USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  22 THR OG1 :   rot  -40:sc=   0.139
USER  MOD Set 1.2: A  25 ASN     :      amide:sc=     0.8  K(o=0.94,f=-5.2!)
USER  MOD Set 2.1: A   7 THR OG1 :   rot  114:sc=    0.15
USER  MOD Set 2.2: A   9 THR OG1 :   rot  180:sc=  0.0327
USER  MOD Single : A   1 MET CE  :methyl -171:sc=  -0.077   (180deg=-0.132)
USER  MOD Single : A   1 MET N   :NH3+    176:sc=    1.21   (180deg=1.19)
USER  MOD Single : A   2 GLN     :      amide:sc= -0.0157  X(o=-0.016,f=0)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+   -128:sc=    1.21   (180deg=-0.223)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  -92:sc= 0.00253
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  27 LYS NZ  :NH3+   -154:sc=    1.22   (180deg=0.807)
USER  MOD Single : A  29 LYS NZ  :NH3+   -174:sc= -0.0227   (180deg=-0.0702)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.754  K(o=-0.75,f=-4.4!)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  X(o=0,f=-0.2)
USER  MOD Single : A  41 GLN     :      amide:sc=  0.0675  K(o=0.067,f=-2.9)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=   0.948  K(o=0.95,f=-5.3!)
USER  MOD Single : A  55 THR OG1 :   rot -170:sc=   0.514
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  100:sc=    1.04
USER  MOD Single : A  60 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  62 GLN     :      amide:sc=  0.0392  X(o=0.039,f=-0.17)
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 SER OG  :   rot  -99:sc=  0.0156
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc=  -0.173  X(o=-0.17,f=-0.018)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -12.594   1.932  -5.789  1.00  9.67           N
ATOM      2  CA  MET A   1     -12.558   2.488  -4.418  1.00 10.38           C
ATOM      3  C   MET A   1     -11.352   3.262  -4.010  1.00  9.62           C
ATOM      4  O   MET A   1     -10.211   2.803  -4.039  1.00  9.62           O
ATOM      5  CB  MET A   1     -13.013   1.386  -3.446  1.00 13.77           C
ATOM      6  CG  MET A   1     -12.025   0.272  -3.095  1.00 16.29           C
ATOM      7  SD  MET A   1     -12.378  -0.839  -1.700  1.00 17.17           S
ATOM      8  CE  MET A   1     -10.670  -1.439  -1.558  1.00 16.11           C
ATOM      0  H1  MET A   1     -13.457   1.364  -5.911  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -12.592   2.710  -6.479  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -11.759   1.331  -5.942  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.266   3.316  -4.388  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -13.314   1.868  -2.516  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.904   0.919  -3.867  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.905  -0.349  -3.983  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -11.060   0.741  -2.901  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.635  -2.274  -0.858  1.00 16.11           H   new
ATOM      0  HE2 MET A   1     -10.318  -1.770  -2.535  1.00 16.11           H   new
ATOM      0  HE3 MET A   1     -10.031  -0.634  -1.196  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -11.494   4.562  -3.697  1.00  9.27           N
ATOM     21  CA  GLN A   2     -10.479   5.491  -3.306  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.975   5.224  -1.930  1.00  8.72           C
ATOM     23  O   GLN A   2     -10.769   5.117  -0.997  1.00  8.22           O
ATOM     24  CB  GLN A   2     -10.757   7.003  -3.363  1.00 14.46           C
ATOM     25  CG  GLN A   2     -11.016   7.500  -4.787  1.00 17.01           C
ATOM     26  CD  GLN A   2     -11.224   9.002  -4.919  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -10.592   9.688  -5.720  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -12.114   9.565  -4.059  1.00 19.49           N
ATOM      0  H   GLN A   2     -12.413   5.005  -3.721  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.762   5.291  -4.103  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -11.620   7.234  -2.739  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -9.907   7.541  -2.943  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2     -10.174   7.209  -5.415  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -11.897   6.991  -5.178  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -12.629   8.979  -3.402  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -12.267  10.573  -4.071  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -8.647   5.168  -1.722  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.979   4.729  -0.536  1.00  5.07           C
ATOM     39  C   ILE A   3      -6.930   5.777  -0.386  1.00  4.01           C
ATOM     40  O   ILE A   3      -6.600   6.471  -1.347  1.00  4.61           O
ATOM     41  CB  ILE A   3      -7.301   3.395  -0.635  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -6.510   3.287  -1.950  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -8.372   2.296  -0.526  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -5.468   2.169  -1.940  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.987   5.454  -2.445  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -8.688   4.605   0.282  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -6.584   3.276   0.177  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -7.206   3.118  -2.772  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -6.012   4.237  -2.145  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.897   1.317  -0.596  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.886   2.382   0.431  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -9.093   2.409  -1.336  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -4.947   2.149  -2.897  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -4.750   2.348  -1.140  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -5.963   1.212  -1.776  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -6.417   6.031   0.831  1.00  4.55           N
ATOM     57  CA  PHE A   4      -5.352   6.934   1.141  1.00  4.68           C
ATOM     58  C   PHE A   4      -4.067   6.273   1.503  1.00  5.30           C
ATOM     59  O   PHE A   4      -4.072   5.609   2.538  1.00  5.58           O
ATOM     60  CB  PHE A   4      -5.679   7.858   2.326  1.00  4.83           C
ATOM     61  CG  PHE A   4      -6.856   8.674   1.914  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -6.693   9.762   1.090  1.00  6.69           C
ATOM     63  CD2 PHE A   4      -8.133   8.428   2.363  1.00  8.34           C
ATOM     64  CE1 PHE A   4      -7.736  10.632   0.878  1.00  9.10           C
ATOM     65  CE2 PHE A   4      -9.229   9.209   2.080  1.00 10.61           C
ATOM     66  CZ  PHE A   4      -8.991  10.363   1.372  1.00  8.90           C
ATOM      0  H   PHE A   4      -6.777   5.567   1.665  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -5.241   7.489   0.209  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -5.904   7.277   3.220  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -4.829   8.497   2.566  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -5.742   9.934   0.607  1.00  6.69           H   new
ATOM      0  HD2 PHE A   4      -8.286   7.557   2.983  1.00  8.34           H   new
ATOM      0  HE1 PHE A   4      -7.568  11.539   0.316  1.00  9.10           H   new
ATOM      0  HE2 PHE A   4     -10.223   8.931   2.397  1.00 10.61           H   new
ATOM      0  HZ  PHE A   4      -9.795  11.063   1.202  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -2.945   6.454   0.783  1.00  4.44           N
ATOM     77  CA  VAL A   5      -1.750   5.750   1.131  1.00  3.87           C
ATOM     78  C   VAL A   5      -0.795   6.811   1.558  1.00  4.93           C
ATOM     79  O   VAL A   5      -0.255   7.610   0.794  1.00  6.84           O
ATOM     80  CB  VAL A   5      -1.193   4.843   0.075  1.00  2.99           C
ATOM     81  CG1 VAL A   5      -0.020   4.018   0.630  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -2.277   3.915  -0.498  1.00  9.13           C
ATOM      0  H   VAL A   5      -2.864   7.074  -0.023  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -1.962   5.032   1.923  1.00  3.87           H   new
ATOM      0  HB  VAL A   5      -0.825   5.470  -0.737  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       0.369   3.367  -0.153  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       0.769   4.689   0.969  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5      -0.365   3.412   1.468  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -1.839   3.271  -1.261  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -2.690   3.301   0.302  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -3.072   4.515  -0.942  1.00  9.13           H   new
ATOM     92  N   LYS A   6      -0.632   6.874   2.891  1.00  6.04           N
ATOM     93  CA  LYS A   6       0.134   7.807   3.657  1.00  6.12           C
ATOM     94  C   LYS A   6       1.540   7.360   3.867  1.00  6.57           C
ATOM     95  O   LYS A   6       1.838   6.285   4.386  1.00  5.76           O
ATOM     96  CB  LYS A   6      -0.601   8.202   4.949  1.00  7.45           C
ATOM     97  CG  LYS A   6       0.160   9.164   5.865  1.00 11.12           C
ATOM     98  CD  LYS A   6      -0.665   9.540   7.097  1.00 14.54           C
ATOM     99  CE  LYS A   6       0.046  10.509   8.043  1.00 18.84           C
ATOM    100  NZ  LYS A   6      -0.951  11.075   8.978  1.00 20.55           N
ATOM      0  H   LYS A   6      -1.090   6.193   3.497  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       0.226   8.722   3.072  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6      -1.554   8.659   4.681  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6      -0.829   7.296   5.510  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       1.096   8.703   6.180  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       0.419  10.066   5.311  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6      -1.604   9.988   6.771  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6      -0.918   8.632   7.644  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       0.831   9.991   8.595  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       0.528  11.306   7.476  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6      -0.481  11.737   9.628  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -1.684  11.580   8.440  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6      -1.390  10.307   9.524  1.00 20.55           H   new
ATOM    114  N   THR A   7       2.489   8.213   3.443  1.00  7.41           N
ATOM    115  CA  THR A   7       3.880   7.884   3.418  1.00  7.48           C
ATOM    116  C   THR A   7       4.537   7.966   4.753  1.00  8.75           C
ATOM    117  O   THR A   7       3.964   8.394   5.754  1.00  8.58           O
ATOM    118  CB  THR A   7       4.679   8.577   2.354  1.00  9.61           C
ATOM    119  OG1 THR A   7       4.707   9.985   2.532  1.00 11.78           O
ATOM    120  CG2 THR A   7       4.028   8.214   1.009  1.00  9.17           C
ATOM      0  H   THR A   7       2.284   9.155   3.109  1.00  7.41           H   new
ATOM      0  HA  THR A   7       3.879   6.833   3.131  1.00  7.48           H   new
ATOM      0  HB  THR A   7       5.718   8.251   2.398  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       5.620  10.269   2.748  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       4.575   8.696   0.198  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       4.054   7.133   0.872  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       2.993   8.556   1.002  1.00  9.17           H   new
