USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16
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 Single : A   1 MET CE  :methyl  170:sc=  -0.388   (180deg=-0.558)
USER  MOD Single : A   1 MET N   :NH3+    168:sc=   0.814   (180deg=0.698)
USER  MOD Single : A   2 GLN     :      amide:sc=  -0.132  K(o=-0.13,f=-1.5)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A   7 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A   9 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  11 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=  0.0545
USER  MOD Single : A  22 THR OG1 :   rot  180:sc=   0.182
USER  MOD Single : A  25 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  27 LYS NZ  :NH3+    167:sc=    1.45   (180deg=1.24)
USER  MOD Single : A  29 LYS NZ  :NH3+   -173:sc=       0   (180deg=-0.0369)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.741  X(o=-0.74,f=-1.2)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc= -0.0344  K(o=-0.034,f=-0.86)
USER  MOD Single : A  41 GLN     :      amide:sc=   0.158  K(o=0.16,f=-3.4!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=    1.48  K(o=1.5,f=-8.4!)
USER  MOD Single : A  55 THR OG1 :   rot  180:sc=   0.066
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot   30:sc=    0.62
USER  MOD Single : A  60 ASN     :      amide:sc=       0  X(o=0,f=-0.041)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  63 LYS NZ  :NH3+    143:sc=     1.3   (180deg=0.623)
USER  MOD Single : A  65 SER OG  :   rot  115:sc=    1.26
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc=  -0.129  X(o=-0.13,f=0)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -13.164   4.381  -3.729  1.00  9.67           N
ATOM      2  CA  MET A   1     -12.777   5.058  -2.471  1.00 10.38           C
ATOM      3  C   MET A   1     -11.381   5.580  -2.476  1.00  9.62           C
ATOM      4  O   MET A   1     -10.671   5.304  -3.441  1.00  9.62           O
ATOM      5  CB  MET A   1     -12.936   3.995  -1.372  1.00 13.77           C
ATOM      6  CG  MET A   1     -11.889   2.882  -1.286  1.00 16.29           C
ATOM      7  SD  MET A   1     -12.087   1.863   0.206  1.00 17.17           S
ATOM      8  CE  MET A   1     -10.641   0.768   0.125  1.00 16.11           C
ATOM      0  H1  MET A   1     -14.059   3.871  -3.587  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -13.284   5.089  -4.481  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -12.421   3.707  -4.003  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.405   5.936  -2.319  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.955   4.510  -0.411  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.911   3.526  -1.501  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.963   2.247  -2.169  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.892   3.323  -1.293  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.546   0.220   1.063  1.00 16.11           H   new
ATOM      0  HE2 MET A   1     -10.765   0.062  -0.696  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -9.743   1.363  -0.040  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -10.970   6.287  -1.408  1.00  9.27           N
ATOM     21  CA  GLN A   2      -9.608   6.636  -1.147  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.041   6.083   0.115  1.00  8.72           C
ATOM     23  O   GLN A   2      -9.640   6.035   1.188  1.00  8.22           O
ATOM     24  CB  GLN A   2      -9.502   8.163  -0.994  1.00 14.46           C
ATOM     25  CG  GLN A   2      -9.990   8.986  -2.188  1.00 17.01           C
ATOM     26  CD  GLN A   2      -9.957  10.477  -1.885  1.00 20.10           C
ATOM     27  OE1 GLN A   2      -8.960  11.162  -2.110  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -11.098  11.029  -1.393  1.00 19.49           N
ATOM      0  H   GLN A   2     -11.615   6.630  -0.696  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.054   6.220  -1.989  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -10.071   8.462  -0.114  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -8.460   8.419  -0.802  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.366   8.776  -3.056  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -11.006   8.688  -2.446  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -11.913  10.442  -1.214  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -11.139  12.030  -1.203  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -7.744   5.740   0.016  1.00  5.87           N
ATOM     38  CA  ILE A   3      -6.927   5.281   1.096  1.00  5.07           C
ATOM     39  C   ILE A   3      -5.699   6.125   1.131  1.00  4.01           C
ATOM     40  O   ILE A   3      -5.410   6.740   0.106  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.529   3.839   0.996  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.746   3.634  -0.312  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -7.758   2.926   1.149  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -5.116   2.243  -0.363  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.238   5.786  -0.868  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -7.518   5.366   2.008  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -5.865   3.558   1.814  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -6.413   3.766  -1.164  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -4.968   4.393  -0.396  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.449   1.884   1.074  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.220   3.098   2.121  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.477   3.149   0.361  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -4.569   2.126  -1.298  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -4.431   2.123   0.476  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -5.899   1.487  -0.303  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -4.972   6.092   2.262  1.00  4.55           N
ATOM     57  CA  PHE A   4      -3.878   6.972   2.532  1.00  4.68           C
ATOM     58  C   PHE A   4      -2.631   6.208   2.815  1.00  5.30           C
ATOM     59  O   PHE A   4      -2.742   5.312   3.651  1.00  5.58           O
ATOM     60  CB  PHE A   4      -4.149   7.928   3.707  1.00  4.83           C
ATOM     61  CG  PHE A   4      -5.387   8.752   3.617  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -5.667   9.390   2.431  1.00  6.69           C
ATOM     63  CD2 PHE A   4      -6.197   8.916   4.716  1.00  8.34           C
ATOM     64  CE1 PHE A   4      -6.775  10.199   2.338  1.00  9.10           C
ATOM     65  CE2 PHE A   4      -7.278   9.760   4.619  1.00 10.61           C
ATOM     66  CZ  PHE A   4      -7.536  10.447   3.456  1.00  8.90           C
ATOM      0  H   PHE A   4      -5.153   5.429   3.016  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -3.755   7.571   1.629  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -4.196   7.339   4.623  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -3.297   8.601   3.804  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -5.020   9.256   1.577  1.00  6.69           H   new
ATOM      0  HD2 PHE A   4      -5.988   8.392   5.637  1.00  8.34           H   new
ATOM      0  HE1 PHE A   4      -7.047  10.638   1.390  1.00  9.10           H   new
ATOM      0  HE2 PHE A   4      -7.934   9.885   5.468  1.00 10.61           H   new
ATOM      0  HZ  PHE A   4      -8.331  11.177   3.421  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -1.427   6.410   2.250  1.00  4.44           N
ATOM     77  CA  VAL A   5      -0.364   5.463   2.392  1.00  3.87           C
ATOM     78  C   VAL A   5       0.782   6.317   2.814  1.00  4.93           C
ATOM     79  O   VAL A   5       1.292   7.130   2.044  1.00  6.84           O
ATOM     80  CB  VAL A   5      -0.094   4.696   1.132  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.093   3.736   1.321  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.296   3.843   0.695  1.00  9.13           C
ATOM      0  H   VAL A   5      -1.189   7.231   1.694  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -0.589   4.673   3.109  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       0.120   5.445   0.370  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.271   3.190   0.394  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.984   4.306   1.583  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       0.866   3.030   2.120  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -1.048   3.308  -0.222  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.538   3.126   1.480  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -2.155   4.489   0.517  1.00  9.13           H   new
ATOM     92  N   LYS A   6       1.255   6.166   4.064  1.00  6.04           N
ATOM     93  CA  LYS A   6       2.301   6.941   4.655  1.00  6.12           C
ATOM     94  C   LYS A   6       3.672   6.484   4.292  1.00  6.57           C
ATOM     95  O   LYS A   6       3.865   5.295   4.043  1.00  5.76           O
ATOM     96  CB  LYS A   6       2.202   6.784   6.182  1.00  7.45           C
ATOM     97  CG  LYS A   6       3.065   7.691   7.060  1.00 11.12           C
ATOM     98  CD  LYS A   6       2.762   7.325   8.514  1.00 14.54           C
ATOM     99  CE  LYS A   6       3.440   8.120   9.631  1.00 18.84           C
ATOM    100  NZ  LYS A   6       4.906   7.977   9.482  1.00 20.55           N
ATOM      0  H   LYS A   6       0.884   5.460   4.700  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       2.168   7.961   4.295  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6       1.161   6.939   6.466  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       2.449   5.751   6.427  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       4.123   7.549   6.839  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       2.838   8.740   6.871  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6       1.685   7.408   8.657  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6       3.022   6.275   8.651  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       3.154   9.170   9.577  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       3.120   7.753  10.606  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6       5.385   8.512  10.234  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6       5.166   6.972   9.552  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       5.198   8.346   8.555  1.00 20.55           H   new
ATOM    114  N   THR A   7       4.680   7.355   4.107  1.00  7.41           N
ATOM    115  CA  THR A   7       6.028   7.061   3.729  1.00  7.48           C
ATOM    116  C   THR A   7       6.959   7.033   4.892  1.00  8.75           C
ATOM    117  O   THR A   7       6.667   6.591   6.002  1.00  8.58           O
ATOM    118  CB  THR A   7       6.534   7.827   2.543  1.00  9.61           C
ATOM    119  OG1 THR A   7       6.533   9.235   2.726  1.00 11.78           O
ATOM    120  CG2 THR A   7       5.605   7.492   1.364  1.00  9.17           C
ATOM      0  H   THR A   7       4.536   8.357   4.234  1.00  7.41           H   new
ATOM      0  HA  THR A   7       5.999   6.037   3.356  1.00  7.48           H   new
ATOM      0  HB  THR A   7       7.571   7.537   2.374  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       6.875   9.670   1.917  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       5.936   8.029   0.476  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       5.634   6.420   1.171  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       4.585   7.789   1.608  1.00  9.17           H   new
