Remark line goes here MASS BOND ANGLE DIHE IMPROPER c3-n -c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 20.0) n -o -c -os 1.1 180.0 2.0 Same as X -o -c -o , penalty score= 56.3 (use general term)) c -c3-n -ca 1.1 180.0 2.0 Using the default value ca-ca-ca-n 1.1 180.0 2.0 Using the default value ca-ca-ca-ha 1.1 180.0 2.0 Using general improper torsional angle X- X-ca-ha, penalty score= 20.0) ca-ca-ca-nh 1.1 180.0 2.0 Using the default value c3-c3-nh-ca 1.1 180.0 2.0 Using the default value NONBON