USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  22 THR OG1 :   rot  180:sc=   0.133
USER  MOD Set 1.2: A  25 ASN     :      amide:sc=   0.128  X(o=0.26,f=0.0058)
USER  MOD Set 2.1: A   7 THR OG1 :   rot  180:sc=   0.936
USER  MOD Set 2.2: A   9 THR OG1 :   rot  180:sc=  0.0168
USER  MOD Single : A   1 MET CE  :methyl -174:sc=  -0.222   (180deg=-0.284)
USER  MOD Single : A   1 MET N   :NH3+    165:sc=     1.1   (180deg=0.89)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  K(o=0,f=-0.87)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+    151:sc=    1.23   (180deg=0.986)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  -77:sc=   0.389
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  27 LYS NZ  :NH3+   -151:sc=    1.38   (180deg=0.972)
USER  MOD Single : A  29 LYS NZ  :NH3+    172:sc=    1.25   (180deg=1.16)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.125  K(o=-0.12,f=-0.65)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  K(o=0,f=-1.3!)
USER  MOD Single : A  41 GLN     :      amide:sc=    1.34  K(o=1.3,f=-5.6!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=   0.674  K(o=0.67,f=-4.1!)
USER  MOD Single : A  55 THR OG1 :   rot  180:sc=   0.199
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  -61:sc=  0.0381
USER  MOD Single : A  60 ASN     :      amide:sc= -0.0899  X(o=-0.09,f=-0.0076)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 SER OG  :   rot   90:sc=    1.13
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HE2:sc=  -0.688  K(o=-0.69,f=-2.8!)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -11.649   5.919  -5.014  1.00  9.67           N
ATOM      2  CA  MET A   1     -11.254   6.725  -3.838  1.00 10.38           C
ATOM      3  C   MET A   1      -9.863   7.257  -3.898  1.00  9.62           C
ATOM      4  O   MET A   1      -8.971   6.823  -4.625  1.00  9.62           O
ATOM      5  CB  MET A   1     -11.465   5.994  -2.501  1.00 13.77           C
ATOM      6  CG  MET A   1     -10.643   4.706  -2.437  1.00 16.29           C
ATOM      7  SD  MET A   1     -11.186   3.531  -1.161  1.00 17.17           S
ATOM      8  CE  MET A   1      -9.897   2.252  -1.177  1.00 16.11           C
ATOM      0  H1  MET A   1     -12.512   5.382  -4.793  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -11.830   6.549  -5.822  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -10.883   5.258  -5.255  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -11.933   7.576  -3.882  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -11.183   6.649  -1.677  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -12.522   5.760  -2.375  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -10.685   4.214  -3.409  1.00 16.29           H   new
ATOM      0  HG3 MET A   1      -9.600   4.964  -2.256  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.185   1.437  -0.514  1.00 16.11           H   new
ATOM      0  HE2 MET A   1      -9.776   1.870  -2.191  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -8.955   2.681  -0.836  1.00 16.11           H   new
ATOM     20  N   GLN A   2      -9.486   8.106  -2.926  1.00  9.27           N
ATOM     21  CA  GLN A   2      -8.153   8.523  -2.617  1.00  9.07           C
ATOM     22  C   GLN A   2      -7.635   7.863  -1.385  1.00  8.72           C
ATOM     23  O   GLN A   2      -8.257   7.938  -0.327  1.00  8.22           O
ATOM     24  CB  GLN A   2      -7.912  10.037  -2.495  1.00 14.46           C
ATOM     25  CG  GLN A   2      -8.245  10.777  -3.792  1.00 17.01           C
ATOM     26  CD  GLN A   2      -8.155  12.295  -3.714  1.00 20.10           C
ATOM     27  OE1 GLN A   2      -7.379  12.847  -2.935  1.00 21.89           O
ATOM     28  NE2 GLN A   2      -9.008  13.054  -4.453  1.00 19.49           N
ATOM      0  H   GLN A   2     -10.172   8.536  -2.305  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -7.604   8.202  -3.502  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2      -8.520  10.437  -1.683  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -6.870  10.218  -2.232  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -7.570  10.429  -4.574  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2      -9.255  10.504  -4.098  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2      -9.656  12.608  -5.102  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2      -9.000  14.070  -4.358  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -6.437   7.258  -1.289  1.00  5.87           N
ATOM     38  CA  ILE A   3      -5.915   6.839  -0.026  1.00  5.07           C
ATOM     39  C   ILE A   3      -4.586   7.504   0.090  1.00  4.01           C
ATOM     40  O   ILE A   3      -3.936   7.958  -0.850  1.00  4.61           O
ATOM     41  CB  ILE A   3      -5.967   5.376   0.301  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.424   4.519  -0.855  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -7.440   5.007   0.550  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -3.939   4.163  -0.789  1.00 10.83           C
ATOM      0  H   ILE A   3      -5.831   7.059  -2.085  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -6.583   7.160   0.773  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -5.349   5.182   1.178  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -5.997   3.593  -0.894  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -5.609   5.048  -1.790  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.514   3.947   0.791  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -7.827   5.596   1.382  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.024   5.217  -0.346  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -3.671   3.558  -1.655  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -3.345   5.077  -0.787  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -3.740   3.600   0.123  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -4.104   7.537   1.345  1.00  4.55           N
ATOM     57  CA  PHE A   4      -2.922   8.165   1.849  1.00  4.68           C
ATOM     58  C   PHE A   4      -1.951   7.073   2.141  1.00  5.30           C
ATOM     59  O   PHE A   4      -2.220   6.059   2.782  1.00  5.58           O
ATOM     60  CB  PHE A   4      -3.157   9.063   3.076  1.00  4.83           C
ATOM     61  CG  PHE A   4      -4.011  10.255   2.812  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -4.351  10.836   1.613  1.00  6.69           C
ATOM     63  CD2 PHE A   4      -4.425  10.885   3.961  1.00  8.34           C
ATOM     64  CE1 PHE A   4      -5.200  11.912   1.500  1.00  9.10           C
ATOM     65  CE2 PHE A   4      -5.277  11.962   3.886  1.00 10.61           C
ATOM     66  CZ  PHE A   4      -5.637  12.490   2.668  1.00  8.90           C
ATOM      0  H   PHE A   4      -4.608   7.064   2.095  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -2.538   8.855   1.097  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -3.619   8.468   3.864  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -2.192   9.399   3.455  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -3.927  10.424   0.709  1.00  6.69           H   new
ATOM      0  HD2 PHE A   4      -4.081  10.534   4.923  1.00  8.34           H   new
ATOM      0  HE1 PHE A   4      -5.510  12.287   0.536  1.00  9.10           H   new
ATOM      0  HE2 PHE A   4      -5.668  12.398   4.794  1.00 10.61           H   new
ATOM      0  HZ  PHE A   4      -6.268  13.366   2.629  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -0.718   7.195   1.617  1.00  4.44           N
ATOM     77  CA  VAL A   5       0.330   6.232   1.751  1.00  3.87           C
ATOM     78  C   VAL A   5       1.412   7.091   2.310  1.00  4.93           C
ATOM     79  O   VAL A   5       2.104   7.881   1.669  1.00  6.84           O
ATOM     80  CB  VAL A   5       0.840   5.755   0.424  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.914   4.705   0.756  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -0.362   5.144  -0.316  1.00  9.13           C
ATOM      0  H   VAL A   5      -0.438   8.010   1.071  1.00  4.44           H   new
ATOM      0  HA  VAL A   5       0.017   5.356   2.319  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       1.272   6.531  -0.208  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       2.334   4.309  -0.169  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       2.705   5.168   1.345  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       1.464   3.893   1.327  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -0.042   4.780  -1.292  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -0.764   4.315   0.266  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -1.133   5.903  -0.447  1.00  9.13           H   new
ATOM     92  N   LYS A   6       1.696   6.969   3.619  1.00  6.04           N
ATOM     93  CA  LYS A   6       2.712   7.558   4.435  1.00  6.12           C
ATOM     94  C   LYS A   6       3.914   6.679   4.408  1.00  6.57           C
ATOM     95  O   LYS A   6       3.832   5.519   4.006  1.00  5.76           O
ATOM     96  CB  LYS A   6       2.217   7.840   5.863  1.00  7.45           C
ATOM     97  CG  LYS A   6       2.907   8.933   6.683  1.00 11.12           C
ATOM     98  CD  LYS A   6       1.937   9.508   7.717  1.00 14.54           C
ATOM     99  CE  LYS A   6       2.477  10.627   8.609  1.00 18.84           C
ATOM    100  NZ  LYS A   6       1.420  11.232   9.449  1.00 20.55           N
ATOM      0  H   LYS A   6       1.114   6.356   4.190  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       2.981   8.534   4.030  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6       1.159   8.093   5.801  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       2.290   6.910   6.427  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       3.784   8.523   7.184  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       3.259   9.726   6.023  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6       1.060   9.884   7.190  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6       1.599   8.694   8.358  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       3.265  10.230   9.249  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       2.930  11.399   7.987  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6       1.832  11.985  10.036  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6       0.680  11.634   8.839  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       1.004  10.503  10.063  1.00 20.55           H   new
ATOM    114  N   THR A   7       5.116   7.151   4.786  1.00  7.41           N
ATOM    115  CA  THR A   7       6.286   6.338   4.911  1.00  7.48           C
ATOM    116  C   THR A   7       6.456   6.089   6.370  1.00  8.75           C
ATOM    117  O   THR A   7       5.435   6.205   7.046  1.00  8.58           O
ATOM    118  CB  THR A   7       7.545   7.046   4.508  1.00  9.61           C
ATOM    119  OG1 THR A   7       7.725   8.351   5.039  1.00 11.78           O
ATOM    120  CG2 THR A   7       7.579   7.223   2.981  1.00  9.17           C
ATOM      0  H   THR A   7       5.279   8.132   5.012  1.00  7.41           H   new
ATOM      0  HA  THR A   7       6.149   5.458   4.283  1.00  7.48           H   new
ATOM      0  HB  THR A   7       8.332   6.406   4.907  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       8.574   8.721   4.717  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       8.496   7.738   2.695  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       7.547   6.245   2.501  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       6.718   7.812   2.664  1.00  9.17           H   new