ATOM    128  N   LEU A   8       8.183   7.560   4.709  1.00  9.84           N
ATOM    129  CA  LEU A   8       9.074   7.679   5.821  1.00 14.15           C
ATOM    130  C   LEU A   8       9.389   9.135   5.770  1.00 17.37           C
ATOM    131  O   LEU A   8       9.358   9.804   6.802  1.00 17.01           O
ATOM    132  CB  LEU A   8      10.333   6.831   5.574  1.00 16.63           C
ATOM    133  CG  LEU A   8      10.167   5.378   6.050  1.00 18.88           C
ATOM    134  CD1 LEU A   8      10.075   4.437   4.837  1.00 18.59           C
ATOM    135  CD2 LEU A   8      11.365   4.974   6.925  1.00 19.31           C
ATOM      0  H   LEU A   8       8.549   7.895   3.818  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       8.674   7.342   6.777  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8      10.568   6.837   4.510  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8      11.180   7.284   6.090  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       9.251   5.300   6.636  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       9.958   3.410   5.182  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       9.217   4.715   4.225  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8      10.985   4.519   4.243  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      11.241   3.944   7.259  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      12.284   5.059   6.345  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      11.420   5.632   7.792  1.00 19.31           H   new
ATOM    147  N   THR A   9       9.677   9.694   4.581  1.00 18.33           N
ATOM    148  CA  THR A   9      10.198  11.011   4.386  1.00 19.24           C
ATOM    149  C   THR A   9       9.127  12.027   4.177  1.00 19.48           C
ATOM    150  O   THR A   9       8.827  12.866   5.025  1.00 23.14           O
ATOM    151  CB  THR A   9      11.182  11.106   3.258  1.00 18.97           C
ATOM    152  OG1 THR A   9      12.151  10.069   3.314  1.00 20.24           O
ATOM    153  CG2 THR A   9      11.926  12.450   3.172  1.00 19.70           C
ATOM      0  H   THR A   9       9.537   9.195   3.702  1.00 18.33           H   new
ATOM      0  HA  THR A   9      10.723  11.228   5.316  1.00 19.24           H   new
ATOM      0  HB  THR A   9      10.564  11.009   2.366  1.00 18.97           H   new
ATOM      0  HG1 THR A   9      12.774  10.162   2.563  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      12.616  12.430   2.329  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      11.206  13.256   3.033  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      12.484  12.617   4.094  1.00 19.70           H   new
ATOM    161  N   GLY A  10       8.531  12.000   2.971  1.00 19.43           N
ATOM    162  CA  GLY A  10       7.828  13.087   2.364  1.00 18.74           C
ATOM    163  C   GLY A  10       6.425  13.076   2.866  1.00 17.62           C
ATOM    164  O   GLY A  10       6.176  12.897   4.057  1.00 19.74           O
ATOM      0  H   GLY A  10       8.541  11.166   2.384  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       8.311  14.034   2.607  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       7.844  12.990   1.278  1.00 18.74           H   new
ATOM    168  N   LYS A  11       5.432  13.287   1.984  1.00 13.56           N
ATOM    169  CA  LYS A  11       4.059  13.456   2.345  1.00 11.91           C
ATOM    170  C   LYS A  11       3.316  12.164   2.341  1.00 10.18           C
ATOM    171  O   LYS A  11       3.692  11.143   1.768  1.00  9.10           O
ATOM    172  CB  LYS A  11       3.462  14.608   1.520  1.00 13.43           C
ATOM    173  CG  LYS A  11       3.251  14.295   0.037  1.00 16.69           C
ATOM    174  CD  LYS A  11       1.967  14.917  -0.515  1.00 17.92           C
ATOM    175  CE  LYS A  11       1.654  14.691  -1.996  1.00 20.81           C
ATOM    176  NZ  LYS A  11       2.454  15.570  -2.878  1.00 21.93           N
ATOM      0  H   LYS A  11       5.592  13.342   0.978  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       3.962  13.766   3.386  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       2.504  14.890   1.957  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       4.118  15.474   1.604  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       4.104  14.663  -0.534  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       3.217  13.214  -0.102  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       1.130  14.534   0.068  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       2.012  15.992  -0.341  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       1.848  13.649  -2.252  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       0.593  14.870  -2.173  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       2.208  15.382  -3.871  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       2.250  16.565  -2.654  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       3.466  15.382  -2.730  1.00 21.93           H   new
ATOM    190  N   THR A  12       2.160  12.082   3.023  1.00  9.63           N
ATOM    191  CA  THR A  12       1.301  10.942   2.941  1.00  9.85           C
ATOM    192  C   THR A  12       0.540  10.978   1.661  1.00 11.66           C
ATOM    193  O   THR A  12      -0.358  11.791   1.448  1.00 12.33           O
ATOM    194  CB  THR A  12       0.345  10.846   4.093  1.00 10.85           C
ATOM    195  OG1 THR A  12       0.963  10.603   5.348  1.00 10.91           O
ATOM    196  CG2 THR A  12      -0.613   9.647   3.998  1.00  9.63           C
ATOM      0  H   THR A  12       1.816  12.818   3.640  1.00  9.63           H   new
ATOM      0  HA  THR A  12       1.939  10.059   2.981  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -0.147  11.817   4.034  1.00 10.85           H   new
ATOM      0  HG1 THR A  12       0.277  10.555   6.047  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -1.275   9.641   4.864  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -1.207   9.727   3.088  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -0.037   8.722   3.975  1.00  9.63           H   new
ATOM    204  N   ILE A  13       0.744   9.990   0.771  1.00 10.42           N
ATOM    205  CA  ILE A  13       0.066   9.907  -0.485  1.00 11.84           C
ATOM    206  C   ILE A  13      -1.315   9.362  -0.349  1.00 10.55           C
ATOM    207  O   ILE A  13      -1.702   8.642   0.570  1.00 11.92           O
ATOM    208  CB  ILE A  13       0.837   9.163  -1.535  1.00 14.86           C
ATOM    209  CG1 ILE A  13       0.877   7.644  -1.293  1.00 14.87           C
ATOM    210  CG2 ILE A  13       2.252   9.761  -1.604  1.00 17.08           C
ATOM    211  CD1 ILE A  13       1.491   6.792  -2.402  1.00 16.46           C
ATOM      0  H   ILE A  13       1.401   9.226   0.930  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -0.013  10.938  -0.831  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       0.328   9.284  -2.491  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       1.433   7.460  -0.374  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13      -0.143   7.299  -1.123  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       2.833   9.235  -2.362  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13       2.188  10.818  -1.864  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       2.740   9.655  -0.635  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       1.461   5.742  -2.113  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       0.925   6.931  -3.323  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       2.526   7.094  -2.563  1.00 16.46           H   new
ATOM    223  N   THR A  14      -2.160   9.618  -1.363  1.00  9.39           N
ATOM    224  CA  THR A  14      -3.548   9.285  -1.447  1.00  9.63           C
ATOM    225  C   THR A  14      -3.743   8.497  -2.697  1.00 11.20           C
ATOM    226  O   THR A  14      -3.250   8.902  -3.748  1.00 11.63           O
ATOM    227  CB  THR A  14      -4.473  10.462  -1.537  1.00 10.38           C
ATOM    228  OG1 THR A  14      -4.256  11.365  -0.463  1.00 16.30           O
ATOM    229  CG2 THR A  14      -5.948  10.028  -1.495  1.00 11.66           C
ATOM      0  H   THR A  14      -1.840  10.103  -2.201  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -3.792   8.750  -0.529  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -4.259  10.948  -2.489  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -4.870  12.125  -0.545  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -6.588  10.908  -1.562  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -6.156   9.363  -2.333  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -6.147   9.505  -0.559  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -4.469   7.368  -2.605  1.00  8.29           N
ATOM    238  CA  LEU A  15      -4.744   6.585  -3.770  1.00  9.03           C
ATOM    239  C   LEU A  15      -6.219   6.461  -3.942  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.964   6.334  -2.972  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.985   5.248  -3.745  1.00 11.08           C
ATOM    242  CG  LEU A  15      -2.473   5.427  -3.525  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.852   4.089  -3.087  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -1.806   6.009  -4.782  1.00 15.88           C
ATOM      0  H   LEU A  15      -4.861   7.001  -1.738  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -4.366   7.089  -4.659  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -4.391   4.619  -2.953  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -4.151   4.723  -4.686  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -2.301   6.146  -2.724  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -0.781   4.218  -2.932  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -2.316   3.759  -2.157  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -2.019   3.340  -3.861  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -0.737   6.128  -4.605  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -1.962   5.333  -5.623  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -2.246   6.980  -5.011  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -6.749   6.488  -5.177  1.00 11.04           N
ATOM    257  CA  GLU A  16      -8.117   6.122  -5.382  1.00 11.50           C
ATOM    258  C   GLU A  16      -8.180   4.719  -5.880  1.00 10.13           C
ATOM    259  O   GLU A  16      -7.755   4.409  -6.992  1.00  9.83           O
ATOM    260  CB  GLU A  16      -8.751   7.037  -6.444  1.00 17.22           C
ATOM    261  CG  GLU A  16      -9.169   8.422  -5.948  1.00 23.33           C
ATOM    262  CD  GLU A  16      -9.757   9.329  -7.019  1.00 26.99           C
ATOM    263  OE1 GLU A  16      -8.930   9.833  -7.825  1.00 28.86           O
ATOM    264  OE2 GLU A  16     -10.985   9.606  -7.082  1.00 28.90           O
ATOM      0  H   GLU A  16      -6.242   6.758  -6.020  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -8.654   6.219  -4.439  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -8.042   7.161  -7.263  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -9.628   6.536  -6.855  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -9.902   8.302  -5.150  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -8.300   8.914  -5.511  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -8.680   3.774  -5.064  1.00  8.99           N