ATOM    128  N   LEU A   8       5.758   7.434   4.944  1.00  9.84           N
ATOM    129  CA  LEU A   8       6.534   7.531   6.141  1.00 14.15           C
ATOM    130  C   LEU A   8       6.845   8.921   6.580  1.00 17.37           C
ATOM    131  O   LEU A   8       6.806   9.227   7.770  1.00 17.01           O
ATOM    132  CB  LEU A   8       7.812   6.707   5.910  1.00 16.63           C
ATOM    133  CG  LEU A   8       8.692   6.673   7.171  1.00 18.88           C
ATOM    134  CD1 LEU A   8       8.017   6.206   8.471  1.00 18.59           C
ATOM    135  CD2 LEU A   8       9.896   5.762   6.879  1.00 19.31           C
ATOM      0  H   LEU A   8       6.233   6.902   4.215  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       5.941   7.139   6.967  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       7.544   5.690   5.623  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       8.377   7.133   5.081  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       8.963   7.711   7.366  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       8.742   6.227   9.285  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       7.186   6.870   8.708  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8       7.644   5.190   8.343  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      10.540   5.718   7.757  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8       9.543   4.759   6.637  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      10.459   6.162   6.036  1.00 19.31           H   new
ATOM    147  N   THR A   9       7.312   9.779   5.655  1.00 18.33           N
ATOM    148  CA  THR A   9       7.636  11.170   5.717  1.00 19.24           C
ATOM    149  C   THR A   9       6.398  11.938   6.028  1.00 19.48           C
ATOM    150  O   THR A   9       6.438  12.403   7.166  1.00 23.14           O
ATOM    151  CB  THR A   9       8.136  11.802   4.452  1.00 18.97           C
ATOM    152  OG1 THR A   9       7.581  11.378   3.216  1.00 20.24           O
ATOM    153  CG2 THR A   9       9.642  11.489   4.414  1.00 19.70           C
ATOM      0  H   THR A   9       7.488   9.431   4.712  1.00 18.33           H   new
ATOM      0  HA  THR A   9       8.431  11.210   6.461  1.00 19.24           H   new
ATOM      0  HB  THR A   9       7.847  12.851   4.511  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       7.999  11.875   2.482  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      10.081  11.920   3.514  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      10.125  11.916   5.293  1.00 19.70           H   new
ATOM      0 HG23 THR A   9       9.789  10.409   4.408  1.00 19.70           H   new
ATOM    161  N   GLY A  10       5.394  12.066   5.142  1.00 19.43           N
ATOM    162  CA  GLY A  10       4.212  12.800   5.474  1.00 18.74           C
ATOM    163  C   GLY A  10       3.369  13.240   4.327  1.00 17.62           C
ATOM    164  O   GLY A  10       2.984  14.405   4.244  1.00 19.74           O
ATOM      0  H   GLY A  10       5.399  11.665   4.204  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       3.600  12.184   6.133  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       4.505  13.682   6.043  1.00 18.74           H   new
ATOM    168  N   LYS A  11       3.106  12.358   3.346  1.00 13.56           N
ATOM    169  CA  LYS A  11       2.439  12.702   2.129  1.00 11.91           C
ATOM    170  C   LYS A  11       1.301  11.754   1.970  1.00 10.18           C
ATOM    171  O   LYS A  11       1.424  10.584   2.330  1.00  9.10           O
ATOM    172  CB  LYS A  11       3.371  12.477   0.926  1.00 13.43           C
ATOM    173  CG  LYS A  11       2.722  12.913  -0.389  1.00 16.69           C
ATOM    174  CD  LYS A  11       3.783  12.903  -1.491  1.00 17.92           C
ATOM    175  CE  LYS A  11       3.212  13.132  -2.892  1.00 20.81           C
ATOM    176  NZ  LYS A  11       4.315  13.016  -3.872  1.00 21.93           N
ATOM      0  H   LYS A  11       3.366  11.373   3.402  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       2.125  13.745   2.167  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       4.297  13.033   1.075  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       3.638  11.422   0.866  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       1.904  12.241  -0.647  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       2.294  13.910  -0.286  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       4.523  13.675  -1.279  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       4.305  11.947  -1.472  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       2.434  12.400  -3.109  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       2.750  14.117  -2.957  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       4.325  13.857  -4.484  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       5.222  12.944  -3.367  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       4.174  12.166  -4.454  1.00 21.93           H   new
ATOM    190  N   THR A  12       0.147  12.223   1.464  1.00  9.63           N
ATOM    191  CA  THR A  12      -0.943  11.336   1.195  1.00  9.85           C
ATOM    192  C   THR A  12      -1.128  11.283  -0.282  1.00 11.66           C
ATOM    193  O   THR A  12      -1.165  12.284  -0.996  1.00 12.33           O
ATOM    194  CB  THR A  12      -2.189  11.684   1.954  1.00 10.85           C
ATOM    195  OG1 THR A  12      -1.984  12.002   3.323  1.00 10.91           O
ATOM    196  CG2 THR A  12      -3.076  10.428   1.997  1.00  9.63           C
ATOM      0  H   THR A  12      -0.031  13.203   1.243  1.00  9.63           H   new
ATOM      0  HA  THR A  12      -0.707  10.336   1.559  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -2.608  12.551   1.443  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -2.844  12.217   3.741  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -3.993  10.649   2.544  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -3.324  10.123   0.980  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -2.540   9.621   2.497  1.00  9.63           H   new
ATOM    204  N   ILE A  13      -1.242  10.074  -0.860  1.00 10.42           N
ATOM    205  CA  ILE A  13      -1.610  10.001  -2.240  1.00 11.84           C
ATOM    206  C   ILE A  13      -2.846   9.169  -2.276  1.00 10.55           C
ATOM    207  O   ILE A  13      -3.111   8.306  -1.440  1.00 11.92           O
ATOM    208  CB  ILE A  13      -0.646   9.346  -3.184  1.00 14.86           C
ATOM    209  CG1 ILE A  13      -0.437   7.830  -3.030  1.00 14.87           C
ATOM    210  CG2 ILE A  13       0.604  10.241  -3.116  1.00 17.08           C
ATOM    211  CD1 ILE A  13       0.572   7.124  -3.935  1.00 16.46           C
ATOM      0  H   ILE A  13      -1.087   9.180  -0.395  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -1.687  11.034  -2.581  1.00 11.84           H   new
ATOM      0  HB  ILE A  13      -1.046   9.303  -4.197  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13      -0.141   7.642  -1.998  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13      -1.404   7.348  -3.177  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       1.373   9.842  -3.777  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13       0.345  11.252  -3.429  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       0.981  10.263  -2.093  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       0.595   6.061  -3.695  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       0.280   7.254  -4.977  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       1.562   7.553  -3.780  1.00 16.46           H   new
ATOM    223  N   THR A  14      -3.800   9.448  -3.182  1.00  9.39           N
ATOM    224  CA  THR A  14      -5.138   8.944  -3.204  1.00  9.63           C
ATOM    225  C   THR A  14      -5.271   8.067  -4.401  1.00 11.20           C
ATOM    226  O   THR A  14      -5.284   8.586  -5.516  1.00 11.63           O
ATOM    227  CB  THR A  14      -6.117  10.078  -3.283  1.00 10.38           C
ATOM    228  OG1 THR A  14      -5.865  11.058  -2.287  1.00 16.30           O
ATOM    229  CG2 THR A  14      -7.476   9.471  -2.896  1.00 11.66           C
ATOM      0  H   THR A  14      -3.619  10.078  -3.963  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -5.348   8.382  -2.294  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -6.064  10.531  -4.273  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -6.392  10.853  -1.486  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -8.243  10.244  -2.932  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -7.731   8.674  -3.595  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -7.418   9.063  -1.887  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -5.402   6.745  -4.189  1.00  8.29           N
ATOM    238  CA  LEU A  15      -5.336   5.802  -5.262  1.00  9.03           C
ATOM    239  C   LEU A  15      -6.626   5.082  -5.461  1.00  8.59           C
ATOM    240  O   LEU A  15      -7.347   4.906  -4.480  1.00  7.79           O
ATOM    241  CB  LEU A  15      -4.227   4.770  -5.001  1.00 11.08           C
ATOM    242  CG  LEU A  15      -2.800   5.342  -4.951  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.844   4.311  -4.329  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -2.385   5.822  -6.352  1.00 15.88           C
ATOM      0  H   LEU A  15      -5.554   6.328  -3.271  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -5.118   6.371  -6.166  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -4.434   4.269  -4.055  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -4.269   4.009  -5.781  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -2.757   6.218  -4.304  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -0.835   4.723  -4.297  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -2.172   4.075  -3.317  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.846   3.403  -4.932  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -1.374   6.227  -6.313  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -2.414   4.983  -7.047  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -3.073   6.597  -6.690  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -6.867   4.652  -6.712  1.00 11.04           N
ATOM    257  CA  GLU A  16      -7.861   3.657  -6.969  1.00 11.50           C
ATOM    258  C   GLU A  16      -7.405   2.246  -7.121  1.00 10.13           C
ATOM    259  O   GLU A  16      -6.597   1.812  -7.940  1.00  9.83           O
ATOM    260  CB  GLU A  16      -8.543   4.118  -8.268  1.00 17.22           C
ATOM    261  CG  GLU A  16      -9.111   5.533  -8.141  1.00 23.33           C
ATOM    262  CD  GLU A  16      -9.888   5.916  -9.392  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -10.982   5.312  -9.559  1.00 28.90           O
ATOM    264  OE2 GLU A  16      -9.430   6.689 -10.275  1.00 28.86           O
ATOM      0  H   GLU A  16      -6.378   4.990  -7.540  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -8.501   3.601  -6.089  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -7.824   4.087  -9.087  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -9.346   3.426  -8.522  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -9.763   5.591  -7.270  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -8.300   6.243  -7.980  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -8.060   1.427  -6.278  1.00  8.99           N
