28       2.445   2.048 -10.431  1.00 11.45           O
ATOM    443  CB  ALA A  28       1.928  -1.146 -10.837  1.00  7.68           C
ATOM      0  H   ALA A  28       1.647  -1.745  -8.466  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       3.446  -0.067  -9.683  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       2.115  -0.652 -11.791  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       2.493  -2.077 -10.793  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       0.864  -1.363 -10.743  1.00  7.68           H   new
ATOM    449  N   LYS A  29       0.604   1.369  -9.345  1.00  8.96           N
ATOM    450  CA  LYS A  29      -0.041   2.628  -9.130  1.00  7.90           C
ATOM    451  C   LYS A  29       0.767   3.727  -8.531  1.00  6.92           C
ATOM    452  O   LYS A  29       0.678   4.923  -8.804  1.00  6.87           O
ATOM    453  CB  LYS A  29      -1.391   2.617  -8.393  1.00 10.28           C
ATOM    454  CG  LYS A  29      -2.450   1.823  -9.161  1.00 14.94           C
ATOM    455  CD  LYS A  29      -2.928   2.503 -10.445  1.00 19.69           C
ATOM    456  CE  LYS A  29      -3.565   1.540 -11.449  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -4.043   2.221 -12.674  1.00 24.98           N
ATOM      0  H   LYS A  29       0.026   0.594  -9.020  1.00  8.96           H   new
ATOM      0  HA  LYS A  29      -0.208   2.844 -10.185  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -1.260   2.184  -7.401  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -1.736   3.641  -8.251  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -2.044   0.843  -9.411  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -3.308   1.656  -8.509  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -3.651   3.277 -10.188  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -2.082   3.001 -10.919  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -2.838   0.776 -11.724  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -4.402   1.028 -10.974  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -4.465   1.522 -13.318  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -4.758   2.932 -12.419  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -3.243   2.688 -13.146  1.00 24.98           H   new
ATOM    471  N   ILE A  30       1.671   3.361  -7.604  1.00  4.57           N
ATOM    472  CA  ILE A  30       2.451   4.242  -6.792  1.00  5.58           C
ATOM    473  C   ILE A  30       3.782   4.512  -7.405  1.00  7.26           C
ATOM    474  O   ILE A  30       4.316   5.619  -7.349  1.00  9.46           O
ATOM    475  CB  ILE A  30       2.672   3.633  -5.439  1.00  5.36           C
ATOM    476  CG1 ILE A  30       1.373   3.601  -4.616  1.00  2.94           C
ATOM    477  CG2 ILE A  30       3.787   4.312  -4.625  1.00  2.78           C
ATOM    478  CD1 ILE A  30       1.386   2.654  -3.416  1.00  2.00           C
ATOM      0  H   ILE A  30       1.870   2.380  -7.410  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       1.900   5.178  -6.706  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.002   2.613  -5.639  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       1.162   4.610  -4.260  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       0.552   3.317  -5.274  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       3.887   3.816  -3.660  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       4.729   4.241  -5.169  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       3.536   5.361  -4.469  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       0.426   2.704  -2.902  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       1.561   1.634  -3.759  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       2.181   2.947  -2.730  1.00  2.00           H   new
ATOM    490  N   GLN A  31       4.337   3.493  -8.085  1.00  7.06           N
ATOM    491  CA  GLN A  31       5.380   3.656  -9.050  1.00  8.67           C
ATOM    492  C   GLN A  31       4.978   4.570 -10.156  1.00 10.90           C
ATOM    493  O   GLN A  31       5.600   5.605 -10.390  1.00  9.63           O
ATOM    494  CB  GLN A  31       5.795   2.285  -9.611  1.00  9.12           C
ATOM    495  CG  GLN A  31       7.287   2.195  -9.935  1.00 10.76           C
ATOM    496  CD  GLN A  31       7.649   3.137 -11.075  1.00 13.78           C
ATOM    497  OE1 GLN A  31       8.510   4.004 -10.933  1.00 14.48           O
ATOM    498  NE2 GLN A  31       7.136   2.855 -12.303  1.00 14.76           N
ATOM      0  H   GLN A  31       4.050   2.522  -7.959  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       6.231   4.113  -8.546  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       5.539   1.511  -8.888  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       5.220   2.080 -10.514  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       7.872   2.446  -9.050  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       7.544   1.171 -10.207  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       6.423   2.133 -12.404  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       7.465   3.365 -13.123  1.00 14.76           H   new
ATOM    507  N   ASP A  32       3.781   4.356 -10.730  1.00 10.93           N
ATOM    508  CA  ASP A  32       3.154   5.251 -11.653  1.00 14.01           C
ATOM    509  C   ASP A  32       3.025   6.650 -11.157  1.00 14.04           C
ATOM    510  O   ASP A  32       3.463   7.636 -11.749  1.00 13.39           O
ATOM    511  CB  ASP A  32       1.843   4.765 -12.292  1.00 18.01           C
ATOM    512  CG  ASP A  32       1.517   5.511 -13.578  1.00 24.33           C
ATOM    513  OD1 ASP A  32       2.262   5.396 -14.588  1.00 26.29           O
ATOM    514  OD2 ASP A  32       0.442   6.167 -13.620  1.00 25.17           O
ATOM      0  H   ASP A  32       3.225   3.522 -10.542  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       3.879   5.255 -12.467  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       1.917   3.698 -12.502  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       1.026   4.894 -11.582  1.00 18.01           H   new
ATOM    519  N   LYS A  33       2.343   6.788 -10.006  1.00 14.22           N
ATOM    520  CA  LYS A  33       1.984   8.094  -9.547  1.00 14.00           C
ATOM    521  C   LYS A  33       3.109   8.779  -8.849  1.00 12.37           C
ATOM    522  O   LYS A  33       3.449   9.907  -9.204  1.00 12.17           O
ATOM    523  CB  LYS A  33       0.756   8.070  -8.621  1.00 18.62           C
ATOM    524  CG  LYS A  33       0.417   9.382  -7.912  1.00 24.00           C
ATOM    525  CD  LYS A  33      -0.182  10.376  -8.910  1.00 27.61           C
ATOM    526  CE  LYS A  33      -0.731  11.702  -8.379  1.00 27.64           C
ATOM    527  NZ  LYS A  33       0.294  12.383  -7.557  1.00 30.06           N
