USER  MOD reduce.3.24.130724 H: found=0, std=0, add=546, rem=0, adj=12
USER  MOD reduce.3.24.130724 removed 554 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  40 TYR OH  :   rot   30:sc=  -0.902
USER  MOD Set 1.2: A  82 TYR OH  :   rot  -51:sc=    1.27
USER  MOD Set 2.1: A  14 TYR OH  :   rot   56:sc=   0.933
USER  MOD Set 2.2: A  44 GLN     :FLIP  amide:sc=   0.676  F(o=-1.4,f=1.6)
USER  MOD Single : A  11 ASN     :      amide:sc=    -1.8! C(o=-1.8!,f=-1.8!)
USER  MOD Single : A  37 LYS NZ  :NH3+    177:sc=       0   (180deg=-0.0108)
USER  MOD Single : A  41 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  43 GLN     :      amide:sc=  -0.912  K(o=-0.91,f=-2.1!)
USER  MOD Single : A  46 GLN     :      amide:sc=  -0.207  K(o=-0.21,f=-2.9!)
USER  MOD Single : A  51 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  52 LYS NZ  :NH3+   -158:sc=  -0.113   (180deg=-0.516)
USER  MOD Single : A  53 ASN     :      amide:sc=   -0.28  X(o=-0.28,f=-0.67)
USER  MOD Single : A  62 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  64 THR OG1 :   rot   73:sc=   -1.44
USER  MOD Single : A  70 ASN     :      amide:sc=   -6.05! C(o=-6!,f=-9.3!)
USER  MOD Single : A  73 ASN     :      amide:sc=  -0.686  X(o=-0.69,f=-0.65)
USER  MOD Single : A  75 THR OG1 :   rot   24:sc=   0.185
USER  MOD Single : A  77 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  80 SER OG  :   rot   97:sc=     1.9
USER  MOD Single : A  81 ASN     :      amide:sc=  -0.696  K(o=-0.7,f=-1.4)
USER  MOD Single : A  86 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD -----------------------------------------------------------------
ATOM     73  N   ARG A   5      -8.919  -3.352  12.527  1.00 23.02           N
ATOM     74  CA  ARG A   5      -8.150  -2.457  11.673  1.00  1.44           C
ATOM     75  C   ARG A   5      -7.010  -3.204  10.987  1.00 23.21           C
ATOM     76  O   ARG A   5      -6.596  -4.281  11.416  1.00 53.55           O
ATOM     77  CB  ARG A   5      -7.591  -1.292  12.491  1.00  5.33           C
ATOM     78  CG  ARG A   5      -8.399  -0.011  12.363  1.00 33.31           C
ATOM     79  CD  ARG A   5      -8.186   0.906  13.557  1.00 31.32           C
ATOM     80  NE  ARG A   5      -9.001   2.115  13.471  1.00 23.40           N
ATOM     81  CZ  ARG A   5      -9.208   2.935  14.496  1.00 51.21           C
ATOM     82  NH1 ARG A   5      -8.663   2.678  15.676  1.00 35.30           N
ATOM     83  NH2 ARG A   5      -9.963   4.015  14.339  1.00 44.42           N
ATOM      0  HA  ARG A   5      -8.818  -2.066  10.906  1.00  1.44           H   new
ATOM      0  HB2 ARG A   5      -7.552  -1.583  13.541  1.00  5.33           H   new
ATOM      0  HB3 ARG A   5      -6.566  -1.097  12.176  1.00  5.33           H   new
ATOM      0  HG2 ARG A   5      -8.115   0.509  11.448  1.00 33.31           H   new
ATOM      0  HG3 ARG A   5      -9.458  -0.255  12.275  1.00 33.31           H   new
ATOM      0  HD2 ARG A   5      -8.429   0.369  14.474  1.00 31.32           H   new
ATOM      0  HD3 ARG A   5      -7.133   1.182  13.619  1.00 31.32           H   new
ATOM      0  HE  ARG A   5      -9.435   2.342  12.576  1.00 23.40           H   new
ATOM      0 HH11 ARG A   5      -8.082   1.849  15.800  1.00 35.30           H   new
ATOM      0 HH12 ARG A   5      -8.824   3.310  16.461  1.00 35.30           H   new
ATOM      0 HH21 ARG A   5     -10.384   4.215  13.432  1.00 44.42           H   new
ATOM      0 HH22 ARG A   5     -10.122   4.645  15.125  1.00 44.42           H   new
ATOM     97  N   PRO A   6      -6.490  -2.622   9.897  1.00 23.31           N
ATOM     98  CA  PRO A   6      -5.392  -3.216   9.130  1.00  2.23           C
ATOM     99  C   PRO A   6      -4.071  -3.190   9.892  1.00 31.02           C
ATOM    100  O   PRO A   6      -3.931  -2.520  10.917  1.00 42.13           O
ATOM    101  CB  PRO A   6      -5.307  -2.327   7.887  1.00 54.23           C
ATOM    102  CG  PRO A   6      -5.871  -1.016   8.317  1.00 61.25           C
ATOM    103  CD  PRO A   6      -6.935  -1.337   9.330  1.00 25.10           C
ATOM      0  HA  PRO A   6      -5.573  -4.268   8.909  1.00  2.23           H   new
ATOM      0  HB2 PRO A   6      -4.277  -2.222   7.546  1.00 54.23           H   new
ATOM      0  HB3 PRO A   6      -5.876  -2.750   7.059  1.00 54.23           H   new
ATOM      0  HG2 PRO A   6      -5.098  -0.382   8.750  1.00 61.25           H   new
ATOM      0  HG3 PRO A   6      -6.290  -0.474   7.469  1.00 61.25           H   new
ATOM      0  HD2 PRO A   6      -7.008  -0.564  10.095  1.00 25.10           H   new
ATOM      0  HD3 PRO A   6      -7.918  -1.421   8.867  1.00 25.10           H   new
ATOM    111  N   PRO A   7      -3.079  -3.934   9.384  1.00 63.12           N
ATOM    112  CA  PRO A   7      -1.752  -4.014  10.002  1.00 43.53           C
ATOM    113  C   PRO A   7      -0.973  -2.711   9.869  1.00  4.24           C
ATOM    114  O   PRO A   7      -1.352  -1.804   9.126  1.00 11.42           O
ATOM    115  CB  PRO A   7      -1.060  -5.131   9.216  1.00 34.40           C
ATOM    116  CG  PRO A   7      -1.748  -5.147   7.895  1.00 34.32           C
ATOM    117  CD  PRO A   7      -3.176  -4.757   8.166  1.00 24.42           C
ATOM      0  HA  PRO A   7      -1.813  -4.203  11.074  1.00 43.53           H   new
ATOM      0  HB2 PRO A   7       0.006  -4.935   9.105  1.00 34.40           H   new
ATOM      0  HB3 PRO A   7      -1.156  -6.091   9.724  1.00 34.40           H   new
ATOM      0  HG2 PRO A   7      -1.278  -4.449   7.202  1.00 34.32           H   new
ATOM      0  HG3 PRO A   7      -1.693  -6.135   7.439  1.00 34.32           H   new
ATOM      0  HD2 PRO A   7      -3.604  -4.196   7.335  1.00 24.42           H   new
ATOM      0  HD3 PRO A   7      -3.809  -5.631   8.321  1.00 24.42           H   new
ATOM    125  N   PRO A   8       0.143  -2.608  10.606  1.00 60.24           N
ATOM    126  CA  PRO A   8       1.000  -1.419  10.587  1.00 12.22           C
ATOM    127  C   PRO A   8       1.743  -1.260   9.264  1.00 33.22           C
ATOM    128  O   PRO A   8       1.575  -2.063   8.348  1.00 55.22           O
ATOM    129  CB  PRO A   8       1.988  -1.676  11.727  1.00 45.33           C
ATOM    130  CG  PRO A   8       2.034  -3.158  11.862  1.00 71.44           C
ATOM    131  CD  PRO A   8       0.655  -3.649  11.514  1.00 62.03           C
ATOM      0  HA  PRO A   8       0.425  -0.500  10.702  1.00 12.22           H   new
ATOM      0  HB2 PRO A   8       2.973  -1.269  11.497  1.00 45.33           H   new
ATOM      0  HB3 PRO A   8       1.656  -1.204  12.652  1.00 45.33           H   new
ATOM      0  HG2 PRO A   8       2.781  -3.588  11.195  1.00 71.44           H   new
ATOM      0  HG3 PRO A   8       2.307  -3.449  12.876  1.00 71.44           H   new
ATOM      0  HD2 PRO A   8       0.686  -4.625  11.030  1.00 62.03           H   new
ATOM      0  HD3 PRO A   8       0.029  -3.753  12.401  1.00 62.03           H   new
ATOM    139  N   VAL A   9       2.562  -0.218   9.172  1.00 33.05           N
ATOM    140  CA  VAL A   9       3.331   0.046   7.962  1.00  4.01           C
ATOM    141  C   VAL A   9       4.254  -1.122   7.632  1.00 53.11           C
ATOM    142  O   VAL A   9       4.858  -1.736   8.513  1.00 74.14           O
ATOM    143  CB  VAL A   9       4.172   1.329   8.100  1.00 64.33           C
ATOM    144  CG1 VAL A   9       3.288   2.561   7.994  1.00 35.00           C
ATOM    145  CG2 VAL A   9       4.939   1.323   9.413  1.00 23.41           C
ATOM      0  H   VAL A   9       2.710   0.458   9.921  1.00 33.05           H   new
ATOM      0  HA  VAL A   9       2.613   0.177   7.153  1.00  4.01           H   new
ATOM      0  HB  VAL A   9       4.894   1.360   7.284  1.00 64.33           H   new
ATOM      0 HG11 VAL A   9       3.900   3.458   8.094  1.00 35.00           H   new
ATOM      0 HG12 VAL A   9       2.789   2.568   7.025  1.00 35.00           H   new
ATOM      0 HG13 VAL A   9       2.540   2.542   8.787  1.00 35.00           H   new
ATOM      0 HG21 VAL A   9       5.528   2.237   9.494  1.00 23.41           H   new
ATOM      0 HG22 VAL A   9       4.236   1.269  10.245  1.00 23.41           H   new
ATOM      0 HG23 VAL A   9       5.603   0.459   9.442  1.00 23.41           H   new
ATOM    155  N   PRO A  10       4.369  -1.437   6.334  1.00 15.53           N
ATOM    156  CA  PRO A  10       5.218  -2.533   5.857  1.00 44.11           C
ATOM    157  C   PRO A  10       6.703  -2.226   6.015  1.00  4.44           C
ATOM    158  O   PRO A  10       7.401  -1.966   5.035  1.00 73.31           O
ATOM    159  CB  PRO A  10       4.850  -2.646   4.376  1.00 63.24           C
ATOM    160  CG  PRO A  10       4.354  -1.294   4.002  1.00 11.33           C
ATOM    161  CD  PRO A  10       3.680  -0.746   5.231  1.00 55.21           C
ATOM      0  HA  PRO A  10       5.056  -3.451   6.422  1.00 44.11           H   new
ATOM      0  HB2 PRO A  10       5.713  -2.931   3.775  1.00 63.24           H   new
ATOM      0  HB3 PRO A  10       4.085  -3.406   4.216  1.00 63.24           H   new
ATOM      0  HG2 PRO A  10       5.175  -0.650   3.687  1.00 11.33           H   new
ATOM      0  HG3 PRO A  10       3.656  -1.351   3.167  1.00 11.33           H   new
ATOM      0  HD2 PRO A  10       3.792   0.336   5.302  1.00 55.21           H   new
ATOM      0  HD3 PRO A  10       2.611  -0.956   5.231  1.00 55.21           H   new
ATOM    169  N   ASN A  11       7.180  -2.256   7.255  1.00  4.11           N
ATOM    170  CA  ASN A  11       8.585  -1.980   7.540  1.00 33.33           C
ATOM    171  C   ASN A  11       9.112  -0.865   6.645  1.00 44.40           C
ATOM    172  O   ASN A  11       9.743  -1.107   5.617  1.00  2.33           O
ATOM    173  CB  ASN A  11       9.423  -3.246   7.347  1.00 13.14           C
ATOM    174  CG  ASN A  11       8.983  -4.053   6.142  1.00 14.43           C
ATOM    175  OD1 ASN A  11       8.115  -4.919   6.244  1.00 15.02           O
ATOM    176  ND2 ASN A  11       9.582  -3.771   4.991  1.00 13.41           N
ATOM      0  H   ASN A  11       6.616  -2.468   8.078  1.00  4.11           H   new
ATOM      0  HA  ASN A  11       8.664  -1.655   8.577  1.00 33.33           H   new
ATOM      0  HB2 ASN A  11      10.471  -2.970   7.233  1.00 13.14           H   new
ATOM      0  HB3 ASN A  11       9.352  -3.865   8.241  1.00 13.14           H   new
ATOM      0 HD21 ASN A  11       9.327  -4.281   4.145  1.00 13.41           H   new
ATOM      0 HD22 ASN A  11      10.297  -3.044   4.953  1.00 13.41           H   new
ATOM    183  N   PRO A  12       8.851   0.389   7.045  1.00 45.41           N
ATOM    184  CA  PRO A  12       9.293   1.568   6.294  1.00 52.24           C
ATOM    185  C   PRO A  12      10.804   1.760   6.353  1.00 54.21           C
ATOM    186  O   PRO A  12      11.416   1.628   7.413  1.00 22.32           O
ATOM    187  CB  PRO A  12       8.579   2.725   6.998  1.00 70.31           C
ATOM    188  CG  PRO A  12       8.336   2.233   8.383  1.00  1.01           C
ATOM    189  CD  PRO A  12       8.106   0.752   8.261  1.00 34.14           C
ATOM      0  HA  PRO A  12       9.058   1.487   5.233  1.00 52.24           H   new
ATOM      0  HB2 PRO A  12       9.192   3.626   7.000  1.00 70.31           H   new
ATOM      0  HB3 PRO A  12       7.644   2.977   6.497  1.00 70.31           H   new
ATOM      0  HG2 PRO A  12       9.189   2.444   9.028  1.00  1.01           H   new
ATOM      0  HG3 PRO A  12       7.472   2.727   8.827  1.00  1.01           H   new