ATOM    272  CA  VAL A  17      -8.058  -0.002  -6.330  1.00  8.85           C
ATOM    273  C   VAL A  17      -9.443  -0.549  -6.373  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.381   0.244  -6.307  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.326  -0.523  -5.128  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -5.815  -0.253  -5.022  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -7.983  -0.011  -3.835  1.00 10.54           C
ATOM      0  H   VAL A  17      -8.627   1.788  -5.511  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -7.557  -0.324  -7.243  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.411  -1.601  -5.265  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.431  -0.691  -4.101  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -5.305  -0.699  -5.876  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -5.637   0.822  -5.014  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -7.440  -0.398  -2.973  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -7.957   1.079  -3.821  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -9.018  -0.350  -3.794  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -9.593  -1.878  -6.520  1.00  7.29           N
ATOM    288  CA  GLU A  18     -10.798  -2.629  -6.349  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.728  -3.298  -5.019  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.646  -3.218  -4.439  1.00  5.28           O
ATOM    291  CB  GLU A  18     -10.872  -3.569  -7.564  1.00 10.28           C
ATOM    292  CG  GLU A  18     -11.109  -2.839  -8.887  1.00 12.65           C
ATOM    293  CD  GLU A  18     -11.071  -3.805 -10.063  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -12.083  -4.539 -10.222  1.00 18.17           O
ATOM    295  OE2 GLU A  18     -10.032  -3.777 -10.775  1.00 14.33           O
ATOM      0  H   GLU A  18      -8.807  -2.474  -6.779  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -11.718  -2.044  -6.330  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18      -9.943  -4.135  -7.632  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -11.674  -4.290  -7.407  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.075  -2.334  -8.859  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -10.350  -2.068  -9.021  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.725  -4.024  -4.607  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.600  -4.951  -3.521  1.00  7.07           C
ATOM    304  C   PRO A  19     -10.810  -6.178  -3.821  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.195  -6.769  -2.935  1.00  6.37           O
ATOM    306  CB  PRO A  19     -13.047  -5.262  -3.145  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.855  -4.032  -3.590  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.087  -3.570  -4.838  1.00  7.49           C
ATOM      0  HA  PRO A  19     -11.023  -4.516  -2.705  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -13.398  -6.165  -3.645  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -13.147  -5.432  -2.073  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.890  -4.287  -3.820  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -13.880  -3.261  -2.820  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.504  -4.006  -5.746  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -13.131  -2.487  -4.955  1.00  7.49           H   new
ATOM    316  N   SER A  20     -10.819  -6.510  -5.124  1.00  6.80           N
ATOM    317  CA  SER A  20     -10.100  -7.603  -5.701  1.00  6.28           C
ATOM    318  C   SER A  20      -8.666  -7.411  -6.055  1.00  8.45           C
ATOM    319  O   SER A  20      -7.966  -8.373  -6.365  1.00  7.26           O
ATOM    320  CB  SER A  20     -10.806  -7.960  -7.021  1.00  8.57           C
ATOM    321  OG  SER A  20     -12.219  -7.982  -6.887  1.00 11.13           O
ATOM      0  H   SER A  20     -11.358  -5.986  -5.813  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -10.101  -8.356  -4.913  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -10.527  -7.236  -7.787  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -10.460  -8.936  -7.363  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -12.626  -8.211  -7.749  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -8.158  -6.167  -5.988  1.00  7.50           N
ATOM    328  CA  ASP A  21      -6.748  -5.993  -6.152  1.00  7.70           C
ATOM    329  C   ASP A  21      -5.873  -6.509  -5.062  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.291  -6.635  -3.912  1.00  8.11           O
ATOM    331  CB  ASP A  21      -6.463  -4.495  -6.357  1.00 11.00           C
ATOM    332  CG  ASP A  21      -6.791  -4.004  -7.760  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -6.271  -4.569  -8.759  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -7.650  -3.083  -7.778  1.00 14.36           O
ATOM      0  H   ASP A  21      -8.696  -5.315  -5.827  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -6.489  -6.606  -7.016  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.042  -3.920  -5.634  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -5.411  -4.301  -6.149  1.00 11.00           H   new
ATOM    339  N   THR A  22      -4.603  -6.829  -5.369  1.00  5.37           N
ATOM    340  CA  THR A  22      -3.749  -7.403  -4.376  1.00  6.01           C
ATOM    341  C   THR A  22      -2.776  -6.356  -3.954  1.00  8.01           C
ATOM    342  O   THR A  22      -2.830  -5.236  -4.459  1.00  8.11           O
ATOM    343  CB  THR A  22      -3.023  -8.665  -4.738  1.00  8.92           C
ATOM    344  OG1 THR A  22      -2.170  -8.525  -5.864  1.00 10.22           O
ATOM    345  CG2 THR A  22      -3.942  -9.836  -5.124  1.00  9.65           C
ATOM      0  H   THR A  22      -4.174  -6.694  -6.285  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -4.412  -7.726  -3.574  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -2.473  -8.869  -3.819  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -2.608  -7.965  -6.539  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -3.336 -10.708  -5.371  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -4.598 -10.075  -4.287  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -4.544  -9.556  -5.988  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -1.769  -6.695  -3.129  1.00  8.32           N
ATOM    354  CA  ILE A  23      -0.799  -5.762  -2.645  1.00  9.92           C
ATOM    355  C   ILE A  23       0.280  -5.514  -3.643  1.00 10.01           C
ATOM    356  O   ILE A  23       0.904  -4.461  -3.764  1.00  8.71           O
ATOM    357  CB  ILE A  23      -0.226  -6.288  -1.363  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -1.321  -6.609  -0.331  1.00 11.38           C
ATOM    359  CG2 ILE A  23       0.915  -5.517  -0.679  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -2.264  -5.461   0.023  1.00 12.30           C
ATOM      0  H   ILE A  23      -1.625  -7.646  -2.789  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -1.289  -4.804  -2.470  1.00  9.92           H   new
ATOM      0  HB  ILE A  23       0.267  -7.189  -1.728  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -1.917  -7.439  -0.710  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -0.840  -6.953   0.585  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23       1.209  -6.036   0.234  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       1.769  -5.458  -1.353  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23       0.577  -4.511  -0.432  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -2.993  -5.802   0.758  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -1.690  -4.633   0.439  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -2.783  -5.127  -0.875  1.00 12.30           H   new
ATOM    372  N   GLU A  24       0.536  -6.486  -4.536  1.00  9.54           N
ATOM    373  CA  GLU A  24       1.273  -6.396  -5.758  1.00 11.81           C
ATOM    374  C   GLU A  24       0.779  -5.308  -6.649  1.00 11.14           C
ATOM    375  O   GLU A  24       1.514  -4.524  -7.247  1.00 10.62           O
ATOM    376  CB  GLU A  24       1.167  -7.745  -6.488  1.00 19.24           C
ATOM    377  CG  GLU A  24       1.994  -7.796  -7.774  1.00 27.76           C
ATOM    378  CD  GLU A  24       1.991  -9.184  -8.399  1.00 32.92           C
ATOM    379  OE1 GLU A  24       0.929  -9.632  -8.908  1.00 36.51           O
ATOM    380  OE2 GLU A  24       3.070  -9.831  -8.468  1.00 34.80           O
ATOM      0  H   GLU A  24       0.189  -7.433  -4.383  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       2.308  -6.158  -5.512  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       1.496  -8.540  -5.819  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24       0.122  -7.941  -6.727  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       1.597  -7.075  -8.489  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       3.020  -7.498  -7.557  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -0.553  -5.176  -6.783  1.00  9.43           N
ATOM    388  CA  ASN A  25      -1.191  -4.208  -7.621  1.00 10.96           C
ATOM    389  C   ASN A  25      -1.140  -2.842  -7.026  1.00  9.68           C
ATOM    390  O   ASN A  25      -0.798  -1.932  -7.780  1.00  9.33           O
ATOM    391  CB  ASN A  25      -2.659  -4.531  -7.943  1.00 16.78           C
ATOM    392  CG  ASN A  25      -2.828  -5.865  -8.658  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -3.496  -6.730  -8.095  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -2.406  -6.042  -9.939  1.00 24.70           N
ATOM      0  H   ASN A  25      -1.215  -5.771  -6.285  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -0.622  -4.243  -8.550  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -3.234  -4.545  -7.017  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -3.073  -3.736  -8.564  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -2.643  -6.898 -10.441  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -1.852  -5.319 -10.398  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -1.431  -2.666  -5.725  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.159  -1.476  -4.980  1.00  5.53           C
ATOM    403  C   VAL A  26       0.255  -1.038  -5.152  1.00  4.42           C
ATOM    404  O   VAL A  26       0.484   0.101  -5.557  1.00  3.40           O
ATOM    405  CB  VAL A  26      -1.395  -1.594  -3.503  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -1.134  -0.259  -2.785  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -2.861  -2.022  -3.325  1.00  8.12           C
ATOM      0  H   VAL A  26      -1.879  -3.391  -5.164  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -1.864  -0.752  -5.388  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -0.712  -2.322  -3.065  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.314  -0.379  -1.717  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -0.100   0.045  -2.947  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.803   0.505  -3.182  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.084  -2.122  -2.263  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -3.516  -1.269  -3.764  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.024  -2.978  -3.822  1.00  8.12           H   new
ATOM    417  N   LYS A  27       1.283  -1.852  -4.854  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.648  -1.463  -5.024  1.00  4.14           C