ATOM    272  CA  VAL A  17      -8.707   2.349  -5.177  1.00  8.85           C
ATOM    273  C   VAL A  17     -10.087   1.846  -4.926  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.969   2.563  -4.457  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.734   1.761  -4.198  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -6.317   2.250  -4.544  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -8.176   2.051  -2.754  1.00 10.54           C
ATOM      0  H   VAL A  17      -9.132   4.060  -4.196  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -8.417   2.050  -6.184  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.716   0.674  -4.273  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.603   1.827  -3.837  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -6.059   1.932  -5.554  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -6.283   3.338  -4.486  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -7.457   1.616  -2.059  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -8.225   3.129  -2.598  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -9.159   1.614  -2.580  1.00 10.54           H   new
ATOM    287  N   GLU A  18     -10.457   0.597  -5.258  1.00  7.29           N
ATOM    288  CA  GLU A  18     -11.684  -0.075  -4.962  1.00  7.08           C
ATOM    289  C   GLU A  18     -11.258  -1.108  -3.976  1.00  6.45           C
ATOM    290  O   GLU A  18     -10.095  -1.499  -4.062  1.00  5.28           O
ATOM    291  CB  GLU A  18     -12.572  -0.595  -6.104  1.00 10.28           C
ATOM    292  CG  GLU A  18     -13.061   0.496  -7.059  1.00 12.65           C
ATOM    293  CD  GLU A  18     -14.087   1.431  -6.435  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -15.179   0.937  -6.047  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -13.833   2.665  -6.414  1.00 18.17           O
ATOM      0  H   GLU A  18      -9.828  -0.004  -5.790  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -12.412   0.647  -4.591  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -12.015  -1.339  -6.674  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -13.436  -1.103  -5.676  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.206   1.081  -7.398  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -13.497   0.027  -7.941  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.982  -1.689  -3.065  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.476  -2.728  -2.216  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.126  -3.992  -2.922  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.505  -4.841  -2.283  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.635  -3.048  -1.275  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.168  -1.633  -0.997  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.013  -0.942  -2.361  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.557  -2.378  -1.745  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -13.383  -3.689  -1.742  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.305  -3.553  -0.367  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.207  -1.649  -0.666  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -12.594  -1.129  -0.220  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.952  -0.953  -2.915  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -12.726   0.103  -2.240  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.661  -4.209  -4.137  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.445  -5.346  -4.976  1.00  6.28           C
ATOM    318  C   SER A  20     -10.132  -5.377  -5.681  1.00  8.45           C
ATOM    319  O   SER A  20      -9.787  -6.314  -6.399  1.00  7.26           O
ATOM    320  CB  SER A  20     -12.581  -5.454  -6.007  1.00  8.57           C
ATOM    321  OG  SER A  20     -12.915  -4.205  -6.593  1.00 11.13           O
ATOM      0  H   SER A  20     -12.295  -3.534  -4.565  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.434  -6.201  -4.300  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -12.288  -6.151  -6.792  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -13.465  -5.871  -5.524  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -13.640  -4.331  -7.241  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -9.357  -4.286  -5.542  1.00  7.50           N
ATOM    328  CA  ASP A  21      -8.009  -4.241  -6.017  1.00  7.70           C
ATOM    329  C   ASP A  21      -7.108  -4.961  -5.074  1.00  7.08           C
ATOM    330  O   ASP A  21      -7.310  -4.917  -3.861  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.624  -2.752  -6.059  1.00 11.00           C
ATOM    332  CG  ASP A  21      -8.319  -1.946  -7.147  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -8.899  -2.488  -8.126  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -8.267  -0.687  -7.139  1.00 14.36           O
ATOM      0  H   ASP A  21      -9.670  -3.424  -5.094  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -7.918  -4.713  -6.995  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.853  -2.304  -5.092  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.546  -2.673  -6.200  1.00 11.00           H   new
ATOM    339  N   THR A  22      -6.114  -5.668  -5.640  1.00  5.37           N
ATOM    340  CA  THR A  22      -5.182  -6.334  -4.784  1.00  6.01           C
ATOM    341  C   THR A  22      -4.107  -5.441  -4.267  1.00  8.01           C
ATOM    342  O   THR A  22      -3.910  -4.285  -4.636  1.00  8.11           O
ATOM    343  CB  THR A  22      -4.459  -7.486  -5.416  1.00  8.92           C
ATOM    344  OG1 THR A  22      -3.849  -7.024  -6.612  1.00 10.22           O
ATOM    345  CG2 THR A  22      -5.445  -8.568  -5.890  1.00  9.65           C
ATOM      0  H   THR A  22      -5.958  -5.777  -6.642  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.836  -6.686  -3.986  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -3.759  -7.880  -4.680  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -3.369  -7.763  -7.041  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -4.892  -9.390  -6.344  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -6.014  -8.940  -5.038  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -6.128  -8.141  -6.624  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -3.337  -5.946  -3.287  1.00  8.32           N
ATOM    354  CA  ILE A  23      -2.285  -5.206  -2.662  1.00  9.92           C
ATOM    355  C   ILE A  23      -1.214  -4.987  -3.674  1.00 10.01           C
ATOM    356  O   ILE A  23      -0.590  -3.928  -3.707  1.00  8.71           O
ATOM    357  CB  ILE A  23      -1.760  -5.900  -1.440  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -2.787  -6.057  -0.307  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.433  -5.283  -0.964  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -3.414  -4.781   0.255  1.00 12.30           C
ATOM      0  H   ILE A  23      -3.448  -6.891  -2.920  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.669  -4.247  -2.314  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -1.551  -6.923  -1.752  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -3.592  -6.697  -0.668  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -2.304  -6.585   0.515  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23      -0.083  -5.812  -0.077  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.312  -5.369  -1.755  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.587  -4.231  -0.723  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -4.118  -5.039   1.046  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -2.632  -4.139   0.661  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -3.940  -4.253  -0.541  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -1.056  -5.895  -4.654  1.00  9.54           N
ATOM    373  CA  GLU A  24      -0.138  -5.796  -5.745  1.00 11.81           C
ATOM    374  C   GLU A  24      -0.540  -4.797  -6.775  1.00 11.14           C
ATOM    375  O   GLU A  24       0.300  -4.150  -7.398  1.00 10.62           O
ATOM    376  CB  GLU A  24      -0.139  -7.186  -6.404  1.00 19.24           C
ATOM    377  CG  GLU A  24       1.112  -7.507  -7.223  1.00 27.76           C
ATOM    378  CD  GLU A  24       1.135  -8.930  -7.762  1.00 32.92           C
ATOM    379  OE1 GLU A  24       0.385  -9.759  -7.182  1.00 36.51           O
ATOM    380  OE2 GLU A  24       1.854  -9.268  -8.740  1.00 34.80           O
ATOM      0  H   GLU A  24      -1.606  -6.754  -4.685  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       0.832  -5.474  -5.366  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24      -0.251  -7.941  -5.626  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -1.011  -7.265  -7.053  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       1.179  -6.809  -8.058  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       1.994  -7.347  -6.603  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -1.843  -4.617  -7.054  1.00  9.43           N
ATOM    388  CA  ASN A  25      -2.400  -3.476  -7.712  1.00 10.96           C
ATOM    389  C   ASN A  25      -2.152  -2.152  -7.075  1.00  9.68           C
ATOM    390  O   ASN A  25      -1.737  -1.288  -7.845  1.00  9.33           O
ATOM    391  CB  ASN A  25      -3.914  -3.716  -7.838  1.00 16.78           C
ATOM    392  CG  ASN A  25      -4.500  -3.045  -9.072  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -5.342  -2.148  -9.048  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -4.266  -3.650 -10.267  1.00 24.70           N
ATOM      0  H   ASN A  25      -2.549  -5.309  -6.805  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -1.890  -3.398  -8.672  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -4.108  -4.788  -7.882  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -4.416  -3.338  -6.947  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -4.780  -3.355 -11.097  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -3.576  -4.399 -10.333  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -2.208  -2.022  -5.738  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.918  -0.821  -5.018  1.00  5.53           C
ATOM    403  C   VAL A  26      -0.468  -0.516  -5.178  1.00  4.42           C
ATOM    404  O   VAL A  26      -0.042   0.608  -5.441  1.00  3.40           O
ATOM    405  CB  VAL A  26      -2.390  -1.010  -3.607  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -1.941   0.095  -2.636  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -3.924  -1.115  -3.642  1.00  8.12           C
ATOM      0  H   VAL A  26      -2.469  -2.796  -5.127  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -2.443   0.056  -5.398  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -1.932  -1.919  -3.218  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -2.325  -0.119  -1.639  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -0.852   0.132  -2.605  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -2.327   1.056  -2.975  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -4.302  -1.253  -2.629  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -4.342  -0.201  -4.064  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -4.217  -1.965  -4.258  1.00  8.12           H   new
ATOM    417  N   LYS A  27       0.453  -1.496  -5.182  1.00  2.64           N
ATOM    418  CA  LYS A  27       1.841  -1.340  -5.489  1.00  4.14           C
ATOM    419  C   LYS A  27       2.118  -0.759  -6.833  1.00  5.58           C