ATOM      0  HD2 PRO A  12       8.476   0.215   9.134  1.00 34.14           H   new
ATOM      0  HD3 PRO A  12       7.046   0.517   8.168  1.00 34.14           H   new
ATOM    197  N   ASP A  13      11.401   2.073   5.208  1.00 21.35           N
ATOM    198  CA  ASP A  13      12.841   2.286   5.130  1.00 45.45           C
ATOM    199  C   ASP A  13      13.159   3.612   4.447  1.00 10.35           C
ATOM    200  O   ASP A  13      13.855   3.650   3.432  1.00 74.53           O
ATOM    201  CB  ASP A  13      13.508   1.136   4.373  1.00 11.11           C
ATOM    202  CG  ASP A  13      14.942   0.909   4.809  1.00  1.15           C
ATOM    203  OD1 ASP A  13      15.563  -0.060   4.324  1.00 31.12           O
ATOM    204  OD2 ASP A  13      15.442   1.700   5.634  1.00 44.21           O
ATOM      0  H   ASP A  13      10.910   2.185   4.321  1.00 21.35           H   new
ATOM      0  HA  ASP A  13      13.233   2.318   6.146  1.00 45.45           H   new
ATOM      0  HB2 ASP A  13      12.935   0.222   4.529  1.00 11.11           H   new
ATOM      0  HB3 ASP A  13      13.486   1.348   3.304  1.00 11.11           H   new
ATOM    210  N   TYR A  14      12.643   4.699   5.010  1.00  5.02           N
ATOM    211  CA  TYR A  14      12.869   6.029   4.454  1.00 44.02           C
ATOM    212  C   TYR A  14      13.991   6.747   5.196  1.00 45.12           C
ATOM    213  O   TYR A  14      14.571   7.707   4.689  1.00 34.42           O
ATOM    214  CB  TYR A  14      11.585   6.859   4.522  1.00 60.54           C
ATOM    215  CG  TYR A  14      10.946   6.873   5.893  1.00 60.32           C
ATOM    216  CD1 TYR A  14      11.564   7.511   6.963  1.00 52.31           C
ATOM    217  CD2 TYR A  14       9.726   6.249   6.118  1.00 62.30           C
ATOM    218  CE1 TYR A  14      10.983   7.526   8.216  1.00 73.11           C
ATOM    219  CE2 TYR A  14       9.138   6.259   7.369  1.00 33.25           C
ATOM    220  CZ  TYR A  14       9.771   6.898   8.414  1.00 10.23           C
ATOM    221  OH  TYR A  14       9.189   6.913   9.662  1.00 40.33           O
ATOM      0  H   TYR A  14      12.066   4.686   5.851  1.00  5.02           H   new
ATOM      0  HA  TYR A  14      13.164   5.913   3.411  1.00 44.02           H   new
ATOM      0  HB2 TYR A  14      11.808   7.883   4.224  1.00 60.54           H   new
ATOM      0  HB3 TYR A  14      10.869   6.466   3.800  1.00 60.54           H   new
ATOM      0  HD1 TYR A  14      12.514   8.003   6.812  1.00 52.31           H   new
ATOM      0  HD2 TYR A  14       9.228   5.747   5.302  1.00 62.30           H   new
ATOM      0  HE1 TYR A  14      11.475   8.027   9.037  1.00 73.11           H   new
ATOM      0  HE2 TYR A  14       8.188   5.769   7.527  1.00 33.25           H   new
ATOM      0  HH  TYR A  14       9.083   7.840   9.962  1.00 40.33           H   new
ATOM    491  N   GLU A  31       4.287   8.437 -16.518  1.00 12.12           N
ATOM    492  CA  GLU A  31       2.977   9.018 -16.245  1.00  4.44           C
ATOM    493  C   GLU A  31       2.048   7.992 -15.608  1.00 32.30           C
ATOM    494  O   GLU A  31       1.065   7.565 -16.216  1.00 10.14           O
ATOM    495  CB  GLU A  31       2.355   9.556 -17.535  1.00 15.41           C
ATOM    496  CG  GLU A  31       3.319  10.368 -18.385  1.00 15.12           C
ATOM    497  CD  GLU A  31       3.789   9.615 -19.615  1.00 35.31           C
ATOM    498  OE1 GLU A  31       2.944   8.976 -20.279  1.00 25.12           O
ATOM    499  OE2 GLU A  31       4.999   9.664 -19.914  1.00 24.03           O
ATOM      0  HA  GLU A  31       3.112   9.842 -15.544  1.00  4.44           H   new
ATOM      0  HB2 GLU A  31       1.981   8.719 -18.124  1.00 15.41           H   new
ATOM      0  HB3 GLU A  31       1.496  10.177 -17.282  1.00 15.41           H   new
ATOM      0  HG2 GLU A  31       2.834  11.294 -18.694  1.00 15.12           H   new
ATOM      0  HG3 GLU A  31       4.183  10.647 -17.782  1.00 15.12           H   new
ATOM    506  N   VAL A  32       2.364   7.597 -14.379  1.00 22.20           N
ATOM    507  CA  VAL A  32       1.557   6.619 -13.657  1.00 43.01           C
ATOM    508  C   VAL A  32       0.760   7.283 -12.539  1.00 32.32           C
ATOM    509  O   VAL A  32       1.124   8.356 -12.057  1.00 11.21           O
ATOM    510  CB  VAL A  32       2.431   5.504 -13.058  1.00 63.41           C
ATOM    511  CG1 VAL A  32       1.569   4.337 -12.599  1.00  4.22           C
ATOM    512  CG2 VAL A  32       3.474   5.044 -14.065  1.00 41.03           C
ATOM      0  H   VAL A  32       3.174   7.939 -13.862  1.00 22.20           H   new
ATOM      0  HA  VAL A  32       0.868   6.181 -14.379  1.00 43.01           H   new
ATOM      0  HB  VAL A  32       2.952   5.904 -12.188  1.00 63.41           H   new
ATOM      0 HG11 VAL A  32       2.205   3.558 -12.178  1.00  4.22           H   new
ATOM      0 HG12 VAL A  32       0.866   4.680 -11.840  1.00  4.22           H   new
ATOM      0 HG13 VAL A  32       1.018   3.935 -13.449  1.00  4.22           H   new
ATOM      0 HG21 VAL A  32       4.083   4.255 -13.624  1.00 41.03           H   new
ATOM      0 HG22 VAL A  32       2.976   4.662 -14.956  1.00 41.03           H   new
ATOM      0 HG23 VAL A  32       4.112   5.885 -14.338  1.00 41.03           H   new
ATOM    522  N   ILE A  33      -0.327   6.637 -12.131  1.00 12.44           N
ATOM    523  CA  ILE A  33      -1.174   7.163 -11.069  1.00 12.11           C
ATOM    524  C   ILE A  33      -1.654   6.049 -10.145  1.00  1.11           C
ATOM    525  O   ILE A  33      -2.086   4.991 -10.603  1.00 45.35           O
ATOM    526  CB  ILE A  33      -2.397   7.904 -11.640  1.00 34.42           C
ATOM    527  CG1 ILE A  33      -1.962   9.198 -12.330  1.00 22.14           C
ATOM    528  CG2 ILE A  33      -3.401   8.199 -10.535  1.00 23.33           C
ATOM    529  CD1 ILE A  33      -3.098   9.937 -13.002  1.00 32.32           C
ATOM      0  H   ILE A  33      -0.642   5.748 -12.520  1.00 12.44           H   new
ATOM      0  HA  ILE A  33      -0.566   7.866 -10.500  1.00 12.11           H   new
ATOM      0  HB  ILE A  33      -2.877   7.264 -12.380  1.00 34.42           H   new
ATOM      0 HG12 ILE A  33      -1.498   9.854 -11.594  1.00 22.14           H   new
ATOM      0 HG13 ILE A  33      -1.201   8.965 -13.074  1.00 22.14           H   new
ATOM      0 HG21 ILE A  33      -4.260   8.723 -10.954  1.00 23.33           H   new
ATOM      0 HG22 ILE A  33      -3.731   7.263 -10.084  1.00 23.33           H   new
ATOM      0 HG23 ILE A  33      -2.932   8.822  -9.774  1.00 23.33           H   new
ATOM      0 HD11 ILE A  33      -2.716  10.844 -13.470  1.00 32.32           H   new
ATOM      0 HD12 ILE A  33      -3.548   9.299 -13.762  1.00 32.32           H   new
ATOM      0 HD13 ILE A  33      -3.850  10.202 -12.259  1.00 32.32           H   new
ATOM    541  N   VAL A  34      -1.577   6.294  -8.842  1.00 60.21           N
ATOM    542  CA  VAL A  34      -2.006   5.313  -7.852  1.00 43.32           C
ATOM    543  C   VAL A  34      -3.225   5.807  -7.081  1.00 61.03           C
ATOM    544  O   VAL A  34      -3.530   6.999  -7.081  1.00 31.34           O
ATOM    545  CB  VAL A  34      -0.877   4.991  -6.855  1.00 32.22           C
ATOM    546  CG1 VAL A  34      -0.726   6.112  -5.838  1.00  1.53           C
ATOM    547  CG2 VAL A  34      -1.142   3.663  -6.160  1.00 14.33           C
ATOM      0  H   VAL A  34      -1.221   7.164  -8.446  1.00 60.21           H   new
ATOM      0  HA  VAL A  34      -2.268   4.406  -8.398  1.00 43.32           H   new
ATOM      0  HB  VAL A  34       0.058   4.906  -7.408  1.00 32.22           H   new
ATOM      0 HG11 VAL A  34       0.076   5.866  -5.142  1.00  1.53           H   new
ATOM      0 HG12 VAL A  34      -0.487   7.042  -6.354  1.00  1.53           H   new
ATOM      0 HG13 VAL A  34      -1.659   6.232  -5.288  1.00  1.53           H   new
ATOM      0 HG21 VAL A  34      -0.334   3.452  -5.459  1.00 14.33           H   new
ATOM      0 HG22 VAL A  34      -2.087   3.718  -5.619  1.00 14.33           H   new
ATOM      0 HG23 VAL A  34      -1.195   2.868  -6.903  1.00 14.33           H   new
ATOM    557  N   ILE A  35      -3.918   4.882  -6.425  1.00 62.33           N
ATOM    558  CA  ILE A  35      -5.103   5.223  -5.649  1.00  2.20           C
ATOM    559  C   ILE A  35      -4.963   4.763  -4.200  1.00 10.41           C
ATOM    560  O   ILE A  35      -4.642   3.605  -3.935  1.00 43.14           O
ATOM    561  CB  ILE A  35      -6.372   4.596  -6.254  1.00 11.23           C
ATOM    562  CG1 ILE A  35      -6.368   4.750  -7.776  1.00 15.25           C
ATOM    563  CG2 ILE A  35      -7.616   5.237  -5.655  1.00 61.32           C
ATOM    564  CD1 ILE A  35      -6.248   6.187  -8.238  1.00 75.15           C
ATOM      0  H   ILE A  35      -3.679   3.891  -6.416  1.00 62.33           H   new
ATOM      0  HA  ILE A  35      -5.196   6.309  -5.676  1.00  2.20           H   new
ATOM      0  HB  ILE A  35      -6.383   3.532  -6.015  1.00 11.23           H   new
ATOM      0 HG12 ILE A  35      -5.540   4.174  -8.189  1.00 15.25           H   new
ATOM      0 HG13 ILE A  35      -7.286   4.323  -8.179  1.00 15.25           H   new
ATOM      0 HG21 ILE A  35      -8.505   4.784  -6.092  1.00 61.32           H   new
ATOM      0 HG22 ILE A  35      -7.622   5.081  -4.576  1.00 61.32           H   new
ATOM      0 HG23 ILE A  35      -7.612   6.306  -5.867  1.00 61.32           H   new
ATOM      0 HD11 ILE A  35      -6.252   6.220  -9.327  1.00 75.15           H   new
ATOM      0 HD12 ILE A  35      -7.089   6.764  -7.854  1.00 75.15           H   new
ATOM      0 HD13 ILE A  35      -5.316   6.612  -7.865  1.00 75.15           H   new
ATOM    576  N   ALA A  36      -5.209   5.679  -3.269  1.00 64.14           N
ATOM    577  CA  ALA A  36      -5.114   5.366  -1.849  1.00 41.13           C
ATOM    578  C   ALA A  36      -6.254   4.455  -1.410  1.00 35.04           C
ATOM    579  O   ALA A  36      -7.406   4.884  -1.316  1.00 45.02           O
ATOM    580  CB  ALA A  36      -5.111   6.646  -1.026  1.00 12.10           C
ATOM      0  H   ALA A  36      -5.475   6.642  -3.473  1.00 64.14           H   new
ATOM      0  HA  ALA A  36      -4.176   4.836  -1.681  1.00 41.13           H   new
ATOM      0  HB1 ALA A  36      -5.040   6.398   0.033  1.00 12.10           H   new
ATOM      0  HB2 ALA A  36      -4.258   7.261  -1.313  1.00 12.10           H   new
ATOM      0  HB3 ALA A  36      -6.033   7.198  -1.208  1.00 12.10           H   new
ATOM    586  N   LYS A  37      -5.930   3.195  -1.141  1.00 44.30           N
ATOM    587  CA  LYS A  37      -6.927   2.223  -0.711  1.00 31.43           C
ATOM    588  C   LYS A  37      -7.750   2.765   0.454  1.00 12.54           C
ATOM    589  O   LYS A  37      -8.943   2.482   0.568  1.00 13.31           O
ATOM    590  CB  LYS A  37      -6.249   0.912  -0.303  1.00 64.30           C
ATOM    591  CG  LYS A  37      -5.583   0.188  -1.459  1.00 45.13           C
ATOM    592  CD  LYS A  37      -5.204  -1.234  -1.080  1.00 53.13           C
ATOM    593  CE  LYS A  37      -6.423  -2.143  -1.036  1.00 71.34           C
ATOM    594  NZ  LYS A  37      -6.095  -3.485  -0.478  1.00 14.41           N
ATOM      0  H   LYS A  37      -4.983   2.823  -1.213  1.00 44.30           H   new
ATOM      0  HA  LYS A  37      -7.597   2.034  -1.549  1.00 31.43           H   new
ATOM      0  HB2 LYS A  37      -5.502   1.122   0.462  1.00 64.30           H   new
