USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=18
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  22 THR OG1 :   rot -124:sc=   0.463
USER  MOD Set 1.2: A  25 ASN     :      amide:sc=   0.501  K(o=0.96,f=-0.0085)
USER  MOD Set 2.1: A   7 THR OG1 :   rot  134:sc=    2.42
USER  MOD Set 2.2: A   9 THR OG1 :   rot  180:sc=    1.02
USER  MOD Single : A   1 MET CE  :methyl -175:sc= -0.0842   (180deg=-0.139)
USER  MOD Single : A   1 MET N   :NH3+   -178:sc=    2.29   (180deg=2.15)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+   -160:sc=    1.11   (180deg=0.264)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  27 LYS NZ  :NH3+   -145:sc=     1.3   (180deg=1.1)
USER  MOD Single : A  29 LYS NZ  :NH3+    156:sc=    1.28   (180deg=1.22)
USER  MOD Single : A  31 GLN     :      amide:sc=   -1.39  K(o=-1.4,f=-2.7)
USER  MOD Single : A  33 LYS NZ  :NH3+   -119:sc= -0.0766   (180deg=-0.511)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  K(o=0,f=-0.6)
USER  MOD Single : A  41 GLN     :      amide:sc=  -0.291  K(o=-0.29,f=-1.1)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=  -0.582  X(o=-0.58,f=-1)
USER  MOD Single : A  55 THR OG1 :   rot  -79:sc=    1.11
USER  MOD Single : A  57 SER OG  :   rot   73:sc=   0.552
USER  MOD Single : A  59 TYR OH  :   rot  130:sc=   0.307
USER  MOD Single : A  60 ASN     :      amide:sc=   0.159  X(o=0.16,f=0)
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  104:sc=   0.426
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HE2:sc=  -0.133  K(o=-0.13,f=-0.82)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -10.765   0.639  -7.014  1.00  9.67           N
ATOM      2  CA  MET A   1     -11.269   1.379  -5.836  1.00 10.38           C
ATOM      3  C   MET A   1     -10.256   2.331  -5.302  1.00  9.62           C
ATOM      4  O   MET A   1      -9.074   2.201  -5.616  1.00  9.62           O
ATOM      5  CB  MET A   1     -11.800   0.422  -4.755  1.00 13.77           C
ATOM      6  CG  MET A   1     -10.670  -0.396  -4.125  1.00 16.29           C
ATOM      7  SD  MET A   1     -11.143  -1.478  -2.743  1.00 17.17           S
ATOM      8  CE  MET A   1      -9.512  -2.273  -2.673  1.00 16.11           C
ATOM      0  H1  MET A   1     -11.512   0.012  -7.376  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -10.490   1.314  -7.756  1.00  9.67           H   new
ATOM      0  H3  MET A   1      -9.939   0.070  -6.739  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -12.114   1.983  -6.168  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.312   0.994  -3.981  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -12.537  -0.251  -5.194  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -10.216  -1.011  -4.903  1.00 16.29           H   new
ATOM      0  HG3 MET A   1      -9.902   0.293  -3.774  1.00 16.29           H   new
ATOM      0  HE1 MET A   1      -9.532  -3.080  -1.940  1.00 16.11           H   new
ATOM      0  HE2 MET A   1      -9.263  -2.679  -3.653  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -8.761  -1.538  -2.384  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -10.665   3.322  -4.488  1.00  9.27           N
ATOM     21  CA  GLN A   2      -9.837   4.364  -3.965  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.205   4.010  -2.663  1.00  8.72           C
ATOM     23  O   GLN A   2      -9.899   3.761  -1.678  1.00  8.22           O
ATOM     24  CB  GLN A   2     -10.541   5.729  -3.891  1.00 14.46           C
ATOM     25  CG  GLN A   2      -9.594   6.859  -3.482  1.00 17.01           C
ATOM     26  CD  GLN A   2     -10.321   8.188  -3.631  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -11.054   8.691  -2.782  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -10.311   8.723  -4.881  1.00 19.49           N
ATOM      0  H   GLN A   2     -11.633   3.399  -4.177  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.034   4.467  -4.694  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -10.979   5.961  -4.862  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2     -11.362   5.672  -3.176  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.266   6.722  -2.452  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2      -8.700   6.846  -4.105  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2      -9.711   8.323  -5.602  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -10.903   9.525  -5.097  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -7.867   3.896  -2.589  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.096   3.786  -1.389  1.00  5.07           C
ATOM     39  C   ILE A   3      -6.308   4.995  -1.017  1.00  4.01           C
ATOM     40  O   ILE A   3      -6.080   5.832  -1.888  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.454   2.448  -1.175  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.284   2.172  -2.134  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -7.416   1.258  -1.333  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -4.357   1.016  -1.757  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.284   3.880  -3.426  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -7.841   3.794  -0.593  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -6.107   2.520  -0.144  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -5.693   1.973  -3.125  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -4.685   3.079  -2.213  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -6.875   0.327  -1.163  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.225   1.345  -0.608  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -7.831   1.257  -2.341  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -3.572   0.919  -2.507  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -3.907   1.213  -0.784  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -4.930   0.090  -1.710  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -5.974   5.192   0.271  1.00  4.55           N
ATOM     57  CA  PHE A   4      -5.263   6.293   0.845  1.00  4.68           C
ATOM     58  C   PHE A   4      -4.059   5.701   1.493  1.00  5.30           C
ATOM     59  O   PHE A   4      -4.070   4.916   2.440  1.00  5.58           O
ATOM     60  CB  PHE A   4      -6.219   6.954   1.852  1.00  4.83           C
ATOM     61  CG  PHE A   4      -7.402   7.693   1.326  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -7.315   8.558   0.260  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -8.476   7.677   2.184  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -8.440   9.274  -0.073  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -9.608   8.353   1.792  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -9.594   9.138   0.663  1.00  8.90           C
ATOM      0  H   PHE A   4      -6.230   4.507   0.982  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -4.942   7.054   0.134  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -6.585   6.176   2.523  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -5.636   7.648   2.457  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -6.396   8.671  -0.295  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -8.433   7.154   3.128  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -8.418   9.947  -0.917  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4     -10.513   8.267   2.374  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4     -10.493   9.650   0.353  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -2.867   6.075   0.995  1.00  4.44           N
ATOM     77  CA  VAL A   5      -1.601   5.749   1.576  1.00  3.87           C
ATOM     78  C   VAL A   5      -0.962   7.012   2.042  1.00  4.93           C
ATOM     79  O   VAL A   5      -0.521   7.867   1.276  1.00  6.84           O
ATOM     80  CB  VAL A   5      -0.705   5.125   0.548  1.00  2.99           C
ATOM     81  CG1 VAL A   5       0.700   4.900   1.133  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.331   3.794   0.098  1.00  9.13           C
ATOM      0  H   VAL A   5      -2.782   6.632   0.145  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -1.751   5.051   2.400  1.00  3.87           H   new
ATOM      0  HB  VAL A   5      -0.604   5.787  -0.312  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.341   4.447   0.377  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.123   5.856   1.441  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       0.633   4.238   1.996  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -0.692   3.326  -0.651  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.430   3.130   0.957  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -2.315   3.982  -0.331  1.00  9.13           H   new
ATOM     92  N   LYS A   6      -0.909   7.146   3.379  1.00  6.04           N
ATOM     93  CA  LYS A   6      -0.453   8.340   4.020  1.00  6.12           C
ATOM     94  C   LYS A   6       0.948   8.092   4.464  1.00  6.57           C
ATOM     95  O   LYS A   6       1.285   7.104   5.114  1.00  5.76           O
ATOM     96  CB  LYS A   6      -1.298   8.678   5.260  1.00  7.45           C
ATOM     97  CG  LYS A   6      -1.409  10.179   5.534  1.00 11.12           C
ATOM     98  CD  LYS A   6      -2.299  10.422   6.754  1.00 14.54           C
ATOM     99  CE  LYS A   6      -2.682  11.883   6.997  1.00 18.84           C
ATOM    100  NZ  LYS A   6      -3.840  12.377   6.218  1.00 20.55           N
ATOM      0  H   LYS A   6      -1.188   6.410   4.028  1.00  6.04           H   new
ATOM      0  HA  LYS A   6      -0.529   9.173   3.321  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6      -2.299   8.266   5.131  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6      -0.862   8.189   6.131  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6      -0.418  10.600   5.706  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6      -1.824  10.687   4.663  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6      -3.212   9.837   6.641  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6      -1.787  10.045   7.639  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6      -2.898  12.012   8.058  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6      -1.819  12.509   6.769  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6      -4.017  13.374   6.454  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -3.636  12.293   5.202  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6      -4.681  11.811   6.450  1.00 20.55           H   new
ATOM    114  N   THR A   7       1.919   8.990   4.221  1.00  7.41           N
ATOM    115  CA  THR A   7       3.264   8.813   4.671  1.00  7.48           C
ATOM    116  C   THR A   7       3.501   9.324   6.051  1.00  8.75           C
ATOM    117  O   THR A   7       2.570   9.850   6.659  1.00  8.58           O
ATOM    118  CB  THR A   7       4.290   9.455   3.786  1.00  9.61           C
ATOM    119  OG1 THR A   7       4.238  10.872   3.861  1.00 11.78           O
ATOM    120  CG2 THR A   7       4.127   9.107   2.296  1.00  9.17           C
ATOM      0  H   THR A   7       1.767   9.855   3.702  1.00  7.41           H   new
ATOM      0  HA  THR A   7       3.382   7.730   4.646  1.00  7.48           H   new
ATOM      0  HB  THR A   7       5.236   9.062   4.158  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       5.145  11.228   3.963  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       4.904   9.607   1.718  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       4.213   8.029   2.163  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       3.148   9.438   1.950  1.00  9.17           H   new