ATOM    419  C   LYS A  27       3.141  -1.057  -6.370  1.00  5.58           C
ATOM    420  O   LYS A  27       3.996  -0.200  -6.592  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.610  -2.544  -4.502  1.00  3.97           C
ATOM    422  CG  LYS A  27       3.404  -2.848  -3.017  1.00  7.45           C
ATOM    423  CD  LYS A  27       4.363  -3.987  -2.667  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.470  -4.288  -1.171  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.068  -5.634  -1.024  1.00 15.47           N
ATOM      0  H   LYS A  27       1.164  -2.797  -4.489  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.646  -0.542  -4.440  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       3.471  -3.458  -5.079  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.638  -2.219  -4.663  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.610  -1.967  -2.409  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.371  -3.137  -2.820  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       4.039  -4.890  -3.184  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       5.354  -3.740  -3.047  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       5.086  -3.539  -0.673  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.486  -4.253  -0.703  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       4.767  -6.051  -0.120  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       4.753  -6.241  -1.807  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       6.105  -5.557  -1.041  1.00 15.47           H   new
ATOM    439  N   ALA A  28       2.571  -1.665  -7.426  1.00  6.61           N
ATOM    440  CA  ALA A  28       2.817  -1.299  -8.786  1.00  7.74           C
ATOM    441  C   ALA A  28       2.216   0.036  -9.064  1.00  9.17           C
ATOM    442  O   ALA A  28       2.885   0.923  -9.591  1.00 11.45           O
ATOM    443  CB  ALA A  28       2.163  -2.328  -9.722  1.00  7.68           C
ATOM      0  H   ALA A  28       1.915  -2.440  -7.329  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       3.894  -1.267  -8.954  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       2.351  -2.048 -10.759  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       2.585  -3.314  -9.530  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       1.088  -2.352  -9.542  1.00  7.68           H   new
ATOM    449  N   LYS A  29       0.945   0.317  -8.722  1.00  8.96           N
ATOM    450  CA  LYS A  29       0.355   1.616  -8.811  1.00  7.90           C
ATOM    451  C   LYS A  29       1.152   2.752  -8.268  1.00  6.92           C
ATOM    452  O   LYS A  29       1.319   3.839  -8.819  1.00  6.87           O
ATOM    453  CB  LYS A  29      -1.045   1.625  -8.174  1.00 10.28           C
ATOM    454  CG  LYS A  29      -2.059   0.851  -9.019  1.00 14.94           C
ATOM    455  CD  LYS A  29      -3.223   0.296  -8.197  1.00 19.69           C
ATOM    456  CE  LYS A  29      -4.285  -0.498  -8.961  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -4.675   0.188 -10.213  1.00 24.98           N
ATOM      0  H   LYS A  29       0.302  -0.392  -8.369  1.00  8.96           H   new
ATOM      0  HA  LYS A  29       0.307   1.796  -9.885  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -0.993   1.187  -7.177  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -1.383   2.654  -8.053  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -2.451   1.506  -9.797  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -1.551   0.028  -9.522  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -2.814  -0.346  -7.417  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -3.715   1.130  -7.697  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -3.902  -1.492  -9.193  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -5.163  -0.634  -8.330  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -5.466  -0.321 -10.656  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -4.967   1.163  -9.998  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -3.866   0.205 -10.866  1.00 24.98           H   new
ATOM    471  N   ILE A  30       1.661   2.509  -7.047  1.00  4.57           N
ATOM    472  CA  ILE A  30       2.593   3.297  -6.301  1.00  5.58           C
ATOM    473  C   ILE A  30       3.853   3.584  -7.043  1.00  7.26           C
ATOM    474  O   ILE A  30       4.296   4.729  -7.114  1.00  9.46           O
ATOM    475  CB  ILE A  30       2.794   2.780  -4.907  1.00  5.36           C
ATOM    476  CG1 ILE A  30       1.570   2.910  -3.986  1.00  2.94           C
ATOM    477  CG2 ILE A  30       3.894   3.600  -4.211  1.00  2.78           C
ATOM    478  CD1 ILE A  30       1.593   2.261  -2.603  1.00  2.00           C
ATOM      0  H   ILE A  30       1.389   1.672  -6.531  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.135   4.278  -6.175  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.030   1.724  -5.041  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       1.381   3.974  -3.844  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       0.713   2.503  -4.523  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.041   3.225  -3.198  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       4.825   3.509  -4.770  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       3.596   4.648  -4.171  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       0.649   2.455  -2.094  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       1.735   1.185  -2.708  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       2.412   2.679  -2.018  1.00  2.00           H   new
ATOM    490  N   GLN A  31       4.456   2.593  -7.723  1.00  7.06           N
ATOM    491  CA  GLN A  31       5.588   2.690  -8.591  1.00  8.67           C
ATOM    492  C   GLN A  31       5.274   3.466  -9.823  1.00 10.90           C
ATOM    493  O   GLN A  31       6.006   4.365 -10.234  1.00  9.63           O
ATOM    494  CB  GLN A  31       6.095   1.267  -8.880  1.00  9.12           C
ATOM    495  CG  GLN A  31       7.408   1.328  -9.662  1.00 10.76           C
ATOM    496  CD  GLN A  31       8.001  -0.011 -10.078  1.00 13.78           C
ATOM    497  OE1 GLN A  31       9.080  -0.349  -9.595  1.00 14.48           O
ATOM    498  NE2 GLN A  31       7.328  -0.722 -11.022  1.00 14.76           N
ATOM      0  H   GLN A  31       4.117   1.633  -7.657  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       6.387   3.251  -8.106  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       6.244   0.728  -7.944  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       5.348   0.715  -9.450  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       7.246   1.925 -10.559  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       8.144   1.856  -9.056  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       6.435  -0.380 -11.378  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       7.716  -1.597 -11.374  1.00 14.76           H   new
ATOM    507  N   ASP A  32       4.186   3.150 -10.548  1.00 10.93           N
ATOM    508  CA  ASP A  32       3.803   3.981 -11.647  1.00 14.01           C
ATOM    509  C   ASP A  32       3.531   5.396 -11.268  1.00 14.04           C
ATOM    510  O   ASP A  32       4.049   6.325 -11.886  1.00 13.39           O
ATOM    511  CB  ASP A  32       2.572   3.367 -12.334  1.00 18.01           C
ATOM    512  CG  ASP A  32       2.337   3.904 -13.738  1.00 24.33           C
ATOM    513  OD1 ASP A  32       3.257   3.683 -14.571  1.00 25.17           O
ATOM    514  OD2 ASP A  32       1.308   4.531 -14.105  1.00 26.29           O
ATOM      0  H   ASP A  32       3.586   2.342 -10.381  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       4.651   4.017 -12.330  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       2.693   2.285 -12.382  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       1.689   3.562 -11.725  1.00 18.01           H   new
ATOM    519  N   LYS A  33       2.596   5.612 -10.325  1.00 14.22           N
ATOM    520  CA  LYS A  33       2.286   6.887  -9.756  1.00 14.00           C
ATOM    521  C   LYS A  33       3.415   7.601  -9.097  1.00 12.37           C
ATOM    522  O   LYS A  33       4.029   8.542  -9.600  1.00 12.17           O
ATOM    523  CB  LYS A  33       0.999   6.852  -8.915  1.00 18.62           C
ATOM    524  CG  LYS A  33       0.380   8.186  -8.493  1.00 24.00           C
ATOM    525  CD  LYS A  33      -0.137   8.826  -9.783  1.00 27.61           C
ATOM    526  CE  LYS A  33      -0.447  10.314  -9.607  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -0.631  11.080 -10.860  1.00 30.06           N
ATOM      0  H   LYS A  33       2.027   4.858  -9.940  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       2.085   7.522 -10.619  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       0.247   6.298  -9.478  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       1.206   6.279  -8.011  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33      -0.429   8.034  -7.779  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.118   8.824  -8.007  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       0.606   8.702 -10.571  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -1.037   8.305 -10.109  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -1.352  10.410  -9.007  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33       0.363  10.771  -9.038  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -0.836  12.074 -10.632  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33       0.237  11.027 -11.430  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -1.424  10.678 -11.400  1.00 30.06           H   new
ATOM    541  N   GLU A  34       3.718   7.210  -7.847  1.00 10.11           N
ATOM    542  CA  GLU A  34       4.639   7.925  -7.018  1.00 10.07           C
ATOM    543  C   GLU A  34       6.043   7.843  -7.511  1.00  9.32           C
ATOM    544  O   GLU A  34       6.777   8.785  -7.803  1.00 11.61           O
ATOM    545  CB  GLU A  34       4.459   7.585  -5.529  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.249   8.344  -4.461  1.00 18.75           C
ATOM    547  CD  GLU A  34       5.233   9.865  -4.520  1.00 22.28           C
ATOM    548  OE1 GLU A  34       4.084  10.383  -4.531  1.00 25.19           O
ATOM    549  OE2 GLU A  34       6.303  10.527  -4.579  1.00 21.95           O
ATOM      0  H   GLU A  34       3.317   6.383  -7.404  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       4.392   8.984  -7.097  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       3.401   7.708  -5.296  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       4.691   6.527  -5.410  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       4.870   8.042  -3.485  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.287   8.017  -4.515  1.00 18.75           H   new
ATOM    556  N   GLY A  35       6.582   6.622  -7.671  1.00  7.22           N
ATOM    557  CA  GLY A  35       7.828   6.386  -8.334  1.00  6.29           C
ATOM    558  C   GLY A  35       8.636   5.396  -7.568  1.00  6.93           C
ATOM    559  O   GLY A  35       9.836   5.315  -7.824  1.00  7.41           O
ATOM      0  H   GLY A  35       6.137   5.771  -7.328  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       7.647   6.017  -9.343  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       8.380   7.321  -8.431  1.00  6.29           H   new
ATOM    563  N   ILE A  36       7.999   4.700  -6.610  1.00  5.86           N