ATOM    420  O   LYS A  27       3.104  -0.024  -6.850  1.00  4.11           O
ATOM    421  CB  LYS A  27       2.617  -2.665  -5.421  1.00  3.97           C
ATOM    422  CG  LYS A  27       2.931  -3.199  -4.021  1.00  7.45           C
ATOM    423  CD  LYS A  27       3.952  -4.338  -4.049  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.250  -4.749  -2.606  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.261  -5.830  -2.604  1.00 15.47           N
ATOM      0  H   LYS A  27       0.211  -2.461  -4.956  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.176  -0.644  -4.720  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       2.045  -3.424  -5.956  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       3.558  -2.538  -5.957  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.313  -2.387  -3.402  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.011  -3.550  -3.554  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.561  -5.185  -4.612  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       4.866  -4.017  -4.549  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       4.616  -3.892  -2.040  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.337  -5.088  -2.116  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       5.628  -5.961  -1.640  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       4.824  -6.715  -2.931  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       6.043  -5.575  -3.240  1.00 15.47           H   new
ATOM    439  N   ALA A  28       1.283  -1.120  -7.824  1.00  6.61           N
ATOM    440  CA  ALA A  28       1.367  -0.587  -9.148  1.00  7.74           C
ATOM    441  C   ALA A  28       1.059   0.871  -9.149  1.00  9.17           C
ATOM    442  O   ALA A  28       1.888   1.626  -9.655  1.00 11.45           O
ATOM    443  CB  ALA A  28       0.513  -1.384 -10.149  1.00  7.68           C
ATOM      0  H   ALA A  28       0.531  -1.799  -7.702  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       2.395  -0.697  -9.492  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       0.608  -0.942 -11.141  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       0.856  -2.418 -10.178  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28      -0.532  -1.357  -9.839  1.00  7.68           H   new
ATOM    449  N   LYS A  29       0.061   1.364  -8.394  1.00  8.96           N
ATOM    450  CA  LYS A  29      -0.141   2.758  -8.147  1.00  7.90           C
ATOM    451  C   LYS A  29       0.980   3.440  -7.440  1.00  6.92           C
ATOM    452  O   LYS A  29       1.357   4.563  -7.771  1.00  6.87           O
ATOM    453  CB  LYS A  29      -1.562   2.964  -7.596  1.00 10.28           C
ATOM    454  CG  LYS A  29      -2.714   2.574  -8.525  1.00 14.94           C
ATOM    455  CD  LYS A  29      -4.093   2.982  -8.000  1.00 19.69           C
ATOM    456  CE  LYS A  29      -5.230   2.939  -9.023  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -5.075   3.947 -10.096  1.00 24.98           N
ATOM      0  H   LYS A  29      -0.631   0.769  -7.938  1.00  8.96           H   new
ATOM      0  HA  LYS A  29      -0.097   3.305  -9.089  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -1.657   2.391  -6.674  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -1.677   4.015  -7.331  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -2.555   3.035  -9.500  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -2.697   1.495  -8.677  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -4.353   2.328  -7.167  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -4.025   3.994  -7.601  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -5.275   1.945  -9.468  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -6.179   3.102  -8.512  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -5.928   3.954 -10.692  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -4.941   4.887  -9.672  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -4.247   3.709 -10.679  1.00 24.98           H   new
ATOM    471  N   ILE A  30       1.601   2.852  -6.402  1.00  4.57           N
ATOM    472  CA  ILE A  30       2.730   3.353  -5.681  1.00  5.58           C
ATOM    473  C   ILE A  30       3.987   3.577  -6.448  1.00  7.26           C
ATOM    474  O   ILE A  30       4.688   4.580  -6.319  1.00  9.46           O
ATOM    475  CB  ILE A  30       2.937   2.462  -4.492  1.00  5.36           C
ATOM    476  CG1 ILE A  30       1.740   2.515  -3.527  1.00  2.94           C
ATOM    477  CG2 ILE A  30       4.173   2.994  -3.749  1.00  2.78           C
ATOM    478  CD1 ILE A  30       1.771   1.276  -2.634  1.00  2.00           C
ATOM      0  H   ILE A  30       1.286   1.952  -6.038  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.482   4.374  -5.390  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.055   1.432  -4.828  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       1.785   3.419  -2.920  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       0.806   2.553  -4.087  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.365   2.375  -2.872  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       5.038   2.962  -4.412  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       3.994   4.022  -3.435  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       0.927   1.303  -1.945  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       1.707   0.380  -3.252  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       2.702   1.260  -2.067  1.00  2.00           H   new
ATOM    490  N   GLN A  31       4.249   2.752  -7.478  1.00  7.06           N
ATOM    491  CA  GLN A  31       5.256   2.960  -8.472  1.00  8.67           C
ATOM    492  C   GLN A  31       5.130   4.219  -9.258  1.00 10.90           C
ATOM    493  O   GLN A  31       6.099   4.915  -9.559  1.00  9.63           O
ATOM    494  CB  GLN A  31       5.341   1.693  -9.340  1.00  9.12           C
ATOM    495  CG  GLN A  31       6.546   1.700 -10.284  1.00 10.76           C
ATOM    496  CD  GLN A  31       6.688   0.365 -11.001  1.00 13.78           C
ATOM    497  OE1 GLN A  31       5.717  -0.365 -11.195  1.00 14.48           O
ATOM    498  NE2 GLN A  31       7.951   0.005 -11.357  1.00 14.76           N
ATOM      0  H   GLN A  31       3.726   1.889  -7.625  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       6.204   3.120  -7.959  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       5.398   0.818  -8.693  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       4.427   1.598  -9.926  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       6.434   2.499 -11.016  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       7.454   1.911  -9.719  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       8.731   0.638 -11.180  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       8.118  -0.898 -11.801  1.00 14.76           H   new
ATOM    507  N   ASP A  32       3.946   4.547  -9.804  1.00 10.93           N
ATOM    508  CA  ASP A  32       3.522   5.827 -10.281  1.00 14.01           C
ATOM    509  C   ASP A  32       3.665   6.928  -9.287  1.00 14.04           C
ATOM    510  O   ASP A  32       4.364   7.895  -9.585  1.00 13.39           O
ATOM    511  CB  ASP A  32       2.104   5.558 -10.811  1.00 18.01           C
ATOM    512  CG  ASP A  32       1.359   6.785 -11.316  1.00 24.33           C
ATOM    513  OD1 ASP A  32       1.603   7.192 -12.483  1.00 25.17           O
ATOM    514  OD2 ASP A  32       0.451   7.289 -10.602  1.00 26.29           O
ATOM      0  H   ASP A  32       3.215   3.845  -9.922  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       4.160   6.225 -11.070  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       2.168   4.832 -11.621  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       1.517   5.098 -10.016  1.00 18.01           H   new
ATOM    519  N   LYS A  33       2.945   6.842  -8.154  1.00 14.22           N
ATOM    520  CA  LYS A  33       2.872   7.946  -7.248  1.00 14.00           C
ATOM    521  C   LYS A  33       4.142   8.349  -6.581  1.00 12.37           C
ATOM    522  O   LYS A  33       4.420   9.539  -6.442  1.00 12.17           O
ATOM    523  CB  LYS A  33       1.830   7.558  -6.185  1.00 18.62           C
ATOM    524  CG  LYS A  33       1.261   8.798  -5.492  1.00 24.00           C
ATOM    525  CD  LYS A  33       0.280   9.504  -6.430  1.00 27.61           C
ATOM    526  CE  LYS A  33      -0.685  10.501  -5.786  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -1.253  11.382  -6.831  1.00 30.06           N
ATOM      0  H   LYS A  33       2.418   6.017  -7.867  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       2.609   8.825  -7.837  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       1.022   6.996  -6.652  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       2.288   6.902  -5.445  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       0.756   8.512  -4.569  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       2.069   9.476  -5.216  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       0.855  10.030  -7.192  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -0.308   8.743  -6.943  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -1.484   9.969  -5.270  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -0.163  11.097  -5.037  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -1.909  12.060  -6.394  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -0.485  11.899  -7.304  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -1.765  10.806  -7.530  1.00 30.06           H   new
ATOM    541  N   GLU A  34       4.974   7.400  -6.117  1.00 10.11           N
ATOM    542  CA  GLU A  34       6.252   7.764  -5.588  1.00 10.07           C
ATOM    543  C   GLU A  34       7.384   7.417  -6.493  1.00  9.32           C
ATOM    544  O   GLU A  34       8.245   8.276  -6.671  1.00 11.61           O
ATOM    545  CB  GLU A  34       6.450   6.925  -4.314  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.564   7.403  -3.162  1.00 18.75           C
ATOM    547  CD  GLU A  34       6.028   8.689  -2.494  1.00 22.28           C
ATOM    548  OE1 GLU A  34       7.118   8.654  -1.863  1.00 21.95           O
ATOM    549  OE2 GLU A  34       5.323   9.721  -2.647  1.00 25.19           O
ATOM      0  H   GLU A  34       4.769   6.401  -6.107  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       6.257   8.843  -5.432  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       6.228   5.880  -4.531  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       7.495   6.972  -4.009  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       4.551   7.550  -3.537  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       5.514   6.616  -2.409  1.00 18.75           H   new
ATOM    556  N   GLY A  35       7.470   6.170  -6.992  1.00  7.22           N
ATOM    557  CA  GLY A  35       8.563   5.786  -7.830  1.00  6.29           C
ATOM    558  C   GLY A  35       9.323   4.572  -7.418  1.00  6.93           C
ATOM    559  O   GLY A  35      10.303   4.119  -8.007  1.00  7.41           O
ATOM      0  H   GLY A  35       6.787   5.433  -6.817  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       8.180   5.623  -8.837  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       9.260   6.622  -7.886  1.00  6.29           H   new
ATOM    563  N   ILE A  36       8.819   3.915  -6.358  1.00  5.86           N
ATOM    564  CA  ILE A  36       9.429   2.759  -5.777  1.00  6.07           C