ATOM    128  N   LEU A   8       4.698   9.023   6.584  1.00  9.84           N
ATOM    129  CA  LEU A   8       5.046   9.507   7.884  1.00 14.15           C
ATOM    130  C   LEU A   8       5.261  10.980   7.825  1.00 17.37           C
ATOM    131  O   LEU A   8       4.870  11.819   8.635  1.00 17.01           O
ATOM    132  CB  LEU A   8       6.277   8.782   8.454  1.00 16.63           C
ATOM    133  CG  LEU A   8       6.543   9.043   9.946  1.00 18.88           C
ATOM    134  CD1 LEU A   8       5.617   8.259  10.892  1.00 18.59           C
ATOM    135  CD2 LEU A   8       8.046   8.883  10.228  1.00 19.31           C
ATOM      0  H   LEU A   8       5.412   8.456   6.127  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       4.221   9.296   8.564  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       6.152   7.710   8.303  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       7.156   9.084   7.884  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       6.276  10.075  10.173  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       5.867   8.497  11.926  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       4.580   8.534  10.697  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8       5.746   7.190  10.724  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8       8.240   9.067  11.285  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8       8.358   7.870   9.973  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8       8.607   9.598   9.626  1.00 19.31           H   new
ATOM    147  N   THR A   9       5.948  11.416   6.754  1.00 18.33           N
ATOM    148  CA  THR A   9       5.992  12.814   6.455  1.00 19.24           C
ATOM    149  C   THR A   9       4.686  13.505   6.267  1.00 19.48           C
ATOM    150  O   THR A   9       4.628  14.714   6.490  1.00 23.14           O
ATOM    151  CB  THR A   9       6.803  13.146   5.238  1.00 18.97           C
ATOM    152  OG1 THR A   9       6.551  12.326   4.106  1.00 20.24           O
ATOM    153  CG2 THR A   9       8.253  12.827   5.638  1.00 19.70           C
ATOM      0  H   THR A   9       6.462  10.817   6.108  1.00 18.33           H   new
ATOM      0  HA  THR A   9       6.453  13.181   7.372  1.00 19.24           H   new
ATOM      0  HB  THR A   9       6.573  14.174   4.957  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       7.120  12.613   3.361  1.00 20.24           H   new
ATOM      0 HG21 THR A   9       8.917  13.042   4.801  1.00 19.70           H   new
ATOM      0 HG22 THR A   9       8.537  13.439   6.494  1.00 19.70           H   new
ATOM      0 HG23 THR A   9       8.334  11.773   5.903  1.00 19.70           H   new
ATOM    161  N   GLY A  10       3.605  12.887   5.758  1.00 19.43           N
ATOM    162  CA  GLY A  10       2.317  13.508   5.709  1.00 18.74           C
ATOM    163  C   GLY A  10       1.901  13.885   4.329  1.00 17.62           C
ATOM    164  O   GLY A  10       1.160  14.834   4.075  1.00 19.74           O
ATOM      0  H   GLY A  10       3.625  11.942   5.375  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       1.577  12.829   6.132  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       2.326  14.400   6.335  1.00 18.74           H   new
ATOM    168  N   LYS A  11       2.254  13.022   3.359  1.00 13.56           N
ATOM    169  CA  LYS A  11       1.714  13.097   2.037  1.00 11.91           C
ATOM    170  C   LYS A  11       0.649  12.055   2.038  1.00 10.18           C
ATOM    171  O   LYS A  11       0.759  11.079   2.779  1.00  9.10           O
ATOM    172  CB  LYS A  11       2.884  12.798   1.085  1.00 13.43           C
ATOM    173  CG  LYS A  11       2.496  12.561  -0.376  1.00 16.69           C
ATOM    174  CD  LYS A  11       3.744  12.491  -1.258  1.00 17.92           C
ATOM    175  CE  LYS A  11       3.423  12.675  -2.743  1.00 20.81           C
ATOM    176  NZ  LYS A  11       4.619  12.994  -3.553  1.00 21.93           N
ATOM      0  H   LYS A  11       2.922  12.263   3.494  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       1.287  14.051   1.728  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       3.586  13.631   1.126  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       3.412  11.917   1.451  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       1.930  11.633  -0.462  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       1.845  13.365  -0.720  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       4.450  13.260  -0.944  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       4.235  11.529  -1.112  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       2.963  11.764  -3.126  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       2.690  13.474  -2.855  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       4.325  13.433  -4.449  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       5.228  13.654  -3.028  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       5.146  12.120  -3.752  1.00 21.93           H   new
ATOM    190  N   THR A  12      -0.380  12.239   1.192  1.00  9.63           N
ATOM    191  CA  THR A  12      -1.241  11.176   0.777  1.00  9.85           C
ATOM    192  C   THR A  12      -1.094  10.800  -0.657  1.00 11.66           C
ATOM    193  O   THR A  12      -1.577  11.520  -1.529  1.00 12.33           O
ATOM    194  CB  THR A  12      -2.706  11.342   1.055  1.00 10.85           C
ATOM    195  OG1 THR A  12      -2.894  11.503   2.454  1.00 10.91           O
ATOM    196  CG2 THR A  12      -3.650  10.184   0.690  1.00  9.63           C
ATOM      0  H   THR A  12      -0.619  13.145   0.788  1.00  9.63           H   new
ATOM      0  HA  THR A  12      -0.876  10.378   1.423  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -2.966  12.189   0.420  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -3.849  11.614   2.645  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -4.674  10.453   0.950  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -3.587   9.987  -0.380  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -3.359   9.290   1.241  1.00  9.63           H   new
ATOM    204  N   ILE A  13      -0.471   9.658  -1.000  1.00 10.42           N
ATOM    205  CA  ILE A  13      -0.487   9.150  -2.336  1.00 11.84           C
ATOM    206  C   ILE A  13      -1.772   8.429  -2.554  1.00 10.55           C
ATOM    207  O   ILE A  13      -2.028   7.389  -1.949  1.00 11.92           O
ATOM    208  CB  ILE A  13       0.609   8.135  -2.476  1.00 14.86           C
ATOM    209  CG1 ILE A  13       2.030   8.630  -2.157  1.00 14.87           C
ATOM    210  CG2 ILE A  13       0.623   7.674  -3.943  1.00 17.08           C
ATOM    211  CD1 ILE A  13       3.010   7.515  -1.794  1.00 16.46           C
ATOM      0  H   ILE A  13       0.051   9.080  -0.341  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -0.364   9.970  -3.044  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       0.383   7.356  -1.748  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       2.417   9.173  -3.019  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       1.980   9.339  -1.330  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       1.410   6.933  -4.084  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -0.341   7.232  -4.195  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       0.810   8.530  -4.592  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       3.989   7.945  -1.583  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.649   6.986  -0.912  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       3.092   6.817  -2.627  1.00 16.46           H   new
ATOM    223  N   THR A  14      -2.707   8.980  -3.349  1.00  9.39           N
ATOM    224  CA  THR A  14      -3.908   8.324  -3.762  1.00  9.63           C
ATOM    225  C   THR A  14      -3.639   7.362  -4.868  1.00 11.20           C
ATOM    226  O   THR A  14      -2.800   7.624  -5.728  1.00 11.63           O
ATOM    227  CB  THR A  14      -5.059   9.238  -4.062  1.00 10.38           C
ATOM    228  OG1 THR A  14      -4.618  10.205  -5.004  1.00 16.30           O
ATOM    229  CG2 THR A  14      -5.401  10.010  -2.777  1.00 11.66           C
ATOM      0  H   THR A  14      -2.621   9.926  -3.720  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -4.246   7.761  -2.892  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -5.910   8.667  -4.433  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -5.356  10.814  -5.217  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -6.237  10.683  -2.968  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -5.675   9.306  -1.991  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -4.534  10.589  -2.459  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -4.285   6.188  -4.747  1.00  8.29           N
ATOM    238  CA  LEU A  15      -4.123   5.104  -5.665  1.00  9.03           C
ATOM    239  C   LEU A  15      -5.448   4.521  -6.018  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.295   4.364  -5.140  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.335   3.930  -5.060  1.00 11.08           C
ATOM    242  CG  LEU A  15      -1.941   4.280  -4.512  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.438   3.089  -3.679  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -0.911   4.570  -5.617  1.00 15.88           C
ATOM      0  H   LEU A  15      -4.938   5.988  -3.990  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -3.598   5.529  -6.521  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -3.925   3.497  -4.253  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -3.223   3.159  -5.822  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -2.042   5.188  -3.917  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -0.449   3.316  -3.280  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -2.128   2.904  -2.856  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.380   2.202  -4.310  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15       0.051   4.810  -5.164  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -0.803   3.692  -6.254  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -1.250   5.414  -6.218  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -5.621   4.184  -7.308  1.00 11.04           N
ATOM    257  CA  GLU A  16      -6.633   3.350  -7.878  1.00 11.50           C
ATOM    258  C   GLU A  16      -6.120   1.959  -8.018  1.00 10.13           C
ATOM    259  O   GLU A  16      -5.337   1.599  -8.897  1.00  9.83           O
ATOM    260  CB  GLU A  16      -7.214   3.984  -9.154  1.00 17.22           C
ATOM    261  CG  GLU A  16      -8.211   3.179  -9.990  1.00 23.33           C
ATOM    262  CD  GLU A  16      -9.604   3.151  -9.377  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -10.125   4.282  -9.180  1.00 28.90           O
ATOM    264  OE2 GLU A  16     -10.092   2.002  -9.211  1.00 28.86           O
ATOM      0  H   GLU A  16      -4.984   4.534  -8.024  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -7.491   3.272  -7.211  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -7.701   4.916  -8.867  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -6.378   4.248  -9.802  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -8.268   3.606 -10.991  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -7.846   2.158 -10.099  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -6.613   0.958  -7.268  1.00  8.99           N
ATOM    272  CA  VAL A  17      -6.316  -0.440  -7.328  1.00  8.85           C