ATOM      0  H   LYS A  33       2.046   6.018  -9.407  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       1.735   8.657 -10.446  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33      -0.110   7.765  -9.209  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       0.914   7.302  -7.863  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33      -0.289   9.196  -7.103  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.315   9.804  -7.460  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       0.585  10.607  -9.649  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -0.991   9.870  -9.437  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -1.026  12.342  -9.211  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -1.626  11.522  -7.783  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -0.076  13.298  -7.229  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33       0.530  11.790  -6.736  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33       1.149  12.540  -8.128  1.00 30.06           H   new
ATOM    541  N   GLU A  34       3.808   8.223  -7.844  1.00 10.11           N
ATOM    542  CA  GLU A  34       4.661   8.876  -6.901  1.00 10.07           C
ATOM    543  C   GLU A  34       6.003   8.682  -7.519  1.00  9.32           C
ATOM    544  O   GLU A  34       6.873   9.550  -7.468  1.00 11.61           O
ATOM    545  CB  GLU A  34       4.758   8.171  -5.537  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.591   8.905  -4.485  1.00 18.75           C
ATOM    547  CD  GLU A  34       4.930  10.218  -4.089  1.00 22.28           C
ATOM    548  OE1 GLU A  34       3.792  10.523  -4.534  1.00 25.19           O
ATOM    549  OE2 GLU A  34       5.652  11.005  -3.419  1.00 21.95           O
ATOM      0  H   GLU A  34       3.770   7.217  -7.678  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       4.305   9.890  -6.719  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       3.750   8.029  -5.146  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       5.184   7.179  -5.688  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       5.711   8.273  -3.605  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.590   9.099  -4.876  1.00 18.75           H   new
ATOM    556  N   GLY A  35       6.369   7.515  -8.076  1.00  7.22           N
ATOM    557  CA  GLY A  35       7.715   7.264  -8.488  1.00  6.29           C
ATOM    558  C   GLY A  35       8.576   6.555  -7.499  1.00  6.93           C
ATOM    559  O   GLY A  35       9.770   6.836  -7.407  1.00  7.41           O
ATOM      0  H   GLY A  35       5.728   6.739  -8.242  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       7.690   6.677  -9.406  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       8.184   8.217  -8.732  1.00  6.29           H   new
ATOM    563  N   ILE A  36       8.046   5.513  -6.833  1.00  5.86           N
ATOM    564  CA  ILE A  36       8.829   4.746  -5.915  1.00  6.07           C
ATOM    565  C   ILE A  36       9.034   3.394  -6.505  1.00  6.36           C
ATOM    566  O   ILE A  36       7.991   2.757  -6.640  1.00  6.18           O
ATOM    567  CB  ILE A  36       8.105   4.667  -4.603  1.00  7.47           C
ATOM    568  CG1 ILE A  36       7.917   6.085  -4.039  1.00  8.52           C
ATOM    569  CG2 ILE A  36       8.975   3.825  -3.654  1.00  7.36           C
ATOM    570  CD1 ILE A  36       6.984   6.019  -2.830  1.00  9.49           C
ATOM      0  H   ILE A  36       7.079   5.203  -6.930  1.00  5.86           H   new
ATOM      0  HA  ILE A  36       9.800   5.207  -5.737  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       7.121   4.213  -4.719  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       8.880   6.506  -3.749  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       7.499   6.742  -4.802  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       8.482   3.743  -2.685  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.115   2.830  -4.075  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36       9.945   4.305  -3.528  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       6.845   7.020  -2.423  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       6.019   5.614  -3.136  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       7.422   5.375  -2.067  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.183   2.852  -6.783  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.201   1.552  -7.389  1.00  9.18           C
ATOM    584  C   PRO A  37       9.703   0.456  -6.511  1.00  9.85           C
ATOM    585  O   PRO A  37       9.954   0.641  -5.321  1.00  8.51           O
ATOM    586  CB  PRO A  37      11.695   1.306  -7.585  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.255   2.655  -8.063  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.287   3.612  -7.349  1.00  8.33           C
ATOM      0  HA  PRO A  37       9.567   1.542  -8.276  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      12.169   0.988  -6.656  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      11.874   0.521  -8.320  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      13.291   2.807  -7.760  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      12.221   2.760  -9.147  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      11.810   4.155  -6.562  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      10.909   4.355  -8.051  1.00  8.33           H   new
ATOM    596  N   PRO A  38       9.097  -0.604  -6.956  1.00  8.71           N
ATOM    597  CA  PRO A  38       8.303  -1.441  -6.104  1.00  9.08           C
ATOM    598  C   PRO A  38       9.014  -2.329  -5.141  1.00  9.28           C
ATOM    599  O   PRO A  38       8.402  -2.776  -4.173  1.00  6.50           O
ATOM    600  CB  PRO A  38       7.475  -2.259  -7.092  1.00 10.31           C
ATOM    601  CG  PRO A  38       8.240  -2.289  -8.425  1.00 10.81           C
ATOM    602  CD  PRO A  38       8.873  -0.890  -8.365  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.740  -0.809  -5.418  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       7.320  -3.270  -6.717  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       6.489  -1.814  -7.226  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       8.982  -3.086  -8.468  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       7.583  -2.418  -9.285  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       9.810  -0.863  -8.921  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.215  -0.146  -8.813  1.00 12.00           H   new
ATOM    610  N   ASP A  39      10.313  -2.620  -5.333  1.00 11.20           N
ATOM    611  CA  ASP A  39      11.150  -3.352  -4.435  1.00 14.96           C
ATOM    612  C   ASP A  39      11.357  -2.796  -3.068  1.00 13.99           C
ATOM    613  O   ASP A  39      11.517  -3.549  -2.109  1.00 13.75           O
ATOM    614  CB  ASP A  39      12.525  -3.600  -5.079  1.00 24.16           C
ATOM    615  CG  ASP A  39      13.287  -2.333  -5.437  1.00 31.06           C
ATOM    616  OD1 ASP A  39      12.835  -1.643  -6.390  1.00 34.22           O