ATOM    128  N   LEU A   8       7.683   5.873   6.877  1.00  9.84           N
ATOM    129  CA  LEU A   8       7.919   5.838   8.287  1.00 14.15           C
ATOM    130  C   LEU A   8       8.289   7.182   8.811  1.00 17.37           C
ATOM    131  O   LEU A   8       7.801   7.580   9.868  1.00 17.01           O
ATOM    132  CB  LEU A   8       9.030   4.848   8.675  1.00 16.63           C
ATOM    133  CG  LEU A   8       8.586   3.377   8.622  1.00 18.88           C
ATOM    134  CD1 LEU A   8       9.758   2.419   8.898  1.00 18.59           C
ATOM    135  CD2 LEU A   8       7.605   3.190   9.792  1.00 19.31           C
ATOM      0  H   LEU A   8       8.515   5.722   6.307  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       6.980   5.508   8.732  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       9.880   4.987   8.006  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       9.376   5.079   9.683  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       8.169   3.162   7.638  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       9.405   1.389   8.852  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8      10.535   2.570   8.149  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8      10.166   2.619   9.889  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8       7.251   2.159   9.809  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8       8.111   3.416  10.731  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8       6.757   3.863   9.666  1.00 19.31           H   new
ATOM    147  N   THR A   9       9.145   7.966   8.131  1.00 18.33           N
ATOM    148  CA  THR A   9       9.458   9.308   8.510  1.00 19.24           C
ATOM    149  C   THR A   9       8.301  10.238   8.384  1.00 19.48           C
ATOM    150  O   THR A   9       8.056  11.105   9.222  1.00 23.14           O
ATOM    151  CB  THR A   9      10.577   9.953   7.747  1.00 18.97           C
ATOM    152  OG1 THR A   9      10.559   9.546   6.387  1.00 20.24           O
ATOM    153  CG2 THR A   9      11.887   9.368   8.300  1.00 19.70           C
ATOM      0  H   THR A   9       9.634   7.656   7.291  1.00 18.33           H   new
ATOM      0  HA  THR A   9       9.760   9.169   9.548  1.00 19.24           H   new
ATOM      0  HB  THR A   9      10.485  11.035   7.835  1.00 18.97           H   new
ATOM      0  HG1 THR A   9      11.295   9.979   5.906  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      12.733   9.809   7.773  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      11.965   9.592   9.364  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      11.893   8.288   8.155  1.00 19.70           H   new
ATOM    161  N   GLY A  10       7.522   9.969   7.321  1.00 19.43           N
ATOM    162  CA  GLY A  10       6.176  10.449   7.364  1.00 18.74           C
ATOM    163  C   GLY A  10       5.627  11.235   6.223  1.00 17.62           C
ATOM    164  O   GLY A  10       4.687  12.003   6.421  1.00 19.74           O
ATOM      0  H   GLY A  10       7.797   9.455   6.484  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       5.528   9.584   7.503  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       6.080  11.066   8.258  1.00 18.74           H   new
ATOM    168  N   LYS A  11       6.213  11.101   5.020  1.00 13.56           N
ATOM    169  CA  LYS A  11       5.720  11.567   3.761  1.00 11.91           C
ATOM    170  C   LYS A  11       4.568  10.820   3.182  1.00 10.18           C
ATOM    171  O   LYS A  11       4.706   9.715   2.660  1.00  9.10           O
ATOM    172  CB  LYS A  11       6.884  11.673   2.761  1.00 13.43           C
ATOM    173  CG  LYS A  11       6.445  12.538   1.579  1.00 16.69           C
ATOM    174  CD  LYS A  11       7.486  12.678   0.466  1.00 17.92           C
ATOM    175  CE  LYS A  11       7.181  11.753  -0.714  1.00 20.81           C
ATOM    176  NZ  LYS A  11       8.368  11.637  -1.591  1.00 21.93           N
ATOM      0  H   LYS A  11       7.110  10.625   4.922  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       5.295  12.549   3.966  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       7.757  12.111   3.244  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       7.175  10.681   2.415  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       5.535  12.114   1.155  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       6.192  13.532   1.948  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       7.513  13.712   0.121  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       8.475  12.449   0.862  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       6.892  10.768  -0.348  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       6.336  12.142  -1.282  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       8.363  10.709  -2.061  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       8.344  12.389  -2.309  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       9.232  11.731  -1.020  1.00 21.93           H   new
ATOM    190  N   THR A  12       3.387  11.460   3.253  1.00  9.63           N
ATOM    191  CA  THR A  12       2.190  10.976   2.638  1.00  9.85           C
ATOM    192  C   THR A  12       2.188  11.335   1.192  1.00 11.66           C
ATOM    193  O   THR A  12       2.247  12.504   0.817  1.00 12.33           O
ATOM    194  CB  THR A  12       0.921  11.569   3.176  1.00 10.85           C
ATOM    195  OG1 THR A  12       0.954  11.205   4.548  1.00 10.91           O
ATOM    196  CG2 THR A  12      -0.323  10.828   2.657  1.00  9.63           C
ATOM      0  H   THR A  12       3.261  12.340   3.753  1.00  9.63           H   new
ATOM      0  HA  THR A  12       2.201   9.905   2.838  1.00  9.85           H   new
ATOM      0  HB  THR A  12       0.865  12.628   2.923  1.00 10.85           H   new
ATOM      0  HG1 THR A  12       0.156  11.552   4.998  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -1.220  11.289   3.070  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -0.354  10.886   1.569  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -0.278   9.783   2.963  1.00  9.63           H   new
ATOM    204  N   ILE A  13       1.919  10.359   0.306  1.00 10.42           N
ATOM    205  CA  ILE A  13       1.455  10.561  -1.031  1.00 11.84           C
ATOM    206  C   ILE A  13       0.021  10.156  -1.057  1.00 10.55           C
ATOM    207  O   ILE A  13      -0.484   9.457  -0.180  1.00 11.92           O
ATOM    208  CB  ILE A  13       2.306   9.869  -2.054  1.00 14.86           C
ATOM    209  CG1 ILE A  13       2.371   8.345  -1.859  1.00 14.87           C
ATOM    210  CG2 ILE A  13       3.683  10.534  -1.885  1.00 17.08           C
ATOM    211  CD1 ILE A  13       2.871   7.642  -3.121  1.00 16.46           C
ATOM      0  H   ILE A  13       2.032   9.372   0.537  1.00 10.42           H   new
ATOM      0  HA  ILE A  13       1.539  11.610  -1.314  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       1.901   9.976  -3.060  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       3.032   8.111  -1.024  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       1.382   7.968  -1.598  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       4.387  10.097  -2.593  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13       3.596  11.604  -2.073  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       4.043  10.373  -0.869  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       2.905   6.566  -2.949  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.195   7.856  -3.949  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       3.870   8.002  -3.366  1.00 16.46           H   new
ATOM    223  N   THR A  14      -0.712  10.697  -2.047  1.00  9.39           N
ATOM    224  CA  THR A  14      -2.138  10.604  -2.095  1.00  9.63           C
ATOM    225  C   THR A  14      -2.475  10.019  -3.424  1.00 11.20           C
ATOM    226  O   THR A  14      -2.443  10.727  -4.429  1.00 11.63           O
ATOM    227  CB  THR A  14      -2.826  11.933  -2.001  1.00 10.38           C
ATOM    228  OG1 THR A  14      -2.589  12.566  -0.752  1.00 16.30           O
ATOM    229  CG2 THR A  14      -4.362  11.892  -2.044  1.00 11.66           C
ATOM      0  H   THR A  14      -0.306  11.209  -2.830  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -2.472  10.007  -1.246  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -2.415  12.447  -2.869  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -3.143  12.146  -0.062  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -4.755  12.906  -1.969  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -4.688  11.445  -2.983  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -4.734  11.296  -1.210  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -2.895   8.742  -3.469  1.00  8.29           N
ATOM    238  CA  LEU A  15      -3.009   8.015  -4.695  1.00  9.03           C
ATOM    239  C   LEU A  15      -4.373   7.446  -4.883  1.00  8.59           C
ATOM    240  O   LEU A  15      -5.069   7.203  -3.898  1.00  7.79           O
ATOM    241  CB  LEU A  15      -2.159   6.734  -4.674  1.00 11.08           C
ATOM    242  CG  LEU A  15      -0.636   6.953  -4.696  1.00 15.79           C
ATOM    243  CD1 LEU A  15       0.119   5.621  -4.553  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -0.213   7.607  -6.022  1.00 15.88           C
ATOM      0  H   LEU A  15      -3.159   8.206  -2.642  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -2.719   8.738  -5.457  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -2.414   6.163  -3.781  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -2.434   6.122  -5.533  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -0.387   7.602  -3.856  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15       1.193   5.808  -4.572  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -0.151   5.149  -3.608  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -0.149   4.960  -5.378  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15       0.867   7.757  -6.026  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -0.492   6.959  -6.853  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -0.713   8.570  -6.129  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -4.854   7.399  -6.139  1.00 11.04           N
ATOM    257  CA  GLU A  16      -6.203   7.058  -6.467  1.00 11.50           C
ATOM    258  C   GLU A  16      -6.501   5.654  -6.869  1.00 10.13           C
ATOM    259  O   GLU A  16      -6.359   5.243  -8.020  1.00  9.83           O
ATOM    260  CB  GLU A  16      -6.651   7.932  -7.650  1.00 17.22           C
ATOM    261  CG  GLU A  16      -6.616   9.429  -7.335  1.00 23.33           C
ATOM    262  CD  GLU A  16      -7.567  10.107  -8.311  1.00 26.99           C
ATOM    263  OE1 GLU A  16      -8.813  10.038  -8.134  1.00 28.90           O
ATOM    264  OE2 GLU A  16      -7.039  10.654  -9.316  1.00 28.86           O
ATOM      0  H   GLU A  16      -4.281   7.607  -6.957  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -6.729   7.215  -5.525  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -6.008   7.732  -8.507  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -7.664   7.651  -7.939  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -6.922   9.614  -6.305  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -5.606   9.823  -7.443  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -7.135   4.905  -5.949  1.00  8.99           N