ATOM    273  C   VAL A  17      -7.610  -1.173  -7.242  1.00  8.04           C
ATOM    274  O   VAL A  17      -8.585  -0.657  -6.697  1.00  8.99           O
ATOM    275  CB  VAL A  17      -5.243  -0.939  -6.406  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -3.981  -0.140  -6.773  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -5.707  -0.671  -4.965  1.00 10.54           C
ATOM      0  H   VAL A  17      -7.297   1.154  -6.537  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -5.833  -0.644  -8.284  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -5.039  -2.006  -6.493  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -3.154  -0.454  -6.136  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -3.725  -0.323  -7.817  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -4.168   0.924  -6.626  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -4.948  -1.023  -4.267  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -5.860   0.399  -4.825  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -6.642  -1.199  -4.780  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -7.654  -2.460  -7.632  1.00  7.29           N
ATOM    288  CA  GLU A  18      -8.851  -3.240  -7.577  1.00  7.08           C
ATOM    289  C   GLU A  18      -8.814  -4.051  -6.328  1.00  6.45           C
ATOM    290  O   GLU A  18      -7.728  -4.197  -5.770  1.00  5.28           O
ATOM    291  CB  GLU A  18      -8.840  -4.221  -8.761  1.00 10.28           C
ATOM    292  CG  GLU A  18      -9.067  -3.431 -10.052  1.00 12.65           C
ATOM    293  CD  GLU A  18     -10.486  -2.886 -10.133  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -11.339  -3.688  -9.668  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -10.757  -1.785 -10.682  1.00 18.17           O
ATOM      0  H   GLU A  18      -6.845  -2.967  -7.991  1.00  7.29           H   new
ATOM      0  HA  GLU A  18      -9.730  -2.596  -7.607  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18      -7.889  -4.751  -8.804  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18      -9.619  -4.973  -8.636  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18      -8.356  -2.606 -10.104  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18      -8.874  -4.073 -10.911  1.00 12.65           H   new
ATOM    302  N   PRO A  19      -9.848  -4.668  -5.837  1.00  7.24           N
ATOM    303  CA  PRO A  19      -9.729  -5.534  -4.701  1.00  7.07           C
ATOM    304  C   PRO A  19      -8.807  -6.700  -4.801  1.00  6.65           C
ATOM    305  O   PRO A  19      -8.423  -7.258  -3.774  1.00  6.37           O
ATOM    306  CB  PRO A  19     -11.162  -6.001  -4.454  1.00  7.61           C
ATOM    307  CG  PRO A  19     -12.024  -4.787  -4.833  1.00  8.16           C
ATOM    308  CD  PRO A  19     -11.200  -4.145  -5.961  1.00  7.49           C
ATOM      0  HA  PRO A  19      -9.262  -4.972  -3.892  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -11.408  -6.870  -5.064  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -11.314  -6.288  -3.413  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -13.017  -5.082  -5.171  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -12.163  -4.107  -3.992  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -11.622  -4.389  -6.936  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -11.205  -3.058  -5.874  1.00  7.49           H   new
ATOM    316  N   SER A  20      -8.489  -7.080  -6.051  1.00  6.80           N
ATOM    317  CA  SER A  20      -7.750  -8.282  -6.280  1.00  6.28           C
ATOM    318  C   SER A  20      -6.299  -8.016  -6.487  1.00  8.45           C
ATOM    319  O   SER A  20      -5.554  -8.926  -6.849  1.00  7.26           O
ATOM    320  CB  SER A  20      -8.209  -9.034  -7.541  1.00  8.57           C
ATOM    321  OG  SER A  20      -9.625  -9.138  -7.512  1.00 11.13           O
ATOM      0  H   SER A  20      -8.740  -6.563  -6.894  1.00  6.80           H   new
ATOM      0  HA  SER A  20      -7.928  -8.877  -5.384  1.00  6.28           H   new
ATOM      0  HB2 SER A  20      -7.886  -8.504  -8.437  1.00  8.57           H   new
ATOM      0  HB3 SER A  20      -7.757 -10.025  -7.577  1.00  8.57           H   new
ATOM      0  HG  SER A  20      -9.934  -9.614  -8.311  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -5.777  -6.811  -6.195  1.00  7.50           N
ATOM    328  CA  ASP A  21      -4.389  -6.488  -6.303  1.00  7.70           C
ATOM    329  C   ASP A  21      -3.696  -6.916  -5.055  1.00  7.08           C
ATOM    330  O   ASP A  21      -4.133  -6.681  -3.930  1.00  8.11           O
ATOM    331  CB  ASP A  21      -4.199  -4.990  -6.595  1.00 11.00           C
ATOM    332  CG  ASP A  21      -4.208  -4.691  -8.088  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -3.145  -5.000  -8.690  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -5.145  -4.053  -8.638  1.00 14.36           O
ATOM      0  H   ASP A  21      -6.347  -6.030  -5.870  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -3.945  -7.023  -7.142  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -4.992  -4.423  -6.108  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -3.256  -4.654  -6.164  1.00 11.00           H   new
ATOM    339  N   THR A  22      -2.571  -7.633  -5.226  1.00  5.37           N
ATOM    340  CA  THR A  22      -1.620  -7.857  -4.181  1.00  6.01           C
ATOM    341  C   THR A  22      -1.011  -6.636  -3.582  1.00  8.01           C
ATOM    342  O   THR A  22      -0.964  -5.581  -4.211  1.00  8.11           O
ATOM    343  CB  THR A  22      -0.660  -8.955  -4.531  1.00  8.92           C
ATOM    344  OG1 THR A  22      -0.081  -8.513  -5.750  1.00 10.22           O
ATOM    345  CG2 THR A  22      -1.328 -10.318  -4.776  1.00  9.65           C
ATOM      0  H   THR A  22      -2.316  -8.068  -6.113  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -2.199  -8.225  -3.334  1.00  6.01           H   new
ATOM      0  HB  THR A  22       0.038  -9.119  -3.710  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -0.209  -9.197  -6.440  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -0.566 -11.057  -5.023  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -1.858 -10.630  -3.876  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -2.034 -10.234  -5.602  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -0.364  -6.656  -2.403  1.00  8.32           N
ATOM    354  CA  ILE A  23       0.253  -5.556  -1.728  1.00  9.92           C
ATOM    355  C   ILE A  23       1.531  -5.288  -2.445  1.00 10.01           C
ATOM    356  O   ILE A  23       2.041  -4.170  -2.503  1.00  8.71           O
ATOM    357  CB  ILE A  23       0.465  -5.704  -0.251  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -0.806  -5.968   0.574  1.00 11.38           C
ATOM    359  CG2 ILE A  23       1.274  -4.606   0.461  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -1.799  -4.806   0.590  1.00 12.30           C
ATOM      0  H   ILE A  23      -0.265  -7.523  -1.875  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -0.441  -4.716  -1.767  1.00  9.92           H   new
ATOM      0  HB  ILE A  23       1.084  -6.601  -0.271  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -1.305  -6.852   0.177  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -0.518  -6.198   1.600  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23       1.349  -4.840   1.523  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       2.274  -4.553   0.029  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23       0.773  -3.646   0.336  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -2.665  -5.076   1.194  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -1.320  -3.924   1.016  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -2.120  -4.588  -0.428  1.00 12.30           H   new
ATOM    372  N   GLU A  24       1.976  -6.274  -3.244  1.00  9.54           N
ATOM    373  CA  GLU A  24       3.095  -6.090  -4.115  1.00 11.81           C
ATOM    374  C   GLU A  24       2.678  -5.144  -5.188  1.00 11.14           C
ATOM    375  O   GLU A  24       3.361  -4.163  -5.477  1.00 10.62           O
ATOM    376  CB  GLU A  24       3.484  -7.483  -4.641  1.00 19.24           C
ATOM    377  CG  GLU A  24       4.814  -7.606  -5.387  1.00 27.76           C
ATOM    378  CD  GLU A  24       5.254  -9.049  -5.592  1.00 32.92           C
ATOM    379  OE1 GLU A  24       4.346  -9.895  -5.807  1.00 36.51           O
ATOM    380  OE2 GLU A  24       6.486  -9.310  -5.557  1.00 34.80           O
ATOM      0  H   GLU A  24       1.558  -7.204  -3.287  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       3.969  -5.659  -3.626  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       3.508  -8.169  -3.794  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24       2.691  -7.826  -5.306  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       4.725  -7.118  -6.358  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       5.586  -7.073  -4.832  1.00 27.76           H   new
ATOM    387  N   ASN A  25       1.501  -5.352  -5.805  1.00  9.43           N
ATOM    388  CA  ASN A  25       1.025  -4.414  -6.774  1.00 10.96           C
ATOM    389  C   ASN A  25       0.647  -3.040  -6.341  1.00  9.68           C
ATOM    390  O   ASN A  25       0.771  -2.092  -7.114  1.00  9.33           O
ATOM    391  CB  ASN A  25      -0.040  -5.006  -7.713  1.00 16.78           C
ATOM    392  CG  ASN A  25       0.670  -6.031  -8.585  1.00 22.31           C
ATOM    393  OD1 ASN A  25       1.473  -5.716  -9.462  1.00 25.66           O
ATOM    394  ND2 ASN A  25       0.507  -7.344  -8.267  1.00 24.70           N
ATOM      0  H   ASN A  25       0.890  -6.152  -5.638  1.00  9.43           H   new
ATOM      0  HA  ASN A  25       1.954  -4.235  -7.316  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -0.843  -5.473  -7.143  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -0.494  -4.226  -8.324  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25       1.048  -8.058  -8.755  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -0.157  -7.614  -7.541  1.00 24.70           H   new
ATOM    401  N   VAL A  26       0.190  -2.909  -5.082  1.00  6.52           N
ATOM    402  CA  VAL A  26       0.130  -1.627  -4.453  1.00  5.53           C
ATOM    403  C   VAL A  26       1.404  -0.858  -4.514  1.00  4.42           C
ATOM    404  O   VAL A  26       1.436   0.301  -4.927  1.00  3.40           O
ATOM    405  CB  VAL A  26      -0.500  -1.661  -3.092  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -0.568  -0.258  -2.465  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -1.908  -2.276  -3.165  1.00  8.12           C
ATOM      0  H   VAL A  26      -0.135  -3.684  -4.504  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -0.558  -1.046  -5.067  1.00  5.53           H   new
ATOM      0  HB  VAL A  26       0.128  -2.284  -2.455  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.030  -0.322  -1.480  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26       0.440   0.146  -2.368  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.162   0.397  -3.103  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -2.350  -2.293  -2.169  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -2.532  -1.678  -3.829  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -1.841  -3.294  -3.549  1.00  8.12           H   new
ATOM    417  N   LYS A  27       2.537  -1.458  -4.108  1.00  2.64           N
ATOM    418  CA  LYS A  27       3.829  -0.854  -3.999  1.00  4.14           C