ATOM    617  OD2 ASP A  39      14.230  -2.000  -4.671  1.00 35.55           O
ATOM      0  H   ASP A  39      10.811  -2.323  -6.172  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      10.584  -4.269  -4.271  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      13.132  -4.194  -4.395  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      12.388  -4.195  -5.982  1.00 24.16           H   new
ATOM    622  N   GLN A  40      11.087  -1.493  -2.875  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.304  -0.736  -1.681  1.00 10.76           C
ATOM    624  C   GLN A  40      10.093  -0.594  -0.825  1.00  8.01           C
ATOM    625  O   GLN A  40      10.184  -0.253   0.354  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.806   0.690  -1.964  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.012   0.719  -2.906  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.076   2.140  -3.446  1.00 16.11           C
ATOM    629  OE1 GLN A  40      12.432   3.033  -2.898  1.00 20.52           O
ATOM    630  NE2 GLN A  40      13.748   2.316  -4.616  1.00 18.16           N
ATOM      0  H   GLN A  40      10.683  -0.922  -3.618  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      12.059  -1.320  -1.155  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      10.996   1.275  -2.400  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      12.075   1.169  -1.023  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.929   0.459  -2.377  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.895  -0.003  -3.715  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.267   1.540  -5.028  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      13.733   3.224  -5.081  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.892  -0.932  -1.325  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.618  -0.664  -0.731  1.00  3.87           C
ATOM    641  C   GLN A  41       7.089  -1.851  -0.002  1.00  4.79           C
ATOM    642  O   GLN A  41       7.219  -2.989  -0.451  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.596  -0.267  -1.810  1.00  4.20           C
ATOM    644  CG  GLN A  41       6.932   1.134  -2.325  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.848   1.406  -3.358  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.632   1.334  -3.188  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.249   1.773  -4.604  1.00  7.13           N
ATOM      0  H   GLN A  41       8.805  -1.430  -2.211  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       7.763   0.153  -0.025  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.617  -0.984  -2.630  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.587  -0.284  -1.397  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       6.914   1.871  -1.522  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       7.927   1.170  -2.769  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       7.243   1.853  -4.817  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.556   1.968  -5.326  1.00  7.13           H   new
ATOM    656  N   ARG A  42       6.466  -1.548   1.150  1.00  5.73           N
ATOM    657  CA  ARG A  42       5.941  -2.579   1.991  1.00  6.97           C
ATOM    658  C   ARG A  42       4.675  -2.068   2.588  1.00  7.15           C
ATOM    659  O   ARG A  42       4.837  -1.169   3.411  1.00  7.33           O
ATOM    660  CB  ARG A  42       6.883  -2.975   3.140  1.00 13.23           C
ATOM    661  CG  ARG A  42       6.309  -3.881   4.231  1.00 21.27           C
ATOM    662  CD  ARG A  42       7.348  -4.404   5.226  1.00 26.14           C
ATOM    663  NE  ARG A  42       8.351  -5.259   4.531  1.00 32.26           N
ATOM    664  CZ  ARG A  42       9.262  -5.968   5.259  1.00 34.32           C
ATOM    665  NH1 ARG A  42       9.389  -5.809   6.609  1.00 35.30           N
ATOM    666  NH2 ARG A  42       9.955  -6.968   4.640  1.00 36.39           N
ATOM      0  H   ARG A  42       6.326  -0.599   1.497  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       5.798  -3.467   1.375  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.751  -3.473   2.709  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       7.242  -2.061   3.613  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       5.544  -3.331   4.778  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       5.815  -4.730   3.759  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       7.849  -3.567   5.712  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       6.853  -4.977   6.010  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       8.357  -5.314   3.513  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.793  -5.145   7.103  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42      10.080  -6.355   7.124  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       9.787  -7.171   3.655  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42      10.641  -7.512   5.163  1.00 36.39           H   new
ATOM    680  N   LEU A  43       3.430  -2.468   2.273  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.219  -1.909   2.790  1.00  3.51           C
ATOM    682  C   LEU A  43       1.734  -2.610   4.011  1.00  5.56           C
ATOM    683  O   LEU A  43       1.795  -3.835   4.103  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.114  -2.030   1.727  1.00  3.74           C
ATOM    685  CG  LEU A  43       1.363  -1.098   0.529  1.00  6.32           C
ATOM    686  CD1 LEU A  43       0.932  -1.642  -0.843  1.00  6.41           C
ATOM    687  CD2 LEU A  43       0.731   0.278   0.798  1.00  9.55           C
ATOM      0  H   LEU A  43       3.259  -3.229   1.616  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       2.437  -0.872   3.046  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       1.057  -3.061   1.379  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.150  -1.792   2.177  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       2.447  -1.015   0.451  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.154  -0.903  -1.613  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.475  -2.563  -1.056  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43      -0.139  -1.846  -0.834  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       0.911   0.934  -0.054  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43      -0.343   0.162   0.947  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       1.176   0.714   1.692  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.132  -1.872   4.961  1.00  4.58           N
ATOM    700  CA  ILE A  44       0.653  -2.336   6.226  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.764  -1.917   6.416  1.00  5.46           C
ATOM    702  O   ILE A  44      -1.189  -0.826   6.038  1.00  6.04           O
ATOM    703  CB  ILE A  44       1.419  -1.850   7.421  1.00  6.80           C
ATOM    704  CG1 ILE A  44       2.941  -1.908   7.208  1.00 10.31           C