ATOM    564  CA  ILE A  36       8.794   3.926  -5.708  1.00  6.07           C
ATOM    565  C   ILE A  36       8.949   2.511  -6.147  1.00  6.36           C
ATOM    566  O   ILE A  36       7.910   1.890  -6.363  1.00  6.18           O
ATOM    567  CB  ILE A  36       8.178   4.122  -4.354  1.00  7.47           C
ATOM    568  CG1 ILE A  36       8.124   5.615  -3.988  1.00  8.52           C
ATOM    569  CG2 ILE A  36       8.967   3.260  -3.354  1.00  7.36           C
ATOM    570  CD1 ILE A  36       7.543   5.807  -2.588  1.00  9.49           C
ATOM      0  H   ILE A  36       6.990   4.670  -6.462  1.00  5.86           H   new
ATOM      0  HA  ILE A  36       9.831   4.260  -5.680  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       7.138   3.795  -4.337  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       9.126   6.042  -4.033  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       7.516   6.151  -4.716  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       8.543   3.380  -2.357  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       8.907   2.213  -3.650  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.010   3.576  -3.345  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       7.514   6.870  -2.349  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       6.533   5.399  -2.554  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       8.168   5.289  -1.861  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.105   1.916  -6.133  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.196   0.534  -6.504  1.00  9.18           C
ATOM    584  C   PRO A  37       9.695  -0.315  -5.386  1.00  9.85           C
ATOM    585  O   PRO A  37       9.883   0.059  -4.230  1.00  8.51           O
ATOM    586  CB  PRO A  37      11.686   0.266  -6.706  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.365   1.418  -5.948  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.396   2.586  -6.188  1.00  8.33           C
ATOM      0  HA  PRO A  37       9.610   0.311  -7.396  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      11.977  -0.705  -6.305  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      11.954   0.268  -7.762  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      12.478   1.195  -4.887  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      13.361   1.630  -6.337  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      11.489   3.358  -5.424  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      11.566   3.068  -7.151  1.00  8.33           H   new
ATOM    596  N   PRO A  38       9.141  -1.471  -5.602  1.00  8.71           N
ATOM    597  CA  PRO A  38       8.468  -2.234  -4.592  1.00  9.08           C
ATOM    598  C   PRO A  38       9.432  -2.944  -3.704  1.00  9.28           C
ATOM    599  O   PRO A  38       8.957  -3.328  -2.637  1.00  6.50           O
ATOM    600  CB  PRO A  38       7.416  -3.086  -5.299  1.00 10.31           C
ATOM    601  CG  PRO A  38       8.091  -3.352  -6.654  1.00 10.81           C
ATOM    602  CD  PRO A  38       8.932  -2.090  -6.902  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.934  -1.607  -3.878  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       7.205  -4.009  -4.758  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       6.469  -2.558  -5.410  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       8.713  -4.247  -6.622  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       7.355  -3.504  -7.444  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       9.884  -2.344  -7.368  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.417  -1.408  -7.578  1.00 12.00           H   new
ATOM    610  N   ASP A  39      10.738  -2.974  -4.025  1.00 11.20           N
ATOM    611  CA  ASP A  39      11.797  -3.350  -3.142  1.00 14.96           C
ATOM    612  C   ASP A  39      11.929  -2.387  -2.012  1.00 13.99           C
ATOM    613  O   ASP A  39      12.289  -2.632  -0.862  1.00 13.75           O
ATOM    614  CB  ASP A  39      13.070  -3.478  -3.995  1.00 24.16           C
ATOM    615  CG  ASP A  39      13.028  -4.432  -5.180  1.00 31.06           C
ATOM    616  OD1 ASP A  39      12.835  -5.641  -4.880  1.00 35.55           O
ATOM    617  OD2 ASP A  39      13.214  -3.991  -6.346  1.00 34.22           O
ATOM      0  H   ASP A  39      11.073  -2.721  -4.955  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      11.594  -4.307  -2.662  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      13.325  -2.487  -4.370  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      13.884  -3.790  -3.340  1.00 24.16           H   new
ATOM    622  N   GLN A  40      11.433  -1.155  -2.218  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.576  -0.065  -1.303  1.00 10.76           C
ATOM    624  C   GLN A  40      10.461   0.031  -0.319  1.00  8.01           C
ATOM    625  O   GLN A  40      10.525   0.551   0.794  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.782   1.267  -2.044  1.00 11.14           C
ATOM    627  CG  GLN A  40      12.149   2.511  -1.232  1.00 14.85           C
ATOM    628  CD  GLN A  40      12.603   3.746  -1.997  1.00 16.11           C
ATOM    629  OE1 GLN A  40      11.884   4.744  -2.031  1.00 20.52           O
ATOM    630  NE2 GLN A  40      13.896   3.798  -2.417  1.00 18.16           N
ATOM      0  H   GLN A  40      10.910  -0.907  -3.058  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      12.474  -0.277  -0.723  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      12.565   1.114  -2.787  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      10.864   1.487  -2.589  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      11.282   2.788  -0.632  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.943   2.236  -0.537  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.478   2.961  -2.382  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      14.284   4.674  -2.767  1.00 18.16           H   new
ATOM    639  N   GLN A  41       9.298  -0.538  -0.685  1.00  6.52           N
ATOM    640  CA  GLN A  41       8.021  -0.354  -0.069  1.00  3.87           C
ATOM    641  C   GLN A  41       7.736  -1.308   1.040  1.00  4.79           C
ATOM    642  O   GLN A  41       7.922  -2.517   0.910  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.820  -0.380  -1.029  1.00  4.20           C
ATOM    644  CG  GLN A  41       6.949   0.560  -2.229  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.734   0.331  -3.116  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.592   0.146  -2.698  1.00  5.21           O
ATOM    647  NE2 GLN A  41       5.891   0.593  -4.442  1.00  7.13           N
ATOM      0  H   GLN A  41       9.249  -1.179  -1.477  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.123   0.655   0.330  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.684  -1.398  -1.394  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.920  -0.118  -0.473  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       6.995   1.598  -1.901  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       7.869   0.358  -2.778  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       6.824   0.752  -4.824  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.076   0.631  -5.054  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.279  -0.801   2.199  1.00  5.73           N
ATOM    657  CA  ARG A  42       6.546  -1.683   3.053  1.00  6.97           C
ATOM    658  C   ARG A  42       5.211  -1.051   3.248  1.00  7.15           C
ATOM    659  O   ARG A  42       5.127   0.149   3.504  1.00  7.33           O
ATOM    660  CB  ARG A  42       7.302  -1.886   4.377  1.00 13.23           C
ATOM    661  CG  ARG A  42       8.552  -2.756   4.224  1.00 21.27           C
ATOM    662  CD  ARG A  42       9.362  -2.766   5.521  1.00 26.14           C
ATOM    663  NE  ARG A  42      10.623  -3.534   5.316  1.00 32.26           N
ATOM    664  CZ  ARG A  42      10.666  -4.898   5.286  1.00 34.32           C
ATOM    665  NH1 ARG A  42       9.681  -5.763   5.666  1.00 35.30           N
ATOM    666  NH2 ARG A  42      11.720  -5.483   4.646  1.00 36.39           N
ATOM      0  H   ARG A  42       7.404   0.155   2.531  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.428  -2.677   2.622  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.589  -0.914   4.778  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       6.633  -2.346   5.104  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       8.264  -3.774   3.961  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       9.167  -2.378   3.407  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       9.591  -1.745   5.826  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       8.777  -3.215   6.324  1.00 26.14           H   new
ATOM      0  HE  ARG A  42      11.493  -3.017   5.193  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.794  -5.403   6.019  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42       9.832  -6.769   5.597  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42      12.439  -4.904   4.212  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42      11.789  -6.500   4.601  1.00 36.39           H   new
ATOM    680  N   LEU A  43       4.142  -1.820   2.975  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.778  -1.413   3.116  1.00  3.51           C
ATOM    682  C   LEU A  43       2.105  -2.046   4.285  1.00  5.56           C
ATOM    683  O   LEU A  43       2.161  -3.260   4.476  1.00  4.19           O
ATOM    684  CB  LEU A  43       2.080  -1.695   1.775  1.00  3.74           C
ATOM    685  CG  LEU A  43       0.696  -1.025   1.770  1.00  6.32           C
ATOM    686  CD1 LEU A  43       0.864   0.500   1.880  1.00  6.41           C
ATOM    687  CD2 LEU A  43      -0.094  -1.407   0.507  1.00  9.55           C
ATOM      0  H   LEU A  43       4.235  -2.778   2.637  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       2.721  -0.347   3.338  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       2.684  -1.315   0.951  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       1.977  -2.770   1.625  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       0.126  -1.379   2.629  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43      -0.117   0.975   1.876  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.382   0.743   2.808  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       1.447   0.864   1.034  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43      -1.069  -0.921   0.527  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       0.455  -1.083  -0.377  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43      -0.228  -2.488   0.475  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.492  -1.232   5.162  1.00  4.58           N
ATOM    700  CA  ILE A  44       1.033  -1.572   6.473  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.384  -1.166   6.691  1.00  5.46           C
ATOM    702  O   ILE A  44      -0.791  -0.115   6.198  1.00  6.04           O
ATOM    703  CB  ILE A  44       2.005  -1.031   7.479  1.00  6.80           C
ATOM    704  CG1 ILE A  44       3.428  -1.480   7.109  1.00 10.31           C
ATOM    705  CG2 ILE A  44       1.561  -1.548   8.858  1.00  7.39           C
ATOM    706  CD1 ILE A  44       4.534  -1.266   8.142  1.00 13.90           C