ATOM    419  C   LYS A  27       4.402  -0.594  -5.349  1.00  5.58           C
ATOM    420  O   LYS A  27       5.011   0.444  -5.605  1.00  4.11           O
ATOM    421  CB  LYS A  27       4.629  -1.883  -3.183  1.00  3.97           C
ATOM    422  CG  LYS A  27       4.195  -1.953  -1.718  1.00  7.45           C
ATOM    423  CD  LYS A  27       5.024  -3.019  -0.999  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.706  -3.103   0.495  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.563  -4.186   1.027  1.00 15.47           N
ATOM      0  H   LYS A  27       2.549  -2.441  -3.835  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       3.827   0.124  -3.517  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       4.514  -2.867  -3.637  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       5.689  -1.632  -3.231  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       4.332  -0.984  -1.239  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       3.134  -2.194  -1.652  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       4.841  -3.989  -1.461  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       6.084  -2.799  -1.129  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       4.916  -2.157   0.994  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.651  -3.322   0.659  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       5.054  -4.695   1.778  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.802  -4.848   0.261  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       6.437  -3.778   1.417  1.00 15.47           H   new
ATOM    439  N   ALA A  28       4.206  -1.557  -6.267  1.00  6.61           N
ATOM    440  CA  ALA A  28       4.454  -1.531  -7.675  1.00  7.74           C
ATOM    441  C   ALA A  28       3.795  -0.340  -8.282  1.00  9.17           C
ATOM    442  O   ALA A  28       4.418   0.487  -8.945  1.00 11.45           O
ATOM    443  CB  ALA A  28       4.197  -2.834  -8.450  1.00  7.68           C
ATOM      0  H   ALA A  28       3.828  -2.461  -5.984  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       5.535  -1.439  -7.776  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       4.423  -2.680  -9.505  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       4.834  -3.625  -8.054  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       3.151  -3.122  -8.341  1.00  7.68           H   new
ATOM    449  N   LYS A  29       2.505  -0.075  -8.010  1.00  8.96           N
ATOM    450  CA  LYS A  29       1.840   1.120  -8.428  1.00  7.90           C
ATOM    451  C   LYS A  29       2.365   2.405  -7.888  1.00  6.92           C
ATOM    452  O   LYS A  29       2.484   3.404  -8.595  1.00  6.87           O
ATOM    453  CB  LYS A  29       0.336   0.981  -8.137  1.00 10.28           C
ATOM    454  CG  LYS A  29      -0.441   1.852  -9.126  1.00 14.94           C
ATOM    455  CD  LYS A  29      -1.841   1.297  -9.394  1.00 19.69           C
ATOM    456  CE  LYS A  29      -2.370   1.761 -10.752  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -3.702   1.151 -10.962  1.00 24.98           N
ATOM      0  H   LYS A  29       1.906  -0.711  -7.483  1.00  8.96           H   new
ATOM      0  HA  LYS A  29       2.043   1.200  -9.496  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29       0.029  -0.061  -8.229  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29       0.120   1.288  -7.114  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -0.521   2.865  -8.733  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29       0.110   1.917 -10.064  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -1.815   0.208  -9.364  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -2.521   1.622  -8.606  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -2.441   2.848 -10.781  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -1.686   1.465 -11.548  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -4.247   1.730 -11.632  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -3.588   0.192 -11.347  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -4.208   1.102 -10.055  1.00 24.98           H   new
ATOM    471  N   ILE A  30       2.823   2.473  -6.625  1.00  4.57           N
ATOM    472  CA  ILE A  30       3.578   3.518  -6.005  1.00  5.58           C
ATOM    473  C   ILE A  30       4.864   3.760  -6.717  1.00  7.26           C
ATOM    474  O   ILE A  30       5.065   4.919  -7.075  1.00  9.46           O
ATOM    475  CB  ILE A  30       3.760   3.328  -4.528  1.00  5.36           C
ATOM    476  CG1 ILE A  30       2.364   3.270  -3.885  1.00  2.94           C
ATOM    477  CG2 ILE A  30       4.551   4.503  -3.930  1.00  2.78           C
ATOM    478  CD1 ILE A  30       2.440   2.595  -2.516  1.00  2.00           C
ATOM      0  H   ILE A  30       2.643   1.712  -5.970  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.981   4.425  -6.101  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       4.314   2.409  -4.337  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       1.962   4.278  -3.780  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       1.680   2.720  -4.532  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.675   4.350  -2.858  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       5.531   4.560  -4.404  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       4.009   5.433  -4.104  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       1.445   2.560  -2.072  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.821   1.580  -2.631  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       3.108   3.162  -1.867  1.00  2.00           H   new
ATOM    490  N   GLN A  31       5.664   2.736  -7.063  1.00  7.06           N
ATOM    491  CA  GLN A  31       6.827   2.978  -7.858  1.00  8.67           C
ATOM    492  C   GLN A  31       6.654   3.664  -9.170  1.00 10.90           C
ATOM    493  O   GLN A  31       7.366   4.600  -9.529  1.00  9.63           O
ATOM    494  CB  GLN A  31       7.586   1.653  -8.039  1.00  9.12           C
ATOM    495  CG  GLN A  31       8.823   1.637  -8.939  1.00 10.76           C
ATOM    496  CD  GLN A  31       9.314   0.196  -8.942  1.00 13.78           C
ATOM    497  OE1 GLN A  31      10.417  -0.109  -8.491  1.00 14.48           O
ATOM    498  NE2 GLN A  31       8.498  -0.706  -9.549  1.00 14.76           N
ATOM      0  H   GLN A  31       5.512   1.762  -6.800  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       7.391   3.716  -7.287  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       7.891   1.308  -7.051  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       6.882   0.919  -8.430  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       8.577   1.969  -9.948  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       9.591   2.311  -8.560  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       7.590  -0.411  -9.909  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       8.793  -1.678  -9.644  1.00 14.76           H   new
ATOM    507  N   ASP A  32       5.526   3.346  -9.829  1.00 10.93           N
ATOM    508  CA  ASP A  32       5.137   3.868 -11.102  1.00 14.01           C
ATOM    509  C   ASP A  32       4.765   5.296 -10.892  1.00 14.04           C
ATOM    510  O   ASP A  32       5.181   6.209 -11.604  1.00 13.39           O
ATOM    511  CB  ASP A  32       4.052   2.967 -11.715  1.00 18.01           C
ATOM    512  CG  ASP A  32       3.644   3.385 -13.120  1.00 24.33           C
ATOM    513  OD1 ASP A  32       4.385   3.249 -14.130  1.00 26.29           O
ATOM    514  OD2 ASP A  32       2.533   3.980 -13.146  1.00 25.17           O
ATOM      0  H   ASP A  32       4.846   2.686  -9.451  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       5.937   3.860 -11.843  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       4.415   1.939 -11.740  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       3.173   2.979 -11.070  1.00 18.01           H   new
ATOM    519  N   LYS A  33       4.021   5.580  -9.808  1.00 14.22           N
ATOM    520  CA  LYS A  33       3.526   6.909  -9.627  1.00 14.00           C
ATOM    521  C   LYS A  33       4.514   7.890  -9.096  1.00 12.37           C
ATOM    522  O   LYS A  33       4.758   8.971  -9.631  1.00 12.17           O
ATOM    523  CB  LYS A  33       2.370   6.844  -8.616  1.00 18.62           C
ATOM    524  CG  LYS A  33       1.606   8.099  -8.188  1.00 24.00           C
ATOM    525  CD  LYS A  33       0.287   7.871  -7.447  1.00 27.61           C
ATOM    526  CE  LYS A  33      -0.806   7.459  -8.436  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -1.201   8.703  -9.132  1.00 30.06           N
ATOM      0  H   LYS A  33       3.768   4.914  -9.078  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       3.239   7.259 -10.618  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       1.634   6.149  -9.021  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       2.769   6.392  -7.708  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       2.258   8.695  -7.550  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.400   8.694  -9.078  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       0.415   7.097  -6.691  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -0.008   8.781  -6.925  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -0.436   6.715  -9.142  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -1.655   7.013  -7.918  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -2.207   8.896  -8.953  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -0.628   9.496  -8.778  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -1.046   8.593 -10.154  1.00 30.06           H   new
ATOM    541  N   GLU A  34       5.037   7.515  -7.915  1.00 10.11           N
ATOM    542  CA  GLU A  34       5.906   8.384  -7.184  1.00 10.07           C
ATOM    543  C   GLU A  34       7.320   8.248  -7.632  1.00  9.32           C
ATOM    544  O   GLU A  34       8.073   9.201  -7.826  1.00 11.61           O
ATOM    545  CB  GLU A  34       5.789   8.044  -5.689  1.00 14.77           C
ATOM    546  CG  GLU A  34       4.547   8.619  -5.004  1.00 18.75           C
ATOM    547  CD  GLU A  34       4.495  10.139  -5.066  1.00 22.28           C
ATOM    548  OE1 GLU A  34       5.564  10.764  -4.836  1.00 25.19           O
ATOM    549  OE2 GLU A  34       3.490  10.747  -5.521  1.00 21.95           O
ATOM      0  H   GLU A  34       4.860   6.615  -7.468  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       5.608   9.417  -7.364  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       5.782   6.960  -5.575  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       6.676   8.413  -5.175  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       3.654   8.209  -5.476  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       4.531   8.301  -3.962  1.00 18.75           H   new
ATOM    556  N   GLY A  35       7.868   7.023  -7.730  1.00  7.22           N
ATOM    557  CA  GLY A  35       9.257   6.756  -7.936  1.00  6.29           C
ATOM    558  C   GLY A  35       9.907   6.315  -6.669  1.00  6.93           C
ATOM    559  O   GLY A  35      11.118   6.438  -6.491  1.00  7.41           O
ATOM      0  H   GLY A  35       7.309   6.172  -7.661  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       9.374   5.985  -8.697  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       9.752   7.652  -8.311  1.00  6.29           H   new
ATOM    563  N   ILE A  36       9.142   5.678  -5.765  1.00  5.86           N