ATOM    705  CG2 ILE A  44       1.033  -2.682   8.655  1.00  7.39           C
ATOM    706  CD1 ILE A  44       3.630  -0.987   8.214  1.00 13.90           C
ATOM      0  H   ILE A  44       0.968  -0.873   4.833  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       0.776  -3.418   6.180  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       1.155  -0.804   7.574  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       3.298  -2.931   7.331  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       3.189  -1.604   6.191  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       1.591  -2.327   9.522  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44      -0.036  -2.579   8.844  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       1.270  -3.731   8.475  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       4.709  -1.027   8.064  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       3.281   0.036   8.069  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       3.392  -1.312   9.227  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.688  -2.734   6.953  1.00  6.75           N
ATOM    719  CA  PHE A  45      -3.041  -2.397   7.267  1.00  4.70           C
ATOM    720  C   PHE A  45      -3.066  -2.709   8.724  1.00  6.34           C
ATOM    721  O   PHE A  45      -2.809  -3.849   9.106  1.00  5.45           O
ATOM    722  CB  PHE A  45      -4.022  -3.349   6.562  1.00  5.51           C
ATOM    723  CG  PHE A  45      -5.379  -2.842   6.913  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -5.752  -1.624   6.396  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -6.127  -3.529   7.840  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -6.934  -1.089   6.851  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -7.321  -2.995   8.265  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -7.669  -1.745   7.811  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.471  -3.703   7.184  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -3.319  -1.383   6.981  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.867  -3.346   5.483  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -3.886  -4.376   6.900  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -5.144  -1.111   5.666  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -5.781  -4.475   8.229  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -7.287  -0.149   6.453  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -7.967  -3.542   8.936  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -8.545  -1.264   8.220  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -3.211  -1.652   9.543  1.00  6.53           N
ATOM    739  CA  ALA A  46      -3.305  -1.740  10.968  1.00  7.15           C
ATOM    740  C   ALA A  46      -2.037  -2.151  11.634  1.00  9.00           C
ATOM    741  O   ALA A  46      -1.480  -1.194  12.170  1.00 11.15           O
ATOM    742  CB  ALA A  46      -4.536  -2.565  11.380  1.00  8.99           C
ATOM      0  H   ALA A  46      -3.265  -0.694   9.197  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -3.462  -0.730  11.346  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -4.590  -2.620  12.467  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -5.438  -2.089  10.996  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -4.454  -3.571  10.969  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -1.664  -3.441  11.558  1.00  9.35           N
ATOM    749  CA  GLY A  47      -0.400  -4.017  11.898  1.00 11.68           C
ATOM    750  C   GLY A  47      -0.133  -5.335  11.256  1.00 11.14           C
ATOM    751  O   GLY A  47       0.763  -6.072  11.663  1.00 13.93           O
ATOM      0  H   GLY A  47      -2.316  -4.151  11.224  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       0.390  -3.322  11.615  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47      -0.348  -4.136  12.980  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -0.818  -5.642  10.140  1.00 10.47           N
ATOM    756  CA  LYS A  48      -0.612  -6.812   9.345  1.00  8.82           C
ATOM    757  C   LYS A  48      -0.125  -6.339   8.019  1.00  7.68           C
ATOM    758  O   LYS A  48      -0.710  -5.398   7.485  1.00  6.47           O
ATOM    759  CB  LYS A  48      -1.792  -7.785   9.180  1.00  9.74           C
ATOM    760  CG  LYS A  48      -3.115  -7.206   8.675  1.00 14.14           C
ATOM    761  CD  LYS A  48      -4.291  -8.130   8.997  1.00 16.32           C
ATOM    762  CE  LYS A  48      -4.200  -9.377   8.115  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -5.381 -10.258   8.265  1.00 23.92           N
ATOM      0  H   LYS A  48      -1.556  -5.041   9.773  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       0.105  -7.430   9.886  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -1.485  -8.574   8.493  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -1.977  -8.257  10.145  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -3.283  -6.230   9.130  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -3.058  -7.050   7.598  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -4.272  -8.411  10.050  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -5.235  -7.613   8.822  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -4.104  -9.076   7.072  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -3.299  -9.935   8.370  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -5.275 -11.089   7.649  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -5.459 -10.568   9.255  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -6.240  -9.736   7.997  1.00 23.92           H   new
ATOM    777  N   GLN A  49       0.965  -6.894   7.458  1.00  8.89           N
ATOM    778  CA  GLN A  49       1.349  -6.526   6.131  1.00  7.18           C
ATOM    779  C   GLN A  49       0.454  -7.046   5.060  1.00  8.23           C
ATOM    780  O   GLN A  49      -0.066  -8.151   5.208  1.00  9.70           O
ATOM    781  CB  GLN A  49       2.757  -6.944   5.673  1.00 11.67           C
ATOM    782  CG  GLN A  49       3.973  -6.401   6.425  1.00 15.82           C
ATOM    783  CD  GLN A  49       5.210  -7.204   6.048  1.00 20.21           C
ATOM    784  OE1 GLN A  49       5.397  -7.672   4.926  1.00 23.23           O
ATOM    785  NE2 GLN A  49       6.033  -7.387   7.115  1.00 20.67           N
ATOM      0  H   GLN A  49       1.568  -7.581   7.911  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       1.293  -5.443   6.240  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       2.806  -8.032   5.711  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       2.862  -6.656   4.627  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       4.123  -5.349   6.182  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       3.804  -6.459   7.500  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       5.805  -6.963   8.014  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       6.879  -7.949   7.016  1.00 20.67           H   new
