USER  MOD reduce.3.24.130724 H: found=0, std=0, add=12, rem=0, adj=1
USER  MOD reduce.3.24.130724 removed 13 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   5 SER OG  :   rot  -26:sc=    0.88
USER  MOD Single : A   6 GLN     :      amide:sc=    1.08  K(o=1.1,f=-0.061)
USER  MOD -----------------------------------------------------------------
ATOM     59  N   SER A   5       1.168  -3.262  -2.485  1.00  0.00           N
ATOM     60  CA  SER A   5       0.725  -4.416  -1.770  1.00  0.00           C
ATOM     61  C   SER A   5      -0.233  -3.955  -0.711  1.00  0.00           C
ATOM     62  O   SER A   5      -1.432  -4.231  -0.746  1.00  0.00           O
ATOM     63  CB  SER A   5       1.974  -5.049  -1.105  1.00  0.00           C
ATOM     64  OG  SER A   5       2.911  -4.033  -0.719  1.00  0.00           O
ATOM      0  HA  SER A   5       0.235  -5.141  -2.420  1.00  0.00           H   new
ATOM      0  HB2 SER A   5       1.674  -5.626  -0.230  1.00  0.00           H   new
ATOM      0  HB3 SER A   5       2.448  -5.744  -1.798  1.00  0.00           H   new
ATOM      0  HG  SER A   5       2.790  -3.243  -1.287  1.00  0.00           H   new
ATOM     70  N   GLN A   6       0.323  -3.234   0.269  1.00  0.00           N
ATOM     71  CA  GLN A   6      -0.358  -2.590   1.346  1.00  0.00           C
ATOM     72  C   GLN A   6       0.472  -1.349   1.425  1.00  0.00           C
ATOM     73  O   GLN A   6       1.104  -0.976   0.435  1.00  0.00           O
ATOM     74  CB  GLN A   6      -0.314  -3.358   2.693  1.00  0.00           C
ATOM     75  CG  GLN A   6      -0.971  -4.755   2.664  1.00  0.00           C
ATOM     76  CD  GLN A   6      -2.502  -4.656   2.623  1.00  0.00           C
ATOM     77  OE1 GLN A   6      -3.144  -4.699   3.678  1.00  0.00           O
ATOM     78  NE2 GLN A   6      -3.093  -4.543   1.400  1.00  0.00           N
ATOM      0  H   GLN A   6       1.332  -3.088   0.313  1.00  0.00           H   new
ATOM      0  HA  GLN A   6      -1.429  -2.473   1.178  1.00  0.00           H   new
ATOM      0  HB2 GLN A   6       0.726  -3.468   2.999  1.00  0.00           H   new
ATOM      0  HB3 GLN A   6      -0.808  -2.755   3.455  1.00  0.00           H   new
ATOM      0  HG2 GLN A   6      -0.618  -5.306   1.793  1.00  0.00           H   new
ATOM      0  HG3 GLN A   6      -0.665  -5.320   3.544  1.00  0.00           H   new
ATOM      0 HE21 GLN A   6      -2.519  -4.512   0.557  1.00  0.00           H   new
ATOM      0 HE22 GLN A   6      -4.109  -4.490   1.328  1.00  0.00           H   new