ATOM    564  CA  ILE A  36       9.596   5.114  -4.533  1.00  6.07           C
ATOM    565  C   ILE A  36       9.620   3.638  -4.741  1.00  6.36           C
ATOM    566  O   ILE A  36       8.542   3.224  -5.163  1.00  6.18           O
ATOM    567  CB  ILE A  36       8.760   5.421  -3.326  1.00  7.47           C
ATOM    568  CG1 ILE A  36       8.102   6.808  -3.417  1.00  8.52           C
ATOM    569  CG2 ILE A  36       9.492   5.342  -1.976  1.00  7.36           C
ATOM    570  CD1 ILE A  36       7.182   7.267  -2.287  1.00  9.49           C
ATOM      0  H   ILE A  36       8.140   5.549  -5.905  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      10.567   5.556  -4.310  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       8.015   4.626  -3.343  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       8.900   7.545  -3.512  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       7.527   6.839  -4.343  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       8.797   5.582  -1.171  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.881   4.334  -1.832  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.317   6.054  -1.967  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       6.803   8.265  -2.509  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       6.346   6.574  -2.194  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       7.740   7.290  -1.351  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.684   2.909  -4.581  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.706   1.571  -5.098  1.00  9.18           C
ATOM    584  C   PRO A  37      10.160   0.583  -4.126  1.00  9.85           C
ATOM    585  O   PRO A  37      10.098   0.988  -2.966  1.00  8.51           O
ATOM    586  CB  PRO A  37      12.172   1.359  -5.472  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.937   2.282  -4.510  1.00  9.27           C
ATOM    588  CD  PRO A  37      12.010   3.507  -4.551  1.00  8.33           C
ATOM      0  HA  PRO A  37      10.057   1.424  -5.961  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      12.469   0.318  -5.348  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      12.361   1.622  -6.513  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      13.031   1.860  -3.509  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      13.945   2.507  -4.857  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      12.146   4.146  -3.678  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      12.195   4.125  -5.430  1.00  8.33           H   new
ATOM    596  N   PRO A  38       9.727  -0.589  -4.486  1.00  8.71           N
ATOM    597  CA  PRO A  38       9.117  -1.509  -3.571  1.00  9.08           C
ATOM    598  C   PRO A  38       9.987  -2.023  -2.476  1.00  9.28           C
ATOM    599  O   PRO A  38       9.422  -2.702  -1.620  1.00  6.50           O
ATOM    600  CB  PRO A  38       8.593  -2.707  -4.360  1.00 10.31           C
ATOM    601  CG  PRO A  38       9.173  -2.543  -5.773  1.00 10.81           C
ATOM    602  CD  PRO A  38       9.656  -1.086  -5.851  1.00 12.00           C
ATOM      0  HA  PRO A  38       8.333  -0.935  -3.077  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       8.914  -3.646  -3.909  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       7.503  -2.719  -4.380  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       9.995  -3.239  -5.943  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       8.419  -2.748  -6.533  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38      10.632  -1.028  -6.334  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.970  -0.483  -6.446  1.00 12.00           H   new
ATOM    610  N   ASP A  39      11.316  -1.825  -2.411  1.00 11.20           N
ATOM    611  CA  ASP A  39      12.212  -2.470  -1.502  1.00 14.96           C
ATOM    612  C   ASP A  39      12.190  -1.771  -0.186  1.00 13.99           C
ATOM    613  O   ASP A  39      12.307  -2.336   0.900  1.00 13.75           O
ATOM    614  CB  ASP A  39      13.642  -2.469  -2.067  1.00 24.16           C
ATOM    615  CG  ASP A  39      13.589  -3.183  -3.410  1.00 31.06           C
ATOM    616  OD1 ASP A  39      13.312  -2.580  -4.481  1.00 34.22           O
ATOM    617  OD2 ASP A  39      13.837  -4.415  -3.313  1.00 35.55           O
ATOM      0  H   ASP A  39      11.794  -1.173  -3.033  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      11.888  -3.502  -1.367  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      14.009  -1.450  -2.186  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      14.326  -2.977  -1.387  1.00 24.16           H   new
ATOM    622  N   GLN A  40      12.020  -0.439  -0.264  1.00 11.60           N
ATOM    623  CA  GLN A  40      12.068   0.471   0.838  1.00 10.76           C
ATOM    624  C   GLN A  40      10.734   0.479   1.502  1.00  8.01           C
ATOM    625  O   GLN A  40      10.610   0.972   2.622  1.00  8.96           O
ATOM    626  CB  GLN A  40      12.431   1.870   0.312  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.798   1.846  -0.376  1.00 14.85           C
ATOM    628  CD  GLN A  40      14.448   3.218  -0.480  1.00 16.11           C
ATOM    629  OE1 GLN A  40      13.827   4.256  -0.256  1.00 20.52           O
ATOM    630  NE2 GLN A  40      15.718   3.323  -0.954  1.00 18.16           N
ATOM      0  H   GLN A  40      11.838   0.030  -1.151  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      12.822   0.168   1.564  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.670   2.210  -0.390  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      12.445   2.583   1.137  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      14.461   1.179   0.174  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      13.685   1.429  -1.377  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      16.260   2.482  -1.150  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      16.128   4.243  -1.113  1.00 18.16           H   new
ATOM    639  N   GLN A  41       9.650   0.036   0.840  1.00  6.52           N
ATOM    640  CA  GLN A  41       8.323   0.274   1.316  1.00  3.87           C
ATOM    641  C   GLN A  41       7.686  -0.729   2.215  1.00  4.79           C
ATOM    642  O   GLN A  41       7.625  -1.939   2.007  1.00  6.34           O
ATOM    643  CB  GLN A  41       7.417   0.449   0.086  1.00  4.20           C
ATOM    644  CG  GLN A  41       7.610   1.705  -0.767  1.00  3.20           C
ATOM    645  CD  GLN A  41       6.598   1.554  -1.894  1.00  4.89           C
ATOM    646  OE1 GLN A  41       5.425   1.765  -1.587  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.793   1.376  -3.228  1.00  7.13           N
ATOM      0  H   GLN A  41       9.694  -0.491  -0.032  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.430   1.150   1.955  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       7.556  -0.419  -0.559  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       6.382   0.431   0.427  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.428   2.611  -0.188  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       8.627   1.772  -1.152  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       7.731   1.195  -3.587  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       6.002   1.424  -3.870  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.178  -0.240   3.361  1.00  5.73           N
ATOM    657  CA  ARG A  42       6.328  -0.936   4.276  1.00  6.97           C
ATOM    658  C   ARG A  42       5.023  -0.235   4.438  1.00  7.15           C
ATOM    659  O   ARG A  42       4.812   0.885   4.901  1.00  7.33           O
ATOM    660  CB  ARG A  42       7.062  -1.102   5.617  1.00 13.23           C
ATOM    661  CG  ARG A  42       6.276  -1.753   6.757  1.00 21.27           C
ATOM    662  CD  ARG A  42       7.009  -1.831   8.098  1.00 26.14           C
ATOM    663  NE  ARG A  42       8.150  -2.770   7.906  1.00 32.26           N
ATOM    664  CZ  ARG A  42       9.191  -2.746   8.789  1.00 34.32           C
ATOM    665  NH1 ARG A  42       9.257  -1.922   9.876  1.00 35.30           N
ATOM    666  NH2 ARG A  42      10.236  -3.619   8.701  1.00 36.39           N
ATOM      0  H   ARG A  42       7.377   0.712   3.669  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.100  -1.925   3.879  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.960  -1.694   5.442  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       7.390  -0.117   5.949  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       5.349  -1.197   6.900  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       5.999  -2.763   6.454  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       7.364  -0.847   8.403  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       6.342  -2.187   8.884  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       8.153  -3.424   7.123  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.496  -1.271  10.069  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42      10.067  -1.958  10.495  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42      10.256  -4.318   7.958  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42      10.998  -3.573   9.378  1.00 36.39           H   new
ATOM    680  N   LEU A  43       3.970  -1.022   4.155  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.626  -0.552   4.291  1.00  3.51           C
ATOM    682  C   LEU A  43       1.890  -1.237   5.390  1.00  5.56           C
ATOM    683  O   LEU A  43       2.059  -2.435   5.612  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.865  -0.869   2.993  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.218  -0.055   1.737  1.00  6.32           C
ATOM    686  CD1 LEU A  43       1.346  -0.422   0.524  1.00  6.41           C
ATOM    687  CD2 LEU A  43       2.141   1.476   1.868  1.00  9.55           C
ATOM      0  H   LEU A  43       4.049  -1.986   3.831  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       2.679   0.515   4.507  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       2.020  -1.923   2.763  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.801  -0.738   3.188  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       3.262  -0.335   1.597  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.641   0.184  -0.333  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.480  -1.477   0.285  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.298  -0.234   0.759  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       2.412   1.937   0.918  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       1.126   1.768   2.136  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       2.831   1.810   2.643  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.074  -0.438   6.100  1.00  4.58           N
ATOM    700  CA  ILE A  44       0.527  -0.806   7.369  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.910  -0.413   7.340  1.00  5.46           C
ATOM    702  O   ILE A  44      -1.272   0.704   6.974  1.00  6.04           O
ATOM    703  CB  ILE A  44       1.286  -0.144   8.481  1.00  6.80           C
ATOM    704  CG1 ILE A  44       2.820  -0.174   8.369  1.00 10.31           C
ATOM    705  CG2 ILE A  44       0.821  -0.732   9.824  1.00  7.39           C
ATOM    706  CD1 ILE A  44       3.624   0.678   9.350  1.00 13.90           C