ATOM    794  N   LEU A  50       0.320  -6.262   3.976  1.00  6.51           N
ATOM    795  CA  LEU A  50      -0.328  -6.613   2.750  1.00  7.41           C
ATOM    796  C   LEU A  50       0.633  -6.983   1.674  1.00  8.27           C
ATOM    797  O   LEU A  50       1.302  -6.099   1.141  1.00  8.34           O
ATOM    798  CB  LEU A  50      -1.320  -5.545   2.259  1.00  7.13           C
ATOM    799  CG  LEU A  50      -2.206  -5.036   3.408  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -3.095  -3.937   2.801  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -3.113  -5.994   4.199  1.00  8.14           C
ATOM      0  H   LEU A  50       0.692  -5.313   3.956  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -0.911  -7.503   2.988  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50      -0.772  -4.710   1.822  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -1.947  -5.962   1.471  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -1.486  -4.744   4.172  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -3.751  -3.533   3.572  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -2.467  -3.139   2.404  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -3.697  -4.359   1.996  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -3.653  -5.436   4.964  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -3.826  -6.463   3.521  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -2.504  -6.763   4.674  1.00  8.14           H   new
ATOM    813  N   GLU A  51       0.715  -8.269   1.289  1.00  9.43           N
ATOM    814  CA  GLU A  51       1.607  -8.681   0.249  1.00 11.90           C
ATOM    815  C   GLU A  51       0.959  -8.768  -1.089  1.00 11.49           C
ATOM    816  O   GLU A  51      -0.181  -9.208  -1.229  1.00  9.88           O
ATOM    817  CB  GLU A  51       2.353  -9.972   0.625  1.00 16.56           C
ATOM    818  CG  GLU A  51       3.231  -9.880   1.874  1.00 26.06           C
ATOM    819  CD  GLU A  51       3.840 -11.205   2.312  1.00 29.86           C
ATOM    820  OE1 GLU A  51       3.210 -11.932   3.125  1.00 33.44           O
ATOM    821  OE2 GLU A  51       5.018 -11.440   1.931  1.00 32.13           O
ATOM      0  H   GLU A  51       0.164  -9.024   1.698  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       2.351  -7.890   0.154  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       1.620 -10.765   0.774  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51       2.978 -10.269  -0.217  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       4.035  -9.168   1.687  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       2.635  -9.479   2.694  1.00 26.06           H   new
ATOM    828  N   ASP A  52       1.703  -8.385  -2.142  1.00 12.71           N
ATOM    829  CA  ASP A  52       1.483  -8.324  -3.554  1.00 16.56           C
ATOM    830  C   ASP A  52       0.423  -9.181  -4.155  1.00 15.83           C
ATOM    831  O   ASP A  52      -0.599  -8.626  -4.557  1.00 17.21           O
ATOM    832  CB  ASP A  52       2.826  -8.681  -4.213  1.00 21.05           C
ATOM    833  CG  ASP A  52       4.042  -7.938  -3.681  1.00 25.12           C
ATOM    834  OD1 ASP A  52       4.530  -8.252  -2.562  1.00 28.37           O
ATOM    835  OD2 ASP A  52       4.469  -6.905  -4.264  1.00 25.82           O
ATOM      0  H   ASP A  52       2.648  -8.053  -1.951  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       1.109  -7.317  -3.738  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       2.996  -9.751  -4.092  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       2.746  -8.490  -5.283  1.00 21.05           H   new
ATOM    840  N   GLY A  53       0.519 -10.521  -4.206  1.00 15.00           N
ATOM    841  CA  GLY A  53      -0.412 -11.386  -4.862  1.00 11.77           C
ATOM    842  C   GLY A  53      -1.620 -11.753  -4.071  1.00 11.10           C
ATOM    843  O   GLY A  53      -1.967 -12.921  -3.907  1.00 11.25           O
ATOM      0  H   GLY A  53       1.287 -11.028  -3.766  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -0.737 -10.907  -5.786  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53       0.107 -12.302  -5.144  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -2.450 -10.758  -3.710  1.00  8.53           N
ATOM    848  CA  ARG A  54      -3.768 -11.082  -3.261  1.00  9.05           C
ATOM    849  C   ARG A  54      -4.604  -9.854  -3.376  1.00  8.96           C
ATOM    850  O   ARG A  54      -4.115  -8.727  -3.439  1.00 11.60           O
ATOM    851  CB  ARG A  54      -3.814 -11.514  -1.786  1.00  7.97           C
ATOM    852  CG  ARG A  54      -5.091 -11.948  -1.063  1.00  9.62           C
ATOM    853  CD  ARG A  54      -4.645 -12.486   0.299  1.00 12.20           C
ATOM    854  NE  ARG A  54      -5.905 -12.881   0.989  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -6.088 -13.273   2.284  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -5.109 -13.098   3.220  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -7.337 -13.707   2.621  1.00 25.50           N
ATOM      0  H   ARG A  54      -2.221  -9.764  -3.727  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -4.124 -11.911  -3.873  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -3.112 -12.342  -1.689  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -3.406 -10.682  -1.212  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -5.777 -11.109  -0.945  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -5.619 -12.714  -1.631  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -3.973 -13.337   0.186  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -4.106 -11.727   0.866  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -6.747 -12.855   0.414  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -4.222 -12.668   2.956  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -5.264 -13.397   4.183  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -8.077 -13.726   1.919  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -7.531 -14.012   3.575  1.00 25.50           H   new
ATOM    871  N   THR A  55      -5.941  -9.955  -3.480  1.00  9.05           N
ATOM    872  CA  THR A  55      -6.869  -8.899  -3.744  1.00  9.03           C
ATOM    873  C   THR A  55      -7.246  -8.098  -2.545  1.00  8.15           C
ATOM    874  O   THR A  55      -7.279  -8.535  -1.396  1.00  5.91           O
ATOM    875  CB  THR A  55      -8.050  -9.256  -4.597  1.00 11.15           C
ATOM    876  OG1 THR A  55      -8.826 -10.277  -3.987  1.00 11.95           O
ATOM    877  CG2 THR A  55      -7.488  -9.767  -5.934  1.00 11.71           C
