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   25:sc=   0.154
USER  MOD Single : A   6 GLN     :      amide:sc=-0.00245  X(o=-0.0025,f=0)
USER  MOD -----------------------------------------------------------------
ATOM     59  N   SER A   5       0.410  -3.297  -2.765  1.00  0.00           N
ATOM     60  CA  SER A   5      -0.596  -4.074  -2.091  1.00  0.00           C
ATOM     61  C   SER A   5      -0.519  -3.750  -0.628  1.00  0.00           C
ATOM     62  O   SER A   5      -1.454  -4.002   0.128  1.00  0.00           O
ATOM     63  CB  SER A   5      -0.347  -5.592  -2.238  1.00  0.00           C
ATOM     64  OG  SER A   5      -0.142  -5.930  -3.607  1.00  0.00           O
ATOM      0  HA  SER A   5      -1.565  -3.833  -2.528  1.00  0.00           H   new
ATOM      0  HB2 SER A   5       0.524  -5.883  -1.650  1.00  0.00           H   new
ATOM      0  HB3 SER A   5      -1.198  -6.147  -1.843  1.00  0.00           H   new
ATOM      0  HG  SER A   5       0.183  -5.143  -4.093  1.00  0.00           H   new
ATOM     70  N   GLN A   6       0.634  -3.200  -0.199  1.00  0.00           N
ATOM     71  CA  GLN A   6       0.914  -2.886   1.175  1.00  0.00           C
ATOM     72  C   GLN A   6       0.699  -1.412   1.327  1.00  0.00           C
ATOM     73  O   GLN A   6       0.299  -0.724   0.389  1.00  0.00           O
ATOM     74  CB  GLN A   6       2.387  -3.191   1.537  1.00  0.00           C
ATOM     75  CG  GLN A   6       2.777  -4.660   1.292  1.00  0.00           C
ATOM     76  CD  GLN A   6       4.285  -4.823   1.493  1.00  0.00           C
ATOM     77  OE1 GLN A   6       4.734  -5.423   2.473  1.00  0.00           O
ATOM     78  NE2 GLN A   6       5.081  -4.267   0.533  1.00  0.00           N
ATOM      0  H   GLN A   6       1.400  -2.965  -0.830  1.00  0.00           H   new
ATOM      0  HA  GLN A   6       0.272  -3.481   1.824  1.00  0.00           H   new
ATOM      0  HB2 GLN A   6       3.040  -2.545   0.950  1.00  0.00           H   new
ATOM      0  HB3 GLN A   6       2.555  -2.947   2.586  1.00  0.00           H   new
ATOM      0  HG2 GLN A   6       2.235  -5.311   1.977  1.00  0.00           H   new
ATOM      0  HG3 GLN A   6       2.499  -4.958   0.281  1.00  0.00           H   new
ATOM      0 HE21 GLN A   6       4.661  -3.781  -0.259  1.00  0.00           H   new
ATOM      0 HE22 GLN A   6       6.096  -4.338   0.608  1.00  0.00           H   new