ATOM    272  CA  VAL A  17      -7.338   3.490  -5.972  1.00  8.85           C
ATOM    273  C   VAL A  17      -8.797   3.228  -5.821  1.00  8.04           C
ATOM    274  O   VAL A  17      -9.595   4.060  -5.391  1.00  8.99           O
ATOM    275  CB  VAL A  17      -6.604   2.722  -4.913  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -5.100   3.045  -4.878  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -7.075   3.062  -3.488  1.00 10.54           C
ATOM      0  H   VAL A  17      -7.541   5.330  -5.115  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -6.936   3.141  -6.923  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -6.804   1.684  -5.180  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -4.620   2.460  -4.093  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -4.652   2.797  -5.840  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -4.961   4.107  -4.676  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -6.507   2.474  -2.767  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -6.917   4.123  -3.296  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -8.135   2.829  -3.390  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -9.376   2.062  -6.157  1.00  7.29           N
ATOM    288  CA  GLU A  18     -10.702   1.647  -5.821  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.572   0.654  -4.718  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.488   0.133  -4.458  1.00  5.28           O
ATOM    291  CB  GLU A  18     -11.464   0.927  -6.947  1.00 10.28           C
ATOM    292  CG  GLU A  18     -12.229   1.946  -7.794  1.00 12.65           C
ATOM    293  CD  GLU A  18     -13.678   2.173  -7.389  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -14.559   1.434  -7.903  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -13.924   2.988  -6.460  1.00 18.17           O
ATOM      0  H   GLU A  18      -8.880   1.358  -6.704  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -11.259   2.552  -5.578  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -10.765   0.372  -7.573  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -12.157   0.201  -6.522  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -11.703   2.900  -7.748  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -12.207   1.619  -8.834  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.595   0.223  -4.042  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.400  -0.818  -3.075  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.294  -2.108  -3.812  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.839  -3.140  -3.321  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.737  -0.877  -2.338  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.170   0.597  -2.378  1.00  8.16           C
ATOM    308  CD  PRO A  19     -12.733   1.087  -3.768  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.530  -0.652  -2.439  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -13.453  -1.529  -2.838  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.628  -1.246  -1.318  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.247   0.699  -2.241  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -12.692   1.173  -1.585  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.523   0.971  -4.510  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -12.454   2.141  -3.761  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.731  -2.158  -5.083  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.539  -3.305  -5.917  1.00  6.28           C
ATOM    318  C   SER A  20     -10.141  -3.422  -6.419  1.00  8.45           C
ATOM    319  O   SER A  20      -9.755  -4.465  -6.944  1.00  7.26           O
ATOM    320  CB  SER A  20     -12.511  -3.322  -7.109  1.00  8.57           C
ATOM    321  OG  SER A  20     -13.816  -3.023  -6.637  1.00 11.13           O
ATOM      0  H   SER A  20     -12.225  -1.391  -5.539  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.747  -4.164  -5.279  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -12.204  -2.592  -7.858  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -12.499  -4.299  -7.593  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -14.445  -3.029  -7.388  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -9.218  -2.466  -6.210  1.00  7.50           N
ATOM    328  CA  ASP A  21      -7.843  -2.589  -6.581  1.00  7.70           C
ATOM    329  C   ASP A  21      -7.150  -3.458  -5.588  1.00  7.08           C
ATOM    330  O   ASP A  21      -7.486  -3.460  -4.404  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.127  -1.232  -6.680  1.00 11.00           C
ATOM    332  CG  ASP A  21      -7.506  -0.468  -7.941  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -7.500  -1.103  -9.029  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -7.719   0.772  -7.867  1.00 14.36           O
ATOM      0  H   ASP A  21      -9.438  -1.574  -5.766  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -7.807  -3.034  -7.575  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.373  -0.630  -5.805  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.049  -1.391  -6.665  1.00 11.00           H   new
ATOM    339  N   THR A  22      -6.175  -4.263  -6.045  1.00  5.37           N
ATOM    340  CA  THR A  22      -5.268  -5.163  -5.403  1.00  6.01           C
ATOM    341  C   THR A  22      -4.150  -4.414  -4.761  1.00  8.01           C
ATOM    342  O   THR A  22      -3.709  -3.362  -5.221  1.00  8.11           O
ATOM    343  CB  THR A  22      -4.832  -6.375  -6.171  1.00  8.92           C
ATOM    344  OG1 THR A  22      -4.425  -5.981  -7.472  1.00 10.22           O
ATOM    345  CG2 THR A  22      -5.924  -7.453  -6.280  1.00  9.65           C
ATOM      0  H   THR A  22      -5.999  -4.278  -7.050  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.865  -5.638  -4.624  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -4.004  -6.821  -5.620  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -4.137  -6.770  -7.978  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -5.542  -8.302  -6.848  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -6.210  -7.783  -5.281  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -6.795  -7.039  -6.788  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -3.574  -4.977  -3.683  1.00  8.32           N
ATOM    354  CA  ILE A  23      -2.434  -4.377  -3.064  1.00  9.92           C
ATOM    355  C   ILE A  23      -1.243  -4.329  -3.958  1.00 10.01           C
ATOM    356  O   ILE A  23      -0.547  -3.316  -3.987  1.00  8.71           O
ATOM    357  CB  ILE A  23      -2.202  -5.074  -1.756  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -3.409  -4.712  -0.875  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.881  -4.723  -1.050  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -3.676  -5.632   0.316  1.00 12.30           C
ATOM      0  H   ILE A  23      -3.895  -5.840  -3.244  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.627  -3.323  -2.865  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -2.109  -6.144  -1.940  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -3.267  -3.698  -0.500  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -4.300  -4.698  -1.503  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23      -0.809  -5.279  -0.115  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23      -0.043  -4.988  -1.694  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.854  -3.654  -0.840  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -4.550  -5.277   0.861  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -3.858  -6.646  -0.041  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -2.810  -5.631   0.978  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -1.026  -5.396  -4.748  1.00  9.54           N
ATOM    373  CA  GLU A  24      -0.143  -5.617  -5.851  1.00 11.81           C
ATOM    374  C   GLU A  24      -0.140  -4.509  -6.848  1.00 11.14           C
ATOM    375  O   GLU A  24       0.888  -4.065  -7.357  1.00 10.62           O
ATOM    376  CB  GLU A  24      -0.516  -6.951  -6.519  1.00 19.24           C
ATOM    377  CG  GLU A  24       0.514  -7.517  -7.498  1.00 27.76           C
ATOM    378  CD  GLU A  24       0.244  -8.969  -7.867  1.00 32.92           C
ATOM    379  OE1 GLU A  24      -0.845  -9.159  -8.473  1.00 34.80           O
ATOM    380  OE2 GLU A  24       1.153  -9.829  -7.721  1.00 36.51           O
ATOM      0  H   GLU A  24      -1.567  -6.243  -4.576  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       0.873  -5.653  -5.458  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24      -0.691  -7.690  -5.737  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -1.459  -6.819  -7.049  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       0.518  -6.912  -8.404  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       1.508  -7.438  -7.058  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -1.301  -3.975  -7.266  1.00  9.43           N
ATOM    388  CA  ASN A  25      -1.400  -2.842  -8.134  1.00 10.96           C
ATOM    389  C   ASN A  25      -1.090  -1.540  -7.479  1.00  9.68           C
ATOM    390  O   ASN A  25      -0.706  -0.581  -8.147  1.00  9.33           O
ATOM    391  CB  ASN A  25      -2.783  -2.875  -8.806  1.00 16.78           C
ATOM    392  CG  ASN A  25      -2.743  -3.676 -10.100  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -2.609  -3.098 -11.177  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -2.951  -5.018 -10.029  1.00 24.70           N
ATOM      0  H   ASN A  25      -2.209  -4.348  -6.988  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -0.623  -2.917  -8.895  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -3.512  -3.314  -8.125  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -3.114  -1.858  -9.014  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -2.999  -5.573 -10.884  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -3.059  -5.470  -9.121  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -1.209  -1.413  -6.145  1.00  6.52           N
ATOM    402  CA  VAL A  26      -0.806  -0.219  -5.469  1.00  5.53           C
ATOM    403  C   VAL A  26       0.675  -0.064  -5.518  1.00  4.42           C
ATOM    404  O   VAL A  26       1.231   0.979  -5.856  1.00  3.40           O
ATOM    405  CB  VAL A  26      -1.268  -0.174  -4.042  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -0.849   1.113  -3.312  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -2.798  -0.225  -3.897  1.00  8.12           C
ATOM      0  H   VAL A  26      -1.585  -2.138  -5.534  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -1.283   0.608  -5.995  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -0.796  -1.055  -3.607  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.213   1.084  -2.285  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26       0.238   1.192  -3.309  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.274   1.976  -3.824  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.065  -0.189  -2.841  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -3.241   0.627  -4.412  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.174  -1.150  -4.335  1.00  8.12           H   new
ATOM    417  N   LYS A  27       1.360  -1.189  -5.245  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.777  -1.345  -5.354  1.00  4.14           C
ATOM    419  C   LYS A  27       3.320  -1.025  -6.704  1.00  5.58           C