ATOM      0  HB3 LYS A  37      -6.991   0.254   0.148  1.00 64.30           H   new
ATOM      0  HG2 LYS A  37      -6.257   0.170  -2.316  1.00 45.13           H   new
ATOM      0  HG3 LYS A  37      -4.691   0.734  -1.766  1.00 45.13           H   new
ATOM      0  HD2 LYS A  37      -4.484  -1.624  -1.800  1.00 53.13           H   new
ATOM      0  HD3 LYS A  37      -4.714  -1.234  -0.107  1.00 53.13           H   new
ATOM      0  HE2 LYS A  37      -7.201  -1.678  -0.430  1.00 71.34           H   new
ATOM      0  HE3 LYS A  37      -6.828  -2.257  -2.042  1.00 71.34           H   new
ATOM      0  HZ1 LYS A  37      -6.961  -4.057  -0.418  1.00 14.41           H   new
ATOM      0  HZ2 LYS A  37      -5.409  -3.961  -1.098  1.00 14.41           H   new
ATOM      0  HZ3 LYS A  37      -5.686  -3.375   0.472  1.00 14.41           H   new
ATOM    608  N   TRP A  38      -7.106   3.547   1.313  1.00 62.01           N
ATOM    609  CA  TRP A  38      -7.779   4.129   2.468  1.00 15.35           C
ATOM    610  C   TRP A  38      -7.105   5.430   2.891  1.00 61.51           C
ATOM    611  O   TRP A  38      -6.245   5.952   2.185  1.00  2.54           O
ATOM    612  CB  TRP A  38      -7.786   3.140   3.634  1.00 25.33           C
ATOM    613  CG  TRP A  38      -7.144   1.827   3.303  1.00 74.21           C
ATOM    614  CD1 TRP A  38      -5.818   1.514   3.400  1.00 15.53           C
ATOM    615  CD2 TRP A  38      -7.802   0.651   2.818  1.00 61.02           C
ATOM    616  NE1 TRP A  38      -5.612   0.214   3.005  1.00  2.15           N
ATOM    617  CE2 TRP A  38      -6.813  -0.338   2.645  1.00  2.50           C
ATOM    618  CE3 TRP A  38      -9.129   0.335   2.517  1.00 62.03           C
ATOM    619  CZ2 TRP A  38      -7.112  -1.617   2.182  1.00  2.33           C
ATOM    620  CZ3 TRP A  38      -9.424  -0.935   2.057  1.00 23.21           C
ATOM    621  CH2 TRP A  38      -8.420  -1.897   1.894  1.00 21.03           C
ATOM      0  H   TRP A  38      -6.119   3.792   1.231  1.00 62.01           H   new
ATOM      0  HA  TRP A  38      -8.808   4.350   2.184  1.00 15.35           H   new
ATOM      0  HB2 TRP A  38      -7.267   3.586   4.483  1.00 25.33           H   new
ATOM      0  HB3 TRP A  38      -8.816   2.964   3.946  1.00 25.33           H   new
ATOM      0  HD1 TRP A  38      -5.045   2.189   3.737  1.00 15.53           H   new
ATOM      0  HE1 TRP A  38      -4.711  -0.263   2.983  1.00  2.15           H   new
ATOM      0  HE3 TRP A  38      -9.911   1.070   2.641  1.00 62.03           H   new
ATOM      0  HZ2 TRP A  38      -6.339  -2.361   2.055  1.00  2.33           H   new
ATOM      0  HZ3 TRP A  38     -10.446  -1.189   1.819  1.00 23.21           H   new
ATOM      0  HH2 TRP A  38      -8.683  -2.880   1.533  1.00 21.03           H   new
ATOM    632  N   ASP A  39      -7.503   5.948   4.049  1.00 52.15           N
ATOM    633  CA  ASP A  39      -6.936   7.188   4.567  1.00 72.54           C
ATOM    634  C   ASP A  39      -5.879   6.899   5.629  1.00 34.22           C
ATOM    635  O   ASP A  39      -6.133   6.176   6.593  1.00 14.01           O
ATOM    636  CB  ASP A  39      -8.037   8.071   5.153  1.00 12.31           C
ATOM    637  CG  ASP A  39      -9.105   7.268   5.870  1.00  3.21           C
ATOM    638  OD1 ASP A  39     -10.300   7.597   5.715  1.00 60.02           O
ATOM    639  OD2 ASP A  39      -8.744   6.310   6.585  1.00 75.42           O
ATOM      0  H   ASP A  39      -8.216   5.528   4.646  1.00 52.15           H   new
ATOM      0  HA  ASP A  39      -6.460   7.715   3.740  1.00 72.54           H   new
ATOM      0  HB2 ASP A  39      -7.595   8.784   5.849  1.00 12.31           H   new
ATOM      0  HB3 ASP A  39      -8.498   8.650   4.353  1.00 12.31           H   new
ATOM    645  N   TYR A  40      -4.692   7.468   5.445  1.00 40.50           N
ATOM    646  CA  TYR A  40      -3.596   7.269   6.385  1.00 11.41           C
ATOM    647  C   TYR A  40      -3.040   8.608   6.864  1.00 41.15           C
ATOM    648  O   TYR A  40      -3.295   9.651   6.263  1.00 54.12           O
ATOM    649  CB  TYR A  40      -2.483   6.445   5.735  1.00  3.12           C
ATOM    650  CG  TYR A  40      -1.660   5.652   6.726  1.00 52.40           C
ATOM    651  CD1 TYR A  40      -2.272   4.844   7.677  1.00 43.24           C
ATOM    652  CD2 TYR A  40      -0.273   5.710   6.709  1.00 62.11           C
ATOM    653  CE1 TYR A  40      -1.524   4.119   8.584  1.00 43.13           C
ATOM    654  CE2 TYR A  40       0.484   4.986   7.612  1.00 13.41           C
ATOM    655  CZ  TYR A  40      -0.147   4.193   8.548  1.00 42.24           C
ATOM    656  OH  TYR A  40       0.602   3.470   9.449  1.00 15.00           O
ATOM      0  H   TYR A  40      -4.465   8.070   4.654  1.00 40.50           H   new
ATOM      0  HA  TYR A  40      -3.984   6.727   7.248  1.00 11.41           H   new
ATOM      0  HB2 TYR A  40      -2.925   5.760   5.011  1.00  3.12           H   new
ATOM      0  HB3 TYR A  40      -1.824   7.113   5.180  1.00  3.12           H   new
ATOM      0  HD1 TYR A  40      -3.350   4.782   7.707  1.00 43.24           H   new
ATOM      0  HD2 TYR A  40       0.223   6.331   5.978  1.00 62.11           H   new
ATOM      0  HE1 TYR A  40      -2.015   3.497   9.318  1.00 43.13           H   new
ATOM      0  HE2 TYR A  40       1.562   5.041   7.585  1.00 13.41           H   new
ATOM      0  HH  TYR A  40       0.120   2.653   9.694  1.00 15.00           H   new
ATOM    666  N   THR A  41      -2.277   8.568   7.952  1.00 42.02           N
ATOM    667  CA  THR A  41      -1.684   9.776   8.513  1.00 63.41           C
ATOM    668  C   THR A  41      -0.163   9.736   8.422  1.00 73.12           C
ATOM    669  O   THR A  41       0.477   8.833   8.963  1.00 12.42           O
ATOM    670  CB  THR A  41      -2.094   9.969   9.986  1.00 63.12           C
ATOM    671  OG1 THR A  41      -1.438  11.120  10.529  1.00 41.31           O
ATOM    672  CG2 THR A  41      -1.742   8.742  10.812  1.00 51.55           C
ATOM      0  H   THR A  41      -2.055   7.713   8.462  1.00 42.02           H   new
ATOM      0  HA  THR A  41      -2.058  10.615   7.925  1.00 63.41           H   new
ATOM      0  HB  THR A  41      -3.174  10.114  10.024  1.00 63.12           H   new
ATOM      0  HG1 THR A  41      -1.704  11.237  11.465  1.00 41.31           H   new
ATOM      0 HG21 THR A  41      -2.041   8.903  11.848  1.00 51.55           H   new
ATOM      0 HG22 THR A  41      -2.265   7.873  10.414  1.00 51.55           H   new
ATOM      0 HG23 THR A  41      -0.667   8.570  10.767  1.00 51.55           H   new
ATOM    680  N   ALA A  42       0.410  10.717   7.735  1.00 43.01           N
ATOM    681  CA  ALA A  42       1.857  10.795   7.575  1.00 40.20           C
ATOM    682  C   ALA A  42       2.559  10.802   8.929  1.00 34.41           C
ATOM    683  O   ALA A  42       2.067  11.393   9.890  1.00 44.43           O
ATOM    684  CB  ALA A  42       2.234  12.035   6.777  1.00 71.32           C
ATOM      0  H   ALA A  42      -0.106  11.470   7.279  1.00 43.01           H   new
ATOM      0  HA  ALA A  42       2.186   9.911   7.029  1.00 40.20           H   new
ATOM      0  HB1 ALA A  42       3.317  12.080   6.665  1.00 71.32           H   new
ATOM      0  HB2 ALA A  42       1.769  11.989   5.792  1.00 71.32           H   new
ATOM      0  HB3 ALA A  42       1.886  12.925   7.301  1.00 71.32           H   new
ATOM    690  N   GLN A  43       3.709  10.139   8.998  1.00 54.34           N
ATOM    691  CA  GLN A  43       4.477  10.067  10.234  1.00 32.33           C
ATOM    692  C   GLN A  43       5.338  11.312  10.413  1.00 72.51           C
ATOM    693  O   GLN A  43       5.548  11.778  11.533  1.00 23.44           O
ATOM    694  CB  GLN A  43       5.358   8.816  10.241  1.00 61.21           C
ATOM    695  CG  GLN A  43       4.575   7.520  10.128  1.00 74.54           C
ATOM    696  CD  GLN A  43       4.451   7.035   8.696  1.00 13.31           C
ATOM    697  OE1 GLN A  43       5.435   6.982   7.959  1.00 41.44           O
ATOM    698  NE2 GLN A  43       3.236   6.679   8.295  1.00 41.42           N
ATOM      0  H   GLN A  43       4.129   9.644   8.211  1.00 54.34           H   new
ATOM      0  HA  GLN A  43       3.775  10.011  11.066  1.00 32.33           H   new
ATOM      0  HB2 GLN A  43       6.066   8.876   9.415  1.00 61.21           H   new
ATOM      0  HB3 GLN A  43       5.942   8.799  11.161  1.00 61.21           H   new
ATOM      0  HG2 GLN A  43       5.064   6.751  10.727  1.00 74.54           H   new
ATOM      0  HG3 GLN A  43       3.579   7.664  10.546  1.00 74.54           H   new
ATOM      0 HE21 GLN A  43       2.448   6.739   8.940  1.00 41.42           H   new
ATOM      0 HE22 GLN A  43       3.091   6.345   7.342  1.00 41.42           H   new
ATOM    707  N   GLN A  44       5.835  11.846   9.301  1.00 24.31           N
ATOM    708  CA  GLN A  44       6.675  13.037   9.337  1.00 71.33           C
ATOM    709  C   GLN A  44       6.461  13.892   8.092  1.00 61.02           C
ATOM    710  O   GLN A  44       5.730  13.505   7.180  1.00  4.00           O
ATOM    711  CB  GLN A  44       8.150  12.644   9.452  1.00  1.14           C
ATOM    712  CG  GLN A  44       8.591  11.627   8.413  1.00 13.53           C
ATOM    713  CD  GLN A  44       9.685  10.709   8.922  1.00 14.41           C
ATOM    714  OE1 GLN A  44       9.293   9.667   9.646  1.00 42.45           O   flip
ATOM    715  NE2 GLN A  44      10.868  10.933   8.667  1.00 23.24           N   flip
ATOM      0  H   GLN A  44       5.671  11.473   8.366  1.00 24.31           H   new
ATOM      0  HA  GLN A  44       6.393  13.623  10.212  1.00 71.33           H   new
ATOM      0  HB2 GLN A  44       8.764  13.539   9.356  1.00  1.14           H   new
ATOM      0  HB3 GLN A  44       8.333  12.237  10.447  1.00  1.14           H   new
ATOM      0  HG2 GLN A  44       7.732  11.029   8.109  1.00 13.53           H   new
ATOM      0  HG3 GLN A  44       8.945  12.151   7.525  1.00 13.53           H   new
ATOM      0 HE21 GLN A  44      11.124  11.746   8.107  1.00 23.24           H   new
ATOM      0 HE22 GLN A  44      11.593  10.306   9.016  1.00 23.24           H   new
ATOM    724  N   ASP A  45       7.102  15.055   8.061  1.00 15.01           N
ATOM    725  CA  ASP A  45       6.981  15.964   6.927  1.00 31.20           C
ATOM    726  C   ASP A  45       7.477  15.303   5.644  1.00 31.32           C
ATOM    727  O   ASP A  45       7.132  15.728   4.543  1.00 23.53           O
ATOM    728  CB  ASP A  45       7.770  17.248   7.190  1.00 24.00           C
ATOM    729  CG  ASP A  45       7.009  18.226   8.064  1.00 34.24           C
ATOM    730  OD1 ASP A  45       7.058  18.079   9.304  1.00 50.23           O
ATOM    731  OD2 ASP A  45       6.364  19.139   7.508  1.00  2.14           O
ATOM      0  H   ASP A  45       7.710  15.391   8.808  1.00 15.01           H   new
ATOM      0  HA  ASP A  45       5.927  16.212   6.803  1.00 31.20           H   new
ATOM      0  HB2 ASP A  45       8.717  16.998   7.669  1.00 24.00           H   new
ATOM      0  HB3 ASP A  45       8.010  17.725   6.240  1.00 24.00           H   new
ATOM    737  N   GLN A  46       8.287  14.261   5.798  1.00 73.03           N
ATOM    738  CA  GLN A  46       8.830  13.541   4.651  1.00 22.15           C
ATOM    739  C   GLN A  46       7.750  12.711   3.967  1.00 23.34           C
ATOM    740  O   GLN A  46       7.659  12.683   2.740  1.00 23.50           O
ATOM    741  CB  GLN A  46       9.983  12.637   5.090  1.00 11.42           C