ATOM    565  C   ILE A  36       9.037   1.545  -6.547  1.00  6.36           C
ATOM    566  O   ILE A  36       7.861   1.376  -6.865  1.00  6.18           O
ATOM    567  CB  ILE A  36       9.102   2.714  -4.314  1.00  7.47           C
ATOM    568  CG1 ILE A  36       9.516   4.046  -3.666  1.00  8.52           C
ATOM    569  CG2 ILE A  36       9.846   1.548  -3.642  1.00  7.36           C
ATOM    570  CD1 ILE A  36       9.140   4.123  -2.187  1.00  9.49           C
ATOM      0  H   ILE A  36       7.958   4.198  -5.890  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      10.516   2.803  -5.840  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       8.030   2.562  -4.185  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36      10.593   4.177  -3.770  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       9.041   4.869  -4.201  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       9.602   1.524  -2.580  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.544   0.609  -4.105  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.921   1.683  -3.764  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       9.456   5.084  -1.781  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       8.060   4.021  -2.080  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       9.636   3.319  -1.643  1.00  9.49           H   new
ATOM    582  N   PRO A  37       9.832   0.598  -6.950  1.00  8.65           N
ATOM    583  CA  PRO A  37       9.428  -0.620  -7.589  1.00  9.18           C
ATOM    584  C   PRO A  37       8.592  -1.576  -6.809  1.00  9.85           C
ATOM    585  O   PRO A  37       8.784  -1.582  -5.594  1.00  8.51           O
ATOM    586  CB  PRO A  37      10.738  -1.273  -8.025  1.00 11.42           C
ATOM    587  CG  PRO A  37      11.652  -0.066  -8.290  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.258   0.836  -7.110  1.00  8.33           C
ATOM      0  HA  PRO A  37       8.744  -0.361  -8.397  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      11.143  -1.924  -7.250  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      10.607  -1.884  -8.918  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      12.709  -0.333  -8.275  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      11.455   0.401  -9.255  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      11.810   0.577  -6.207  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      11.467   1.885  -7.321  1.00  8.33           H   new
ATOM    596  N   PRO A  38       7.670  -2.333  -7.326  1.00  8.71           N
ATOM    597  CA  PRO A  38       6.798  -3.126  -6.508  1.00  9.08           C
ATOM    598  C   PRO A  38       7.440  -4.168  -5.658  1.00  9.28           C
ATOM    599  O   PRO A  38       6.836  -4.538  -4.652  1.00  6.50           O
ATOM    600  CB  PRO A  38       5.901  -3.817  -7.532  1.00 10.31           C
ATOM    601  CG  PRO A  38       5.750  -2.842  -8.710  1.00 10.81           C
ATOM    602  CD  PRO A  38       7.113  -2.134  -8.655  1.00 12.00           C
ATOM      0  HA  PRO A  38       6.309  -2.477  -5.782  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       6.342  -4.758  -7.861  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       4.930  -4.055  -7.099  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       5.587  -3.356  -9.657  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       4.917  -2.152  -8.574  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       7.783  -2.538  -9.413  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       6.999  -1.071  -8.865  1.00 12.00           H   new
ATOM    610  N   ASP A  39       8.670  -4.587  -6.006  1.00 11.20           N
ATOM    611  CA  ASP A  39       9.416  -5.579  -5.297  1.00 14.96           C
ATOM    612  C   ASP A  39      10.134  -5.029  -4.113  1.00 13.99           C
ATOM    613  O   ASP A  39      10.338  -5.697  -3.101  1.00 13.75           O
ATOM    614  CB  ASP A  39      10.304  -6.234  -6.369  1.00 24.16           C
ATOM    615  CG  ASP A  39      11.360  -5.381  -7.057  1.00 31.06           C
ATOM    616  OD1 ASP A  39      11.077  -4.721  -8.093  1.00 35.55           O
ATOM    617  OD2 ASP A  39      12.501  -5.415  -6.524  1.00 34.22           O
ATOM      0  H   ASP A  39       9.166  -4.218  -6.817  1.00 11.20           H   new
ATOM      0  HA  ASP A  39       8.782  -6.331  -4.827  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      10.811  -7.081  -5.907  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39       9.649  -6.637  -7.141  1.00 24.16           H   new
ATOM    622  N   GLN A  40      10.296  -3.694  -4.104  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.038  -3.052  -3.063  1.00 10.76           C
ATOM    624  C   GLN A  40      10.183  -2.440  -2.008  1.00  8.01           C
ATOM    625  O   GLN A  40      10.743  -2.000  -1.005  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.983  -1.982  -3.636  1.00 11.14           C
ATOM    627  CG  GLN A  40      12.922  -2.560  -4.697  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.865  -1.418  -5.046  1.00 16.11           C
ATOM    629  OE1 GLN A  40      14.126  -0.415  -4.383  1.00 20.52           O
ATOM    630  NE2 GLN A  40      14.622  -1.598  -6.161  1.00 18.16           N
ATOM      0  H   GLN A  40       9.917  -3.063  -4.811  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      11.616  -3.846  -2.590  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.395  -1.174  -4.072  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      12.572  -1.547  -2.828  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.469  -3.421  -4.314  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.369  -2.898  -5.573  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.463  -2.408  -6.760  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      15.349  -0.923  -6.398  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.848  -2.462  -2.169  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.807  -2.031  -1.289  1.00  3.87           C
ATOM    641  C   GLN A  41       7.366  -3.046  -0.290  1.00  4.79           C
ATOM    642  O   GLN A  41       7.354  -4.242  -0.574  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.563  -1.740  -2.145  1.00  4.20           C
ATOM    644  CG  GLN A  41       6.824  -0.508  -3.015  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.606  -0.219  -3.880  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.490  -0.119  -3.372  1.00  5.21           O
ATOM    647  NE2 GLN A  41       5.704  -0.052  -5.226  1.00  7.13           N
ATOM      0  H   GLN A  41       8.452  -2.832  -3.033  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.213  -1.176  -0.748  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.330  -2.600  -2.773  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.698  -1.570  -1.504  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.046   0.353  -2.385  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       7.697  -0.675  -3.645  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       6.612  -0.127  -5.684  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       4.869   0.149  -5.777  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.188  -2.657   0.985  1.00  5.73           N
ATOM    657  CA  ARG A  42       6.694  -3.539   1.997  1.00  6.97           C
ATOM    658  C   ARG A  42       5.570  -2.854   2.694  1.00  7.15           C
ATOM    659  O   ARG A  42       5.798  -1.779   3.248  1.00  7.33           O
ATOM    660  CB  ARG A  42       7.814  -4.050   2.919  1.00 13.23           C
ATOM    661  CG  ARG A  42       7.432  -4.895   4.136  1.00 21.27           C
ATOM    662  CD  ARG A  42       8.606  -5.699   4.699  1.00 26.14           C
ATOM    663  NE  ARG A  42       8.166  -6.639   5.768  1.00 32.26           N
ATOM    664  CZ  ARG A  42       8.669  -6.630   7.036  1.00 34.32           C
ATOM    665  NH1 ARG A  42       9.550  -5.692   7.492  1.00 35.30           N
ATOM    666  NH2 ARG A  42       8.293  -7.665   7.842  1.00 36.39           N
ATOM      0  H   ARG A  42       7.390  -1.715   1.319  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.302  -4.455   1.554  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       8.501  -4.638   2.311  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       8.368  -3.183   3.279  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       7.039  -4.242   4.915  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       6.630  -5.579   3.859  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       9.083  -6.259   3.895  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       9.356  -5.017   5.100  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       7.449  -7.327   5.539  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       9.866  -4.946   6.873  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42       9.892  -5.737   8.452  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       7.669  -8.389   7.485  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42       8.636  -7.715   8.801  1.00 36.39           H   new
ATOM    680  N   LEU A  43       4.353  -3.424   2.637  1.00  4.65           N
ATOM    681  CA  LEU A  43       3.195  -2.823   3.223  1.00  3.51           C
ATOM    682  C   LEU A  43       2.890  -3.490   4.520  1.00  5.56           C
ATOM    683  O   LEU A  43       2.884  -4.711   4.669  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.971  -2.859   2.292  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.134  -2.281   0.876  1.00  6.32           C
ATOM    686  CD1 LEU A  43       0.792  -1.792   0.304  1.00  6.41           C
ATOM    687  CD2 LEU A  43       3.079  -1.071   0.796  1.00  9.55           C
ATOM      0  H   LEU A  43       4.170  -4.316   2.177  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       3.420  -1.770   3.394  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       1.653  -3.897   2.196  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       1.160  -2.321   2.783  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       2.549  -3.114   0.308  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       0.948  -1.391  -0.697  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       0.092  -2.626   0.256  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.384  -1.013   0.948  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       3.139  -0.724  -0.235  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       2.697  -0.269   1.427  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       4.072  -1.361   1.139  1.00  9.55           H   new
ATOM    699  N   ILE A  44       2.554  -2.639   5.505  1.00  4.58           N
ATOM    700  CA  ILE A  44       2.337  -2.939   6.886  1.00  5.55           C
ATOM    701  C   ILE A  44       1.121  -2.119   7.148  1.00  5.46           C
ATOM    702  O   ILE A  44       1.062  -0.984   6.679  1.00  6.04           O
ATOM    703  CB  ILE A  44       3.531  -2.623   7.737  1.00  6.80           C
ATOM    704  CG1 ILE A  44       4.889  -3.249   7.377  1.00 10.31           C
ATOM    705  CG2 ILE A  44       3.185  -3.058   9.171  1.00  7.39           C
ATOM    706  CD1 ILE A  44       5.063  -4.752   7.167  1.00 13.90           C
