PSF CMAP CHEQ 2 !NTITLE ** * Minimal file defining a single improper torsion 4 !NATOM 1 AAL 3 ALA C 32 0.340000 12.0110 0 0.00000 -0.301140E-02 2 AAL 3 ALA CA 22 0.700000E-01 12.0110 0 0.00000 -0.301140E-02 3 AAL 3 ALA OT2 72 -0.670000 15.9990 0 0.00000 -0.301140E-02 4 AAL 3 ALA OT1 72 -0.670000 15.9990 0 0.00000 -0.301140E-02 0 !NBOND: bonds 0 !NTHETA: angles 0 !NPHI: dihedrals 1 !NIMPHI: impropers 1 2 3 4 0 !NDON: donors 0 !NACC: acceptors 0 !NNB 0 0 0 0 1 0 !NGRP NST2 0 0 0 1 !MOLNT 1 1 1 1 0 0 !NUMLP NUMLPH 0 !NCRTERM: cross-terms