ATOM    742  CG  GLN A  46      10.935  12.273   3.961  1.00 34.24           C
ATOM    743  CD  GLN A  46      11.490  10.869   4.095  1.00 73.02           C
ATOM    744  OE1 GLN A  46      11.332  10.224   5.132  1.00 20.35           O
ATOM    745  NE2 GLN A  46      12.144  10.388   3.046  1.00 52.44           N
ATOM      0  H   GLN A  46       8.582  13.896   6.704  1.00 73.03           H   new
ATOM      0  HA  GLN A  46       9.204  14.275   3.937  1.00 22.15           H   new
ATOM      0  HB2 GLN A  46      10.544  13.136   5.880  1.00 11.42           H   new
ATOM      0  HB3 GLN A  46       9.574  11.722   5.518  1.00 11.42           H   new
ATOM      0  HG2 GLN A  46      10.414  12.364   3.008  1.00 34.24           H   new
ATOM      0  HG3 GLN A  46      11.760  12.985   3.943  1.00 34.24           H   new
ATOM      0 HE21 GLN A  46      12.251  10.958   2.207  1.00 52.44           H   new
ATOM      0 HE22 GLN A  46      12.540   9.448   3.079  1.00 52.44           H   new
ATOM    754  N   GLU A  47       6.932  12.036   4.770  1.00 41.10           N
ATOM    755  CA  GLU A  47       5.859  11.204   4.239  1.00 33.53           C
ATOM    756  C   GLU A  47       4.683  12.061   3.779  1.00  2.32           C
ATOM    757  O   GLU A  47       4.718  13.288   3.877  1.00  4.51           O
ATOM    758  CB  GLU A  47       5.389  10.203   5.298  1.00 75.01           C
ATOM    759  CG  GLU A  47       6.511   9.357   5.875  1.00 61.10           C
ATOM    760  CD  GLU A  47       7.498   8.899   4.818  1.00 45.41           C
ATOM    761  OE1 GLU A  47       8.354   9.715   4.414  1.00 25.30           O
ATOM    762  OE2 GLU A  47       7.417   7.727   4.396  1.00 32.34           O
ATOM      0  H   GLU A  47       6.992  12.049   5.788  1.00 41.10           H   new
ATOM      0  HA  GLU A  47       6.248  10.659   3.379  1.00 33.53           H   new
ATOM      0  HB2 GLU A  47       4.901  10.746   6.108  1.00 75.01           H   new
ATOM      0  HB3 GLU A  47       4.639   9.546   4.857  1.00 75.01           H   new
ATOM      0  HG2 GLU A  47       7.039   9.931   6.636  1.00 61.10           H   new
ATOM      0  HG3 GLU A  47       6.085   8.485   6.372  1.00 61.10           H   new
ATOM    769  N   LEU A  48       3.643  11.406   3.275  1.00 34.14           N
ATOM    770  CA  LEU A  48       2.456  12.107   2.797  1.00 62.12           C
ATOM    771  C   LEU A  48       1.188  11.482   3.369  1.00 74.34           C
ATOM    772  O   LEU A  48       1.116  10.269   3.567  1.00 15.12           O
ATOM    773  CB  LEU A  48       2.405  12.083   1.268  1.00 52.21           C
ATOM    774  CG  LEU A  48       2.189  13.431   0.582  1.00  0.04           C
ATOM    775  CD1 LEU A  48       2.463  13.322  -0.910  1.00 22.53           C
ATOM    776  CD2 LEU A  48       0.775  13.937   0.831  1.00 74.25           C
ATOM      0  H   LEU A  48       3.597  10.391   3.187  1.00 34.14           H   new
ATOM      0  HA  LEU A  48       2.515  13.141   3.136  1.00 62.12           H   new
ATOM      0  HB2 LEU A  48       3.338  11.656   0.900  1.00 52.21           H   new
ATOM      0  HB3 LEU A  48       1.604  11.410   0.962  1.00 52.21           H   new
ATOM      0  HG  LEU A  48       2.890  14.149   1.007  1.00  0.04           H   new
ATOM      0 HD11 LEU A  48       2.304  14.292  -1.381  1.00 22.53           H   new
ATOM      0 HD12 LEU A  48       3.494  13.007  -1.068  1.00 22.53           H   new
ATOM      0 HD13 LEU A  48       1.788  12.589  -1.351  1.00 22.53           H   new
ATOM      0 HD21 LEU A  48       0.640  14.898   0.335  1.00 74.25           H   new
ATOM      0 HD22 LEU A  48       0.057  13.220   0.434  1.00 74.25           H   new
ATOM      0 HD23 LEU A  48       0.615  14.056   1.903  1.00 74.25           H   new
ATOM    788  N   ASP A  49       0.188  12.318   3.630  1.00 64.40           N
ATOM    789  CA  ASP A  49      -1.079  11.846   4.176  1.00 21.33           C
ATOM    790  C   ASP A  49      -2.090  11.594   3.062  1.00 13.34           C
ATOM    791  O   ASP A  49      -2.442  12.505   2.311  1.00 61.44           O
ATOM    792  CB  ASP A  49      -1.641  12.865   5.169  1.00 31.30           C
ATOM    793  CG  ASP A  49      -0.550  13.592   5.931  1.00 53.40           C
ATOM    794  OD1 ASP A  49       0.108  14.468   5.332  1.00 13.34           O
ATOM    795  OD2 ASP A  49      -0.356  13.287   7.126  1.00 74.32           O
ATOM      0  H   ASP A  49       0.231  13.325   3.472  1.00 64.40           H   new
ATOM      0  HA  ASP A  49      -0.895  10.906   4.696  1.00 21.33           H   new
ATOM      0  HB2 ASP A  49      -2.252  13.591   4.633  1.00 31.30           H   new
ATOM      0  HB3 ASP A  49      -2.297  12.356   5.876  1.00 31.30           H   new
ATOM    801  N   ILE A  50      -2.553  10.352   2.960  1.00 22.40           N
ATOM    802  CA  ILE A  50      -3.523   9.979   1.939  1.00 10.34           C
ATOM    803  C   ILE A  50      -4.924   9.861   2.528  1.00  1.53           C
ATOM    804  O   ILE A  50      -5.090   9.563   3.710  1.00 21.44           O
ATOM    805  CB  ILE A  50      -3.148   8.647   1.265  1.00 42.41           C
ATOM    806  CG1 ILE A  50      -2.894   7.570   2.321  1.00 15.31           C
ATOM    807  CG2 ILE A  50      -1.923   8.828   0.380  1.00 42.31           C
ATOM    808  CD1 ILE A  50      -2.638   6.199   1.736  1.00 43.02           C
ATOM      0  H   ILE A  50      -2.271   9.587   3.573  1.00 22.40           H   new
ATOM      0  HA  ILE A  50      -3.512  10.771   1.190  1.00 10.34           H   new
ATOM      0  HB  ILE A  50      -3.981   8.326   0.639  1.00 42.41           H   new
ATOM      0 HG12 ILE A  50      -2.037   7.863   2.928  1.00 15.31           H   new
ATOM      0 HG13 ILE A  50      -3.754   7.517   2.988  1.00 15.31           H   new
ATOM      0 HG21 ILE A  50      -1.670   7.878  -0.090  1.00 42.31           H   new
ATOM      0 HG22 ILE A  50      -2.137   9.568  -0.391  1.00 42.31           H   new
ATOM      0 HG23 ILE A  50      -1.083   9.168   0.986  1.00 42.31           H   new
ATOM      0 HD11 ILE A  50      -2.466   5.486   2.542  1.00 43.02           H   new
ATOM      0 HD12 ILE A  50      -3.503   5.885   1.152  1.00 43.02           H   new
ATOM      0 HD13 ILE A  50      -1.760   6.237   1.091  1.00 43.02           H   new
ATOM    820  N   LYS A  51      -5.932  10.095   1.695  1.00 12.34           N
ATOM    821  CA  LYS A  51      -7.322  10.013   2.130  1.00 62.34           C
ATOM    822  C   LYS A  51      -8.092   8.990   1.301  1.00 24.54           C
ATOM    823  O   LYS A  51      -7.669   8.617   0.207  1.00 65.32           O
ATOM    824  CB  LYS A  51      -7.994  11.383   2.024  1.00 73.31           C
ATOM    825  CG  LYS A  51      -8.698  11.816   3.298  1.00 23.22           C
ATOM    826  CD  LYS A  51      -9.556  13.048   3.070  1.00 53.40           C
ATOM    827  CE  LYS A  51     -10.425  13.355   4.279  1.00 31.30           C
ATOM    828  NZ  LYS A  51     -11.802  13.761   3.886  1.00 72.51           N
ATOM      0  H   LYS A  51      -5.812  10.343   0.713  1.00 12.34           H   new
ATOM      0  HA  LYS A  51      -7.332   9.692   3.171  1.00 62.34           H   new
ATOM      0  HB2 LYS A  51      -7.242  12.128   1.763  1.00 73.31           H   new
ATOM      0  HB3 LYS A  51      -8.717  11.361   1.209  1.00 73.31           H   new
ATOM      0  HG2 LYS A  51      -9.321  11.001   3.665  1.00 23.22           H   new
ATOM      0  HG3 LYS A  51      -7.958  12.025   4.071  1.00 23.22           H   new
ATOM      0  HD2 LYS A  51      -8.916  13.903   2.855  1.00 53.40           H   new
ATOM      0  HD3 LYS A  51     -10.189  12.895   2.196  1.00 53.40           H   new
ATOM      0  HE2 LYS A  51     -10.476  12.476   4.922  1.00 31.30           H   new
ATOM      0  HE3 LYS A  51      -9.965  14.152   4.864  1.00 31.30           H   new
ATOM      0  HZ1 LYS A  51     -12.362  13.961   4.739  1.00 72.51           H   new
ATOM      0  HZ2 LYS A  51     -11.756  14.615   3.293  1.00 72.51           H   new
ATOM      0  HZ3 LYS A  51     -12.251  12.991   3.350  1.00 72.51           H   new
ATOM    842  N   LYS A  52      -9.226   8.540   1.828  1.00 22.25           N
ATOM    843  CA  LYS A  52     -10.057   7.564   1.136  1.00 75.32           C
ATOM    844  C   LYS A  52     -10.309   7.988  -0.307  1.00 43.44           C
ATOM    845  O   LYS A  52     -10.654   9.138  -0.575  1.00 61.33           O
ATOM    846  CB  LYS A  52     -11.391   7.389   1.867  1.00  2.14           C
ATOM    847  CG  LYS A  52     -11.369   6.297   2.922  1.00 60.11           C
ATOM    848  CD  LYS A  52     -11.328   4.915   2.293  1.00 41.51           C
ATOM    849  CE  LYS A  52     -12.672   4.538   1.688  1.00 73.33           C
ATOM    850  NZ  LYS A  52     -13.749   4.492   2.715  1.00 32.34           N
ATOM      0  H   LYS A  52      -9.590   8.837   2.733  1.00 22.25           H   new
ATOM      0  HA  LYS A  52      -9.525   6.613   1.129  1.00 75.32           H   new
ATOM      0  HB2 LYS A  52     -11.663   8.333   2.339  1.00  2.14           H   new
ATOM      0  HB3 LYS A  52     -12.168   7.162   1.137  1.00  2.14           H   new
ATOM      0  HG2 LYS A  52     -10.500   6.430   3.567  1.00 60.11           H   new
ATOM      0  HG3 LYS A  52     -12.252   6.384   3.555  1.00 60.11           H   new
ATOM      0  HD2 LYS A  52     -10.560   4.888   1.520  1.00 41.51           H   new
ATOM      0  HD3 LYS A  52     -11.048   4.179   3.047  1.00 41.51           H   new
ATOM      0  HE2 LYS A  52     -12.938   5.259   0.915  1.00 73.33           H   new
ATOM      0  HE3 LYS A  52     -12.592   3.566   1.202  1.00 73.33           H   new
ATOM      0  HZ1 LYS A  52     -14.529   3.895   2.374  1.00 32.34           H   new
ATOM      0  HZ2 LYS A  52     -13.370   4.095   3.598  1.00 32.34           H   new
ATOM      0  HZ3 LYS A  52     -14.102   5.454   2.892  1.00 32.34           H   new
ATOM    864  N   ASN A  53     -10.133   7.050  -1.233  1.00 11.43           N
ATOM    865  CA  ASN A  53     -10.342   7.329  -2.650  1.00 62.44           C
ATOM    866  C   ASN A  53      -9.567   8.570  -3.082  1.00 61.52           C
ATOM    867  O   ASN A  53     -10.158   9.601  -3.401  1.00  3.13           O
ATOM    868  CB  ASN A  53     -11.832   7.515  -2.940  1.00 13.35           C
ATOM    869  CG  ASN A  53     -12.100   7.858  -4.394  1.00 23.04           C
ATOM    870  OD1 ASN A  53     -11.411   7.376  -5.293  1.00 50.42           O
ATOM    871  ND2 ASN A  53     -13.104   8.694  -4.629  1.00 72.31           N
ATOM      0  H   ASN A  53      -9.847   6.093  -1.028  1.00 11.43           H   new
ATOM      0  HA  ASN A  53      -9.972   6.477  -3.221  1.00 62.44           H   new
ATOM      0  HB2 ASN A  53     -12.367   6.601  -2.681  1.00 13.35           H   new
ATOM      0  HB3 ASN A  53     -12.227   8.307  -2.304  1.00 13.35           H   new
ATOM      0 HD21 ASN A  53     -13.331   8.962  -5.587  1.00 72.31           H   new
ATOM      0 HD22 ASN A  53     -13.648   9.069  -3.852  1.00 72.31           H   new
ATOM    878  N   GLU A  54      -8.242   8.462  -3.087  1.00 13.30           N
ATOM    879  CA  GLU A  54      -7.388   9.576  -3.480  1.00 53.01           C
ATOM    880  C   GLU A  54      -6.389   9.146  -4.549  1.00 52.25           C
ATOM    881  O   GLU A  54      -5.684   8.150  -4.391  1.00 45.13           O
ATOM    882  CB  GLU A  54      -6.642  10.127  -2.262  1.00 43.32           C
ATOM    883  CG  GLU A  54      -5.795  11.350  -2.571  1.00  4.53           C
