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   35:sc=   0.133
USER  MOD Single : A   6 GLN     :      amide:sc=   0.356  X(o=0.36,f=0)
USER  MOD -----------------------------------------------------------------
ATOM     59  N   SER A   5       1.702  -2.416  -1.468  1.00  0.00           N
ATOM     60  CA  SER A   5       2.295  -3.210  -0.433  1.00  0.00           C
ATOM     61  C   SER A   5       1.204  -3.509   0.554  1.00  0.00           C
ATOM     62  O   SER A   5       1.019  -4.643   0.993  1.00  0.00           O
ATOM     63  CB  SER A   5       3.433  -2.425   0.248  1.00  0.00           C
ATOM     64  OG  SER A   5       4.383  -2.000  -0.726  1.00  0.00           O
ATOM      0  HA  SER A   5       2.723  -4.129  -0.834  1.00  0.00           H   new
ATOM      0  HB2 SER A   5       3.026  -1.560   0.773  1.00  0.00           H   new
ATOM      0  HB3 SER A   5       3.921  -3.051   0.995  1.00  0.00           H   new
ATOM      0  HG  SER A   5       3.919  -1.780  -1.561  1.00  0.00           H   new
ATOM     70  N   GLN A   6       0.432  -2.465   0.895  1.00  0.00           N
ATOM     71  CA  GLN A   6      -0.862  -2.545   1.493  1.00  0.00           C
ATOM     72  C   GLN A   6      -1.381  -1.284   0.877  1.00  0.00           C
ATOM     73  O   GLN A   6      -0.569  -0.513   0.354  1.00  0.00           O
ATOM     74  CB  GLN A   6      -0.930  -2.395   3.041  1.00  0.00           C
ATOM     75  CG  GLN A   6      -0.406  -3.603   3.849  1.00  0.00           C
ATOM     76  CD  GLN A   6       1.071  -3.437   4.239  1.00  0.00           C
ATOM     77  OE1 GLN A   6       1.401  -2.599   5.087  1.00  0.00           O
ATOM     78  NE2 GLN A   6       1.971  -4.251   3.619  1.00  0.00           N
ATOM      0  H   GLN A   6       0.732  -1.502   0.743  1.00  0.00           H   new
ATOM      0  HA  GLN A   6      -1.358  -3.503   1.335  1.00  0.00           H   new
ATOM      0  HB2 GLN A   6      -0.359  -1.512   3.329  1.00  0.00           H   new
ATOM      0  HB3 GLN A   6      -1.966  -2.211   3.326  1.00  0.00           H   new
ATOM      0  HG2 GLN A   6      -1.007  -3.725   4.750  1.00  0.00           H   new
ATOM      0  HG3 GLN A   6      -0.526  -4.512   3.260  1.00  0.00           H   new
ATOM      0 HE21 GLN A   6       1.653  -4.928   2.925  1.00  0.00           H   new
ATOM      0 HE22 GLN A   6       2.963  -4.183   3.849  1.00  0.00           H   new