Remark line goes here MASS BOND ANGLE DIHE IMPROPER c3-c3-nh-ca 1.1 180.0 2.0 Using the default value ca-ca-ca-nh 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= 6.0) NONBON