ATOM      0  H   ILE A  44       2.422  -1.646   5.314  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       2.194  -3.992   7.128  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       3.695  -1.557   7.582  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       5.224  -2.764   6.460  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       5.586  -2.960   8.164  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       4.028  -2.847   9.829  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       2.309  -2.509   9.516  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       2.973  -4.127   9.186  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       6.103  -4.967   6.922  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       4.788  -5.281   8.080  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       4.422  -5.082   6.350  1.00 13.90           H   new
ATOM    718  N   PHE A  45       0.100  -2.738   7.767  1.00  6.75           N
ATOM    719  CA  PHE A  45      -1.055  -2.054   8.262  1.00  4.70           C
ATOM    720  C   PHE A  45      -1.158  -2.272   9.733  1.00  6.34           C
ATOM    721  O   PHE A  45      -1.290  -3.455  10.043  1.00  5.45           O
ATOM    722  CB  PHE A  45      -2.320  -2.647   7.621  1.00  5.51           C
ATOM    723  CG  PHE A  45      -3.563  -1.855   7.839  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -3.641  -0.500   7.621  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -4.700  -2.495   8.274  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -4.830   0.183   7.719  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -5.922  -1.865   8.293  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -5.973  -0.518   8.023  1.00  6.84           C
ATOM      0  H   PHE A  45       0.077  -3.745   7.928  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -0.966  -0.993   8.027  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -2.154  -2.747   6.548  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -2.473  -3.652   8.015  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -2.743   0.043   7.366  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -4.631  -3.519   8.609  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -4.866   1.251   7.560  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -6.823  -2.417   8.515  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -6.923  -0.004   8.050  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -1.160  -1.264  10.623  1.00  6.53           N
ATOM    739  CA  ALA A  46      -1.147  -1.495  12.034  1.00  7.15           C
ATOM    740  C   ALA A  46       0.119  -2.207  12.362  1.00  9.00           C
ATOM    741  O   ALA A  46       1.230  -1.682  12.312  1.00 11.15           O
ATOM    742  CB  ALA A  46      -2.427  -2.112  12.622  1.00  8.99           C
ATOM      0  H   ALA A  46      -1.171  -0.278  10.361  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -1.159  -0.534  12.548  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -2.307  -2.243  13.697  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -3.272  -1.450  12.429  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -2.611  -3.080  12.157  1.00  8.99           H   new
ATOM    748  N   GLY A  47       0.014  -3.453  12.859  1.00  9.35           N
ATOM    749  CA  GLY A  47       1.136  -4.339  12.898  1.00 11.68           C
ATOM    750  C   GLY A  47       0.942  -5.564  12.073  1.00 11.14           C
ATOM    751  O   GLY A  47       1.341  -6.661  12.461  1.00 13.93           O
ATOM      0  H   GLY A  47      -0.849  -3.847  13.234  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       2.022  -3.809  12.548  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47       1.326  -4.630  13.931  1.00 11.68           H   new
ATOM    755  N   LYS A  48       0.240  -5.478  10.929  1.00 10.47           N
ATOM    756  CA  LYS A  48      -0.014  -6.583  10.057  1.00  8.82           C
ATOM    757  C   LYS A  48       0.706  -6.353   8.773  1.00  7.68           C
ATOM    758  O   LYS A  48       0.454  -5.422   8.010  1.00  6.47           O
ATOM    759  CB  LYS A  48      -1.515  -6.849   9.860  1.00  9.74           C
ATOM    760  CG  LYS A  48      -2.271  -7.133  11.159  1.00 14.14           C
ATOM    761  CD  LYS A  48      -3.744  -6.731  11.067  1.00 16.32           C
ATOM    762  CE  LYS A  48      -4.146  -5.330  11.534  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -5.571  -5.038  11.264  1.00 23.92           N
ATOM      0  H   LYS A  48      -0.167  -4.603  10.598  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       0.368  -7.495  10.517  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -1.966  -5.986   9.370  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -1.638  -7.697   9.187  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -2.199  -8.195  11.395  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -1.798  -6.592  11.979  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -4.052  -6.836  10.027  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -4.322  -7.452  11.645  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -3.954  -5.236  12.603  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -3.524  -4.589  11.032  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -5.798  -4.079  11.597  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -5.751  -5.101  10.242  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -6.167  -5.728  11.764  1.00 23.92           H   new
ATOM    777  N   GLN A  49       1.565  -7.305   8.367  1.00  8.89           N
ATOM    778  CA  GLN A  49       2.231  -7.371   7.103  1.00  7.18           C
ATOM    779  C   GLN A  49       1.319  -7.850   6.026  1.00  8.23           C
ATOM    780  O   GLN A  49       0.826  -8.977   6.045  1.00  9.70           O
ATOM    781  CB  GLN A  49       3.453  -8.303   7.160  1.00 11.67           C
ATOM    782  CG  GLN A  49       4.210  -8.346   5.831  1.00 15.82           C
ATOM    783  CD  GLN A  49       5.379  -9.313   5.952  1.00 20.21           C
ATOM    784  OE1 GLN A  49       6.495  -8.931   6.301  1.00 23.23           O
ATOM    785  NE2 GLN A  49       5.149 -10.627   5.689  1.00 20.67           N
ATOM      0  H   GLN A  49       1.812  -8.089   8.971  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       2.557  -6.356   6.875  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       4.126  -7.968   7.949  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       3.128  -9.309   7.424  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       3.543  -8.662   5.029  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       4.571  -7.351   5.572  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       4.220 -10.934   5.400  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       5.905 -11.305   5.781  1.00 20.67           H   new
ATOM    794  N   LEU A  50       1.072  -7.048   4.975  1.00  6.51           N
ATOM    795  CA  LEU A  50       0.125  -7.403   3.964  1.00  7.41           C
ATOM    796  C   LEU A  50       0.677  -8.165   2.808  1.00  8.27           C
ATOM    797  O   LEU A  50       1.738  -7.858   2.268  1.00  8.34           O
ATOM    798  CB  LEU A  50      -0.428  -6.104   3.354  1.00  7.13           C
ATOM    799  CG  LEU A  50      -1.022  -5.012   4.259  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -1.481  -3.822   3.399  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -2.135  -5.630   5.122  1.00  8.14           C
ATOM      0  H   LEU A  50       1.531  -6.149   4.825  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -0.606  -8.035   4.469  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       0.380  -5.646   2.784  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -1.201  -6.387   2.640  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -0.276  -4.615   4.947  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -1.902  -3.049   4.042  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -0.628  -3.416   2.854  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.239  -4.156   2.690  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -2.563  -4.863   5.768  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -2.913  -6.036   4.476  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -1.719  -6.429   5.735  1.00  8.14           H   new
ATOM    813  N   GLU A  51      -0.027  -9.220   2.361  1.00  9.43           N
ATOM    814  CA  GLU A  51       0.445  -9.970   1.240  1.00 11.90           C
ATOM    815  C   GLU A  51      -0.164  -9.569  -0.060  1.00 11.49           C
ATOM    816  O   GLU A  51      -1.381  -9.412  -0.145  1.00  9.88           O
ATOM    817  CB  GLU A  51       0.386 -11.490   1.471  1.00 16.56           C
ATOM    818  CG  GLU A  51       0.550 -12.339   0.209  1.00 26.06           C
ATOM    819  CD  GLU A  51       0.539 -13.848   0.404  1.00 29.86           C
ATOM    820  OE1 GLU A  51       1.323 -14.429   1.202  1.00 32.13           O
ATOM    821  OE2 GLU A  51      -0.359 -14.476  -0.218  1.00 33.44           O
ATOM      0  H   GLU A  51      -0.904  -9.548   2.765  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       1.499  -9.707   1.155  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       1.166 -11.766   2.181  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51      -0.569 -11.736   1.935  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51      -0.249 -12.078  -0.485  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       1.490 -12.063  -0.269  1.00 26.06           H   new
ATOM    828  N   ASP A  52       0.685  -9.303  -1.068  1.00 12.71           N
ATOM    829  CA  ASP A  52       0.442  -8.857  -2.405  1.00 16.56           C
ATOM    830  C   ASP A  52      -0.828  -9.299  -3.046  1.00 15.83           C
ATOM    831  O   ASP A  52      -1.613  -8.526  -3.595  1.00 17.21           O
ATOM    832  CB  ASP A  52       1.657  -9.180  -3.290  1.00 21.05           C
ATOM    833  CG  ASP A  52       2.802  -8.264  -2.883  1.00 25.12           C
ATOM    834  OD1 ASP A  52       2.833  -7.716  -1.748  1.00 28.37           O
ATOM    835  OD2 ASP A  52       3.731  -8.096  -3.718  1.00 25.82           O
ATOM      0  H   ASP A  52       1.687  -9.420  -0.917  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       0.300  -7.780  -2.311  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       1.946 -10.224  -3.172  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       1.410  -9.035  -4.342  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -1.096 -10.617  -3.056  1.00 15.00           N
ATOM    841  CA  GLY A  53      -2.084 -11.262  -3.863  1.00 11.77           C
ATOM    842  C   GLY A  53      -3.397 -11.280  -3.158  1.00 11.10           C
ATOM    843  O   GLY A  53      -4.378 -11.789  -3.698  1.00 11.25           O
ATOM      0  H   GLY A  53      -0.589 -11.273  -2.462  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -2.182 -10.741  -4.815  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -1.770 -12.281  -4.088  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -3.471 -10.714  -1.940  1.00  8.53           N
ATOM    848  CA  ARG A  54      -4.741 -10.529  -1.309  1.00  9.05           C
ATOM    849  C   ARG A  54      -5.336  -9.199  -1.620  1.00  8.96           C
ATOM    850  O   ARG A  54      -4.702  -8.319  -2.201  1.00 11.60           O
ATOM    851  CB  ARG A  54      -4.656 -10.741   0.212  1.00  7.97           C
ATOM    852  CG  ARG A  54      -4.305 -12.172   0.623  1.00  9.62           C
ATOM    853  CD  ARG A  54      -3.804 -12.378   2.054  1.00 12.20           C