ATOM    884  CD  GLU A  54      -6.478  12.647  -2.185  1.00 74.02           C
ATOM    885  OE1 GLU A  54      -7.165  12.668  -1.142  1.00 14.41           O
ATOM    886  OE2 GLU A  54      -6.326  13.640  -2.926  1.00  3.21           O
ATOM      0  H   GLU A  54      -7.738   7.615  -2.824  1.00 13.30           H   new
ATOM      0  HA  GLU A  54      -8.023  10.359  -3.895  1.00 53.01           H   new
ATOM      0  HB2 GLU A  54      -7.366  10.382  -1.488  1.00 43.32           H   new
ATOM      0  HB3 GLU A  54      -6.001   9.345  -1.854  1.00 43.32           H   new
ATOM      0  HG2 GLU A  54      -4.845  11.273  -2.041  1.00  4.53           H   new
ATOM      0  HG3 GLU A  54      -5.565  11.368  -3.636  1.00  4.53           H   new
ATOM    893  N   ARG A  55      -6.337   9.903  -5.641  1.00 63.11           N
ATOM    894  CA  ARG A  55      -5.427   9.601  -6.739  1.00 23.31           C
ATOM    895  C   ARG A  55      -4.256  10.578  -6.760  1.00 13.12           C
ATOM    896  O   ARG A  55      -4.408  11.753  -6.423  1.00 31.34           O
ATOM    897  CB  ARG A  55      -6.171   9.650  -8.074  1.00 41.12           C
ATOM    898  CG  ARG A  55      -7.156  10.803  -8.182  1.00 24.31           C
ATOM    899  CD  ARG A  55      -8.544  10.396  -7.716  1.00 54.12           C
ATOM    900  NE  ARG A  55      -9.356   9.871  -8.812  1.00 70.24           N
ATOM    901  CZ  ARG A  55     -10.667   9.677  -8.726  1.00 12.32           C
ATOM    902  NH1 ARG A  55     -11.312   9.964  -7.605  1.00 12.11           N
ATOM    903  NH2 ARG A  55     -11.337   9.196  -9.767  1.00  4.03           N
ATOM      0  H   ARG A  55      -6.915  10.730  -5.788  1.00 63.11           H   new
ATOM      0  HA  ARG A  55      -5.035   8.595  -6.586  1.00 23.31           H   new
ATOM      0  HB2 ARG A  55      -5.444   9.728  -8.882  1.00 41.12           H   new
ATOM      0  HB3 ARG A  55      -6.707   8.711  -8.216  1.00 41.12           H   new
ATOM      0  HG2 ARG A  55      -6.802  11.642  -7.584  1.00 24.31           H   new
ATOM      0  HG3 ARG A  55      -7.204  11.146  -9.215  1.00 24.31           H   new
ATOM      0  HD2 ARG A  55      -8.457   9.641  -6.935  1.00 54.12           H   new
ATOM      0  HD3 ARG A  55      -9.045  11.257  -7.273  1.00 54.12           H   new
ATOM      0  HE  ARG A  55      -8.891   9.641  -9.690  1.00 70.24           H   new
ATOM      0 HH11 ARG A  55     -10.802  10.335  -6.804  1.00 12.11           H   new
ATOM      0 HH12 ARG A  55     -12.319   9.814  -7.543  1.00 12.11           H   new
ATOM      0 HH21 ARG A  55     -10.845   8.976 -10.633  1.00  4.03           H   new
ATOM      0 HH22 ARG A  55     -12.344   9.047  -9.701  1.00  4.03           H   new
ATOM    917  N   LEU A  56      -3.088  10.086  -7.159  1.00 71.33           N
ATOM    918  CA  LEU A  56      -1.890  10.917  -7.224  1.00 55.34           C
ATOM    919  C   LEU A  56      -0.990  10.483  -8.376  1.00 63.03           C
ATOM    920  O   LEU A  56      -1.278   9.506  -9.069  1.00 23.15           O
ATOM    921  CB  LEU A  56      -1.121  10.841  -5.904  1.00 54.05           C
ATOM    922  CG  LEU A  56      -1.506  11.872  -4.843  1.00 32.22           C
ATOM    923  CD1 LEU A  56      -2.701  11.388  -4.037  1.00 34.41           C
ATOM    924  CD2 LEU A  56      -0.327  12.162  -3.927  1.00 64.03           C
ATOM      0  H   LEU A  56      -2.945   9.117  -7.442  1.00 71.33           H   new
ATOM      0  HA  LEU A  56      -2.200  11.947  -7.397  1.00 55.34           H   new
ATOM      0  HB2 LEU A  56      -1.260   9.846  -5.482  1.00 54.05           H   new
ATOM      0  HB3 LEU A  56      -0.058  10.950  -6.119  1.00 54.05           H   new
ATOM      0  HG  LEU A  56      -1.784  12.797  -5.348  1.00 32.22           H   new
ATOM      0 HD11 LEU A  56      -2.960  12.135  -3.287  1.00 34.41           H   new
ATOM      0 HD12 LEU A  56      -3.550  11.232  -4.703  1.00 34.41           H   new
ATOM      0 HD13 LEU A  56      -2.450  10.449  -3.543  1.00 34.41           H   new
ATOM      0 HD21 LEU A  56      -0.620  12.898  -3.178  1.00 64.03           H   new
ATOM      0 HD22 LEU A  56      -0.018  11.243  -3.430  1.00 64.03           H   new
ATOM      0 HD23 LEU A  56       0.503  12.554  -4.515  1.00 64.03           H   new
ATOM    936  N   TRP A  57       0.101  11.212  -8.574  1.00 25.53           N
ATOM    937  CA  TRP A  57       1.046  10.902  -9.641  1.00  2.12           C
ATOM    938  C   TRP A  57       2.181  10.024  -9.125  1.00 31.12           C
ATOM    939  O   TRP A  57       3.014  10.469  -8.334  1.00 23.25           O
ATOM    940  CB  TRP A  57       1.613  12.189 -10.239  1.00  3.45           C
ATOM    941  CG  TRP A  57       0.664  12.882 -11.169  1.00 52.12           C
ATOM    942  CD1 TRP A  57       0.787  13.005 -12.524  1.00 62.42           C
ATOM    943  CD2 TRP A  57      -0.553  13.547 -10.813  1.00 73.33           C
ATOM    944  NE1 TRP A  57      -0.280  13.705 -13.032  1.00 25.13           N
ATOM    945  CE2 TRP A  57      -1.117  14.049 -12.003  1.00 22.42           C
ATOM    946  CE3 TRP A  57      -1.222  13.764  -9.606  1.00 41.20           C
ATOM    947  CZ2 TRP A  57      -2.316  14.755 -12.017  1.00 32.14           C
ATOM    948  CZ3 TRP A  57      -2.413  14.467  -9.622  1.00 62.33           C
ATOM    949  CH2 TRP A  57      -2.950  14.954 -10.821  1.00  3.14           C
ATOM      0  H   TRP A  57       0.354  12.023  -8.009  1.00 25.53           H   new
ATOM      0  HA  TRP A  57       0.511  10.354 -10.417  1.00  2.12           H   new
ATOM      0  HB2 TRP A  57       1.880  12.870  -9.431  1.00  3.45           H   new
ATOM      0  HB3 TRP A  57       2.532  11.957 -10.777  1.00  3.45           H   new
ATOM      0  HD1 TRP A  57       1.604  12.610 -13.110  1.00 62.42           H   new
ATOM      0  HE1 TRP A  57      -0.426  13.932 -14.016  1.00 25.13           H   new
ATOM      0  HE3 TRP A  57      -0.817  13.390  -8.678  1.00 41.20           H   new
ATOM      0  HZ2 TRP A  57      -2.732  15.133 -12.940  1.00 32.14           H   new
ATOM      0  HZ3 TRP A  57      -2.938  14.644  -8.695  1.00 62.33           H   new
ATOM      0  HH2 TRP A  57      -3.883  15.497 -10.801  1.00  3.14           H   new
ATOM    960  N   LEU A  58       2.209   8.774  -9.576  1.00 42.52           N
ATOM    961  CA  LEU A  58       3.243   7.834  -9.161  1.00 61.31           C
ATOM    962  C   LEU A  58       4.615   8.273  -9.664  1.00 52.20           C
ATOM    963  O   LEU A  58       4.811   8.478 -10.864  1.00 24.15           O
ATOM    964  CB  LEU A  58       2.922   6.431  -9.680  1.00  4.10           C
ATOM    965  CG  LEU A  58       2.688   5.359  -8.615  1.00 54.00           C
ATOM    966  CD1 LEU A  58       2.506   3.994  -9.262  1.00 44.31           C
ATOM    967  CD2 LEU A  58       3.841   5.332  -7.622  1.00 74.12           C
ATOM      0  H   LEU A  58       1.527   8.389 -10.229  1.00 42.52           H   new
ATOM      0  HA  LEU A  58       3.266   7.816  -8.071  1.00 61.31           H   new
ATOM      0  HB2 LEU A  58       2.033   6.492 -10.307  1.00  4.10           H   new
ATOM      0  HB3 LEU A  58       3.742   6.106 -10.320  1.00  4.10           H   new
ATOM      0  HG  LEU A  58       1.775   5.606  -8.073  1.00 54.00           H   new
ATOM      0 HD11 LEU A  58       2.341   3.244  -8.489  1.00 44.31           H   new
ATOM      0 HD12 LEU A  58       1.646   4.020  -9.932  1.00 44.31           H   new
ATOM      0 HD13 LEU A  58       3.401   3.738  -9.830  1.00 44.31           H   new
ATOM      0 HD21 LEU A  58       3.657   4.563  -6.872  1.00 74.12           H   new
ATOM      0 HD22 LEU A  58       4.769   5.111  -8.148  1.00 74.12           H   new
ATOM      0 HD23 LEU A  58       3.924   6.303  -7.134  1.00 74.12           H   new
ATOM    979  N   LEU A  59       5.560   8.413  -8.743  1.00 42.21           N
ATOM    980  CA  LEU A  59       6.915   8.826  -9.094  1.00 62.50           C
ATOM    981  C   LEU A  59       7.850   7.623  -9.162  1.00 72.10           C
ATOM    982  O   LEU A  59       8.258   7.203 -10.245  1.00 41.45           O
ATOM    983  CB  LEU A  59       7.441   9.837  -8.073  1.00 21.34           C
ATOM    984  CG  LEU A  59       6.656  11.144  -7.957  1.00  4.20           C
ATOM    985  CD1 LEU A  59       7.369  12.115  -7.028  1.00 10.01           C
ATOM    986  CD2 LEU A  59       6.453  11.768  -9.329  1.00 41.23           C
ATOM      0  H   LEU A  59       5.414   8.247  -7.747  1.00 42.21           H   new
ATOM      0  HA  LEU A  59       6.883   9.294 -10.078  1.00 62.50           H   new
ATOM      0  HB2 LEU A  59       7.458   9.359  -7.094  1.00 21.34           H   new
ATOM      0  HB3 LEU A  59       8.473  10.078  -8.328  1.00 21.34           H   new
ATOM      0  HG  LEU A  59       5.677  10.920  -7.533  1.00  4.20           H   new
ATOM      0 HD11 LEU A  59       6.795  13.039  -6.958  1.00 10.01           H   new
ATOM      0 HD12 LEU A  59       7.462  11.669  -6.038  1.00 10.01           H   new
ATOM      0 HD13 LEU A  59       8.362  12.333  -7.422  1.00 10.01           H   new
ATOM      0 HD21 LEU A  59       5.892  12.697  -9.227  1.00 41.23           H   new
ATOM      0 HD22 LEU A  59       7.423  11.977  -9.781  1.00 41.23           H   new
ATOM      0 HD23 LEU A  59       5.898  11.078  -9.964  1.00 41.23           H   new
ATOM    998  N   ASP A  60       8.183   7.072  -8.000  1.00 21.00           N
ATOM    999  CA  ASP A  60       9.067   5.915  -7.928  1.00 61.34           C
ATOM   1000  C   ASP A  60       8.524   4.874  -6.954  1.00 12.03           C
ATOM   1001  O   ASP A  60       8.475   5.106  -5.746  1.00 21.05           O
ATOM   1002  CB  ASP A  60      10.472   6.344  -7.503  1.00 40.22           C
ATOM   1003  CG  ASP A  60      11.540   5.877  -8.473  1.00 21.11           C
ATOM   1004  OD1 ASP A  60      11.411   6.163  -9.681  1.00 31.11           O
ATOM   1005  OD2 ASP A  60      12.505   5.225  -8.022  1.00 40.24           O
ATOM      0  H   ASP A  60       7.854   7.408  -7.095  1.00 21.00           H   new
ATOM      0  HA  ASP A  60       9.117   5.467  -8.920  1.00 61.34           H   new
ATOM      0  HB2 ASP A  60      10.508   7.430  -7.423  1.00 40.22           H   new
ATOM      0  HB3 ASP A  60      10.686   5.944  -6.512  1.00 40.22           H   new
ATOM   1011  N   ASP A  61       8.115   3.728  -7.487  1.00 43.40           N
ATOM   1012  CA  ASP A  61       7.575   2.653  -6.666  1.00 31.54           C
ATOM   1013  C   ASP A  61       8.400   1.380  -6.824  1.00 70.05           C
ATOM   1014  O   ASP A  61       8.037   0.482  -7.586  1.00 31.03           O
ATOM   1015  CB  ASP A  61       6.116   2.380  -7.040  1.00 30.32           C
ATOM   1016  CG  ASP A  61       5.856   2.557  -8.523  1.00 41.15           C
ATOM   1017  OD1 ASP A  61       5.692   1.537  -9.223  1.00 41.33           O
ATOM   1018  OD2 ASP A  61       5.814   3.717  -8.983  1.00 23.44           O
ATOM      0  H   ASP A  61       8.148   3.520  -8.485  1.00 43.40           H   new
ATOM      0  HA  ASP A  61       7.622   2.967  -5.623  1.00 31.54           H   new
ATOM      0  HB2 ASP A  61       5.853   1.364  -6.747  1.00 30.32           H   new
ATOM      0  HB3 ASP A  61       5.468   3.052  -6.478  1.00 30.32           H   new
ATOM   1024  N   SER A  62       9.513   1.308  -6.101  1.00 62.11           N
ATOM   1025  CA  SER A  62      10.393   0.148  -6.167  1.00 24.53           C
ATOM   1026  C   SER A  62      10.347  -0.642  -4.861  1.00 74.12           C