ATOM    420  O   LYS A  27       4.391  -0.430  -6.807  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.152  -2.747  -4.845  1.00  3.97           C
ATOM    422  CG  LYS A  27       2.829  -3.118  -3.397  1.00  7.45           C
ATOM    423  CD  LYS A  27       3.401  -4.459  -2.933  1.00  9.02           C
ATOM    424  CE  LYS A  27       3.152  -4.590  -1.429  1.00 12.90           C
ATOM    425  NZ  LYS A  27       3.538  -5.869  -0.791  1.00 15.47           N
ATOM      0  H   LYS A  27       0.896  -2.040  -4.929  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       3.262  -0.601  -4.722  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       2.659  -3.475  -5.490  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.226  -2.873  -4.986  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.207  -2.332  -2.743  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       1.746  -3.140  -3.276  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       2.927  -5.281  -3.470  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       4.468  -4.512  -3.148  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       3.688  -3.785  -0.926  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       2.090  -4.428  -1.246  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       2.924  -6.047   0.029  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       3.434  -6.644  -1.476  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       4.528  -5.815  -0.477  1.00 15.47           H   new
ATOM    439  N   ALA A  28       2.662  -1.399  -7.816  1.00  6.61           N
ATOM    440  CA  ALA A  28       2.943  -0.943  -9.142  1.00  7.74           C
ATOM    441  C   ALA A  28       2.989   0.530  -9.361  1.00  9.17           C
ATOM    442  O   ALA A  28       3.852   1.115 -10.014  1.00 11.45           O
ATOM    443  CB  ALA A  28       2.020  -1.610 -10.175  1.00  7.68           C
ATOM      0  H   ALA A  28       1.886  -2.061  -7.787  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       3.975  -1.261  -9.288  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       2.262  -1.240 -11.171  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       2.161  -2.690 -10.145  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       0.982  -1.373  -9.942  1.00  7.68           H   new
ATOM    449  N   LYS A  29       2.059   1.307  -8.777  1.00  8.96           N
ATOM    450  CA  LYS A  29       1.878   2.725  -8.800  1.00  7.90           C
ATOM    451  C   LYS A  29       2.753   3.516  -7.890  1.00  6.92           C
ATOM    452  O   LYS A  29       2.896   4.735  -7.969  1.00  6.87           O
ATOM    453  CB  LYS A  29       0.389   2.977  -8.509  1.00 10.28           C
ATOM    454  CG  LYS A  29      -0.108   4.423  -8.564  1.00 14.94           C
ATOM    455  CD  LYS A  29       0.110   5.146  -9.895  1.00 19.69           C
ATOM    456  CE  LYS A  29      -0.639   4.428 -11.019  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -0.350   5.136 -12.287  1.00 24.98           N
ATOM      0  H   LYS A  29       1.333   0.872  -8.208  1.00  8.96           H   new
ATOM      0  HA  LYS A  29       2.184   3.083  -9.783  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -0.196   2.393  -9.220  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29       0.169   2.584  -7.517  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -1.174   4.431  -8.337  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29       0.390   4.990  -7.777  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -0.237   6.176  -9.818  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29       1.175   5.185 -10.125  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -0.323   3.387 -11.083  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -1.711   4.424 -10.821  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -0.736   4.591 -13.085  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -0.790   6.078 -12.267  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29       0.679   5.237 -12.402  1.00 24.98           H   new
ATOM    471  N   ILE A  30       3.404   2.825  -6.937  1.00  4.57           N
ATOM    472  CA  ILE A  30       4.462   3.357  -6.135  1.00  5.58           C
ATOM    473  C   ILE A  30       5.772   3.161  -6.817  1.00  7.26           C
ATOM    474  O   ILE A  30       6.634   4.038  -6.785  1.00  9.46           O
ATOM    475  CB  ILE A  30       4.326   2.712  -4.788  1.00  5.36           C
ATOM    476  CG1 ILE A  30       3.032   3.256  -4.159  1.00  2.94           C
ATOM    477  CG2 ILE A  30       5.528   3.059  -3.893  1.00  2.78           C
ATOM    478  CD1 ILE A  30       2.719   2.671  -2.782  1.00  2.00           C
ATOM      0  H   ILE A  30       3.184   1.854  -6.716  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       4.405   4.437  -5.996  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       4.293   1.627  -4.887  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       3.109   4.340  -4.073  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       2.198   3.048  -4.829  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       5.408   2.581  -2.921  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       6.445   2.703  -4.362  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       5.583   4.140  -3.761  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       1.792   3.104  -2.405  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.608   1.590  -2.863  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       3.533   2.902  -2.095  1.00  2.00           H   new
ATOM    490  N   GLN A  31       5.939   2.153  -7.693  1.00  7.06           N
ATOM    491  CA  GLN A  31       6.990   2.048  -8.657  1.00  8.67           C
ATOM    492  C   GLN A  31       7.012   3.098  -9.714  1.00 10.90           C
ATOM    493  O   GLN A  31       7.984   3.810  -9.961  1.00  9.63           O
ATOM    494  CB  GLN A  31       7.093   0.637  -9.259  1.00  9.12           C
ATOM    495  CG  GLN A  31       8.233   0.334 -10.232  1.00 10.76           C
ATOM    496  CD  GLN A  31       8.333  -1.124 -10.657  1.00 13.78           C
ATOM    497  OE1 GLN A  31       9.293  -1.843 -10.383  1.00 14.48           O
ATOM    498  NE2 GLN A  31       7.355  -1.657 -11.437  1.00 14.76           N
ATOM      0  H   GLN A  31       5.298   1.361  -7.729  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       7.888   2.240  -8.070  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       7.167  -0.070  -8.433  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       6.155   0.428  -9.774  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       8.107   0.950 -11.122  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       9.175   0.630  -9.771  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       6.541  -1.096 -11.689  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       7.435  -2.618 -11.770  1.00 14.76           H   new
ATOM    507  N   ASP A  32       5.862   3.362 -10.360  1.00 10.93           N
ATOM    508  CA  ASP A  32       5.591   4.597 -11.028  1.00 14.01           C
ATOM    509  C   ASP A  32       5.971   5.889 -10.389  1.00 14.04           C
ATOM    510  O   ASP A  32       6.678   6.703 -10.980  1.00 13.39           O
ATOM    511  CB  ASP A  32       4.068   4.538 -11.233  1.00 18.01           C
ATOM    512  CG  ASP A  32       3.635   5.318 -12.466  1.00 24.33           C
ATOM    513  OD1 ASP A  32       4.430   5.728 -13.353  1.00 25.17           O
ATOM    514  OD2 ASP A  32       2.401   5.565 -12.532  1.00 26.29           O
ATOM      0  H   ASP A  32       5.095   2.693 -10.419  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       6.225   4.638 -11.914  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       3.754   3.499 -11.331  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       3.567   4.941 -10.353  1.00 18.01           H   new
ATOM    519  N   LYS A  33       5.568   6.101  -9.123  1.00 14.22           N
ATOM    520  CA  LYS A  33       5.631   7.400  -8.528  1.00 14.00           C
ATOM    521  C   LYS A  33       6.932   7.616  -7.835  1.00 12.37           C
ATOM    522  O   LYS A  33       7.786   8.360  -8.314  1.00 12.17           O
ATOM    523  CB  LYS A  33       4.406   7.465  -7.600  1.00 18.62           C
ATOM    524  CG  LYS A  33       4.296   8.745  -6.770  1.00 24.00           C
ATOM    525  CD  LYS A  33       4.094   9.998  -7.624  1.00 27.61           C
ATOM    526  CE  LYS A  33       2.765  10.026  -8.383  1.00 27.64           C
ATOM    527  NZ  LYS A  33       2.828  11.151  -9.342  1.00 30.06           N
ATOM      0  H   LYS A  33       5.199   5.373  -8.512  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       5.594   8.208  -9.259  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       3.505   7.362  -8.204  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       4.435   6.611  -6.923  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       3.463   8.649  -6.074  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       5.200   8.862  -6.172  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       4.152  10.877  -6.981  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33       4.912  10.072  -8.341  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33       2.602   9.084  -8.906  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33       1.931  10.156  -7.693  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33       1.938  11.201  -9.878  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33       2.970  12.041  -8.824  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33       3.620  11.003 -10.000  1.00 30.06           H   new
ATOM    541  N   GLU A  34       7.196   6.901  -6.727  1.00 10.11           N
ATOM    542  CA  GLU A  34       8.360   7.045  -5.908  1.00 10.07           C
ATOM    543  C   GLU A  34       9.504   6.220  -6.387  1.00  9.32           C
ATOM    544  O   GLU A  34      10.643   6.663  -6.247  1.00 11.61           O
ATOM    545  CB  GLU A  34       8.016   6.676  -4.455  1.00 14.77           C
ATOM    546  CG  GLU A  34       6.924   7.567  -3.861  1.00 18.75           C
ATOM    547  CD  GLU A  34       7.371   9.009  -3.668  1.00 22.28           C
ATOM    548  OE1 GLU A  34       8.196   9.246  -2.746  1.00 25.19           O
ATOM    549  OE2 GLU A  34       6.972   9.927  -4.435  1.00 21.95           O
ATOM      0  H   GLU A  34       6.560   6.181  -6.383  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       8.674   8.087  -5.967  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       7.692   5.636  -4.416  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       8.915   6.753  -3.843  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       6.052   7.547  -4.514  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.612   7.158  -2.900  1.00 18.75           H   new
ATOM    556  N   GLY A  35       9.235   5.027  -6.945  1.00  7.22           N
ATOM    557  CA  GLY A  35      10.207   4.180  -7.564  1.00  6.29           C
ATOM    558  C   GLY A  35      11.030   3.348  -6.642  1.00  6.93           C
ATOM    559  O   GLY A  35      12.258   3.387  -6.696  1.00  7.41           O
ATOM      0  H   GLY A  35       8.294   4.634  -6.966  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       9.692   3.516  -8.258  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35      10.878   4.802  -8.156  1.00  6.29           H   new
ATOM    563  N   ILE A  36      10.260   2.423  -6.041  1.00  5.86           N
