USER  MOD reduce.3.24.130724 H: found=0, std=0, add=15, rem=0, adj=0
USER  MOD reduce.3.24.130724 removed 15 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   8 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD -----------------------------------------------------------------
ATOM    112  N   PRO A   7      26.882  34.319  23.651  1.00  0.00           N
ATOM    113  CA  PRO A   7      26.106  33.837  24.781  1.00  0.00           C
ATOM    114  C   PRO A   7      25.287  34.818  25.597  1.00  0.00           C
ATOM    115  O   PRO A   7      24.260  34.479  26.182  1.00  0.00           O
ATOM    116  CB  PRO A   7      27.118  33.180  25.721  1.00  0.00           C
ATOM    117  CG  PRO A   7      28.114  32.568  24.741  1.00  0.00           C
ATOM    118  CD  PRO A   7      28.170  33.652  23.669  1.00  0.00           C
ATOM      0  HA  PRO A   7      25.341  33.196  24.343  1.00  0.00           H   new
ATOM      0  HB2 PRO A   7      27.591  33.906  26.383  1.00  0.00           H   new
ATOM      0  HB3 PRO A   7      26.654  32.425  26.356  1.00  0.00           H   new
ATOM      0  HG2 PRO A   7      29.087  32.390  25.199  1.00  0.00           H   new
ATOM      0  HG3 PRO A   7      27.769  31.613  24.344  1.00  0.00           H   new
ATOM      0  HD2 PRO A   7      28.967  34.364  23.886  1.00  0.00           H   new
ATOM      0  HD3 PRO A   7      28.389  33.216  22.694  1.00  0.00           H   new
ATOM    126  N   GLN A   8      25.723  36.079  25.606  1.00  0.00           N
ATOM    127  CA  GLN A   8      25.191  37.150  26.433  1.00  0.00           C
ATOM    128  C   GLN A   8      24.101  38.059  25.890  1.00  0.00           C
ATOM    129  O   GLN A   8      23.382  38.702  26.643  1.00  0.00           O
ATOM    130  CB  GLN A   8      26.434  37.994  26.706  1.00  0.00           C
ATOM    131  CG  GLN A   8      26.288  38.968  27.869  1.00  0.00           C
ATOM    132  CD  GLN A   8      27.637  39.500  28.302  1.00  0.00           C
ATOM    133  OE1 GLN A   8      28.091  39.232  29.424  1.00  0.00           O
ATOM    134  NE2 GLN A   8      28.334  40.294  27.492  1.00  0.00           N
ATOM      0  H   GLN A   8      26.490  36.389  25.009  1.00  0.00           H   new
ATOM      0  HA  GLN A   8      24.672  36.685  27.271  1.00  0.00           H   new
ATOM      0  HB2 GLN A   8      27.273  37.329  26.908  1.00  0.00           H   new
ATOM      0  HB3 GLN A   8      26.682  38.556  25.806  1.00  0.00           H   new
ATOM      0  HG2 GLN A   8      25.643  39.796  27.576  1.00  0.00           H   new
ATOM      0  HG3 GLN A   8      25.803  38.469  28.708  1.00  0.00           H   new
ATOM      0 HE21 GLN A   8      27.972  40.522  26.566  1.00  0.00           H   new
ATOM      0 HE22 GLN A   8      29.230  40.674  27.797  1.00  0.00           H   new