ATOM   1027  O   SER A  62      10.156  -1.859  -4.865  1.00 40.32           O
ATOM   1028  CB  SER A  62      11.829   0.586  -6.458  1.00 54.25           C
ATOM   1029  OG  SER A  62      12.249   0.137  -7.736  1.00 64.55           O
ATOM      0  H   SER A  62       9.826   2.039  -5.463  1.00 62.11           H   new
ATOM      0  HA  SER A  62      10.046  -0.495  -6.976  1.00 24.53           H   new
ATOM      0  HB2 SER A  62      11.898   1.673  -6.410  1.00 54.25           H   new
ATOM      0  HB3 SER A  62      12.496   0.190  -5.692  1.00 54.25           H   new
ATOM      0  HG  SER A  62      13.169   0.431  -7.900  1.00 64.55           H   new
ATOM   1035  N   LYS A  63      10.521   0.059  -3.746  1.00 61.55           N
ATOM   1036  CA  LYS A  63      10.498  -0.576  -2.433  1.00  4.32           C
ATOM   1037  C   LYS A  63       9.073  -0.671  -1.901  1.00 24.40           C
ATOM   1038  O   LYS A  63       8.125  -0.220  -2.546  1.00 20.14           O
ATOM   1039  CB  LYS A  63      11.369   0.210  -1.451  1.00 24.13           C
ATOM   1040  CG  LYS A  63      11.064   1.699  -1.422  1.00 12.11           C
ATOM   1041  CD  LYS A  63      12.061   2.487  -2.256  1.00 32.03           C
ATOM   1042  CE  LYS A  63      11.399   3.672  -2.944  1.00 71.43           C
ATOM   1043  NZ  LYS A  63      12.079   4.955  -2.616  1.00 11.12           N
ATOM      0  H   LYS A  63      10.679   1.066  -3.725  1.00 61.55           H   new
ATOM      0  HA  LYS A  63      10.896  -1.585  -2.536  1.00  4.32           H   new
ATOM      0  HB2 LYS A  63      11.233  -0.199  -0.450  1.00 24.13           H   new
ATOM      0  HB3 LYS A  63      12.417   0.068  -1.714  1.00 24.13           H   new
ATOM      0  HG2 LYS A  63      10.056   1.873  -1.798  1.00 12.11           H   new
ATOM      0  HG3 LYS A  63      11.086   2.056  -0.392  1.00 12.11           H   new
ATOM      0  HD2 LYS A  63      12.871   2.841  -1.618  1.00 32.03           H   new
ATOM      0  HD3 LYS A  63      12.508   1.833  -3.005  1.00 32.03           H   new
ATOM      0  HE2 LYS A  63      11.413   3.519  -4.023  1.00 71.43           H   new
ATOM      0  HE3 LYS A  63      10.353   3.728  -2.643  1.00 71.43           H   new
ATOM      0  HZ1 LYS A  63      11.598   5.737  -3.104  1.00 11.12           H   new
ATOM      0  HZ2 LYS A  63      12.044   5.114  -1.589  1.00 11.12           H   new
ATOM      0  HZ3 LYS A  63      13.071   4.911  -2.926  1.00 11.12           H   new
ATOM   1057  N   THR A  64       8.926  -1.262  -0.718  1.00 52.00           N
ATOM   1058  CA  THR A  64       7.615  -1.417  -0.099  1.00 44.04           C
ATOM   1059  C   THR A  64       6.856  -0.096  -0.081  1.00  1.24           C
ATOM   1060  O   THR A  64       5.627  -0.075  -0.126  1.00 75.40           O
ATOM   1061  CB  THR A  64       7.735  -1.947   1.342  1.00 20.03           C
ATOM   1062  OG1 THR A  64       6.517  -1.707   2.055  1.00  2.05           O
ATOM   1063  CG2 THR A  64       8.894  -1.283   2.070  1.00 23.13           C
ATOM      0  H   THR A  64       9.699  -1.641  -0.170  1.00 52.00           H   new
ATOM      0  HA  THR A  64       7.064  -2.140  -0.700  1.00 44.04           H   new
ATOM      0  HB  THR A  64       7.924  -3.020   1.296  1.00 20.03           H   new
ATOM      0  HG1 THR A  64       5.824  -2.321   1.734  1.00  2.05           H   new
ATOM      0 HG21 THR A  64       8.958  -1.674   3.085  1.00 23.13           H   new
ATOM      0 HG22 THR A  64       9.824  -1.493   1.541  1.00 23.13           H   new
ATOM      0 HG23 THR A  64       8.732  -0.206   2.106  1.00 23.13           H   new
ATOM   1071  N   TRP A  65       7.595   1.006  -0.015  1.00 45.22           N
ATOM   1072  CA  TRP A  65       6.990   2.333   0.008  1.00 74.35           C
ATOM   1073  C   TRP A  65       7.076   2.994  -1.363  1.00 72.20           C
ATOM   1074  O   TRP A  65       8.106   2.925  -2.032  1.00  4.30           O
ATOM   1075  CB  TRP A  65       7.678   3.211   1.055  1.00 21.21           C
ATOM   1076  CG  TRP A  65       7.180   2.975   2.449  1.00 35.12           C
ATOM   1077  CD1 TRP A  65       7.338   1.843   3.195  1.00 62.04           C
ATOM   1078  CD2 TRP A  65       6.441   3.893   3.261  1.00 53.23           C
ATOM   1079  NE1 TRP A  65       6.740   2.002   4.423  1.00 44.44           N
ATOM   1080  CE2 TRP A  65       6.184   3.251   4.488  1.00 24.11           C
ATOM   1081  CE3 TRP A  65       5.972   5.196   3.072  1.00 34.00           C
ATOM   1082  CZ2 TRP A  65       5.480   3.868   5.518  1.00 11.23           C
ATOM   1083  CZ3 TRP A  65       5.272   5.808   4.095  1.00 31.54           C
ATOM   1084  CH2 TRP A  65       5.033   5.144   5.307  1.00 55.12           C
ATOM      0  H   TRP A  65       8.614   1.007   0.024  1.00 45.22           H   new
ATOM      0  HA  TRP A  65       5.938   2.221   0.272  1.00 74.35           H   new
ATOM      0  HB2 TRP A  65       8.752   3.026   1.024  1.00 21.21           H   new
ATOM      0  HB3 TRP A  65       7.527   4.259   0.796  1.00 21.21           H   new
ATOM      0  HD1 TRP A  65       7.856   0.953   2.869  1.00 62.04           H   new
ATOM      0  HE1 TRP A  65       6.715   1.303   5.165  1.00 44.44           H   new
ATOM      0  HE3 TRP A  65       6.153   5.716   2.143  1.00 34.00           H   new
ATOM      0  HZ2 TRP A  65       5.293   3.358   6.451  1.00 11.23           H   new
ATOM      0  HZ3 TRP A  65       4.903   6.814   3.959  1.00 31.54           H   new
ATOM      0  HH2 TRP A  65       4.486   5.649   6.089  1.00 55.12           H   new
ATOM   1095  N   TRP A  66       5.986   3.633  -1.775  1.00 63.33           N
ATOM   1096  CA  TRP A  66       5.938   4.306  -3.068  1.00 23.32           C
ATOM   1097  C   TRP A  66       5.831   5.816  -2.891  1.00 30.15           C
ATOM   1098  O   TRP A  66       5.246   6.297  -1.920  1.00 11.22           O
ATOM   1099  CB  TRP A  66       4.756   3.792  -3.891  1.00  0.14           C
ATOM   1100  CG  TRP A  66       4.799   2.314  -4.133  1.00 24.51           C
ATOM   1101  CD1 TRP A  66       5.862   1.480  -3.927  1.00 71.14           C
ATOM   1102  CD2 TRP A  66       3.733   1.494  -4.626  1.00 32.45           C
ATOM   1103  NE1 TRP A  66       5.520   0.193  -4.264  1.00 74.44           N
ATOM   1104  CE2 TRP A  66       4.219   0.174  -4.694  1.00 23.30           C
ATOM   1105  CE3 TRP A  66       2.415   1.748  -5.013  1.00 52.43           C
ATOM   1106  CZ2 TRP A  66       3.433  -0.887  -5.136  1.00  2.41           C
ATOM   1107  CZ3 TRP A  66       1.637   0.694  -5.453  1.00 74.51           C
ATOM   1108  CH2 TRP A  66       2.148  -0.611  -5.510  1.00 34.04           C
ATOM      0  H   TRP A  66       5.125   3.699  -1.233  1.00 63.33           H   new
ATOM      0  HA  TRP A  66       6.864   4.085  -3.599  1.00 23.32           H   new
ATOM      0  HB2 TRP A  66       3.828   4.042  -3.376  1.00  0.14           H   new
ATOM      0  HB3 TRP A  66       4.738   4.310  -4.850  1.00  0.14           H   new
ATOM      0  HD1 TRP A  66       6.828   1.787  -3.554  1.00 71.14           H   new
ATOM      0  HE1 TRP A  66       6.135  -0.618  -4.204  1.00 74.44           H   new
ATOM      0  HE3 TRP A  66       2.012   2.749  -4.969  1.00 52.43           H   new
ATOM      0  HZ2 TRP A  66       3.825  -1.892  -5.182  1.00  2.41           H   new
ATOM      0  HZ3 TRP A  66       0.618   0.878  -5.758  1.00 74.51           H   new
ATOM      0  HH2 TRP A  66       1.513  -1.413  -5.856  1.00 34.04           H   new
ATOM   1119  N   ARG A  67       6.402   6.561  -3.833  1.00 30.11           N
ATOM   1120  CA  ARG A  67       6.370   8.018  -3.780  1.00 71.31           C
ATOM   1121  C   ARG A  67       5.471   8.583  -4.874  1.00 61.13           C
ATOM   1122  O   ARG A  67       5.683   8.326  -6.060  1.00  2.31           O
ATOM   1123  CB  ARG A  67       7.784   8.584  -3.922  1.00  4.44           C
ATOM   1124  CG  ARG A  67       7.815  10.070  -4.244  1.00 73.13           C
ATOM   1125  CD  ARG A  67       9.121  10.709  -3.798  1.00 14.53           C
ATOM   1126  NE  ARG A  67       8.934  11.584  -2.644  1.00 64.53           N
ATOM   1127  CZ  ARG A  67       9.835  12.473  -2.241  1.00 62.41           C
ATOM   1128  NH1 ARG A  67      10.979  12.605  -2.898  1.00 54.44           N
ATOM   1129  NH2 ARG A  67       9.593  13.233  -1.181  1.00 71.35           N
ATOM      0  H   ARG A  67       6.892   6.179  -4.642  1.00 30.11           H   new
ATOM      0  HA  ARG A  67       5.963   8.313  -2.813  1.00 71.31           H   new
ATOM      0  HB2 ARG A  67       8.331   8.410  -2.995  1.00  4.44           H   new
ATOM      0  HB3 ARG A  67       8.307   8.039  -4.708  1.00  4.44           H   new
ATOM      0  HG2 ARG A  67       7.686  10.214  -5.317  1.00 73.13           H   new
ATOM      0  HG3 ARG A  67       6.979  10.567  -3.753  1.00 73.13           H   new
ATOM      0  HD2 ARG A  67       9.840   9.929  -3.549  1.00 14.53           H   new
ATOM      0  HD3 ARG A  67       9.545  11.282  -4.623  1.00 14.53           H   new
ATOM      0  HE  ARG A  67       8.063  11.508  -2.118  1.00 64.53           H   new
ATOM      0 HH11 ARG A  67      11.168  12.023  -3.714  1.00 54.44           H   new
ATOM      0 HH12 ARG A  67      11.670  13.288  -2.587  1.00 54.44           H   new
ATOM      0 HH21 ARG A  67       8.714  13.135  -0.674  1.00 71.35           H   new
ATOM      0 HH22 ARG A  67      10.286  13.915  -0.873  1.00 71.35           H   new
ATOM   1143  N   VAL A  68       4.465   9.352  -4.469  1.00  5.24           N
ATOM   1144  CA  VAL A  68       3.535   9.955  -5.415  1.00 12.51           C
ATOM   1145  C   VAL A  68       3.389  11.452  -5.166  1.00 74.24           C
ATOM   1146  O   VAL A  68       3.818  11.964  -4.132  1.00 52.10           O
ATOM   1147  CB  VAL A  68       2.147   9.294  -5.333  1.00 14.33           C
ATOM   1148  CG1 VAL A  68       2.235   7.819  -5.691  1.00 44.43           C
ATOM   1149  CG2 VAL A  68       1.549   9.480  -3.947  1.00 14.11           C
ATOM      0  H   VAL A  68       4.274   9.572  -3.491  1.00  5.24           H   new
ATOM      0  HA  VAL A  68       3.948   9.795  -6.411  1.00 12.51           H   new
ATOM      0  HB  VAL A  68       1.490   9.779  -6.055  1.00 14.33           H   new
ATOM      0 HG11 VAL A  68       1.244   7.369  -5.627  1.00 44.43           H   new
ATOM      0 HG12 VAL A  68       2.617   7.713  -6.706  1.00 44.43           H   new
ATOM      0 HG13 VAL A  68       2.907   7.315  -4.996  1.00 44.43           H   new
ATOM      0 HG21 VAL A  68       0.568   9.006  -3.907  1.00 14.11           H   new
ATOM      0 HG22 VAL A  68       2.203   9.023  -3.204  1.00 14.11           H   new
ATOM      0 HG23 VAL A  68       1.447  10.544  -3.735  1.00 14.11           H   new
ATOM   1159  N   ARG A  69       2.779  12.149  -6.120  1.00 74.13           N
ATOM   1160  CA  ARG A  69       2.577  13.587  -6.003  1.00 13.44           C
ATOM   1161  C   ARG A  69       1.091  13.933  -6.051  1.00 41.22           C
ATOM   1162  O   ARG A  69       0.304  13.244  -6.697  1.00 41.44           O
ATOM   1163  CB  ARG A  69       3.318  14.320  -7.124  1.00 54.40           C
ATOM   1164  CG  ARG A  69       3.361  15.829  -6.940  1.00 71.04           C
ATOM   1165  CD  ARG A  69       2.797  16.554  -8.153  1.00 65.34           C
ATOM   1166  NE  ARG A  69       3.826  16.828  -9.154  1.00 34.33           N
ATOM   1167  CZ  ARG A  69       3.569  17.350 -10.347  1.00 13.02           C