ATOM      0  H   ILE A  44       0.787   0.488   5.784  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       0.612  -1.877   7.553  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       1.048   0.917   8.407  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       3.144  -1.209   8.481  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       3.088   0.136   7.359  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       1.368  -0.256  10.638  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44      -0.247  -0.552   9.950  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       1.012  -1.805   9.837  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       4.689   0.556   9.151  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       3.351   1.726   9.230  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       3.407   0.361  10.370  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.801  -1.306   7.806  1.00  6.75           N
ATOM    719  CA  PHE A  45      -3.187  -1.012   8.004  1.00  4.70           C
ATOM    720  C   PHE A  45      -3.360  -1.191   9.473  1.00  6.34           C
ATOM    721  O   PHE A  45      -3.364  -2.315   9.971  1.00  5.45           O
ATOM    722  CB  PHE A  45      -4.173  -1.882   7.207  1.00  5.51           C
ATOM    723  CG  PHE A  45      -5.490  -1.191   7.299  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -5.763   0.152   7.414  1.00  5.87           C
ATOM    725  CD2 PHE A  45      -6.582  -2.007   7.125  1.00  6.86           C
ATOM    726  CE1 PHE A  45      -7.005   0.740   7.376  1.00  6.64           C
ATOM    727  CE2 PHE A  45      -7.852  -1.481   7.116  1.00  6.68           C
ATOM    728  CZ  PHE A  45      -8.064  -0.129   7.257  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.549  -2.263   8.053  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -3.424  -0.014   7.635  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.856  -1.982   6.169  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -4.230  -2.889   7.621  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -4.917   0.810   7.547  1.00  5.87           H   new
ATOM      0  HD2 PHE A  45      -6.441  -3.070   6.994  1.00  6.86           H   new
ATOM      0  HE1 PHE A  45      -7.140   1.810   7.435  1.00  6.64           H   new
ATOM      0  HE2 PHE A  45      -8.699  -2.141   6.996  1.00  6.68           H   new
ATOM      0  HZ  PHE A  45      -9.074   0.254   7.274  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -3.624  -0.086  10.194  1.00  6.53           N
ATOM    739  CA  ALA A  46      -3.578  -0.001  11.621  1.00  7.15           C
ATOM    740  C   ALA A  46      -2.236  -0.304  12.192  1.00  9.00           C
ATOM    741  O   ALA A  46      -1.276   0.463  12.140  1.00 11.15           O
ATOM    742  CB  ALA A  46      -4.774  -0.675  12.313  1.00  8.99           C
ATOM      0  H   ALA A  46      -3.884   0.797   9.756  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -3.714   1.052  11.868  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -4.674  -0.573  13.394  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -5.699  -0.199  11.987  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -4.798  -1.732  12.050  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -2.189  -1.488  12.829  1.00  9.35           N
ATOM    749  CA  GLY A  47      -0.985  -2.109  13.288  1.00 11.68           C
ATOM    750  C   GLY A  47      -0.665  -3.290  12.437  1.00 11.14           C
ATOM    751  O   GLY A  47       0.455  -3.786  12.550  1.00 13.93           O
ATOM      0  H   GLY A  47      -3.025  -2.035  13.033  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47      -0.163  -1.394  13.257  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47      -1.099  -2.419  14.327  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -1.530  -3.824  11.557  1.00 10.47           N
ATOM    756  CA  LYS A  48      -1.200  -4.953  10.744  1.00  8.82           C
ATOM    757  C   LYS A  48      -0.270  -4.612   9.631  1.00  7.68           C
ATOM    758  O   LYS A  48      -0.562  -3.846   8.714  1.00  6.47           O
ATOM    759  CB  LYS A  48      -2.371  -5.783  10.191  1.00  9.74           C
ATOM    760  CG  LYS A  48      -3.238  -6.449  11.262  1.00 14.14           C
ATOM    761  CD  LYS A  48      -4.233  -7.329  10.503  1.00 16.32           C
ATOM    762  CE  LYS A  48      -5.350  -7.815  11.429  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -6.114  -8.815  10.651  1.00 23.92           N
ATOM      0  H   LYS A  48      -2.474  -3.467  11.407  1.00 10.47           H   new
ATOM      0  HA  LYS A  48      -0.704  -5.598  11.469  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -3.002  -5.137   9.581  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -1.974  -6.555   9.532  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -2.630  -7.044  11.943  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -3.756  -5.704  11.865  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -4.662  -6.767   9.673  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -3.713  -8.185  10.073  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -4.940  -8.257  12.337  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -5.990  -6.988  11.737  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -6.893  -9.185  11.232  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -6.502  -8.367   9.796  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -5.485  -9.597  10.378  1.00 23.92           H   new
ATOM    777  N   GLN A  49       1.014  -5.011   9.658  1.00  8.89           N
ATOM    778  CA  GLN A  49       2.051  -4.858   8.685  1.00  7.18           C
ATOM    779  C   GLN A  49       1.839  -5.779   7.533  1.00  8.23           C
ATOM    780  O   GLN A  49       1.748  -7.004   7.598  1.00  9.70           O
ATOM    781  CB  GLN A  49       3.424  -5.026   9.357  1.00 11.67           C
ATOM    782  CG  GLN A  49       3.679  -4.098  10.546  1.00 15.82           C
ATOM    783  CD  GLN A  49       5.172  -4.010  10.828  1.00 20.21           C
ATOM    784  OE1 GLN A  49       5.716  -2.932  11.060  1.00 23.23           O
ATOM    785  NE2 GLN A  49       5.841  -5.191  10.746  1.00 20.67           N
ATOM      0  H   GLN A  49       1.368  -5.508  10.476  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       2.020  -3.851   8.269  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       3.524  -6.058   9.693  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       4.200  -4.857   8.611  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       3.282  -3.105  10.335  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       3.156  -4.470  11.427  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       5.332  -6.053  10.550  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       6.852  -5.215  10.880  1.00 20.67           H   new
ATOM    794  N   LEU A  50       1.743  -5.195   6.326  1.00  6.51           N
ATOM    795  CA  LEU A  50       1.230  -5.946   5.223  1.00  7.41           C
ATOM    796  C   LEU A  50       2.181  -6.711   4.370  1.00  8.27           C
ATOM    797  O   LEU A  50       3.135  -6.161   3.821  1.00  8.34           O
ATOM    798  CB  LEU A  50       0.294  -5.215   4.245  1.00  7.13           C
ATOM    799  CG  LEU A  50      -0.627  -4.224   4.976  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -1.378  -3.253   4.049  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -1.674  -4.858   5.908  1.00  8.14           C
ATOM      0  H   LEU A  50       2.011  -4.233   6.116  1.00  6.51           H   new
ATOM      0  HA  LEU A  50       0.673  -6.643   5.849  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       0.888  -4.681   3.503  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -0.310  -5.944   3.705  1.00  7.13           H   new
ATOM      0  HG  LEU A  50       0.101  -3.681   5.579  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -2.004  -2.590   4.647  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -0.659  -2.661   3.483  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.004  -3.819   3.359  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -2.270  -4.073   6.373  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -2.325  -5.514   5.331  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -1.169  -5.437   6.682  1.00  8.14           H   new
ATOM    813  N   GLU A  51       1.956  -8.018   4.147  1.00  9.43           N
ATOM    814  CA  GLU A  51       2.704  -8.831   3.239  1.00 11.90           C
ATOM    815  C   GLU A  51       2.264  -8.753   1.818  1.00 11.49           C
ATOM    816  O   GLU A  51       1.077  -8.795   1.499  1.00  9.88           O
ATOM    817  CB  GLU A  51       2.514 -10.258   3.779  1.00 16.56           C
ATOM    818  CG  GLU A  51       3.096 -10.424   5.184  1.00 26.06           C
ATOM    819  CD  GLU A  51       3.070 -11.845   5.728  1.00 29.86           C
ATOM    820  OE1 GLU A  51       2.078 -12.622   5.706  1.00 32.13           O
ATOM    821  OE2 GLU A  51       4.180 -12.210   6.199  1.00 33.44           O
ATOM      0  H   GLU A  51       1.216  -8.533   4.624  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       3.740  -8.493   3.204  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       1.451 -10.500   3.796  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51       2.991 -10.967   3.103  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       4.128 -10.073   5.177  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       2.544  -9.779   5.868  1.00 26.06           H   new
ATOM    828  N   ASP A  52       3.254  -8.814   0.910  1.00 12.71           N
ATOM    829  CA  ASP A  52       3.149  -8.445  -0.467  1.00 16.56           C
ATOM    830  C   ASP A  52       2.231  -9.294  -1.278  1.00 15.83           C
ATOM    831  O   ASP A  52       1.451  -8.869  -2.128  1.00 17.21           O
ATOM    832  CB  ASP A  52       4.550  -8.439  -1.101  1.00 21.05           C
ATOM    833  CG  ASP A  52       5.570  -7.524  -0.438  1.00 25.12           C
ATOM    834  OD1 ASP A  52       5.403  -6.280  -0.552  1.00 25.82           O
ATOM    835  OD2 ASP A  52       6.543  -8.107   0.110  1.00 28.37           O
ATOM      0  H   ASP A  52       4.188  -9.143   1.155  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       2.704  -7.450  -0.475  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       4.939  -9.457  -1.087  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       4.454  -8.148  -2.147  1.00 21.05           H   new
ATOM    840  N   GLY A  53       2.279 -10.619  -1.053  1.00 15.00           N
ATOM    841  CA  GLY A  53       1.569 -11.613  -1.797  1.00 11.77           C
ATOM    842  C   GLY A  53       0.244 -11.962  -1.212  1.00 11.10           C
ATOM    843  O   GLY A  53      -0.227 -13.079  -1.423  1.00 11.25           O
ATOM      0  H   GLY A  53       2.848 -11.020  -0.307  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53       1.424 -11.257  -2.817  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53       2.179 -12.514  -1.858  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -0.306 -11.051  -0.390  1.00  8.53           N
ATOM    848  CA  ARG A  54      -1.698 -11.100  -0.064  1.00  9.05           C
ATOM    849  C   ARG A  54      -2.368  -9.995  -0.805  1.00  8.96           C
ATOM    850  O   ARG A  54      -1.675  -9.149  -1.367  1.00 11.60           O
ATOM    851  CB  ARG A  54      -2.028 -11.009   1.436  1.00  7.97           C
ATOM    852  CG  ARG A  54      -1.485 -12.247   2.152  1.00  9.62           C
ATOM    853  CD  ARG A  54      -1.686 -12.111   3.663  1.00 12.20           C
