EINIT = 71.536527  EOUTPUT = -21.3157717 DELTA E = -92.8522987
 INI-ELEC = -2.16297349 INI-VDW = 10.2312846
 OUT-ELEC = -2.68829599 OUT-VDW = -31.6052067
 39 A:LYS433  RMS =  3.4690 SA =  0.7032  S
 73 A:GLN467  RMS =  2.6809 SA =  0.6025  S
 102 A:GLN496  RMS =  1.2082 SA =  0.5259  S
 158 A:THR552  RMS =  0.5326 SA =  0.4132  S
 161 A:VAL555  RMS =  2.8078 SA =  0.7804  S
 243 A:LYS637  RMS =  0.3643 SA =  0.5120  S
 ========================================
 CHARMM ENERGY [KCAL/MOL]
 INITIAL = 71.536527  OUTPUT = -21.3157717
 ========================================
 SIDE-CHAIN RMSD [A]
 SELECTED RESIDUES:
 CORE = 0 SURFACE = 2.2314847   ALL= 2.2314847
 ALL RESIDUES:
 CORE = 0 SURFACE = 0.410155044   ALL= 0.333951333