USER  MOD reduce.3.24.130724 H: found=0, std=0, add=8, rem=0, adj=1
USER  MOD reduce.3.24.130724 removed 9 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Single : A   7 SER OG  :   rot   79:sc=   0.939
USER  MOD -----------------------------------------------------------------
ATOM     74  N   ASP A   6      39.538  27.323  13.247  1.00  0.00           N
ATOM     75  CA  ASP A   6      39.627  27.097  14.676  1.00  0.00           C
ATOM     76  C   ASP A   6      39.692  28.386  15.469  1.00  0.00           C
ATOM     77  O   ASP A   6      39.553  28.338  16.695  1.00  0.00           O
ATOM     78  CB  ASP A   6      40.791  26.183  15.025  1.00  0.00           C
ATOM     79  CG  ASP A   6      42.111  26.566  14.384  1.00  0.00           C
ATOM     80  OD1 ASP A   6      42.989  25.812  13.890  1.00  0.00           O
ATOM     81  OD2 ASP A   6      42.229  27.791  14.162  1.00  0.00           O
ATOM      0  HA  ASP A   6      38.703  26.595  14.964  1.00  0.00           H   new
ATOM      0  HB2 ASP A   6      40.917  26.175  16.108  1.00  0.00           H   new
ATOM      0  HB3 ASP A   6      40.539  25.166  14.726  1.00  0.00           H   new
ATOM     86  N   SER A   7      39.850  29.542  14.814  1.00  0.00           N
ATOM     87  CA  SER A   7      40.238  30.767  15.492  1.00  0.00           C
ATOM     88  C   SER A   7      39.422  31.977  15.073  1.00  0.00           C
ATOM     89  O   SER A   7      39.571  32.499  13.966  1.00  0.00           O
ATOM     90  CB  SER A   7      41.684  31.018  15.094  1.00  0.00           C
ATOM     91  OG  SER A   7      42.540  30.119  15.742  1.00  0.00           O
ATOM      0  H   SER A   7      39.712  29.646  13.809  1.00  0.00           H   new
ATOM      0  HA  SER A   7      40.082  30.640  16.563  1.00  0.00           H   new
ATOM      0  HB2 SER A   7      41.792  30.916  14.014  1.00  0.00           H   new
ATOM      0  HB3 SER A   7      41.964  32.041  15.347  1.00  0.00           H   new
ATOM      0  HG  SER A   7      42.506  29.251  15.289  1.00  0.00           H   new