ATOM      0  H   ILE A  44       1.302  -0.256   4.934  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       1.011  -2.655   6.597  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       2.017   0.059   7.495  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       3.393  -2.543   6.872  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       3.717  -0.959   6.196  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       2.243  -1.177   9.623  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       0.552  -1.196   9.071  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       1.573  -2.638   8.859  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       5.480  -1.630   7.742  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       4.620  -0.203   8.368  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       4.291  -1.812   9.054  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.322  -1.899   7.316  1.00  6.75           N
ATOM    719  CA  PHE A  45      -2.558  -1.297   7.710  1.00  4.70           C
ATOM    720  C   PHE A  45      -2.560  -1.507   9.185  1.00  6.34           C
ATOM    721  O   PHE A  45      -2.485  -2.666   9.592  1.00  5.45           O
ATOM    722  CB  PHE A  45      -3.806  -1.916   7.057  1.00  5.51           C
ATOM    723  CG  PHE A  45      -5.054  -1.285   7.571  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -5.206   0.082   7.549  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -6.024  -2.070   8.147  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -6.318   0.738   8.023  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -7.184  -1.446   8.543  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -7.360  -0.096   8.350  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.229  -2.889   7.545  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -2.614  -0.255   7.396  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.752  -1.793   5.975  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -3.829  -2.988   7.255  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -4.404   0.675   7.135  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -5.881  -3.132   8.283  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -6.368   1.812   8.129  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -7.967  -2.024   9.012  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -8.350   0.323   8.459  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -2.649  -0.417   9.967  1.00  6.53           N
ATOM    739  CA  ALA A  46      -2.568  -0.371  11.394  1.00  7.15           C
ATOM    740  C   ALA A  46      -1.213  -0.748  11.884  1.00  9.00           C
ATOM    741  O   ALA A  46      -0.344   0.072  12.178  1.00 11.15           O
ATOM    742  CB  ALA A  46      -3.702  -1.120  12.115  1.00  8.99           C
ATOM      0  H   ALA A  46      -2.790   0.510   9.565  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -2.725   0.673  11.665  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -3.566  -1.036  13.193  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -4.661  -0.684  11.835  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -3.684  -2.171  11.828  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -0.957  -2.058  12.056  1.00  9.35           N
ATOM    749  CA  GLY A  47       0.359  -2.531  12.351  1.00 11.68           C
ATOM    750  C   GLY A  47       0.547  -3.889  11.767  1.00 11.14           C
ATOM    751  O   GLY A  47       1.513  -4.573  12.102  1.00 13.93           O
ATOM      0  H   GLY A  47      -1.664  -2.790  11.990  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       1.102  -1.844  11.946  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47       0.511  -2.564  13.430  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -0.250  -4.216  10.734  1.00 10.47           N
ATOM    756  CA  LYS A  48      -0.114  -5.342   9.863  1.00  8.82           C
ATOM    757  C   LYS A  48       0.620  -5.050   8.600  1.00  7.68           C
ATOM    758  O   LYS A  48       0.005  -4.420   7.742  1.00  6.47           O
ATOM    759  CB  LYS A  48      -1.502  -5.941   9.579  1.00  9.74           C
ATOM    760  CG  LYS A  48      -1.593  -7.145   8.640  1.00 14.14           C
ATOM    761  CD  LYS A  48      -1.013  -8.517   8.990  1.00 16.32           C
ATOM    762  CE  LYS A  48      -1.581  -9.093  10.289  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -1.254 -10.524  10.482  1.00 23.92           N
ATOM      0  H   LYS A  48      -1.057  -3.643  10.489  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       0.506  -6.072  10.383  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -1.941  -6.230  10.534  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -2.128  -5.150   9.167  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -2.652  -7.299   8.436  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -1.128  -6.842   7.702  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -1.215  -9.210   8.173  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48       0.070  -8.435   9.078  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -1.194  -8.521  11.133  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -2.664  -8.971  10.291  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -1.665 -10.856  11.377  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -1.645 -11.079   9.694  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -0.221 -10.643  10.510  1.00 23.92           H   new
ATOM    777  N   GLN A  49       1.784  -5.685   8.369  1.00  8.89           N
ATOM    778  CA  GLN A  49       2.410  -5.610   7.086  1.00  7.18           C
ATOM    779  C   GLN A  49       1.780  -6.319   5.937  1.00  8.23           C
ATOM    780  O   GLN A  49       1.557  -7.528   5.938  1.00  9.70           O
ATOM    781  CB  GLN A  49       3.870  -6.028   7.327  1.00 11.67           C
ATOM    782  CG  GLN A  49       4.833  -5.665   6.194  1.00 15.82           C
ATOM    783  CD  GLN A  49       6.282  -6.038   6.470  1.00 20.21           C
ATOM    784  OE1 GLN A  49       7.117  -5.157   6.669  1.00 23.23           O
ATOM    785  NE2 GLN A  49       6.574  -7.366   6.427  1.00 20.67           N
ATOM      0  H   GLN A  49       2.285  -6.243   9.060  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       2.297  -4.588   6.725  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       4.220  -5.561   8.247  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       3.904  -7.106   7.484  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       4.508  -6.164   5.281  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       4.773  -4.592   6.010  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       5.833  -8.046   6.257  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       7.534  -7.682   6.564  1.00 20.67           H   new
ATOM    794  N   LEU A  50       1.373  -5.615   4.866  1.00  6.51           N
ATOM    795  CA  LEU A  50       0.546  -6.308   3.927  1.00  7.41           C
ATOM    796  C   LEU A  50       1.240  -7.064   2.847  1.00  8.27           C
ATOM    797  O   LEU A  50       2.159  -6.480   2.276  1.00  8.34           O
ATOM    798  CB  LEU A  50      -0.404  -5.302   3.255  1.00  7.13           C
ATOM    799  CG  LEU A  50      -1.261  -4.449   4.204  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -1.944  -3.479   3.226  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -2.229  -5.227   5.112  1.00  8.14           C
ATOM      0  H   LEU A  50       1.594  -4.641   4.657  1.00  6.51           H   new
ATOM      0  HA  LEU A  50       0.037  -7.061   4.530  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       0.189  -4.633   2.632  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -1.070  -5.850   2.589  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -0.665  -3.953   4.970  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -2.595  -2.803   3.780  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -1.186  -2.901   2.698  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.536  -4.045   2.506  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -2.782  -4.527   5.739  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -2.928  -5.794   4.497  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -1.664  -5.912   5.744  1.00  8.14           H   new
ATOM    813  N   GLU A  51       0.869  -8.313   2.514  1.00  9.43           N
ATOM    814  CA  GLU A  51       1.547  -9.186   1.606  1.00 11.90           C
ATOM    815  C   GLU A  51       0.919  -9.324   0.262  1.00 11.49           C
ATOM    816  O   GLU A  51      -0.297  -9.441   0.122  1.00  9.88           O
ATOM    817  CB  GLU A  51       1.785 -10.547   2.282  1.00 16.56           C
ATOM    818  CG  GLU A  51       2.558 -10.485   3.600  1.00 26.06           C
ATOM    819  CD  GLU A  51       2.628 -11.879   4.208  1.00 29.86           C
ATOM    820  OE1 GLU A  51       3.196 -12.760   3.509  1.00 33.44           O
ATOM    821  OE2 GLU A  51       2.151 -12.110   5.351  1.00 32.13           O
ATOM      0  H   GLU A  51       0.033  -8.744   2.909  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       2.503  -8.712   1.384  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       0.820 -11.019   2.466  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51       2.328 -11.190   1.589  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       3.563 -10.100   3.428  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       2.068  -9.799   4.291  1.00 26.06           H   new
ATOM    828  N   ASP A  52       1.833  -9.428  -0.719  1.00 12.71           N
ATOM    829  CA  ASP A  52       1.688  -9.228  -2.128  1.00 16.56           C
ATOM    830  C   ASP A  52       0.582  -9.915  -2.851  1.00 15.83           C
ATOM    831  O   ASP A  52      -0.100  -9.250  -3.629  1.00 17.21           O
ATOM    832  CB  ASP A  52       3.057  -9.542  -2.756  1.00 21.05           C
ATOM    833  CG  ASP A  52       4.133  -8.643  -2.163  1.00 25.12           C
ATOM    834  OD1 ASP A  52       4.764  -8.987  -1.129  1.00 25.82           O
ATOM    835  OD2 ASP A  52       4.340  -7.557  -2.767  1.00 28.37           O
ATOM      0  H   ASP A  52       2.793  -9.685  -0.491  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       1.368  -8.193  -2.245  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       3.312 -10.588  -2.583  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       3.010  -9.400  -3.836  1.00 21.05           H   new
ATOM    840  N   GLY A  53       0.240 -11.169  -2.504  1.00 15.00           N
ATOM    841  CA  GLY A  53      -0.795 -11.866  -3.202  1.00 11.77           C
ATOM    842  C   GLY A  53      -1.972 -12.116  -2.324  1.00 11.10           C
ATOM    843  O   GLY A  53      -2.548 -13.186  -2.512  1.00 11.25           O
ATOM      0  H   GLY A  53       0.676 -11.696  -1.747  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -1.105 -11.285  -4.071  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -0.409 -12.815  -3.574  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -2.372 -11.242  -1.383  1.00  8.53           N
ATOM    848  CA  ARG A  54      -3.637 -11.306  -0.718  1.00  9.05           C
ATOM    849  C   ARG A  54      -4.421 -10.136  -1.205  1.00  8.96           C
ATOM    850  O   ARG A  54      -3.836  -9.123  -1.584  1.00 11.60           O
ATOM    851  CB  ARG A  54      -3.392 -11.248   0.799  1.00  7.97           C
ATOM    852  CG  ARG A  54      -2.485 -12.309   1.426  1.00  9.62           C
ATOM    853  CD  ARG A  54      -2.786 -13.777   1.118  1.00 12.20           C