ATOM    854  NE  ARG A  54      -0.916 -13.096   4.472  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -1.425 -13.456   5.687  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -2.756 -13.508   5.986  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -0.568 -13.721   6.716  1.00 25.50           N
ATOM      0  H   ARG A  54       0.208 -10.286   0.046  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -2.062 -12.084  -0.358  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -1.589 -10.107   1.862  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -3.106 -10.937   1.579  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -1.994 -13.140   1.788  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -0.426 -12.371   1.928  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -1.399 -11.104   3.967  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -2.747 -12.222   3.889  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -0.039 -13.488   4.130  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -3.448 -13.268   5.276  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -3.059 -13.787   6.919  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54       0.439 -13.649   6.572  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -0.935 -13.991   7.629  1.00 25.50           H   new
ATOM    871  N   THR A  55      -3.710 -10.028  -0.894  1.00  9.05           N
ATOM    872  CA  THR A  55      -4.545  -9.156  -1.660  1.00  9.03           C
ATOM    873  C   THR A  55      -5.235  -8.159  -0.794  1.00  8.15           C
ATOM    874  O   THR A  55      -5.101  -8.269   0.424  1.00  5.91           O
ATOM    875  CB  THR A  55      -5.520  -9.894  -2.529  1.00 11.15           C
ATOM    876  OG1 THR A  55      -6.524 -10.697  -1.927  1.00 11.95           O
ATOM    877  CG2 THR A  55      -4.837 -10.827  -3.544  1.00 11.71           C
ATOM      0  H   THR A  55      -4.255 -10.725  -0.386  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -3.882  -8.614  -2.334  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -6.013  -9.026  -2.967  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -6.134 -11.551  -1.645  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -5.596 -11.332  -4.142  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -4.189 -10.242  -4.197  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -4.241 -11.569  -3.013  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -6.050  -7.200  -1.268  1.00  6.91           N
ATOM    886  CA  LEU A  56      -6.861  -6.261  -0.557  1.00  8.29           C
ATOM    887  C   LEU A  56      -8.092  -6.993  -0.146  1.00  8.05           C
ATOM    888  O   LEU A  56      -8.569  -6.760   0.964  1.00 10.17           O
ATOM    889  CB  LEU A  56      -7.032  -5.002  -1.424  1.00  6.60           C
ATOM    890  CG  LEU A  56      -5.714  -4.277  -1.744  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -6.024  -3.041  -2.604  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.014  -3.773  -0.471  1.00  9.85           C
ATOM      0  H   LEU A  56      -6.150  -7.071  -2.275  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -6.426  -5.874   0.365  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -7.517  -5.281  -2.359  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -7.700  -4.309  -0.912  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -5.065  -4.987  -2.256  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -5.096  -2.518  -2.837  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -6.507  -3.354  -3.530  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -6.688  -2.373  -2.055  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.087  -3.267  -0.741  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -5.669  -3.076   0.053  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -4.789  -4.618   0.180  1.00  9.85           H   new
ATOM    904  N   SER A  57      -8.666  -7.919  -0.935  1.00  8.92           N
ATOM    905  CA  SER A  57      -9.625  -8.903  -0.540  1.00  9.00           C
ATOM    906  C   SER A  57      -9.233  -9.724   0.641  1.00  9.44           C
ATOM    907  O   SER A  57     -10.059  -9.956   1.523  1.00 10.91           O
ATOM    908  CB  SER A  57      -9.957  -9.780  -1.759  1.00 10.32           C
ATOM    909  OG  SER A  57     -10.603  -8.978  -2.736  1.00 13.59           O
ATOM      0  H   SER A  57      -8.440  -7.983  -1.928  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -10.511  -8.369  -0.198  1.00  9.00           H   new
ATOM      0  HB2 SER A  57      -9.046 -10.216  -2.170  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -10.601 -10.608  -1.464  1.00 10.32           H   new
ATOM      0  HG  SER A  57      -9.949  -8.377  -3.151  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -7.974 -10.153   0.838  1.00  9.11           N
ATOM    916  CA  ASP A  58      -7.416 -10.951   1.885  1.00  7.91           C
ATOM    917  C   ASP A  58      -7.371 -10.151   3.141  1.00  9.12           C
ATOM    918  O   ASP A  58      -7.789 -10.665   4.178  1.00  8.61           O
ATOM    919  CB  ASP A  58      -5.980 -11.457   1.662  1.00  8.41           C
ATOM    920  CG  ASP A  58      -5.915 -12.569   0.626  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -6.350 -13.721   0.898  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -5.286 -12.326  -0.438  1.00 10.05           O
ATOM      0  H   ASP A  58      -7.250  -9.902   0.165  1.00  9.11           H   new
ATOM      0  HA  ASP A  58      -8.068 -11.823   1.924  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -5.350 -10.627   1.341  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -5.574 -11.819   2.606  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -6.734  -8.968   3.078  1.00  7.97           N
ATOM    928  CA  TYR A  59      -6.595  -8.106   4.211  1.00  8.45           C
ATOM    929  C   TYR A  59      -7.839  -7.350   4.530  1.00 10.98           C
ATOM    930  O   TYR A  59      -7.871  -6.571   5.482  1.00 12.95           O
ATOM    931  CB  TYR A  59      -5.417  -7.138   4.007  1.00  7.94           C
ATOM    932  CG  TYR A  59      -4.166  -7.741   4.545  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -3.892  -7.908   5.882  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -3.172  -8.116   3.671  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -2.671  -8.342   6.341  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -1.916  -8.513   4.064  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -1.698  -8.636   5.416  1.00  6.76           C
ATOM    938  OH  TYR A  59      -0.398  -8.939   5.875  1.00  7.63           O
ATOM      0  H   TYR A  59      -6.308  -8.604   2.226  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -6.395  -8.750   5.068  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -5.297  -6.916   2.947  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -5.621  -6.193   4.510  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -4.668  -7.689   6.601  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -3.391  -8.097   2.614  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -2.482  -8.449   7.399  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -1.137  -8.719   3.345  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -0.089  -9.770   5.458  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -8.925  -7.540   3.760  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.171  -6.851   3.891  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.116  -5.366   3.993  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.678  -4.687   4.851  1.00 14.26           O
ATOM    952  CB  ASN A  60     -10.956  -7.481   5.053  1.00 19.23           C
ATOM    953  CG  ASN A  60     -11.567  -8.857   4.831  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -12.779  -9.068   4.851  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -10.742  -9.928   4.685  1.00 24.09           N
ATOM      0  H   ASN A  60      -8.933  -8.218   2.998  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -10.687  -6.988   2.941  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.289  -7.545   5.912  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -11.760  -6.797   5.324  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -11.134 -10.865   4.597  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60      -9.731  -9.794   4.664  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -9.299  -4.828   3.069  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.056  -3.438   2.837  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.118  -2.915   1.932  1.00 13.74           C
ATOM    965  O   ILE A  61     -10.303  -3.429   0.830  1.00 14.60           O
ATOM    966  CB  ILE A  61      -7.687  -3.118   2.313  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -6.698  -3.239   3.484  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.535  -1.688   1.767  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.230  -3.364   3.080  1.00 11.42           C
ATOM      0  H   ILE A  61      -8.764  -5.418   2.431  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.092  -2.941   3.806  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -7.502  -3.811   1.492  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -6.809  -2.365   4.126  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -6.970  -4.109   4.081  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.516  -1.542   1.409  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.234  -1.536   0.944  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.747  -0.971   2.560  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -4.612  -3.444   3.974  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -5.096  -4.255   2.466  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -4.933  -2.483   2.511  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -10.859  -1.918   2.448  1.00 13.97           N
ATOM    982  CA  GLN A  62     -11.868  -1.338   1.617  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.536   0.032   1.134  1.00 13.94           C
ATOM    984  O   GLN A  62     -10.511   0.639   1.440  1.00 12.15           O
ATOM    985  CB  GLN A  62     -13.228  -1.458   2.325  1.00 19.53           C
ATOM    986  CG  GLN A  62     -13.102  -0.810   3.705  1.00 26.38           C
ATOM    987  CD  GLN A  62     -14.500  -0.505   4.225  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -14.998   0.620   4.206  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -15.150  -1.554   4.795  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.770  -1.530   3.387  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -11.925  -1.903   0.687  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -14.006  -0.965   1.742  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -13.517  -2.505   2.421  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -12.580  -1.478   4.391  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -12.513   0.105   3.641  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -14.720  -2.479   4.800  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -16.068  -1.416   5.217  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -12.363   0.587   0.230  1.00 11.73           N
ATOM    999  CA  LYS A  63     -12.127   1.902  -0.279  1.00 11.97           C
ATOM   1000  C   LYS A  63     -12.127   2.947   0.783  1.00 10.41           C
ATOM   1001  O   LYS A  63     -12.826   2.870   1.792  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -13.141   2.312  -1.360  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -14.614   2.366  -0.949  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -15.618   2.837  -2.003  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -17.027   2.586  -1.460  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -18.083   2.761  -2.482  1.00 25.97           N
