Remark line goes here MASS BOND ANGLE DIHE IMPROPER ca-ca-ca-ha 1.1 180.0 2.0 Using general improper torsional angle X- X-ca-ha, penalty score= 6.0) ca-ca-ca-n 1.1 180.0 2.0 Using the default value c -ca-n -nc 1.1 180.0 2.0 Using the default value cc-n -c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0) c -cd-cc-cl 1.1 180.0 2.0 Using the default value cc-cd-cd-nh 1.1 180.0 2.0 Using the default value cd-h4-cd-nc 1.1 180.0 2.0 Same as X -X -ca-ha, penalty score= 67.2 (use general term)) cd-hn-nh-hn 1.1 180.0 2.0 Same as X -X -na-hn, penalty score= 41.2 (use general term)) NONBON