ATOM      0  H   THR A  55      -6.411 -10.853  -3.370  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.279  -8.237  -4.378  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.696  -8.389  -4.734  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -9.591 -10.492  -4.560  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -8.311 -10.041  -6.594  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -6.894  -8.983  -6.402  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -6.860 -10.640  -5.755  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.572  -6.820  -2.805  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.822  -5.848  -1.787  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.034  -6.156  -0.977  1.00  8.05           C
ATOM    888  O   LEU A  56      -8.967  -6.182   0.251  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.009  -4.476  -2.455  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.693  -3.905  -3.009  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -6.930  -3.044  -4.262  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -6.107  -3.004  -1.909  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.664  -6.452  -3.752  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -6.968  -5.854  -1.110  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.732  -4.566  -3.266  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.428  -3.777  -1.731  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.028  -4.723  -3.285  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -5.977  -2.658  -4.624  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -7.394  -3.652  -5.039  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.587  -2.211  -4.012  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -5.168  -2.572  -2.254  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.811  -2.204  -1.680  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.926  -3.596  -1.012  1.00  9.85           H   new
ATOM    904  N   SER A  57     -10.123  -6.508  -1.684  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.286  -7.009  -1.019  1.00  9.00           C
ATOM    906  C   SER A  57     -10.983  -8.225  -0.214  1.00  9.44           C
ATOM    907  O   SER A  57     -11.487  -8.404   0.894  1.00 10.91           O
ATOM    908  CB  SER A  57     -12.461  -7.228  -1.987  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.591  -7.660  -1.245  1.00 13.59           O
ATOM      0  H   SER A  57     -10.199  -6.447  -2.699  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.606  -6.238  -0.318  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -12.689  -6.304  -2.518  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -12.197  -7.971  -2.739  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -14.347  -7.801  -1.853  1.00 13.59           H   new
ATOM    915  N   ASP A  58     -10.208  -9.215  -0.693  1.00  9.11           N
ATOM    916  CA  ASP A  58      -9.999 -10.466  -0.032  1.00  7.91           C
ATOM    917  C   ASP A  58      -9.195 -10.291   1.210  1.00  9.12           C
ATOM    918  O   ASP A  58      -9.280 -11.109   2.125  1.00  8.61           O
ATOM    919  CB  ASP A  58      -9.201 -11.353  -1.002  1.00  8.41           C
ATOM    920  CG  ASP A  58      -9.272 -12.855  -0.768  1.00 11.50           C
ATOM    921  OD1 ASP A  58     -10.353 -13.452  -1.019  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -8.290 -13.437  -0.235  1.00 10.05           O
ATOM      0  H   ASP A  58      -9.706  -9.140  -1.578  1.00  9.11           H   new
ATOM      0  HA  ASP A  58     -10.959 -10.903   0.241  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -9.549 -11.149  -2.015  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -8.155 -11.051  -0.958  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -8.500  -9.150   1.361  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.828  -8.654   2.522  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.693  -7.907   3.478  1.00 10.98           C
ATOM    930  O   TYR A  59      -8.298  -7.561   4.590  1.00 12.95           O
ATOM    931  CB  TYR A  59      -6.625  -7.750   2.207  1.00  7.94           C
ATOM    932  CG  TYR A  59      -5.265  -8.351   2.304  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.854  -8.862   3.512  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.464  -8.412   1.188  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -3.545  -9.259   3.655  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -3.179  -8.889   1.292  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -2.753  -9.307   2.531  1.00  6.76           C
ATOM    938  OH  TYR A  59      -1.501  -9.931   2.714  1.00  7.63           O
ATOM      0  H   TYR A  59      -8.400  -8.504   0.578  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -7.494  -9.580   2.990  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.750  -7.365   1.195  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -6.663  -6.894   2.881  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -5.547  -8.950   4.335  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -4.844  -8.086   0.231  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -3.149  -9.526   4.624  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -2.528  -8.934   0.432  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -1.258 -10.422   1.901  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.873  -7.460   3.012  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.915  -6.767   3.702  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.711  -5.291   3.697  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.999  -4.582   4.660  1.00 14.26           O
ATOM    952  CB  ASN A  60     -11.368  -7.289   5.076  1.00 19.23           C
ATOM    953  CG  ASN A  60     -11.746  -8.760   4.981  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -10.992  -9.695   5.243  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -13.061  -9.026   4.756  1.00 24.09           N
ATOM      0  H   ASN A  60     -10.122  -7.604   2.033  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -11.779  -7.018   3.087  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.568  -7.158   5.805  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -12.220  -6.709   5.430  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -13.403  -9.986   4.806  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -13.705  -8.266   4.537  1.00 24.09           H   new
ATOM    962  N   ILE A  61     -10.232  -4.782   2.548  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.822  -3.424   2.367  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.868  -2.791   1.515  1.00 13.74           C
ATOM    965  O   ILE A  61     -11.007  -2.998   0.311  1.00 14.60           O
ATOM    966  CB  ILE A  61      -8.509  -3.261   1.660  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -7.365  -3.970   2.403  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -8.086  -1.785   1.560  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -7.167  -3.467   3.832  1.00 11.42           C