ATOM      0  H   LYS A  63     -13.192   0.127  -0.147  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -11.132   1.844  -0.720  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -12.858   3.296  -1.734  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -13.048   1.615  -2.193  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -14.910   1.369  -0.622  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -14.699   3.023  -0.084  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -15.476   3.896  -2.218  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -15.469   2.299  -2.939  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -17.081   1.573  -1.060  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -17.217   3.267  -0.630  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -19.013   2.578  -2.055  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -18.055   3.735  -2.847  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -17.924   2.094  -3.264  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -11.224   3.936   0.653  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -11.176   5.009   1.596  1.00 10.94           C
ATOM   1022  C   GLU A  64     -10.665   4.712   2.964  1.00  9.74           C
ATOM   1023  O   GLU A  64     -10.762   5.440   3.950  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -12.453   5.866   1.601  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -13.092   6.082   0.227  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -14.175   7.151   0.260  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -14.970   7.129   1.237  1.00 31.72           O
ATOM   1028  OE2 GLU A  64     -14.308   8.018  -0.645  1.00 32.61           O
ATOM      0  H   GLU A  64     -10.534   3.993  -0.097  1.00 10.04           H   new
ATOM      0  HA  GLU A  64     -10.368   5.618   1.191  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -13.186   5.395   2.256  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -12.218   6.839   2.033  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -12.322   6.369  -0.489  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -13.520   5.143  -0.124  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -9.910   3.601   3.034  1.00  6.85           N
ATOM   1036  CA  SER A  65      -9.192   3.147   4.185  1.00  6.90           C
ATOM   1037  C   SER A  65      -7.837   3.766   4.216  1.00  4.72           C
ATOM   1038  O   SER A  65      -7.060   3.644   3.270  1.00  3.91           O
ATOM   1039  CB  SER A  65      -9.014   1.619   4.200  1.00  7.28           C
ATOM   1040  OG  SER A  65     -10.265   0.953   4.292  1.00 10.56           O
ATOM      0  H   SER A  65      -9.794   2.979   2.234  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -9.780   3.440   5.055  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -8.497   1.302   3.294  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -8.385   1.333   5.043  1.00  7.28           H   new
ATOM      0  HG  SER A  65     -10.506   0.587   3.415  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -7.482   4.446   5.320  1.00  4.48           N
ATOM   1047  CA  THR A  66      -6.211   5.062   5.542  1.00  3.80           C
ATOM   1048  C   THR A  66      -5.147   4.063   5.841  1.00  4.60           C
ATOM   1049  O   THR A  66      -4.929   3.593   6.957  1.00  5.33           O
ATOM   1050  CB  THR A  66      -6.214   6.153   6.571  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -7.297   7.067   6.483  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -4.955   7.028   6.449  1.00  3.40           C
ATOM      0  H   THR A  66      -8.121   4.573   6.105  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -5.982   5.547   4.593  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -6.280   5.603   7.510  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -7.216   7.739   7.192  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -4.982   7.811   7.206  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -4.068   6.412   6.596  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -4.922   7.482   5.459  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -4.308   3.724   4.846  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -3.077   3.000   4.939  1.00  3.85           C
ATOM   1062  C   LEU A  67      -1.906   3.859   5.272  1.00  3.80           C
ATOM   1063  O   LEU A  67      -1.886   4.989   4.787  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -2.661   2.158   3.722  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -3.822   1.384   3.075  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -3.401   0.590   1.827  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -4.378   0.288   4.000  1.00  8.12           C
ATOM      0  H   LEU A  67      -4.514   3.984   3.881  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -3.328   2.316   5.749  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -2.213   2.813   2.975  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -1.891   1.450   4.028  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -4.543   2.169   2.847  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -4.266   0.067   1.419  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -3.004   1.274   1.077  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -2.634  -0.135   2.099  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -5.196  -0.231   3.499  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -3.587  -0.424   4.236  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -4.746   0.741   4.921  1.00  8.12           H   new
ATOM   1079  N   HIS A  68      -0.949   3.399   6.098  1.00  2.94           N
ATOM   1080  CA  HIS A  68       0.209   4.125   6.517  1.00  4.17           C
ATOM   1081  C   HIS A  68       1.418   3.580   5.838  1.00  5.32           C
ATOM   1082  O   HIS A  68       1.687   2.383   5.759  1.00  7.70           O
ATOM   1083  CB  HIS A  68       0.398   4.076   8.042  1.00  5.57           C
ATOM   1084  CG  HIS A  68       1.536   4.886   8.589  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       1.998   6.047   8.003  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       2.296   4.704   9.702  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       2.999   6.542   8.781  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       3.187   5.751   9.821  1.00 16.30           N
ATOM      0  H   HIS A  68      -0.987   2.461   6.498  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       0.066   5.169   6.237  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68      -0.524   4.416   8.514  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       0.543   3.037   8.337  1.00  5.57           H   new
ATOM      0  HD1 HIS A  68       1.650   6.461   7.138  1.00 13.74           H   new
ATOM      0  HD2 HIS A  68       2.215   3.871  10.385  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       3.555   7.445   8.578  1.00 14.75           H   new
ATOM   1096  N   LEU A  69       2.231   4.437   5.194  1.00  5.29           N
ATOM   1097  CA  LEU A  69       3.491   4.090   4.614  1.00  3.97           C
ATOM   1098  C   LEU A  69       4.582   4.447   5.563  1.00  5.07           C
ATOM   1099  O   LEU A  69       4.733   5.590   5.991  1.00  4.34           O
ATOM   1100  CB  LEU A  69       3.639   4.746   3.231  1.00  6.08           C
ATOM   1101  CG  LEU A  69       4.938   4.449   2.463  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.283   2.986   2.138  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       4.926   5.168   1.103  1.00  6.87           C
ATOM      0  H   LEU A  69       1.997   5.422   5.072  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       3.553   3.015   4.444  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       2.798   4.431   2.613  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       3.556   5.826   3.356  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       5.688   4.796   3.174  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.227   2.947   1.595  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.373   2.419   3.065  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.493   2.554   1.524  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       5.851   4.950   0.568  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       4.076   4.820   0.515  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       4.843   6.243   1.261  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       5.476   3.483   5.851  1.00  4.29           N
ATOM   1116  CA  VAL A  70       6.702   3.596   6.577  1.00  6.26           C
ATOM   1117  C   VAL A  70       7.749   3.073   5.654  1.00  9.22           C
ATOM   1118  O   VAL A  70       7.662   2.070   4.948  1.00  9.36           O
ATOM   1119  CB  VAL A  70       6.684   2.868   7.889  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       8.130   2.814   8.410  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       5.780   3.544   8.933  1.00  8.54           C
ATOM      0  H   VAL A  70       5.319   2.524   5.540  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       6.891   4.631   6.863  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       6.276   1.870   7.728  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       8.153   2.290   9.365  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       8.756   2.286   7.691  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       8.507   3.828   8.543  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       5.807   2.973   9.861  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       6.135   4.558   9.120  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       4.757   3.581   8.559  1.00  8.54           H   new
ATOM   1131  N   LEU A  71       8.885   3.790   5.594  1.00 12.71           N
ATOM   1132  CA  LEU A  71       9.982   3.395   4.766  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.035   2.756   5.604  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.716   3.343   6.443  1.00 19.26           O
ATOM   1135  CB  LEU A  71      10.586   4.577   3.989  1.00 17.10           C
ATOM   1136  CG  LEU A  71       9.708   5.337   2.980  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      10.561   6.444   2.339  1.00 19.57           C
ATOM   1138  CD2 LEU A  71       9.175   4.344   1.933  1.00 17.51           C
ATOM      0  H   LEU A  71       9.044   4.648   6.122  1.00 12.71           H   new
ATOM      0  HA  LEU A  71       9.599   2.685   4.033  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      10.947   5.300   4.720  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      11.458   4.205   3.451  1.00 17.10           H   new
ATOM      0  HG  LEU A  71       8.849   5.799   3.467  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71       9.958   6.997   1.619  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      10.916   7.124   3.113  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      11.415   5.997   1.830  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71       8.551   4.874   1.213  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      10.013   3.878   1.414  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71       8.583   3.575   2.429  1.00 17.51           H   new