ATOM    564  CA  ILE A  36      10.794   1.289  -5.352  1.00  6.07           C
ATOM    565  C   ILE A  36      10.188   0.025  -5.856  1.00  6.36           C
ATOM    566  O   ILE A  36       8.983   0.068  -6.099  1.00  6.18           O
ATOM    567  CB  ILE A  36      10.719   1.459  -3.864  1.00  7.47           C
ATOM    568  CG1 ILE A  36      11.161   0.246  -3.027  1.00  8.52           C
ATOM    569  CG2 ILE A  36       9.337   2.042  -3.525  1.00  7.36           C
ATOM    570  CD1 ILE A  36      11.161   0.663  -1.557  1.00  9.49           C
ATOM      0  H   ILE A  36       9.241   2.464  -6.034  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      11.859   1.215  -5.573  1.00  6.07           H   new
ATOM      0  HB  ILE A  36      11.484   2.171  -3.554  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36      10.484  -0.593  -3.185  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36      12.155  -0.084  -3.330  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       9.254   2.177  -2.447  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.217   3.005  -4.021  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36       8.560   1.358  -3.866  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36      11.471  -0.180  -0.940  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36      11.854   1.492  -1.414  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36      10.158   0.975  -1.267  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.863  -1.044  -6.160  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.292  -2.199  -6.789  1.00  9.18           C
ATOM    584  C   PRO A  37       9.455  -3.020  -5.869  1.00  9.85           C
ATOM    585  O   PRO A  37       9.559  -2.843  -4.657  1.00  8.51           O
ATOM    586  CB  PRO A  37      11.409  -3.077  -7.348  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.689  -2.532  -6.693  1.00  9.27           C
ATOM    588  CD  PRO A  37      12.315  -1.118  -6.221  1.00  8.33           C
ATOM      0  HA  PRO A  37       9.640  -1.831  -7.581  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      11.251  -4.126  -7.099  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      11.460  -3.011  -8.435  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      13.004  -3.158  -5.858  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      13.517  -2.507  -7.402  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      12.750  -0.913  -5.243  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      12.708  -0.369  -6.908  1.00  8.33           H   new
ATOM    596  N   PRO A  38       8.552  -3.799  -6.387  1.00  8.71           N
ATOM    597  CA  PRO A  38       7.391  -4.162  -5.627  1.00  9.08           C
ATOM    598  C   PRO A  38       7.659  -5.135  -4.531  1.00  9.28           C
ATOM    599  O   PRO A  38       6.808  -5.093  -3.644  1.00  6.50           O
ATOM    600  CB  PRO A  38       6.417  -4.764  -6.637  1.00 10.31           C
ATOM    601  CG  PRO A  38       6.760  -4.056  -7.958  1.00 10.81           C
ATOM    602  CD  PRO A  38       8.286  -3.958  -7.808  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.001  -3.279  -5.121  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       6.544  -5.843  -6.719  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       5.381  -4.586  -6.347  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       6.462  -4.634  -8.832  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       6.285  -3.079  -8.045  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       8.772  -4.853  -8.196  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.678  -3.112  -8.373  1.00 12.00           H   new
ATOM    610  N   ASP A  39       8.823  -5.809  -4.547  1.00 11.20           N
ATOM    611  CA  ASP A  39       9.249  -6.834  -3.645  1.00 14.96           C
ATOM    612  C   ASP A  39       9.925  -6.135  -2.516  1.00 13.99           C
ATOM    613  O   ASP A  39      10.112  -6.655  -1.418  1.00 13.75           O
ATOM    614  CB  ASP A  39      10.223  -7.879  -4.215  1.00 24.16           C
ATOM    615  CG  ASP A  39       9.483  -8.920  -5.042  1.00 31.06           C
ATOM    616  OD1 ASP A  39       8.643  -9.708  -4.531  1.00 35.55           O
ATOM    617  OD2 ASP A  39       9.667  -8.959  -6.288  1.00 34.22           O
ATOM      0  H   ASP A  39       9.529  -5.617  -5.257  1.00 11.20           H   new
ATOM      0  HA  ASP A  39       8.361  -7.404  -3.371  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      10.972  -7.384  -4.833  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      10.755  -8.368  -3.399  1.00 24.16           H   new
ATOM    622  N   GLN A  40      10.331  -4.864  -2.685  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.009  -4.151  -1.648  1.00 10.76           C
ATOM    624  C   GLN A  40       9.924  -3.508  -0.855  1.00  8.01           C
ATOM    625  O   GLN A  40      10.107  -3.121   0.297  1.00  8.96           O
ATOM    626  CB  GLN A  40      12.037  -3.163  -2.224  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.262  -3.810  -2.875  1.00 14.85           C
ATOM    628  CD  GLN A  40      14.521  -2.958  -2.936  1.00 16.11           C
ATOM    629  OE1 GLN A  40      14.514  -1.852  -3.474  1.00 20.52           O
ATOM    630  NE2 GLN A  40      15.707  -3.425  -2.462  1.00 18.16           N
ATOM      0  H   GLN A  40      10.189  -4.329  -3.542  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      11.610  -4.798  -1.009  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.540  -2.535  -2.964  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      12.375  -2.505  -1.423  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.495  -4.726  -2.332  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.996  -4.101  -3.891  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      15.751  -4.338  -2.010  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      16.552  -2.862  -2.559  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.745  -3.197  -1.424  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.670  -2.501  -0.790  1.00  3.87           C
ATOM    641  C   GLN A  41       6.889  -3.400   0.106  1.00  4.79           C
ATOM    642  O   GLN A  41       6.116  -4.271  -0.290  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.738  -2.003  -1.907  1.00  4.20           C
ATOM    644  CG  GLN A  41       7.239  -0.755  -2.638  1.00  3.20           C
ATOM    645  CD  GLN A  41       6.165  -0.308  -3.619  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.982  -0.221  -3.293  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.495  -0.200  -4.934  1.00  7.13           N
ATOM      0  H   GLN A  41       8.531  -3.449  -2.389  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.071  -1.687  -0.186  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.601  -2.804  -2.633  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.759  -1.790  -1.479  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.456   0.040  -1.925  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       8.168  -0.972  -3.166  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       7.471  -0.270  -5.222  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.767  -0.049  -5.632  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.067  -3.124   1.410  1.00  5.73           N
ATOM    657  CA  ARG A  42       6.361  -3.751   2.484  1.00  6.97           C
ATOM    658  C   ARG A  42       5.310  -2.762   2.854  1.00  7.15           C
ATOM    659  O   ARG A  42       5.530  -1.726   3.479  1.00  7.33           O
ATOM    660  CB  ARG A  42       7.235  -4.200   3.666  1.00 13.23           C
ATOM    661  CG  ARG A  42       6.504  -5.218   4.543  1.00 21.27           C
ATOM    662  CD  ARG A  42       7.183  -5.337   5.909  1.00 26.14           C
ATOM    663  NE  ARG A  42       6.751  -6.682   6.383  1.00 32.26           N
ATOM    664  CZ  ARG A  42       7.166  -7.216   7.569  1.00 34.32           C
ATOM    665  NH1 ARG A  42       7.993  -6.513   8.397  1.00 35.30           N
ATOM    666  NH2 ARG A  42       6.709  -8.452   7.925  1.00 36.39           N
ATOM      0  H   ARG A  42       7.739  -2.427   1.732  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       5.940  -4.706   2.170  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       8.160  -4.638   3.291  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       7.513  -3.333   4.266  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       5.465  -4.915   4.672  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       6.494  -6.190   4.050  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       8.268  -5.267   5.828  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       6.863  -4.548   6.589  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       6.119  -7.227   5.797  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.307  -5.579   8.132  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42       8.297  -6.921   9.281  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       6.071  -8.957   7.310  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42       7.006  -8.871   8.806  1.00 36.39           H   new
ATOM    680  N   LEU A  43       4.052  -3.027   2.459  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.927  -2.193   2.749  1.00  3.51           C
ATOM    682  C   LEU A  43       2.226  -2.719   3.954  1.00  5.56           C
ATOM    683  O   LEU A  43       2.083  -3.930   4.120  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.906  -2.144   1.601  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.254  -0.958   0.686  1.00  6.32           C
ATOM    686  CD1 LEU A  43       1.417  -1.032  -0.603  1.00  6.41           C
ATOM    687  CD2 LEU A  43       2.030   0.464   1.227  1.00  9.55           C
ATOM      0  H   LEU A  43       3.809  -3.855   1.916  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       3.314  -1.186   2.906  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       1.926  -3.076   1.036  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.897  -2.033   1.997  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       3.329  -1.082   0.558  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.667  -0.190  -1.248  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.633  -1.965  -1.124  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.357  -0.994  -0.351  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       2.320   1.192   0.469  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       0.977   0.598   1.474  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       2.634   0.612   2.122  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.775  -1.778   4.802  1.00  4.58           N
ATOM    700  CA  ILE A  44       1.200  -2.033   6.086  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.021  -1.190   6.214  1.00  5.46           C
ATOM    702  O   ILE A  44      -0.094  -0.029   5.815  1.00  6.04           O
ATOM    703  CB  ILE A  44       2.136  -1.715   7.215  1.00  6.80           C
ATOM    704  CG1 ILE A  44       3.579  -2.240   7.144  1.00 10.31           C
ATOM    705  CG2 ILE A  44       1.613  -1.862   8.654  1.00  7.39           C
ATOM    706  CD1 ILE A  44       3.676  -3.731   7.466  1.00 13.90           C