ATOM    854  NE  ARG A  54      -4.891 -11.983   2.993  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -4.894 -12.076   4.355  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -3.866 -12.613   5.075  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -5.990 -11.584   5.004  1.00 25.50           N
ATOM      0  H   ARG A  54      -2.668 -10.390  -1.400  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -5.403 -11.290  -1.722  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -3.908 -10.063   0.622  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -5.612 -10.469   0.660  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -5.190 -12.793   0.481  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -3.542 -12.544  -0.061  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -3.526 -13.420   2.212  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -2.911 -11.779   2.233  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -5.734 -11.597   2.567  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -3.040 -12.971   4.596  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -3.924 -12.656   6.092  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -6.756 -11.172   4.471  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -6.043 -11.629   6.022  1.00 25.50           H   new
ATOM    871  N   THR A  55      -6.618  -8.937  -1.312  1.00  9.05           N
ATOM    872  CA  THR A  55      -7.159  -7.675  -1.710  1.00  9.03           C
ATOM    873  C   THR A  55      -7.359  -6.850  -0.486  1.00  8.15           C
ATOM    874  O   THR A  55      -6.988  -7.207   0.631  1.00  5.91           O
ATOM    875  CB  THR A  55      -8.498  -7.769  -2.380  1.00 11.15           C
ATOM    876  OG1 THR A  55      -9.470  -8.368  -1.537  1.00 11.95           O
ATOM    877  CG2 THR A  55      -8.302  -8.680  -3.604  1.00 11.71           C
ATOM      0  H   THR A  55      -7.252  -9.561  -0.814  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.453  -7.248  -2.422  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.850  -6.770  -2.637  1.00 11.15           H   new
ATOM      0  HG1 THR A  55     -10.329  -8.410  -2.007  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -9.249  -8.786  -4.134  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -7.560  -8.240  -4.270  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -7.958  -9.661  -3.276  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.842  -5.605  -0.646  1.00  6.91           N
ATOM    886  CA  LEU A  56      -8.096  -4.697   0.429  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.336  -5.074   1.165  1.00  8.05           C
ATOM    888  O   LEU A  56      -9.466  -5.077   2.388  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.391  -3.253  -0.011  1.00  6.60           C
ATOM    890  CG  LEU A  56      -7.145  -2.448  -0.417  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.509  -1.157  -1.169  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -6.136  -2.135   0.701  1.00  9.85           C
ATOM      0  H   LEU A  56      -8.065  -5.215  -1.562  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -7.180  -4.752   1.018  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -9.084  -3.276  -0.852  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.895  -2.733   0.804  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.626  -3.138  -1.083  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.598  -0.622  -1.435  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -8.061  -1.407  -2.075  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -8.127  -0.526  -0.530  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -5.303  -1.564   0.290  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.626  -1.552   1.481  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.763  -3.067   1.126  1.00  9.85           H   new
ATOM    904  N   SER A  57     -10.339  -5.619   0.455  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.492  -6.251   1.017  1.00  9.00           C
ATOM    906  C   SER A  57     -11.061  -7.415   1.842  1.00  9.44           C
ATOM    907  O   SER A  57     -11.757  -7.671   2.823  1.00 10.91           O
ATOM    908  CB  SER A  57     -12.473  -6.845  -0.008  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.820  -6.740   0.429  1.00 13.59           O
ATOM      0  H   SER A  57     -10.346  -5.619  -0.565  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.993  -5.457   1.571  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -12.359  -6.329  -0.961  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -12.228  -7.893  -0.181  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -14.414  -7.126  -0.248  1.00 13.59           H   new
ATOM    915  N   ASP A  58     -10.018  -8.193   1.502  1.00  9.11           N
ATOM    916  CA  ASP A  58      -9.656  -9.353   2.255  1.00  7.91           C
ATOM    917  C   ASP A  58      -9.060  -9.019   3.579  1.00  9.12           C
ATOM    918  O   ASP A  58      -9.363  -9.706   4.553  1.00  8.61           O
ATOM    919  CB  ASP A  58      -8.732 -10.187   1.351  1.00  8.41           C
ATOM    920  CG  ASP A  58      -8.542 -11.583   1.928  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -7.667 -11.761   2.817  1.00 10.05           O
ATOM    922  OD2 ASP A  58      -9.282 -12.505   1.493  1.00 11.70           O
ATOM      0  H   ASP A  58      -9.419  -8.015   0.696  1.00  9.11           H   new
ATOM      0  HA  ASP A  58     -10.538  -9.935   2.521  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -9.158 -10.255   0.350  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -7.766  -9.693   1.253  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -8.268  -7.933   3.630  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.550  -7.437   4.763  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.452  -6.605   5.607  1.00 10.98           C
ATOM    930  O   TYR A  59      -7.975  -6.051   6.596  1.00 12.95           O
ATOM    931  CB  TYR A  59      -6.228  -6.794   4.309  1.00  7.94           C
ATOM    932  CG  TYR A  59      -5.055  -7.710   4.243  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.435  -8.143   5.391  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.369  -8.016   3.090  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -3.343  -8.975   5.466  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -3.270  -8.841   3.054  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -2.800  -9.326   4.252  1.00  6.76           C
ATOM    938  OH  TYR A  59      -1.795 -10.317   4.260  1.00  7.63           O
ATOM      0  H   TYR A  59      -8.118  -7.352   2.805  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -7.233  -8.241   5.427  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.379  -6.354   3.323  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -5.990  -5.977   4.990  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -4.847  -7.795   6.327  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -4.713  -7.584   2.162  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -2.942  -9.326   6.406  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -2.793  -9.099   2.120  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -1.947 -10.931   5.008  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.743  -6.512   5.241  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.654  -5.584   5.837  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.165  -4.178   5.911  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.107  -3.664   7.026  1.00 14.26           O
ATOM    952  CB  ASN A  60     -11.192  -6.103   7.181  1.00 19.23           C
ATOM    953  CG  ASN A  60     -12.250  -7.135   6.817  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -13.355  -6.819   6.380  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -11.852  -8.435   6.864  1.00 24.09           N
ATOM      0  H   ASN A  60     -10.163  -7.094   4.516  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -11.494  -5.525   5.145  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.396  -6.549   7.778  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -11.619  -5.294   7.773  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -12.475  -9.171   6.532  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -10.931  -8.673   7.231  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -9.707  -3.665   4.755  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.213  -2.323   4.732  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.178  -1.355   4.138  1.00 13.74           C
ATOM    965  O   ILE A  61     -10.601  -1.475   2.989  1.00 14.60           O
ATOM    966  CB  ILE A  61      -7.907  -2.210   4.002  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -6.916  -3.086   4.787  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.422  -0.764   3.806  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.435  -3.019   4.417  1.00 11.42           C
ATOM      0  H   ILE A  61      -9.678  -4.160   3.863  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.065  -2.065   5.781  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -8.013  -2.559   2.975  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -7.007  -2.826   5.842  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -7.237  -4.123   4.685  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.473  -0.768   3.271  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.161  -0.207   3.230  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.288  -0.290   4.778  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -4.869  -3.693   5.060  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -5.306  -3.316   3.376  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -5.072  -2.000   4.551  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -10.660  -0.444   5.002  1.00 13.97           N
ATOM    982  CA  GLN A  62     -11.683   0.458   4.574  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.068   1.755   4.173  1.00 13.94           C
ATOM    984  O   GLN A  62      -9.868   1.991   4.039  1.00 12.15           O
ATOM    985  CB  GLN A  62     -12.773   0.647   5.642  1.00 19.53           C
ATOM    986  CG  GLN A  62     -13.200  -0.737   6.136  1.00 26.38           C
ATOM    987  CD  GLN A  62     -14.222  -0.501   7.239  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -13.901  -0.411   8.423  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -15.483  -0.320   6.764  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.353  -0.332   5.968  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.184   0.025   3.708  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.395   1.247   6.470  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -13.626   1.182   5.225  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -13.632  -1.323   5.325  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -12.344  -1.297   6.513  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -15.670  -0.412   5.766  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -16.242  -0.092   7.406  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -11.932   2.731   3.842  1.00 11.73           N
ATOM    999  CA  LYS A  63     -11.420   3.971   3.346  1.00 11.97           C
ATOM   1000  C   LYS A  63     -10.787   4.803   4.408  1.00 10.41           C
ATOM   1001  O   LYS A  63     -11.129   4.658   5.580  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -12.508   4.832   2.683  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -13.664   5.217   3.608  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -14.809   6.006   2.971  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -15.972   6.387   3.890  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -15.565   7.242   5.028  1.00 25.97           N
