MOLINFO STRUCTURE=chignolin.pdb
RANDOM_EXCHANGES

#section 1
#add here the experimental cvs and restraints:




#section 2
#first collective variable here:

#second collective variable here:

#this is the third collective variable:
ab: ANTIBETARMSD RESIDUES=all TYPE=DRMSD LESS_THAN={RATIONAL R_0=0.08 NN=8 MM=12} STRANDS_CUTOFF=1.

#this is the fourth collective variable:
ca: GROUP ATOMS=5,12,33,53,59,74,88,95,109,133
WHOLEMOLECULES ENTITY0=ca
rg: GYRATION ATOMS=ca

#add here the printout of the collective variables