ATOM      0  H   ILE A  44       1.814  -0.784   4.579  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       0.971  -3.097   6.152  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       2.177  -0.649   6.990  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       3.979  -2.060   6.146  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       4.201  -1.680   7.842  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       2.403  -1.597   9.357  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       0.760  -1.200   8.801  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       1.305  -2.893   8.826  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       4.716  -4.050   7.401  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       3.303  -3.910   8.474  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       3.078  -4.297   6.752  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.014  -1.745   6.932  1.00  6.75           N
ATOM    719  CA  PHE A  45      -2.172  -1.081   7.445  1.00  4.70           C
ATOM    720  C   PHE A  45      -2.154  -1.280   8.922  1.00  6.34           C
ATOM    721  O   PHE A  45      -2.475  -2.368   9.397  1.00  5.45           O
ATOM    722  CB  PHE A  45      -3.417  -1.602   6.709  1.00  5.51           C
ATOM    723  CG  PHE A  45      -4.693  -0.886   6.989  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -4.797   0.460   7.247  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -5.842  -1.641   6.947  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -6.022   0.985   7.586  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -7.077  -1.085   7.180  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -7.170   0.229   7.575  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.005  -2.736   7.172  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -2.186  -0.005   7.269  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.226  -1.555   5.637  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -3.551  -2.653   6.964  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -3.927   1.097   7.184  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -5.772  -2.696   6.726  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -6.084   2.025   7.870  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -7.971  -1.678   7.053  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -8.118   0.655   7.868  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -1.810  -0.327   9.807  1.00  6.53           N
ATOM    739  CA  ALA A  46      -1.874  -0.339  11.235  1.00  7.15           C
ATOM    740  C   ALA A  46      -1.109  -1.451  11.866  1.00  9.00           C
ATOM    741  O   ALA A  46       0.115  -1.328  11.891  1.00 11.15           O
ATOM    742  CB  ALA A  46      -3.368  -0.447  11.585  1.00  8.99           C
ATOM      0  H   ALA A  46      -1.441   0.563   9.473  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -1.411   0.567  11.625  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -3.488  -0.461  12.668  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -3.901   0.409  11.172  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -3.775  -1.366  11.163  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -1.664  -2.570  12.363  1.00  9.35           N
ATOM    749  CA  GLY A  47      -0.965  -3.731  12.821  1.00 11.68           C
ATOM    750  C   GLY A  47      -0.737  -4.741  11.749  1.00 11.14           C
ATOM    751  O   GLY A  47       0.177  -5.557  11.857  1.00 13.93           O
ATOM      0  H   GLY A  47      -2.675  -2.670  12.451  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47      -0.004  -3.428  13.236  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47      -1.531  -4.192  13.631  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -1.594  -4.729  10.713  1.00 10.47           N
ATOM    756  CA  LYS A  48      -1.619  -5.707   9.670  1.00  8.82           C
ATOM    757  C   LYS A  48      -0.636  -5.437   8.583  1.00  7.68           C
ATOM    758  O   LYS A  48      -0.544  -4.348   8.020  1.00  6.47           O
ATOM    759  CB  LYS A  48      -3.041  -5.699   9.084  1.00  9.74           C
ATOM    760  CG  LYS A  48      -4.223  -5.983  10.013  1.00 14.14           C
ATOM    761  CD  LYS A  48      -5.568  -5.531   9.441  1.00 16.32           C
ATOM    762  CE  LYS A  48      -6.652  -5.674  10.511  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -7.971  -5.128  10.120  1.00 23.92           N
ATOM      0  H   LYS A  48      -2.302  -4.004  10.597  1.00 10.47           H   new
ATOM      0  HA  LYS A  48      -1.344  -6.673  10.093  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -3.205  -4.722   8.630  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -3.070  -6.433   8.279  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -4.265  -7.053  10.219  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -4.055  -5.482  10.966  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -5.504  -4.495   9.109  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -5.823  -6.130   8.567  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -6.767  -6.730  10.756  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -6.318  -5.171  11.419  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -8.648  -5.264  10.898  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -7.879  -4.113   9.915  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -8.314  -5.623   9.272  1.00 23.92           H   new
ATOM    777  N   GLN A  49       0.087  -6.458   8.089  1.00  8.89           N
ATOM    778  CA  GLN A  49       0.784  -6.397   6.842  1.00  7.18           C
ATOM    779  C   GLN A  49      -0.148  -6.591   5.695  1.00  8.23           C
ATOM    780  O   GLN A  49      -1.120  -7.333   5.823  1.00  9.70           O
ATOM    781  CB  GLN A  49       1.854  -7.502   6.825  1.00 11.67           C
ATOM    782  CG  GLN A  49       2.726  -7.564   5.570  1.00 15.82           C
ATOM    783  CD  GLN A  49       3.835  -8.607   5.574  1.00 20.21           C
ATOM    784  OE1 GLN A  49       4.927  -8.375   5.059  1.00 23.23           O
ATOM    785  NE2 GLN A  49       3.437  -9.846   5.969  1.00 20.67           N
ATOM      0  H   GLN A  49       0.190  -7.351   8.571  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       1.244  -5.414   6.741  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       2.504  -7.366   7.690  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       1.357  -8.465   6.948  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       2.080  -7.754   4.713  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       3.178  -6.584   5.418  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       2.517  -9.976   6.391  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       4.058 -10.645   5.843  1.00 20.67           H   new
ATOM    794  N   LEU A  50       0.110  -5.954   4.539  1.00  6.51           N
ATOM    795  CA  LEU A  50      -0.858  -5.996   3.487  1.00  7.41           C
ATOM    796  C   LEU A  50      -0.239  -6.844   2.430  1.00  8.27           C
ATOM    797  O   LEU A  50       0.703  -6.320   1.838  1.00  8.34           O
ATOM    798  CB  LEU A  50      -1.086  -4.566   2.968  1.00  7.13           C
ATOM    799  CG  LEU A  50      -1.956  -3.629   3.822  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -2.362  -2.481   2.882  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -3.227  -4.283   4.390  1.00  8.14           C
ATOM      0  H   LEU A  50       0.959  -5.426   4.335  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -1.822  -6.394   3.805  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50      -0.111  -4.096   2.840  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -1.538  -4.636   1.979  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -1.383  -3.314   4.694  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -2.986  -1.771   3.424  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -1.468  -1.975   2.519  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.920  -2.883   2.036  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -3.781  -3.552   4.979  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -3.852  -4.636   3.570  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -2.950  -5.125   5.024  1.00  8.14           H   new
ATOM    813  N   GLU A  51      -0.750  -8.063   2.180  1.00  9.43           N
ATOM    814  CA  GLU A  51      -0.387  -9.045   1.205  1.00 11.90           C
ATOM    815  C   GLU A  51      -0.957  -8.779  -0.146  1.00 11.49           C
ATOM    816  O   GLU A  51      -2.076  -8.294  -0.305  1.00  9.88           O
ATOM    817  CB  GLU A  51      -0.550 -10.522   1.601  1.00 16.56           C
ATOM    818  CG  GLU A  51      -0.071 -10.971   2.983  1.00 26.06           C
ATOM    819  CD  GLU A  51      -0.306 -12.429   3.351  1.00 29.86           C
ATOM    820  OE1 GLU A  51      -1.431 -12.822   3.761  1.00 33.44           O
ATOM    821  OE2 GLU A  51       0.681 -13.212   3.340  1.00 32.13           O
ATOM      0  H   GLU A  51      -1.528  -8.402   2.745  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       0.693  -8.906   1.158  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51      -1.608 -10.770   1.522  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51      -0.025 -11.123   0.858  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       0.998 -10.771   3.053  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51      -0.562 -10.349   3.731  1.00 26.06           H   new
ATOM    828  N   ASP A  52      -0.169  -9.136  -1.176  1.00 12.71           N
ATOM    829  CA  ASP A  52      -0.289  -8.596  -2.494  1.00 16.56           C
ATOM    830  C   ASP A  52      -1.542  -8.810  -3.272  1.00 15.83           C
ATOM    831  O   ASP A  52      -2.127  -7.961  -3.942  1.00 17.21           O
ATOM    832  CB  ASP A  52       0.912  -9.111  -3.304  1.00 21.05           C
ATOM    833  CG  ASP A  52       2.259  -8.940  -2.617  1.00 25.12           C
ATOM    834  OD1 ASP A  52       2.815  -7.810  -2.660  1.00 25.82           O
ATOM    835  OD2 ASP A  52       2.735  -9.861  -1.901  1.00 28.37           O
ATOM      0  H   ASP A  52       0.578  -9.825  -1.088  1.00 12.71           H   new
ATOM      0  HA  ASP A  52      -0.320  -7.518  -2.334  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       0.761 -10.169  -3.521  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       0.938  -8.590  -4.261  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -2.014 -10.067  -3.348  1.00 15.00           N
ATOM    841  CA  GLY A  53      -3.134 -10.419  -4.165  1.00 11.77           C
ATOM    842  C   GLY A  53      -4.478 -10.294  -3.534  1.00 11.10           C
ATOM    843  O   GLY A  53      -5.460 -10.842  -4.033  1.00 11.25           O
ATOM      0  H   GLY A  53      -1.612 -10.851  -2.834  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -3.116  -9.794  -5.058  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -3.006 -11.450  -4.495  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -4.567  -9.580  -2.397  1.00  8.53           N
ATOM    848  CA  ARG A  54      -5.797  -9.180  -1.787  1.00  9.05           C
ATOM    849  C   ARG A  54      -6.152  -7.810  -2.255  1.00  8.96           C
ATOM    850  O   ARG A  54      -5.344  -7.070  -2.814  1.00 11.60           O
ATOM    851  CB  ARG A  54      -5.839  -9.414  -0.267  1.00  7.97           C
ATOM    852  CG  ARG A  54      -5.403 -10.780   0.267  1.00  9.62           C
ATOM    853  CD  ARG A  54      -5.665 -10.975   1.762  1.00 12.20           C
ATOM    854  NE  ARG A  54      -4.635 -11.872   2.357  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -4.566 -13.212   2.109  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -5.586 -13.992   1.646  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -3.432 -13.874   2.481  1.00 25.50           N