ATOM      0  H   ILE A  61     -10.126  -5.345   1.704  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.700  -2.976   3.353  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -8.669  -3.693   0.672  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -7.566  -5.041   2.427  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -6.439  -3.832   1.845  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -7.130  -1.715   1.041  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.841  -1.227   1.007  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.987  -1.366   2.561  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -6.344  -4.010   4.298  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -6.935  -2.402   3.814  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -8.080  -3.630   4.405  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -11.743  -1.935   2.074  1.00 13.97           N
ATOM    982  CA  GLN A  62     -12.887  -1.269   1.533  1.00 15.52           C
ATOM    983  C   GLN A  62     -12.699   0.207   1.459  1.00 13.94           C
ATOM    984  O   GLN A  62     -11.622   0.798   1.519  1.00 12.15           O
ATOM    985  CB  GLN A  62     -14.192  -1.749   2.191  1.00 19.53           C
ATOM    986  CG  GLN A  62     -14.665  -1.018   3.449  1.00 26.38           C
ATOM    987  CD  GLN A  62     -13.630  -0.727   4.526  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -12.956  -1.707   4.838  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -13.470   0.523   5.038  1.00 32.71           N
ATOM      0  H   GLN A  62     -11.623  -1.676   3.053  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.994  -1.563   0.489  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -14.986  -1.684   1.447  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -14.074  -2.803   2.440  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -15.105  -0.070   3.141  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -15.463  -1.608   3.900  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -14.073   1.284   4.724  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -12.747   0.700   5.735  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -13.774   1.000   1.307  1.00 11.73           N
ATOM    999  CA  LYS A  63     -13.933   2.405   1.090  1.00 11.97           C
ATOM   1000  C   LYS A  63     -13.441   3.216   2.239  1.00 10.41           C
ATOM   1001  O   LYS A  63     -14.012   3.063   3.317  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -15.351   2.697   0.572  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -15.682   4.186   0.684  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -16.995   4.530  -0.022  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -17.766   5.793   0.366  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -16.887   6.982   0.445  1.00 25.97           N
ATOM      0  H   LYS A  63     -14.696   0.566   1.345  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -13.276   2.744   0.289  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -15.434   2.380  -0.468  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -16.076   2.116   1.142  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -15.751   4.465   1.735  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -14.872   4.772   0.251  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -16.781   4.596  -1.089  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -17.668   3.684   0.117  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -18.555   5.974  -0.364  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -18.253   5.638   1.329  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -17.448   7.840   0.270  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -16.459   7.035   1.391  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -16.137   6.907  -0.271  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -12.464   4.115   2.026  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -11.791   4.892   3.021  1.00 10.94           C
ATOM   1022  C   GLU A  64     -11.015   3.976   3.904  1.00  9.74           C
ATOM   1023  O   GLU A  64     -11.079   4.202   5.112  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -12.658   5.984   3.670  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -13.169   6.988   2.635  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -14.394   7.653   3.245  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -14.171   8.668   3.958  1.00 32.61           O
ATOM   1028  OE2 GLU A  64     -15.554   7.290   2.911  1.00 31.72           O
ATOM      0  H   GLU A  64     -12.119   4.313   1.087  1.00 10.04           H   new
ATOM      0  HA  GLU A  64     -11.047   5.541   2.559  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -13.504   5.523   4.179  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -12.077   6.507   4.429  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -12.403   7.727   2.401  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -13.424   6.487   1.702  1.00 24.16           H   new
ATOM   1035  N   SER A  65     -10.161   3.066   3.404  1.00  6.85           N
ATOM   1036  CA  SER A  65      -9.250   2.352   4.244  1.00  6.90           C
ATOM   1037  C   SER A  65      -7.946   3.071   4.214  1.00  4.72           C
ATOM   1038  O   SER A  65      -7.688   3.722   3.202  1.00  3.91           O
ATOM   1039  CB  SER A  65      -8.815   0.968   3.736  1.00  7.28           C
ATOM   1040  OG  SER A  65      -9.981   0.159   3.800  1.00 10.56           O
ATOM      0  H   SER A  65     -10.101   2.824   2.415  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -9.778   2.269   5.194  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -8.432   1.026   2.717  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -8.017   0.556   4.353  1.00  7.28           H   new
ATOM      0  HG  SER A  65     -10.560   0.358   3.034  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -7.135   2.898   5.273  1.00  4.48           N
ATOM   1047  CA  THR A  66      -5.865   3.555   5.321  1.00  3.80           C
ATOM   1048  C   THR A  66      -4.838   2.479   5.404  1.00  4.60           C
ATOM   1049  O   THR A  66      -4.888   1.559   6.219  1.00  5.33           O
ATOM   1050  CB  THR A  66      -5.771   4.458   6.515  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -6.649   5.573   6.503  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -4.398   5.151   6.485  1.00  3.40           C
ATOM      0  H   THR A  66      -7.352   2.315   6.082  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -5.719   4.179   4.440  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -5.988   3.807   7.362  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -6.518   6.101   7.318  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -4.306   5.814   7.345  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -3.610   4.399   6.521  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -4.304   5.732   5.567  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -3.855   2.595   4.493  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -2.768   1.686   4.301  1.00  3.85           C
ATOM   1062  C   LEU A  67      -1.463   2.312   4.655  1.00  3.80           C
