Remark line goes here MASS BOND ANGLE DIHE IMPROPER ca-ca-ca-os 1.1 180.0 2.0 Using the default value ca-ca-ca-oh 1.1 180.0 2.0 Using the default value c -ca-ca-ca 1.1 180.0 2.0 Using the default value ca-h4-c -o 10.5 180.0 2.0 Using general improper torsional angle X- X- c- o, penalty score= 6.0) NONBON