ATOM      0  H   LYS A  63     -12.948   2.669   3.913  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -10.671   3.677   2.611  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -12.049   5.742   2.298  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -12.910   4.291   1.826  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -14.076   4.304   4.039  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -13.261   5.805   4.433  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -14.397   6.921   2.545  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -15.207   5.420   2.142  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -16.731   6.908   3.307  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -16.434   5.478   4.275  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -16.310   7.941   5.221  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -15.418   6.651   5.871  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -14.680   7.735   4.792  1.00 25.97           H   new
ATOM   1020  N   GLU A  64      -9.844   5.689   4.042  1.00 10.04           N
ATOM   1021  CA  GLU A  64      -9.253   6.704   4.858  1.00 10.94           C
ATOM   1022  C   GLU A  64      -8.264   6.080   5.781  1.00  9.74           C
ATOM   1023  O   GLU A  64      -7.989   6.704   6.805  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -10.189   7.646   5.635  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -11.082   8.490   4.723  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -12.270   9.152   5.406  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -12.151   9.875   6.431  1.00 31.72           O
ATOM   1028  OE2 GLU A  64     -13.377   8.898   4.861  1.00 32.61           O
ATOM      0  H   GLU A  64      -9.464   5.694   3.095  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -8.787   7.376   4.137  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -10.816   7.056   6.303  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64      -9.591   8.308   6.261  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -10.471   9.266   4.261  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -11.454   7.856   3.918  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -7.919   4.815   5.482  1.00  6.85           N
ATOM   1036  CA  SER A  65      -7.097   4.049   6.368  1.00  6.90           C
ATOM   1037  C   SER A  65      -5.661   4.297   6.061  1.00  4.72           C
ATOM   1038  O   SER A  65      -5.308   4.434   4.890  1.00  3.91           O
ATOM   1039  CB  SER A  65      -7.289   2.535   6.172  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.635   2.104   6.313  1.00 10.56           O
ATOM      0  H   SER A  65      -8.206   4.325   4.634  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -7.378   4.348   7.378  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -6.931   2.258   5.180  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -6.670   2.003   6.894  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.959   1.758   5.455  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -4.778   4.379   7.072  1.00  4.48           N
ATOM   1047  CA  THR A  66      -3.370   4.534   6.871  1.00  3.80           C
ATOM   1048  C   THR A  66      -2.675   3.238   6.628  1.00  4.60           C
ATOM   1049  O   THR A  66      -2.504   2.385   7.498  1.00  5.33           O
ATOM   1050  CB  THR A  66      -2.878   5.143   8.150  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -3.606   6.279   8.592  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -1.407   5.540   7.939  1.00  3.40           C
ATOM      0  H   THR A  66      -5.049   4.337   8.054  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -3.168   5.141   5.989  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -3.011   4.393   8.930  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -3.220   6.609   9.430  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -1.016   5.988   8.853  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -0.823   4.654   7.691  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -1.338   6.260   7.124  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -2.117   3.106   5.412  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -1.124   2.120   5.120  1.00  3.85           C
ATOM   1062  C   LEU A  67       0.240   2.630   5.434  1.00  3.80           C
ATOM   1063  O   LEU A  67       0.516   3.828   5.460  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -1.189   1.560   3.689  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -2.530   0.951   3.246  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -2.483   0.345   1.833  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -2.920  -0.268   4.098  1.00  8.12           C
ATOM      0  H   LEU A  67      -2.360   3.696   4.616  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -1.350   1.276   5.771  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -0.935   2.363   2.997  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -0.418   0.796   3.587  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -3.219   1.791   3.327  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -3.460  -0.068   1.581  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -2.220   1.120   1.113  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -1.736  -0.448   1.802  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -3.873  -0.665   3.750  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.152  -1.036   4.007  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -3.012   0.032   5.142  1.00  8.12           H   new
ATOM   1079  N   HIS A  68       1.188   1.776   5.861  1.00  2.94           N
ATOM   1080  CA  HIS A  68       2.559   2.139   6.046  1.00  4.17           C
ATOM   1081  C   HIS A  68       3.381   1.573   4.940  1.00  5.32           C
ATOM   1082  O   HIS A  68       3.274   0.382   4.654  1.00  7.70           O
ATOM   1083  CB  HIS A  68       3.009   1.632   7.427  1.00  5.57           C
ATOM   1084  CG  HIS A  68       2.166   2.101   8.576  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       2.258   1.470   9.799  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       1.317   3.156   8.702  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       1.301   2.073  10.554  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       0.741   3.108   9.956  1.00 16.30           N
ATOM      0  H   HIS A  68       0.993   0.800   6.085  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       2.687   3.221   6.017  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       3.009   0.542   7.416  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       4.038   1.949   7.597  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68       1.126   3.905   7.948  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       1.027   1.739  11.544  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68       0.035   3.737  10.338  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       4.239   2.389   4.302  1.00  5.29           N
ATOM   1097  CA  LEU A  69       5.066   1.927   3.231  1.00  3.97           C
ATOM   1098  C   LEU A  69       6.479   1.961   3.702  1.00  5.07           C
ATOM   1099  O   LEU A  69       7.116   2.945   4.076  1.00  4.34           O
ATOM   1100  CB  LEU A  69       4.996   2.759   1.939  1.00  6.08           C
ATOM   1101  CG  LEU A  69       6.030   2.316   0.891  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.836   0.853   0.457  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       6.040   3.200  -0.368  1.00  6.87           C
ATOM      0  H   LEU A  69       4.360   3.376   4.530  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       4.702   0.931   2.978  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       3.996   2.678   1.513  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       5.156   3.810   2.179  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       6.989   2.423   1.398  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.591   0.590  -0.284  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.935   0.200   1.324  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.844   0.731   0.023  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       6.792   2.831  -1.065  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       5.059   3.169  -0.842  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       6.276   4.227  -0.090  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       7.094   0.766   3.742  1.00  4.29           N
ATOM   1116  CA  VAL A  70       8.349   0.504   4.375  1.00  6.26           C
ATOM   1117  C   VAL A  70       9.154  -0.010   3.230  1.00  9.22           C
ATOM   1118  O   VAL A  70       8.695  -0.565   2.233  1.00  9.36           O
ATOM   1119  CB  VAL A  70       8.245  -0.513   5.472  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       9.548  -1.115   6.025  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       7.397   0.090   6.604  1.00  8.54           C
ATOM      0  H   VAL A  70       6.692  -0.065   3.308  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       8.772   1.377   4.873  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       7.778  -1.381   5.006  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       9.312  -1.833   6.811  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70      10.085  -1.619   5.222  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70      10.171  -0.320   6.435  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       7.307  -0.632   7.415  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       7.877   0.995   6.976  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       6.405   0.335   6.224  1.00  8.54           H   new
ATOM   1131  N   LEU A  71      10.484   0.180   3.283  1.00 12.71           N
ATOM   1132  CA  LEU A  71      11.423  -0.076   2.235  1.00 16.06           C
ATOM   1133  C   LEU A  71      12.160  -1.338   2.527  1.00 18.09           C
ATOM   1134  O   LEU A  71      12.352  -1.633   3.706  1.00 19.26           O
ATOM   1135  CB  LEU A  71      12.383   1.069   1.870  1.00 17.10           C
ATOM   1136  CG  LEU A  71      11.876   2.168   0.922  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      11.864   1.623  -0.516  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      10.479   2.633   1.367  1.00 17.51           C
ATOM      0  H   LEU A  71      10.936   0.540   4.123  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      10.820  -0.176   1.333  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      12.697   1.548   2.797  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      13.273   0.627   1.422  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      12.538   3.034   0.955  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      11.505   2.396  -1.195  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      12.874   1.329  -0.802  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      11.204   0.757  -0.571  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71      10.123   3.412   0.693  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71       9.790   1.789   1.343  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71      10.533   3.028   2.381  1.00 17.51           H   new