ATOM   1063  O   LEU A  67      -1.160   3.340   4.052  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -2.708   1.404   2.791  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -3.868   0.594   2.187  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -3.504   0.038   0.800  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -4.328  -0.597   3.045  1.00  8.12           C
ATOM      0  H   LEU A  67      -3.819   3.381   3.844  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -2.925   0.802   4.919  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -2.654   2.360   2.269  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -1.779   0.874   2.582  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -4.685   1.313   2.130  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -4.346  -0.529   0.403  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -3.272   0.863   0.127  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -2.636  -0.615   0.886  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -5.148  -1.111   2.544  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -3.497  -1.288   3.183  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -4.665  -0.237   4.017  1.00  8.12           H   new
ATOM   1079  N   HIS A  68      -0.696   1.862   5.664  1.00  2.94           N
ATOM   1080  CA  HIS A  68       0.511   2.525   6.049  1.00  4.17           C
ATOM   1081  C   HIS A  68       1.722   1.971   5.379  1.00  5.32           C
ATOM   1082  O   HIS A  68       1.871   0.751   5.388  1.00  7.70           O
ATOM   1083  CB  HIS A  68       0.808   2.377   7.551  1.00  5.57           C
ATOM   1084  CG  HIS A  68       1.929   3.219   8.084  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       2.195   4.524   7.724  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       2.827   2.919   9.060  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       3.289   4.912   8.432  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       3.705   3.966   9.254  1.00 16.30           N
ATOM      0  H   HIS A  68      -0.914   1.033   6.217  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       0.332   3.561   5.762  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68      -0.098   2.619   8.106  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       1.037   1.331   7.755  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68       2.850   1.989   9.608  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       3.761   5.878   8.334  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68       4.500   4.001   9.892  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       2.535   2.790   4.688  1.00  5.29           N
ATOM   1097  CA  LEU A  69       3.610   2.404   3.828  1.00  3.97           C
ATOM   1098  C   LEU A  69       4.925   2.561   4.511  1.00  5.07           C
ATOM   1099  O   LEU A  69       5.330   3.643   4.932  1.00  4.34           O
ATOM   1100  CB  LEU A  69       3.455   3.054   2.443  1.00  6.08           C
ATOM   1101  CG  LEU A  69       4.606   2.847   1.445  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       4.790   1.328   1.292  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       4.140   3.397   0.086  1.00  6.87           C
ATOM      0  H   LEU A  69       2.431   3.804   4.736  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       3.570   1.336   3.615  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       2.540   2.672   1.990  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       3.317   4.126   2.585  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       5.524   3.335   1.774  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       5.600   1.128   0.590  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.034   0.892   2.261  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       3.867   0.886   0.917  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       4.933   3.267  -0.650  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       3.251   2.857  -0.239  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       3.905   4.457   0.184  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       5.709   1.471   4.587  1.00  4.29           N
ATOM   1116  CA  VAL A  70       7.039   1.559   5.105  1.00  6.26           C
ATOM   1117  C   VAL A  70       8.069   1.113   4.126  1.00  9.22           C
ATOM   1118  O   VAL A  70       7.857   0.704   2.985  1.00  9.36           O
ATOM   1119  CB  VAL A  70       7.136   0.833   6.414  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       6.701   1.685   7.618  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       6.522  -0.573   6.311  1.00  8.54           C
ATOM      0  H   VAL A  70       5.426   0.536   4.293  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       7.256   2.611   5.288  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       8.189   0.659   6.635  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       6.796   1.099   8.532  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       7.335   2.569   7.686  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       5.663   1.992   7.490  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       6.605  -1.078   7.273  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       5.471  -0.492   6.034  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       7.054  -1.148   5.553  1.00  8.54           H   new
ATOM   1131  N   LEU A  71       9.351   1.126   4.531  1.00 12.71           N
ATOM   1132  CA  LEU A  71      10.428   0.643   3.723  1.00 16.06           C
ATOM   1133  C   LEU A  71      10.861  -0.777   3.855  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.213  -1.153   4.972  1.00 19.26           O
ATOM   1135  CB  LEU A  71      11.650   1.529   4.014  1.00 17.10           C
ATOM   1136  CG  LEU A  71      12.918   1.137   3.237  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      12.845   1.289   1.708  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      14.204   1.892   3.612  1.00 17.51           C
ATOM      0  H   LEU A  71       9.646   1.480   5.441  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      10.028   0.690   2.710  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      11.399   2.563   3.777  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      11.866   1.490   5.082  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      12.962   0.091   3.540  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      13.794   0.984   1.266  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      12.045   0.661   1.318  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      12.645   2.330   1.455  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71      15.030   1.531   2.999  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      14.063   2.959   3.439  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71      14.432   1.722   4.664  1.00 17.51           H   new