ATOM    854  NE  ARG A  54      -4.260 -13.903   1.296  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -4.800 -15.111   0.958  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -4.123 -16.047   0.230  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -6.052 -15.400   1.418  1.00 25.50           N
ATOM      0  H   ARG A  54      -1.793 -10.461  -1.074  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -4.185 -12.225  -0.924  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -2.970 -10.270   1.031  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -4.361 -11.303   1.295  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -1.462 -12.104   1.111  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -2.517 -12.180   2.508  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -2.485 -14.039   0.104  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -2.247 -14.442   1.792  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -4.830 -13.134   1.649  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -3.172 -15.857  -0.086  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -4.568 -16.936   0.002  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -6.552 -14.723   1.994  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -6.487 -16.293   1.186  1.00 25.50           H   new
ATOM    871  N   THR A  55      -5.765 -10.180  -1.202  1.00  9.05           N
ATOM    872  CA  THR A  55      -6.682  -9.198  -1.691  1.00  9.03           C
ATOM    873  C   THR A  55      -6.909  -8.223  -0.588  1.00  8.15           C
ATOM    874  O   THR A  55      -6.578  -8.439   0.577  1.00  5.91           O
ATOM    875  CB  THR A  55      -7.950  -9.622  -2.373  1.00 11.15           C
ATOM    876  OG1 THR A  55      -8.965 -10.065  -1.484  1.00 11.95           O
ATOM    877  CG2 THR A  55      -7.657 -10.652  -3.477  1.00 11.71           C
ATOM      0  H   THR A  55      -6.257 -10.987  -0.817  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.189  -8.762  -2.560  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.361  -8.726  -2.838  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -9.695 -10.470  -1.997  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -8.590 -10.945  -3.958  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -6.990 -10.211  -4.218  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -7.183 -11.530  -3.039  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.430  -7.026  -0.913  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.895  -6.124   0.094  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.111  -6.565   0.834  1.00  8.05           C
ATOM    888  O   LEU A  56      -9.313  -6.286   2.015  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.051  -4.736  -0.550  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.738  -4.257  -1.191  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.073  -3.005  -2.018  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.680  -3.931  -0.122  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.529  -6.684  -1.869  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -7.147  -6.093   0.886  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.834  -4.772  -1.307  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.371  -4.018   0.205  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.316  -5.041  -1.820  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.167  -2.629  -2.493  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -7.805  -3.260  -2.784  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.485  -2.237  -1.364  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.764  -3.595  -0.607  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.054  -3.143   0.532  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.472  -4.824   0.468  1.00  9.85           H   new
ATOM    904  N   SER A  57      -9.994  -7.295   0.129  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.099  -8.052   0.629  1.00  9.00           C
ATOM    906  C   SER A  57     -10.682  -9.123   1.578  1.00  9.44           C
ATOM    907  O   SER A  57     -11.307  -9.264   2.627  1.00 10.91           O
ATOM    908  CB  SER A  57     -11.934  -8.552  -0.562  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.030  -9.276  -0.022  1.00 13.59           O
ATOM      0  H   SER A  57      -9.925  -7.360  -0.887  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.736  -7.410   1.238  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -12.284  -7.715  -1.167  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -11.335  -9.188  -1.214  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -13.591  -9.612  -0.752  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -9.584  -9.873   1.374  1.00  9.11           N
ATOM    916  CA  ASP A  58      -8.984 -10.764   2.317  1.00  7.91           C
ATOM    917  C   ASP A  58      -8.531 -10.141   3.593  1.00  9.12           C
ATOM    918  O   ASP A  58      -8.983 -10.643   4.620  1.00  8.61           O
ATOM    919  CB  ASP A  58      -7.818 -11.389   1.535  1.00  8.41           C
ATOM    920  CG  ASP A  58      -7.401 -12.702   2.183  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -8.154 -13.711   2.228  1.00 10.05           O
ATOM    922  OD2 ASP A  58      -6.219 -12.744   2.619  1.00 11.70           O
ATOM      0  H   ASP A  58      -9.081  -9.854   0.487  1.00  9.11           H   new
ATOM      0  HA  ASP A  58      -9.717 -11.488   2.673  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -8.115 -11.563   0.501  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -6.973 -10.700   1.513  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -7.789  -9.020   3.552  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.295  -8.330   4.702  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.274  -7.408   5.345  1.00 10.98           C
ATOM    930  O   TYR A  59      -7.900  -6.666   6.252  1.00 12.95           O
ATOM    931  CB  TYR A  59      -6.185  -7.437   4.122  1.00  7.94           C
ATOM    932  CG  TYR A  59      -4.841  -8.068   4.001  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.328  -8.588   5.166  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.081  -8.055   2.855  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -3.045  -9.082   5.158  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -2.778  -8.493   2.873  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -2.281  -9.078   4.014  1.00  6.76           C
ATOM    938  OH  TYR A  59      -0.960  -9.567   4.100  1.00  7.63           O
ATOM      0  H   TYR A  59      -7.521  -8.574   2.675  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -7.010  -9.057   5.463  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.497  -7.098   3.134  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -6.094  -6.550   4.749  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -4.921  -8.608   6.069  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -4.512  -7.697   1.932  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -2.628  -9.482   6.070  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -2.152  -8.379   2.001  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -0.929 -10.487   3.764  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.528  -7.387   4.861  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.526  -6.490   5.356  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.187  -5.045   5.226  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.715  -4.314   6.062  1.00 14.26           O
ATOM    952  CB  ASN A  60     -10.934  -6.798   6.807  1.00 19.23           C
ATOM    953  CG  ASN A  60     -11.390  -8.248   6.886  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -10.734  -9.242   7.193  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -12.695  -8.445   6.559  1.00 24.09           N
ATOM      0  H   ASN A  60      -9.855  -8.001   4.115  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -11.376  -6.674   4.699  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.094  -6.629   7.480  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -11.736  -6.131   7.124  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -13.088  -9.386   6.575  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -13.281  -7.652   6.297  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -9.386  -4.539   4.271  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.266  -3.149   3.957  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.433  -2.652   3.175  1.00 13.74           C
ATOM    965  O   ILE A  61     -10.820  -3.267   2.183  1.00 14.60           O
ATOM    966  CB  ILE A  61      -7.929  -2.935   3.309  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -6.816  -3.042   4.365  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.724  -1.637   2.510  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.595  -3.734   3.761  1.00 11.42           C
ATOM      0  H   ILE A  61      -8.792  -5.130   3.689  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.295  -2.541   4.861  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -7.887  -3.726   2.560  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -6.543  -2.049   4.721  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -7.174  -3.603   5.228  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.714  -1.618   2.100  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.448  -1.593   1.696  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.865  -0.779   3.167  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -4.809  -3.807   4.513  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -5.872  -4.734   3.427  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -5.232  -3.155   2.912  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -11.066  -1.571   3.666  1.00 13.97           N
ATOM    982  CA  GLN A  62     -12.187  -0.937   3.046  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.907   0.329   2.311  1.00 13.94           C
ATOM    984  O   GLN A  62     -10.795   0.836   2.169  1.00 12.15           O
ATOM    985  CB  GLN A  62     -13.204  -0.774   4.189  1.00 19.53           C
ATOM    986  CG  GLN A  62     -13.561  -2.060   4.937  1.00 26.38           C
ATOM    987  CD  GLN A  62     -13.895  -3.214   4.003  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -14.512  -3.092   2.945  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -13.346  -4.385   4.422  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.783  -1.119   4.535  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.560  -1.551   2.226  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.808  -0.055   4.906  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -14.119  -0.345   3.780  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -12.726  -2.346   5.576  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -14.412  -1.870   5.591  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -12.845  -4.425   5.310  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -13.435  -5.224   3.849  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -13.011   0.873   1.769  1.00 11.73           N
ATOM    999  CA  LYS A  63     -13.002   2.092   1.021  1.00 11.97           C
ATOM   1000  C   LYS A  63     -12.936   3.262   1.942  1.00 10.41           C
ATOM   1001  O   LYS A  63     -13.708   3.365   2.894  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -14.190   2.133   0.044  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -15.568   2.005   0.696  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -16.583   2.117  -0.444  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -17.933   2.260   0.261  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -19.019   2.363  -0.740  1.00 25.97           N
