NSTEP = 10002 TIME(PS) = 10.002 TEMP(K) = 1763.89 PRESS = 0.0 Etot = 11.7606 EKtot = 10.5156 EPtot = 1.2450 BOND = 0.0000 ANGLE = 0.0000 DIHED = 0.0000 1-4 NB = 0.0000 1-4 EEL = 0.0000 VDWAALS = -0.4713 EELEC = 0.0000 EGB = 0.0000 RESTRAINT = 1.7163 EAMBER (non-restraint) = -0.4713