ATOM   1168  NH1 ARG A  69       2.323  17.654 -10.688  1.00 21.03           N
ATOM   1169  NH2 ARG A  69       4.557  17.571 -11.204  1.00 24.45           N
ATOM      0  H   ARG A  69       2.417  11.741  -6.982  1.00 74.13           H   new
ATOM      0  HA  ARG A  69       2.977  13.908  -5.041  1.00 13.44           H   new
ATOM      0  HB2 ARG A  69       4.338  13.940  -7.183  1.00 54.40           H   new
ATOM      0  HB3 ARG A  69       2.838  14.092  -8.075  1.00 54.40           H   new
ATOM      0  HG2 ARG A  69       2.792  16.105  -6.052  1.00 71.04           H   new
ATOM      0  HG3 ARG A  69       4.390  16.147  -6.770  1.00 71.04           H   new
ATOM      0  HD2 ARG A  69       2.007  15.951  -8.601  1.00 65.34           H   new
ATOM      0  HD3 ARG A  69       2.341  17.492  -7.835  1.00 65.34           H   new
ATOM      0  HE  ARG A  69       4.794  16.606  -8.923  1.00 34.33           H   new
ATOM      0 HH11 ARG A  69       1.560  17.487 -10.033  1.00 21.03           H   new
ATOM      0 HH12 ARG A  69       2.129  18.055 -11.606  1.00 21.03           H   new
ATOM      0 HH21 ARG A  69       5.517  17.340 -10.947  1.00 24.45           H   new
ATOM      0 HH22 ARG A  69       4.357  17.972 -12.120  1.00 24.45           H   new
ATOM   1183  N   ASN A  70       0.716  15.005  -5.361  1.00 44.12           N
ATOM   1184  CA  ASN A  70      -0.675  15.442  -5.324  1.00 63.42           C
ATOM   1185  C   ASN A  70      -0.861  16.735  -6.112  1.00 33.42           C
ATOM   1186  O   ASN A  70       0.090  17.266  -6.686  1.00 71.20           O
ATOM   1187  CB  ASN A  70      -1.129  15.642  -3.876  1.00 13.34           C
ATOM   1188  CG  ASN A  70       0.033  15.891  -2.934  1.00 40.51           C
ATOM   1189  OD1 ASN A  70       0.504  14.976  -2.257  1.00 33.25           O
ATOM   1190  ND2 ASN A  70       0.502  17.132  -2.888  1.00 15.31           N
ATOM      0  H   ASN A  70       1.356  15.587  -4.820  1.00 44.12           H   new
ATOM      0  HA  ASN A  70      -1.286  14.667  -5.786  1.00 63.42           H   new
ATOM      0  HB2 ASN A  70      -1.819  16.484  -3.828  1.00 13.34           H   new
ATOM      0  HB3 ASN A  70      -1.678  14.761  -3.545  1.00 13.34           H   new
ATOM      0 HD21 ASN A  70       1.284  17.359  -2.274  1.00 15.31           H   new
ATOM      0 HD22 ASN A  70       0.080  17.858  -3.467  1.00 15.31           H   new
ATOM   1197  N   ALA A  71      -2.091  17.237  -6.132  1.00 12.51           N
ATOM   1198  CA  ALA A  71      -2.402  18.469  -6.847  1.00 63.12           C
ATOM   1199  C   ALA A  71      -1.714  19.668  -6.199  1.00 62.03           C
ATOM   1200  O   ALA A  71      -1.676  20.756  -6.770  1.00 71.32           O
ATOM   1201  CB  ALA A  71      -3.906  18.686  -6.896  1.00 15.31           C
ATOM      0  H   ALA A  71      -2.889  16.810  -5.661  1.00 12.51           H   new
ATOM      0  HA  ALA A  71      -2.027  18.373  -7.866  1.00 63.12           H   new
ATOM      0  HB1 ALA A  71      -4.123  19.609  -7.433  1.00 15.31           H   new
ATOM      0  HB2 ALA A  71      -4.378  17.848  -7.409  1.00 15.31           H   new
ATOM      0  HB3 ALA A  71      -4.297  18.756  -5.881  1.00 15.31           H   new
ATOM   1207  N   ALA A  72      -1.174  19.458  -5.003  1.00 43.23           N
ATOM   1208  CA  ALA A  72      -0.485  20.520  -4.280  1.00 34.33           C
ATOM   1209  C   ALA A  72       0.927  20.725  -4.814  1.00 11.50           C
ATOM   1210  O   ALA A  72       1.675  21.564  -4.315  1.00 14.54           O
ATOM   1211  CB  ALA A  72      -0.448  20.205  -2.791  1.00  5.02           C
ATOM      0  H   ALA A  72      -1.200  18.563  -4.515  1.00 43.23           H   new
ATOM      0  HA  ALA A  72      -1.039  21.447  -4.432  1.00 34.33           H   new
ATOM      0  HB1 ALA A  72       0.069  21.006  -2.262  1.00  5.02           H   new
ATOM      0  HB2 ALA A  72      -1.466  20.119  -2.412  1.00  5.02           H   new
ATOM      0  HB3 ALA A  72       0.080  19.265  -2.631  1.00  5.02           H   new
ATOM   1217  N   ASN A  73       1.285  19.951  -5.835  1.00 44.11           N
ATOM   1218  CA  ASN A  73       2.611  20.047  -6.437  1.00 34.14           C
ATOM   1219  C   ASN A  73       3.689  19.603  -5.454  1.00 51.42           C
ATOM   1220  O   ASN A  73       4.837  20.040  -5.537  1.00 21.13           O
ATOM   1221  CB  ASN A  73       2.882  21.482  -6.895  1.00 51.20           C
ATOM   1222  CG  ASN A  73       1.622  22.192  -7.354  1.00 61.15           C
ATOM   1223  OD1 ASN A  73       0.979  21.776  -8.318  1.00 15.42           O
ATOM   1224  ND2 ASN A  73       1.263  23.266  -6.662  1.00  3.11           N
ATOM      0  H   ASN A  73       0.677  19.252  -6.262  1.00 44.11           H   new
ATOM      0  HA  ASN A  73       2.639  19.384  -7.302  1.00 34.14           H   new
ATOM      0  HB2 ASN A  73       3.333  22.042  -6.076  1.00 51.20           H   new
ATOM      0  HB3 ASN A  73       3.606  21.470  -7.710  1.00 51.20           H   new
ATOM      0 HD21 ASN A  73       0.423  23.783  -6.922  1.00  3.11           H   new
ATOM      0 HD22 ASN A  73       1.827  23.574  -5.870  1.00  3.11           H   new
ATOM   1231  N   ARG A  74       3.311  18.732  -4.524  1.00 65.24           N
ATOM   1232  CA  ARG A  74       4.246  18.228  -3.524  1.00  3.13           C
ATOM   1233  C   ARG A  74       4.376  16.710  -3.617  1.00  3.41           C
ATOM   1234  O   ARG A  74       3.400  16.007  -3.878  1.00 24.24           O
ATOM   1235  CB  ARG A  74       3.787  18.626  -2.120  1.00 45.42           C
ATOM   1236  CG  ARG A  74       4.894  18.569  -1.079  1.00 55.02           C
ATOM   1237  CD  ARG A  74       5.296  19.961  -0.618  1.00 32.13           C
ATOM   1238  NE  ARG A  74       6.634  19.978  -0.031  1.00 75.15           N
ATOM   1239  CZ  ARG A  74       7.751  19.931  -0.748  1.00 41.21           C
ATOM   1240  NH1 ARG A  74       7.691  19.867  -2.071  1.00 53.30           N
ATOM   1241  NH2 ARG A  74       8.931  19.952  -0.142  1.00 55.02           N
ATOM      0  H   ARG A  74       2.365  18.361  -4.442  1.00 65.24           H   new
ATOM      0  HA  ARG A  74       5.222  18.672  -3.719  1.00  3.13           H   new
ATOM      0  HB2 ARG A  74       3.382  19.637  -2.152  1.00 45.42           H   new
ATOM      0  HB3 ARG A  74       2.975  17.967  -1.812  1.00 45.42           H   new
ATOM      0  HG2 ARG A  74       4.560  17.983  -0.223  1.00 55.02           H   new
ATOM      0  HG3 ARG A  74       5.762  18.058  -1.496  1.00 55.02           H   new
ATOM      0  HD2 ARG A  74       5.263  20.647  -1.464  1.00 32.13           H   new
ATOM      0  HD3 ARG A  74       4.574  20.323   0.114  1.00 32.13           H   new
ATOM      0  HE  ARG A  74       6.715  20.029   0.985  1.00 75.15           H   new
ATOM      0 HH11 ARG A  74       6.786  19.854  -2.540  1.00 53.30           H   new
ATOM      0 HH12 ARG A  74       8.550  19.831  -2.619  1.00 53.30           H   new
ATOM      0 HH21 ARG A  74       8.981  20.004   0.875  1.00 55.02           H   new
ATOM      0 HH22 ARG A  74       9.788  19.916  -0.694  1.00 55.02           H   new
ATOM   1255  N   THR A  75       5.591  16.212  -3.404  1.00 51.31           N
ATOM   1256  CA  THR A  75       5.849  14.779  -3.465  1.00 14.53           C
ATOM   1257  C   THR A  75       6.171  14.219  -2.085  1.00 13.12           C
ATOM   1258  O   THR A  75       7.045  14.729  -1.385  1.00 52.00           O
ATOM   1259  CB  THR A  75       7.014  14.459  -4.421  1.00 21.12           C
ATOM   1260  OG1 THR A  75       8.244  14.955  -3.879  1.00 32.41           O
ATOM   1261  CG2 THR A  75       6.775  15.075  -5.791  1.00 71.41           C
ATOM      0  H   THR A  75       6.410  16.780  -3.188  1.00 51.31           H   new
ATOM      0  HA  THR A  75       4.940  14.310  -3.841  1.00 14.53           H   new
ATOM      0  HB  THR A  75       7.076  13.376  -4.532  1.00 21.12           H   new
ATOM      0  HG1 THR A  75       8.166  15.029  -2.905  1.00 32.41           H   new
ATOM      0 HG21 THR A  75       7.611  14.835  -6.448  1.00 71.41           H   new
ATOM      0 HG22 THR A  75       5.854  14.674  -6.214  1.00 71.41           H   new
ATOM      0 HG23 THR A  75       6.689  16.157  -5.693  1.00 71.41           H   new
ATOM   1269  N   GLY A  76       5.460  13.165  -1.698  1.00 33.51           N
ATOM   1270  CA  GLY A  76       5.685  12.553  -0.401  1.00 34.20           C
ATOM   1271  C   GLY A  76       5.810  11.044  -0.487  1.00 71.40           C
ATOM   1272  O   GLY A  76       5.862  10.480  -1.579  1.00 44.02           O
ATOM      0  H   GLY A  76       4.732  12.723  -2.259  1.00 33.51           H   new
ATOM      0  HA2 GLY A  76       6.593  12.965   0.040  1.00 34.20           H   new
ATOM      0  HA3 GLY A  76       4.862  12.809   0.266  1.00 34.20           H   new
ATOM   1276  N   TYR A  77       5.857  10.390   0.669  1.00  5.31           N
ATOM   1277  CA  TYR A  77       5.981   8.938   0.720  1.00  3.30           C
ATOM   1278  C   TYR A  77       4.746   8.309   1.356  1.00 75.12           C
ATOM   1279  O   TYR A  77       4.088   8.918   2.201  1.00 42.23           O
ATOM   1280  CB  TYR A  77       7.231   8.539   1.505  1.00 72.12           C
ATOM   1281  CG  TYR A  77       8.501   8.587   0.685  1.00 22.43           C
ATOM   1282  CD1 TYR A  77       9.207   9.775   0.532  1.00 14.31           C
ATOM   1283  CD2 TYR A  77       8.996   7.446   0.067  1.00 63.44           C
ATOM   1284  CE1 TYR A  77      10.367   9.824  -0.216  1.00 13.42           C
ATOM   1285  CE2 TYR A  77      10.157   7.486  -0.682  1.00 13.04           C
ATOM   1286  CZ  TYR A  77      10.838   8.676  -0.821  1.00 12.40           C
ATOM   1287  OH  TYR A  77      11.994   8.720  -1.566  1.00 23.41           O
ATOM      0  H   TYR A  77       5.811  10.842   1.582  1.00  5.31           H   new
ATOM      0  HA  TYR A  77       6.069   8.570  -0.302  1.00  3.30           H   new
ATOM      0  HB2 TYR A  77       7.338   9.202   2.364  1.00 72.12           H   new
ATOM      0  HB3 TYR A  77       7.098   7.530   1.895  1.00 72.12           H   new
ATOM      0  HD1 TYR A  77       8.842  10.674   1.006  1.00 14.31           H   new
ATOM      0  HD2 TYR A  77       8.465   6.512   0.173  1.00 63.44           H   new
ATOM      0  HE1 TYR A  77      10.903  10.755  -0.327  1.00 13.42           H   new
ATOM      0  HE2 TYR A  77      10.529   6.589  -1.156  1.00 13.04           H   new
ATOM      0  HH  TYR A  77      12.188   7.828  -1.922  1.00 23.41           H   new
ATOM   1297  N   VAL A  78       4.435   7.083   0.946  1.00  2.20           N
ATOM   1298  CA  VAL A  78       3.280   6.368   1.474  1.00  4.04           C
ATOM   1299  C   VAL A  78       3.460   4.859   1.347  1.00 44.51           C
ATOM   1300  O   VAL A  78       4.086   4.363   0.410  1.00 52.53           O
ATOM   1301  CB  VAL A  78       1.984   6.782   0.753  1.00 41.22           C
ATOM   1302  CG1 VAL A  78       1.496   8.130   1.263  1.00 41.04           C
ATOM   1303  CG2 VAL A  78       2.202   6.820  -0.752  1.00 42.43           C
ATOM      0  H   VAL A  78       4.968   6.564   0.248  1.00  2.20           H   new
ATOM      0  HA  VAL A  78       3.201   6.633   2.528  1.00  4.04           H   new
ATOM      0  HB  VAL A  78       1.216   6.039   0.968  1.00 41.22           H   new
ATOM      0 HG11 VAL A  78       0.579   8.406   0.742  1.00 41.04           H   new
ATOM      0 HG12 VAL A  78       1.300   8.065   2.333  1.00 41.04           H   new