ATOM      0  H   LYS A  63     -13.937   0.453   1.853  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -12.105   2.142   0.403  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -14.153   3.071  -0.511  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -14.072   1.328  -0.682  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -15.667   1.052   1.215  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -15.724   2.789   1.437  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -16.373   2.977  -1.079  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -16.560   1.235  -1.084  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -18.106   1.402   0.910  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -17.928   3.145   0.897  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -19.933   2.460  -0.252  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -18.858   3.195  -1.342  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -19.030   1.506  -1.329  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -12.093   4.259   1.617  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -11.827   5.440   2.378  1.00 10.94           C
ATOM   1022  C   GLU A  64     -10.969   5.298   3.588  1.00  9.74           C
ATOM   1023  O   GLU A  64     -11.125   5.937   4.627  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -13.075   6.283   2.690  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -12.934   7.801   2.821  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -14.320   8.421   2.925  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -14.799   8.520   4.086  1.00 31.72           O
ATOM   1028  OE2 GLU A  64     -14.897   8.784   1.865  1.00 32.61           O
ATOM      0  H   GLU A  64     -11.555   4.235   0.751  1.00 10.04           H   new
ATOM      0  HA  GLU A  64     -11.207   5.988   1.669  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -13.808   6.087   1.907  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -13.498   5.911   3.623  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -12.343   8.049   3.703  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -12.404   8.206   1.958  1.00 24.16           H   new
ATOM   1035  N   SER A  65     -10.036   4.331   3.540  1.00  6.85           N
ATOM   1036  CA  SER A  65      -9.179   3.992   4.633  1.00  6.90           C
ATOM   1037  C   SER A  65      -7.765   4.327   4.305  1.00  4.72           C
ATOM   1038  O   SER A  65      -7.423   4.599   3.155  1.00  3.91           O
ATOM   1039  CB  SER A  65      -9.256   2.471   4.849  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.991   2.064   6.184  1.00 10.56           O
ATOM      0  H   SER A  65      -9.872   3.764   2.708  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -9.493   4.545   5.518  1.00  6.90           H   new
ATOM      0  HB2 SER A  65     -10.249   2.124   4.564  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -8.544   1.983   4.183  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.063   1.756   6.254  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -6.916   4.460   5.339  1.00  4.48           N
ATOM   1047  CA  THR A  66      -5.557   4.905   5.316  1.00  3.80           C
ATOM   1048  C   THR A  66      -4.565   3.827   5.587  1.00  4.60           C
ATOM   1049  O   THR A  66      -4.552   3.196   6.643  1.00  5.33           O
ATOM   1050  CB  THR A  66      -5.350   6.055   6.257  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -6.257   7.102   5.944  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -3.891   6.536   6.191  1.00  3.40           C
ATOM      0  H   THR A  66      -7.214   4.232   6.287  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -5.376   5.237   4.294  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -5.548   5.730   7.278  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -6.119   7.850   6.562  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -3.752   7.371   6.878  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -3.226   5.720   6.472  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -3.660   6.859   5.176  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -3.782   3.593   4.519  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -2.627   2.751   4.550  1.00  3.85           C
ATOM   1062  C   LEU A  67      -1.372   3.472   4.906  1.00  3.80           C
ATOM   1063  O   LEU A  67      -1.173   4.670   4.715  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -2.435   2.057   3.192  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -3.621   1.139   2.849  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -3.463   0.599   1.418  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -3.749   0.028   3.905  1.00  8.12           C
ATOM      0  H   LEU A  67      -3.959   4.004   3.602  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -2.814   2.019   5.335  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -2.320   2.810   2.412  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -1.515   1.472   3.209  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -4.554   1.702   2.874  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -4.305  -0.051   1.179  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -3.437   1.432   0.716  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -2.535   0.032   1.343  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -4.591  -0.617   3.654  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.833  -0.562   3.925  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -3.914   0.475   4.885  1.00  8.12           H   new
ATOM   1079  N   HIS A  68      -0.433   2.650   5.408  1.00  2.94           N
ATOM   1080  CA  HIS A  68       0.780   3.253   5.864  1.00  4.17           C
ATOM   1081  C   HIS A  68       1.891   2.745   5.011  1.00  5.32           C
ATOM   1082  O   HIS A  68       2.281   1.578   5.017  1.00  7.70           O
ATOM   1083  CB  HIS A  68       0.962   2.948   7.361  1.00  5.57           C
ATOM   1084  CG  HIS A  68       0.284   3.883   8.318  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       0.145   3.603   9.663  1.00 13.74           N
ATOM   1086  CD2 HIS A  68      -0.382   5.034   8.034  1.00 12.79           C
ATOM   1087  CE1 HIS A  68      -0.616   4.605  10.179  1.00 14.75           C
ATOM   1088  NE2 HIS A  68      -0.970   5.435   9.216  1.00 16.30           N
ATOM      0  H   HIS A  68      -0.501   1.636   5.496  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       0.763   4.339   5.772  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       0.596   1.939   7.551  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       2.029   2.947   7.582  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68      -0.439   5.533   7.078  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68      -0.889   4.706  11.219  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68      -1.581   6.244   9.328  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       2.471   3.591   4.141  1.00  5.29           N
ATOM   1097  CA  LEU A  69       3.555   3.267   3.267  1.00  3.97           C
ATOM   1098  C   LEU A  69       4.766   3.574   4.079  1.00  5.07           C
ATOM   1099  O   LEU A  69       4.984   4.724   4.457  1.00  4.34           O
ATOM   1100  CB  LEU A  69       3.546   3.988   1.908  1.00  6.08           C
ATOM   1101  CG  LEU A  69       4.502   3.369   0.875  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       3.806   2.146   0.254  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       4.819   4.438  -0.184  1.00  6.87           C
ATOM      0  H   LEU A  69       2.164   4.559   4.043  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       3.499   2.225   2.952  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       2.533   3.975   1.506  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       3.816   5.033   2.059  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       5.438   3.043   1.328  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       4.465   1.688  -0.484  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       3.577   1.422   1.036  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       2.882   2.461  -0.231  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       5.497   4.022  -0.929  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       3.896   4.754  -0.670  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       5.289   5.297   0.295  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       5.616   2.608   4.469  1.00  4.29           N
ATOM   1116  CA  VAL A  70       6.791   2.769   5.267  1.00  6.26           C
ATOM   1117  C   VAL A  70       7.973   2.428   4.426  1.00  9.22           C
ATOM   1118  O   VAL A  70       7.869   1.526   3.596  1.00  9.36           O
ATOM   1119  CB  VAL A  70       6.680   1.845   6.443  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       7.967   1.823   7.284  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       5.627   2.385   7.425  1.00  8.54           C
ATOM      0  H   VAL A  70       5.467   1.634   4.203  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       6.901   3.791   5.628  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       6.447   0.864   6.030  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       7.841   1.141   8.125  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       8.800   1.487   6.666  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       8.174   2.825   7.658  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       5.547   1.713   8.279  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       5.925   3.375   7.769  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       4.661   2.450   6.923  1.00  8.54           H   new
ATOM   1131  N   LEU A  71       8.994   3.303   4.459  1.00 12.71           N
ATOM   1132  CA  LEU A  71      10.047   3.279   3.492  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.276   2.881   4.233  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.419   2.987   5.450  1.00 19.26           O
ATOM   1135  CB  LEU A  71      10.458   4.604   2.828  1.00 17.10           C
ATOM   1136  CG  LEU A  71       9.358   5.227   1.952  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      10.053   6.216   1.001  1.00 19.57           C
ATOM   1138  CD2 LEU A  71       8.595   4.175   1.129  1.00 17.51           C
ATOM      0  H   LEU A  71       9.090   4.034   5.163  1.00 12.71           H   new
ATOM      0  HA  LEU A  71       9.668   2.629   2.703  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      10.739   5.316   3.604  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      11.344   4.433   2.216  1.00 17.10           H   new
ATOM      0  HG  LEU A  71       8.623   5.716   2.592  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71       9.309   6.685   0.357  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      10.564   6.983   1.583  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      10.779   5.682   0.388  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71       7.830   4.667   0.529  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71       9.291   3.652   0.473  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71       8.123   3.459   1.802  1.00 17.51           H   new