#THIS STUFF CAME FROM THE DOCUMENTATION #SWITCHED TO NEXTGEN KIC -in:file:s ./input/a3h-v0.1.9_input_newZ.pdb -in:file:fullatom -loops:frag_files ./input/a3h2.frag9 ./input/a3h2.frag3 none -loops:frag_sizes 9 3 1 -loops:loop_file ./input/a3h2.loops -in:file:psipred_ss2 ./input/a3h2.psipred_ss2 -loops:extended -loops:refine refine_kic_with_fragments -loops:kic_rama2b -loops:ramp_fa_rep -loops:ramp_rama -ex1 -ex2 -auto_setup_metals #-constraints:cst_fa_file ./input/a3h2_fa.cst #-constraints:cst_file ./input/a3h2_cen.cst -nstruct 1 -out:pdb -out:file:fullatom -out:prefix a3h2_v0.3.0- -mute protocols.looprelax.FragmentPerturber