NSTEP ENERGY RMS GMAX NAME NUMBER 1200 -2.6043E+06 1.0491E+09 3.6743E+10 H1 4 BOND = 651.4710 ANGLE = 18.3128 DIHED = 11.4737 VDWAALS = 1276.0995 EEL = -2606248.0275 HBOND = 0.0000 1-4 VDW = 0.0075 1-4 EEL = -19.3000 RESTRAINT = 0.0000