ATOM      0 HG13 VAL A  78       2.259   8.886   1.080  1.00 41.04           H   new
ATOM      0 HG21 VAL A  78       1.276   7.114  -1.246  1.00 42.43           H   new
ATOM      0 HG22 VAL A  78       2.985   7.541  -0.988  1.00 42.43           H   new
ATOM      0 HG23 VAL A  78       2.502   5.832  -1.101  1.00 42.43           H   new
ATOM   1313  N   PRO A  79       2.902   4.113   2.310  1.00 73.55           N
ATOM   1314  CA  PRO A  79       2.986   2.648   2.326  1.00 13.43           C
ATOM   1315  C   PRO A  79       2.163   2.008   1.214  1.00 73.42           C
ATOM   1316  O   PRO A  79       0.960   2.248   1.103  1.00 62.13           O
ATOM   1317  CB  PRO A  79       2.416   2.276   3.696  1.00 62.21           C
ATOM   1318  CG  PRO A  79       1.516   3.409   4.054  1.00 42.54           C
ATOM   1319  CD  PRO A  79       2.142   4.639   3.456  1.00 65.10           C
ATOM      0  HA  PRO A  79       4.005   2.296   2.163  1.00 13.43           H   new
ATOM      0  HB2 PRO A  79       1.869   1.334   3.654  1.00 62.21           H   new
ATOM      0  HB3 PRO A  79       3.209   2.152   4.434  1.00 62.21           H   new
ATOM      0  HG2 PRO A  79       0.513   3.250   3.659  1.00 42.54           H   new
ATOM      0  HG3 PRO A  79       1.421   3.506   5.136  1.00 42.54           H   new
ATOM      0  HD2 PRO A  79       1.388   5.361   3.141  1.00 65.10           H   new
ATOM      0  HD3 PRO A  79       2.791   5.147   4.169  1.00 65.10           H   new
ATOM   1327  N   SER A  80       2.817   1.194   0.393  1.00 15.32           N
ATOM   1328  CA  SER A  80       2.145   0.521  -0.713  1.00 43.10           C
ATOM   1329  C   SER A  80       0.978  -0.322  -0.206  1.00 10.51           C
ATOM   1330  O   SER A  80       0.069  -0.661  -0.965  1.00 64.24           O
ATOM   1331  CB  SER A  80       3.134  -0.363  -1.475  1.00 12.52           C
ATOM   1332  OG  SER A  80       2.467  -1.166  -2.433  1.00 15.32           O
ATOM      0  H   SER A  80       3.812   0.984   0.472  1.00 15.32           H   new
ATOM      0  HA  SER A  80       1.755   1.283  -1.388  1.00 43.10           H   new
ATOM      0  HB2 SER A  80       3.876   0.261  -1.973  1.00 12.52           H   new
ATOM      0  HB3 SER A  80       3.672  -1.000  -0.773  1.00 12.52           H   new
ATOM      0  HG  SER A  80       2.519  -0.737  -3.313  1.00 15.32           H   new
ATOM   1338  N   ASN A  81       1.009  -0.654   1.079  1.00 43.43           N
ATOM   1339  CA  ASN A  81      -0.046  -1.457   1.687  1.00 64.11           C
ATOM   1340  C   ASN A  81      -1.345  -0.664   1.786  1.00 44.01           C
ATOM   1341  O   ASN A  81      -2.436  -1.234   1.756  1.00 42.10           O
ATOM   1342  CB  ASN A  81       0.384  -1.931   3.078  1.00 34.44           C
ATOM   1343  CG  ASN A  81       1.392  -3.061   3.019  1.00 15.14           C
ATOM   1344  OD1 ASN A  81       1.934  -3.370   1.958  1.00 12.42           O
ATOM   1345  ND2 ASN A  81       1.649  -3.686   4.163  1.00 51.51           N
ATOM      0  H   ASN A  81       1.753  -0.380   1.721  1.00 43.43           H   new
ATOM      0  HA  ASN A  81      -0.220  -2.326   1.052  1.00 64.11           H   new
ATOM      0  HB2 ASN A  81       0.814  -1.093   3.627  1.00 34.44           H   new
ATOM      0  HB3 ASN A  81      -0.494  -2.260   3.634  1.00 34.44           H   new
ATOM      0 HD21 ASN A  81       2.319  -4.455   4.185  1.00 51.51           H   new
ATOM      0 HD22 ASN A  81       1.177  -3.397   5.019  1.00 51.51           H   new
ATOM   1352  N   TYR A  82      -1.220   0.653   1.901  1.00  5.13           N
ATOM   1353  CA  TYR A  82      -2.383   1.526   2.005  1.00 52.23           C
ATOM   1354  C   TYR A  82      -2.718   2.152   0.655  1.00 71.21           C
ATOM   1355  O   TYR A  82      -3.632   2.969   0.545  1.00 61.22           O
ATOM   1356  CB  TYR A  82      -2.134   2.623   3.041  1.00 71.35           C
ATOM   1357  CG  TYR A  82      -1.965   2.099   4.450  1.00 43.21           C
ATOM   1358  CD1 TYR A  82      -0.833   1.379   4.812  1.00 42.22           C
ATOM   1359  CD2 TYR A  82      -2.937   2.321   5.416  1.00 15.14           C
ATOM   1360  CE1 TYR A  82      -0.674   0.898   6.098  1.00 72.21           C
ATOM   1361  CE2 TYR A  82      -2.786   1.845   6.704  1.00 24.13           C
ATOM   1362  CZ  TYR A  82      -1.653   1.134   7.040  1.00 31.21           C
ATOM   1363  OH  TYR A  82      -1.500   0.656   8.321  1.00 30.33           O
ATOM      0  H   TYR A  82      -0.324   1.140   1.925  1.00  5.13           H   new
ATOM      0  HA  TYR A  82      -3.231   0.920   2.324  1.00 52.23           H   new
ATOM      0  HB2 TYR A  82      -1.240   3.180   2.760  1.00 71.35           H   new
ATOM      0  HB3 TYR A  82      -2.967   3.326   3.021  1.00 71.35           H   new
ATOM      0  HD1 TYR A  82      -0.065   1.192   4.076  1.00 42.22           H   new
ATOM      0  HD2 TYR A  82      -3.827   2.875   5.156  1.00 15.14           H   new
ATOM      0  HE1 TYR A  82       0.212   0.340   6.364  1.00 72.21           H   new
ATOM      0  HE2 TYR A  82      -3.551   2.029   7.444  1.00 24.13           H   new
ATOM      0  HH  TYR A  82      -1.272  -0.297   8.290  1.00 30.33           H   new
ATOM   1373  N   VAL A  83      -1.969   1.763  -0.373  1.00 64.50           N
ATOM   1374  CA  VAL A  83      -2.185   2.283  -1.718  1.00 33.24           C
ATOM   1375  C   VAL A  83      -2.356   1.152  -2.724  1.00 23.51           C
ATOM   1376  O   VAL A  83      -1.935   0.021  -2.480  1.00 23.53           O
ATOM   1377  CB  VAL A  83      -1.018   3.182  -2.165  1.00  4.40           C
ATOM   1378  CG1 VAL A  83       0.020   2.370  -2.925  1.00 43.51           C
ATOM   1379  CG2 VAL A  83      -1.530   4.336  -3.013  1.00  2.44           C
ATOM      0  H   VAL A  83      -1.207   1.089  -0.299  1.00 64.50           H   new
ATOM      0  HA  VAL A  83      -3.099   2.876  -1.685  1.00 33.24           H   new
ATOM      0  HB  VAL A  83      -0.541   3.597  -1.277  1.00  4.40           H   new
ATOM      0 HG11 VAL A  83       0.837   3.022  -3.233  1.00 43.51           H   new
ATOM      0 HG12 VAL A  83       0.408   1.581  -2.281  1.00 43.51           H   new
ATOM      0 HG13 VAL A  83      -0.441   1.924  -3.807  1.00 43.51           H   new
ATOM      0 HG21 VAL A  83      -0.692   4.961  -3.320  1.00  2.44           H   new
ATOM      0 HG22 VAL A  83      -2.033   3.943  -3.897  1.00  2.44           H   new
ATOM      0 HG23 VAL A  83      -2.233   4.932  -2.431  1.00  2.44           H   new
ATOM   1389  N   GLU A  84      -2.976   1.463  -3.857  1.00  3.13           N
ATOM   1390  CA  GLU A  84      -3.204   0.472  -4.902  1.00 63.45           C
ATOM   1391  C   GLU A  84      -3.492   1.146  -6.240  1.00  1.21           C
ATOM   1392  O   GLU A  84      -4.448   1.910  -6.368  1.00 54.24           O
ATOM   1393  CB  GLU A  84      -4.366  -0.448  -4.520  1.00 30.45           C
ATOM   1394  CG  GLU A  84      -4.801  -1.377  -5.641  1.00 24.14           C
ATOM   1395  CD  GLU A  84      -6.157  -1.011  -6.210  1.00 70.34           C
ATOM   1396  OE1 GLU A  84      -6.522   0.181  -6.155  1.00 60.43           O
ATOM   1397  OE2 GLU A  84      -6.855  -1.919  -6.710  1.00 43.33           O
ATOM      0  H   GLU A  84      -3.330   2.394  -4.075  1.00  3.13           H   new
ATOM      0  HA  GLU A  84      -2.297  -0.124  -5.004  1.00 63.45           H   new
ATOM      0  HB2 GLU A  84      -4.076  -1.046  -3.656  1.00 30.45           H   new
ATOM      0  HB3 GLU A  84      -5.216   0.162  -4.215  1.00 30.45           H   new
ATOM      0  HG2 GLU A  84      -4.058  -1.351  -6.438  1.00 24.14           H   new
ATOM      0  HG3 GLU A  84      -4.832  -2.401  -5.268  1.00 24.14           H   new
ATOM   1404  N   ARG A  85      -2.657   0.858  -7.233  1.00 53.05           N
ATOM   1405  CA  ARG A  85      -2.821   1.437  -8.562  1.00 25.22           C
ATOM   1406  C   ARG A  85      -4.222   1.169  -9.103  1.00 22.24           C
ATOM   1407  O   ARG A  85      -4.668   0.022  -9.159  1.00 15.33           O
ATOM   1408  CB  ARG A  85      -1.772   0.870  -9.521  1.00 33.55           C
ATOM   1409  CG  ARG A  85      -0.490   1.685  -9.572  1.00 60.41           C
ATOM   1410  CD  ARG A  85       0.615   1.034  -8.754  1.00 30.54           C
ATOM   1411  NE  ARG A  85       0.911  -0.320  -9.214  1.00 11.11           N
ATOM   1412  CZ  ARG A  85       1.599  -0.587 -10.319  1.00 63.41           C
ATOM   1413  NH1 ARG A  85       2.058   0.402 -11.073  1.00 23.42           N
ATOM   1414  NH2 ARG A  85       1.827  -1.846 -10.672  1.00 45.20           N
ATOM      0  H   ARG A  85      -1.860   0.228  -7.143  1.00 53.05           H   new
ATOM      0  HA  ARG A  85      -2.683   2.515  -8.482  1.00 25.22           H   new
ATOM      0  HB2 ARG A  85      -1.532  -0.150  -9.222  1.00 33.55           H   new
ATOM      0  HB3 ARG A  85      -2.199   0.817 -10.523  1.00 33.55           H   new
ATOM      0  HG2 ARG A  85      -0.165   1.790 -10.607  1.00 60.41           H   new
ATOM      0  HG3 ARG A  85      -0.681   2.690  -9.194  1.00 60.41           H   new
ATOM      0  HD2 ARG A  85       1.517   1.643  -8.814  1.00 30.54           H   new
ATOM      0  HD3 ARG A  85       0.320   1.004  -7.705  1.00 30.54           H   new
ATOM      0  HE  ARG A  85       0.571  -1.104  -8.657  1.00 11.11           H   new
ATOM      0 HH11 ARG A  85       1.883   1.371 -10.805  1.00 23.42           H   new
ATOM      0 HH12 ARG A  85       2.586   0.194 -11.921  1.00 23.42           H   new
ATOM      0 HH21 ARG A  85       1.474  -2.609 -10.095  1.00 45.20           H   new
ATOM      0 HH22 ARG A  85       2.355  -2.050 -11.520  1.00 45.20           H   new
ATOM   1428  N   LYS A  86      -4.912   2.232  -9.501  1.00  2.13           N
ATOM   1429  CA  LYS A  86      -6.261   2.113 -10.037  1.00 51.53           C
ATOM   1430  C   LYS A  86      -7.190   1.441  -9.032  1.00 34.54           C
ATOM   1431  O   LYS A  86      -8.012   0.598  -9.397  1.00 23.21           O
ATOM   1432  CB  LYS A  86      -6.242   1.314 -11.343  1.00 71.22           C
ATOM   1433  CG  LYS A  86      -5.722   2.103 -12.533  1.00 21.33           C
ATOM   1434  CD  LYS A  86      -6.696   3.193 -12.947  1.00 10.14           C
ATOM   1435  CE  LYS A  86      -7.345   2.882 -14.287  1.00 62.31           C
ATOM   1436  NZ  LYS A  86      -8.815   3.114 -14.259  1.00 41.52           N
ATOM      0  H   LYS A  86      -4.557   3.188  -9.462  1.00  2.13           H   new
ATOM      0  HA  LYS A  86      -6.636   3.117 -10.236  1.00 51.53           H   new
ATOM      0  HB2 LYS A  86      -5.623   0.427 -11.207  1.00 71.22           H   new
ATOM      0  HB3 LYS A  86      -7.252   0.967 -11.561  1.00 71.22           H   new
ATOM      0  HG2 LYS A  86      -4.760   2.549 -12.282  1.00 21.33           H   new
ATOM      0  HG3 LYS A  86      -5.551   1.428 -13.372  1.00 21.33           H   new
ATOM      0  HD2 LYS A  86      -7.467   3.302 -12.185  1.00 10.14           H   new
ATOM      0  HD3 LYS A  86      -6.172   4.147 -13.008  1.00 10.14           H   new
ATOM      0  HE2 LYS A  86      -6.894   3.503 -15.061  1.00 62.31           H   new
ATOM      0  HE3 LYS A  86      -7.146   1.844 -14.554  1.00 62.31           H   new
ATOM      0  HZ1 LYS A  86      -9.220   2.891 -15.191  1.00 41.52           H   new
ATOM      0  HZ2 LYS A  86      -9.249   2.503 -13.538  1.00 41.52           H   new
ATOM      0  HZ3 LYS A  86      -9.005   4.110 -14.029  1.00 41.52           H   new