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  180:sc=   0.136
USER  MOD Single : A   6 GLN     :      amide:sc=   0.929  K(o=0.93,f=-0.16)
USER  MOD -----------------------------------------------------------------
ATOM     59  N   SER A   5       1.848  -2.577  -1.577  1.00  0.00           N
ATOM     60  CA  SER A   5       2.297  -3.321  -0.428  1.00  0.00           C
ATOM     61  C   SER A   5       1.039  -3.683   0.324  1.00  0.00           C
ATOM     62  O   SER A   5       0.677  -4.849   0.467  1.00  0.00           O
ATOM     63  CB  SER A   5       3.315  -2.511   0.426  1.00  0.00           C
ATOM     64  OG  SER A   5       2.839  -1.222   0.821  1.00  0.00           O
ATOM      0  HA  SER A   5       2.849  -4.218  -0.709  1.00  0.00           H   new
ATOM      0  HB2 SER A   5       3.565  -3.085   1.318  1.00  0.00           H   new
ATOM      0  HB3 SER A   5       4.237  -2.389  -0.143  1.00  0.00           H   new
ATOM      0  HG  SER A   5       3.525  -0.769   1.354  1.00  0.00           H   new
ATOM     70  N   GLN A   6       0.316  -2.639   0.750  1.00  0.00           N
ATOM     71  CA  GLN A   6      -1.034  -2.627   1.217  1.00  0.00           C
ATOM     72  C   GLN A   6      -1.282  -1.190   0.886  1.00  0.00           C
ATOM     73  O   GLN A   6      -0.314  -0.451   0.688  1.00  0.00           O
ATOM     74  CB  GLN A   6      -1.249  -2.821   2.745  1.00  0.00           C
ATOM     75  CG  GLN A   6      -0.919  -4.224   3.295  1.00  0.00           C
ATOM     76  CD  GLN A   6      -1.905  -5.280   2.776  1.00  0.00           C
ATOM     77  OE1 GLN A   6      -2.931  -5.553   3.407  1.00  0.00           O
ATOM     78  NE2 GLN A   6      -1.578  -5.890   1.601  1.00  0.00           N
ATOM      0  H   GLN A   6       0.721  -1.703   0.769  1.00  0.00           H   new
ATOM      0  HA  GLN A   6      -1.650  -3.423   0.799  1.00  0.00           H   new
ATOM      0  HB2 GLN A   6      -0.638  -2.090   3.275  1.00  0.00           H   new
ATOM      0  HB3 GLN A   6      -2.290  -2.595   2.978  1.00  0.00           H   new
ATOM      0  HG2 GLN A   6       0.095  -4.499   3.006  1.00  0.00           H   new
ATOM      0  HG3 GLN A   6      -0.946  -4.204   4.384  1.00  0.00           H   new
ATOM      0 HE21 GLN A   6      -0.720  -5.632   1.114  1.00  0.00           H   new
ATOM      0 HE22 GLN A   6      -2.192  -6.604   1.209  1.00  0.00           H   new