ATOM      0  H   ARG A  54      -3.745  -9.268  -1.880  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -6.600  -9.838  -2.121  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -5.212  -8.657   0.204  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -6.860  -9.236   0.069  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -5.925 -11.559  -0.288  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -4.338 -10.911   0.075  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -5.653 -10.010   2.269  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -6.657 -11.401   1.911  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -3.943 -11.462   2.984  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -6.498 -13.578   1.455  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -5.436 -14.989   1.491  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -2.669 -13.367   2.930  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -3.347 -14.876   2.310  1.00 25.50           H   new
ATOM    871  N   THR A  55      -7.438  -7.452  -2.095  1.00  9.05           N
ATOM    872  CA  THR A  55      -7.929  -6.153  -2.437  1.00  9.03           C
ATOM    873  C   THR A  55      -7.864  -5.228  -1.271  1.00  8.15           C
ATOM    874  O   THR A  55      -7.637  -5.588  -0.117  1.00  5.91           O
ATOM    875  CB  THR A  55      -9.322  -6.151  -2.995  1.00 11.15           C
ATOM    876  OG1 THR A  55     -10.339  -6.612  -2.117  1.00 11.95           O
ATOM    877  CG2 THR A  55      -9.414  -7.122  -4.184  1.00 11.71           C
ATOM      0  H   THR A  55      -8.152  -8.077  -1.720  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -7.268  -5.804  -3.230  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -9.489  -5.101  -3.233  1.00 11.15           H   new
ATOM      0  HG1 THR A  55     -11.207  -6.571  -2.571  1.00 11.95           H   new
ATOM      0 HG21 THR A  55     -10.428  -7.114  -4.583  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -8.716  -6.812  -4.962  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -9.163  -8.129  -3.852  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -8.183  -3.948  -1.534  1.00  6.91           N
ATOM    886  CA  LEU A  56      -8.287  -3.038  -0.436  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.573  -3.269   0.279  1.00  8.05           C
ATOM    888  O   LEU A  56      -9.707  -2.965   1.464  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.069  -1.609  -0.964  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.865  -1.434  -1.904  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -6.736  -0.064  -2.591  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.602  -1.685  -1.062  1.00  9.85           C
ATOM      0  H   LEU A  56      -8.361  -3.556  -2.459  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -7.514  -3.201   0.315  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.969  -1.292  -1.490  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -7.945  -0.939  -0.113  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -7.005  -2.140  -2.723  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -5.852  -0.058  -3.228  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -7.622   0.123  -3.198  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -6.643   0.715  -1.834  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.718  -1.571  -1.689  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -5.561  -0.966  -0.244  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.631  -2.696  -0.655  1.00  9.85           H   new
ATOM    904  N   SER A  57     -10.601  -3.820  -0.390  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.906  -4.046   0.151  1.00  9.00           C
ATOM    906  C   SER A  57     -11.946  -5.164   1.136  1.00  9.44           C
ATOM    907  O   SER A  57     -12.622  -5.059   2.158  1.00 10.91           O
ATOM    908  CB  SER A  57     -12.942  -4.385  -0.934  1.00 10.32           C
ATOM    909  OG  SER A  57     -14.209  -4.661  -0.355  1.00 13.59           O
ATOM      0  H   SER A  57     -10.517  -4.124  -1.360  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -12.151  -3.104   0.641  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -13.030  -3.552  -1.632  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -12.604  -5.248  -1.508  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -14.853  -4.873  -1.063  1.00 13.59           H   new
ATOM    915  N   ASP A  58     -11.129  -6.185   0.823  1.00  9.11           N
ATOM    916  CA  ASP A  58     -10.935  -7.285   1.716  1.00  7.91           C
ATOM    917  C   ASP A  58     -10.401  -6.913   3.056  1.00  9.12           C
ATOM    918  O   ASP A  58     -10.776  -7.443   4.101  1.00  8.61           O
ATOM    919  CB  ASP A  58      -9.906  -8.291   1.174  1.00  8.41           C
ATOM    920  CG  ASP A  58     -10.336  -8.949  -0.130  1.00 11.50           C
ATOM    921  OD1 ASP A  58     -11.446  -9.542  -0.176  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -9.507  -8.998  -1.078  1.00 10.05           O
ATOM      0  H   ASP A  58     -10.603  -6.249  -0.048  1.00  9.11           H   new
ATOM      0  HA  ASP A  58     -11.941  -7.696   1.803  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -8.956  -7.780   1.019  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -9.734  -9.064   1.923  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -9.448  -5.967   3.140  1.00  7.97           N
ATOM    928  CA  TYR A  59      -8.812  -5.477   4.323  1.00  8.45           C
ATOM    929  C   TYR A  59      -9.576  -4.395   5.005  1.00 10.98           C
ATOM    930  O   TYR A  59      -9.136  -3.788   5.979  1.00 12.95           O
ATOM    931  CB  TYR A  59      -7.393  -5.019   3.945  1.00  7.94           C
ATOM    932  CG  TYR A  59      -6.494  -6.207   3.964  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -6.130  -6.737   5.180  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -5.883  -6.711   2.840  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -5.151  -7.698   5.271  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -4.913  -7.684   2.879  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -4.596  -8.196   4.116  1.00  6.76           C
ATOM    938  OH  TYR A  59      -3.469  -9.026   4.291  1.00  7.63           O
ATOM      0  H   TYR A  59      -9.092  -5.505   2.303  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -8.770  -6.285   5.053  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -7.394  -4.560   2.956  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -7.039  -4.264   4.647  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -6.621  -6.393   6.078  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -6.181  -6.322   1.877  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -4.823  -8.056   6.236  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -4.423  -8.030   1.981  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -2.756  -8.520   4.734  1.00  7.63           H   new
ATOM    948  N   ASN A  60     -10.756  -4.068   4.447  1.00 12.38           N
ATOM    949  CA  ASN A  60     -11.475  -2.900   4.853  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.766  -1.591   4.811  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.867  -0.847   5.785  1.00 14.26           O
ATOM    952  CB  ASN A  60     -12.248  -3.189   6.150  1.00 19.23           C
ATOM    953  CG  ASN A  60     -13.368  -4.156   5.792  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -13.362  -5.255   6.343  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -14.336  -3.851   4.888  1.00 24.09           N
ATOM      0  H   ASN A  60     -11.212  -4.612   3.715  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -12.191  -2.711   4.053  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -11.590  -3.622   6.903  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -12.653  -2.269   6.572  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -15.060  -4.535   4.665  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -14.339  -2.939   4.432  1.00 24.09           H   new
ATOM    962  N   ILE A  61     -10.113  -1.152   3.720  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.398   0.076   3.563  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.291   1.034   2.852  1.00 13.74           C
ATOM    965  O   ILE A  61     -10.774   0.763   1.754  1.00 14.60           O
ATOM    966  CB  ILE A  61      -8.082  -0.117   2.870  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -7.238  -1.255   3.468  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.402   1.259   2.956  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.937  -1.495   2.704  1.00 11.42           C
ATOM      0  H   ILE A  61     -10.085  -1.712   2.868  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.137   0.482   4.540  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -8.212  -0.440   1.837  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -7.005  -1.021   4.507  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -7.826  -2.173   3.472  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.427   1.214   2.472  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.022   2.003   2.455  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.275   1.537   4.002  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -5.385  -2.309   3.173  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -6.165  -1.759   1.671  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -5.332  -0.589   2.722  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -10.700   2.086   3.584  1.00 13.97           N
ATOM    982  CA  GLN A  62     -11.650   3.073   3.175  1.00 15.52           C
ATOM    983  C   GLN A  62     -10.913   4.312   2.798  1.00 13.94           C
ATOM    984  O   GLN A  62      -9.706   4.426   3.003  1.00 12.15           O
ATOM    985  CB  GLN A  62     -12.736   3.255   4.248  1.00 19.53           C
ATOM    986  CG  GLN A  62     -13.677   2.059   4.406  1.00 26.38           C
ATOM    987  CD  GLN A  62     -14.801   2.214   5.421  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -15.981   2.398   5.127  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -14.410   2.075   6.716  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.342   2.257   4.524  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.199   2.758   2.288  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.254   3.451   5.206  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -13.328   4.137   4.003  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -14.121   1.842   3.434  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -13.081   1.190   4.685  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -13.426   1.923   6.938  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -15.101   2.123   7.465  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -11.596   5.367   2.318  1.00 11.73           N
ATOM    999  CA  LYS A  63     -10.973   6.548   1.808  1.00 11.97           C
ATOM   1000  C   LYS A  63     -10.399   7.410   2.880  1.00 10.41           C
ATOM   1001  O   LYS A  63     -10.851   7.427   4.024  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -11.952   7.368   0.951  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -13.202   7.793   1.724  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -14.162   8.594   0.841  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -15.324   9.204   1.627  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -15.077  10.632   1.931  1.00 25.97           N
ATOM      0  H   LYS A  63     -12.615   5.399   2.284  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -10.147   6.205   1.185  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -11.443   8.256   0.575  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -12.249   6.779   0.083  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -13.711   6.909   2.109  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -12.911   8.394   2.586  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -13.610   9.390   0.342  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -14.559   7.944   0.061  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -16.245   9.106   1.053  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -15.467   8.652   2.556  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -15.882  11.018   2.464  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -14.211  10.721   2.499  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -14.965  11.162   1.043  1.00 25.97           H   new
ATOM   1020  N   GLU A  64      -9.314   8.074   2.446  1.00 10.04           N
ATOM   1021  CA  GLU A  64      -8.438   8.884   3.234  1.00 10.94           C
ATOM   1022  C   GLU A  64      -7.780   8.073   4.296  1.00  9.74           C
ATOM   1023  O   GLU A  64      -7.402   8.631   5.325  1.00  9.42           O
ATOM   1024  CB  GLU A  64      -8.999  10.169   3.867  1.00 18.31           C
ATOM   1025  CG  GLU A  64      -9.241  11.208   2.771  1.00 24.16           C
ATOM   1026  CD  GLU A  64      -9.920  12.500   3.202  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -11.126  12.437   3.561  1.00 32.61           O
ATOM   1028  OE2 GLU A  64      -9.268  13.578   3.177  1.00 31.72           O
ATOM      0  H   GLU A  64      -9.028   8.041   1.468  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -7.736   9.245   2.482  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64      -9.930   9.953   4.392  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64      -8.300  10.559   4.606  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64      -8.281  11.460   2.321  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64      -9.847  10.747   1.991  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -7.710   6.733   4.200  1.00  6.85           N
ATOM   1036  CA  SER A  65      -7.051   6.017   5.248  1.00  6.90           C
ATOM   1037  C   SER A  65      -5.598   6.100   4.925  1.00  4.72           C
ATOM   1038  O   SER A  65      -5.194   6.381   3.798  1.00  3.91           O
ATOM   1039  CB  SER A  65      -7.373   4.514   5.192  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.704   4.167   5.545  1.00 10.56           O
ATOM      0  H   SER A  65      -8.088   6.169   3.439  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -7.349   6.429   6.212  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -7.176   4.154   4.182  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -6.689   3.987   5.857  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -9.269   4.181   4.744  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -4.761   5.860   5.950  1.00  4.48           N
ATOM   1047  CA  THR A  66      -3.354   6.075   5.811  1.00  3.80           C
ATOM   1048  C   THR A  66      -2.745   4.726   5.982  1.00  4.60           C
ATOM   1049  O   THR A  66      -2.877   3.988   6.957  1.00  5.33           O
ATOM   1050  CB  THR A  66      -2.744   7.035   6.789  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -3.385   8.298   6.694  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -1.236   7.198   6.536  1.00  3.40           C
ATOM      0  H   THR A  66      -5.054   5.521   6.866  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -3.165   6.541   4.844  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -2.883   6.631   7.792  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -2.982   8.918   7.337  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -0.819   7.899   7.259  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -0.743   6.232   6.642  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -1.075   7.579   5.527  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -2.038   4.340   4.904  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -1.182   3.195   4.913  1.00  3.85           C
ATOM   1062  C   LEU A  67       0.224   3.657   5.084  1.00  3.80           C
ATOM   1063  O   LEU A  67       0.654   4.716   4.631  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -1.052   2.641   3.484  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -2.415   2.296   2.860  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -2.297   1.656   1.466  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -3.126   1.287   3.777  1.00  8.12           C
ATOM      0  H   LEU A  67      -2.062   4.832   4.011  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -1.575   2.509   5.663  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -0.545   3.375   2.858  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -0.427   1.748   3.499  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -2.966   3.230   2.754  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -3.293   1.437   1.081  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -1.791   2.346   0.791  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -1.724   0.732   1.537  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -4.096   1.029   3.351  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.518   0.387   3.867  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -3.268   1.729   4.763  1.00  8.12           H   new
ATOM   1079  N   HIS A  68       1.062   2.748   5.615  1.00  2.94           N
ATOM   1080  CA  HIS A  68       2.470   2.973   5.723  1.00  4.17           C
ATOM   1081  C   HIS A  68       3.320   2.191   4.782  1.00  5.32           C
ATOM   1082  O   HIS A  68       3.189   0.977   4.634  1.00  7.70           O
ATOM   1083  CB  HIS A  68       2.951   2.709   7.160  1.00  5.57           C
ATOM   1084  CG  HIS A  68       2.483   3.817   8.055  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       2.857   5.145   8.011  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       1.765   3.605   9.191  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       2.346   5.685   9.149  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       1.745   4.785   9.906  1.00 16.30           N
ATOM      0  H   HIS A  68       0.757   1.843   5.975  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       2.594   4.020   5.445  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       2.565   1.753   7.514  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       4.039   2.642   7.184  1.00  5.57           H   new
ATOM      0  HD1 HIS A  68       3.397   5.617   7.285  1.00 13.74           H   new
ATOM      0  HD2 HIS A  68       1.294   2.678   9.482  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       2.423   6.731   9.405  1.00 14.75           H   new
ATOM   1096  N   LEU A  69       4.265   2.852   4.090  1.00  5.29           N
ATOM   1097  CA  LEU A  69       5.191   2.283   3.160  1.00  3.97           C
ATOM   1098  C   LEU A  69       6.410   1.944   3.946  1.00  5.07           C
ATOM   1099  O   LEU A  69       7.136   2.827   4.401  1.00  4.34           O
ATOM   1100  CB  LEU A  69       5.365   3.262   1.987  1.00  6.08           C
ATOM   1101  CG  LEU A  69       6.499   2.939   0.999  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       6.555   1.509   0.437  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       6.470   3.984  -0.129  1.00  6.87           C
ATOM      0  H   LEU A  69       4.390   3.859   4.189  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       4.865   1.358   2.684  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       4.428   3.303   1.432  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       5.538   4.258   2.394  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       7.418   2.991   1.582  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       7.401   1.419  -0.245  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       6.673   0.800   1.257  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       5.631   1.293  -0.100  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       7.267   3.773  -0.841  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       5.508   3.942  -0.639  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       6.614   4.979   0.293  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       6.680   0.652   4.202  1.00  4.29           N
ATOM   1116  CA  VAL A  70       7.893   0.204   4.811  1.00  6.26           C
ATOM   1117  C   VAL A  70       8.773  -0.316   3.726  1.00  9.22           C
ATOM   1118  O   VAL A  70       8.313  -0.904   2.749  1.00  9.36           O
ATOM   1119  CB  VAL A  70       7.527  -0.849   5.815  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       8.702  -1.684   6.350  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       6.652  -0.221   6.912  1.00  8.54           C
ATOM      0  H   VAL A  70       6.034  -0.105   3.978  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       8.432   0.996   5.331  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       6.942  -1.605   5.292  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       8.331  -2.415   7.068  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       9.187  -2.202   5.522  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       9.422  -1.028   6.839  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       6.384  -0.983   7.644  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       7.205   0.578   7.406  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       5.746   0.188   6.465  1.00  8.54           H   new
ATOM   1131  N   LEU A  71      10.106  -0.279   3.901  1.00 12.71           N
ATOM   1132  CA  LEU A  71      11.079  -0.866   3.033  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.491  -2.129   3.707  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.786  -2.166   4.901  1.00 19.26           O
ATOM   1135  CB  LEU A  71      12.380  -0.053   2.926  1.00 17.10           C
ATOM   1136  CG  LEU A  71      13.547  -0.732   2.190  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      13.144  -1.398   0.863  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      14.632   0.283   1.790  1.00 17.51           C
ATOM      0  H   LEU A  71      10.531   0.191   4.700  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      10.636  -0.958   2.041  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      12.156   0.886   2.420  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      12.711   0.198   3.934  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      13.898  -1.475   2.906  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      14.021  -1.855   0.404  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      12.394  -2.165   1.054  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      12.732  -0.647   0.189  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71      15.440  -0.233   1.272  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      14.201   1.035   1.130  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71      15.025   0.767   2.684  1.00 17.51           H   new