<ROSETTASCRIPTS> <SCOREFXNS> <ScoreFunction name="ref_full" weights="ref2015" symmetric="1"> <Reweight scoretype="coordinate_constraint" weight="0.1"/> <Reweight scoretype="res_type_constraint" weight="0"/> </ScoreFunction> <ScoreFunction name="soft_rep_full" weights="soft_rep" symmetric="1"> <Reweight scoretype="coordinate_constraint" weight="0.1"/> <Reweight scoretype="res_type_constraint" weight="0"/> </ScoreFunction> <ScoreFunction name="ref_no_pssm" weights="ref2015" symmetric="1"> <Reweight scoretype="coordinate_constraint" weight="0.1"/> </ScoreFunction> <ScoreFunction name="ref_pure" weights="ref2015" symmetric="1"/> </SCOREFXNS> <RESIDUE_SELECTORS> <Index name="ress_fix" resnums="101A,103A,116A,156A,154A,72A,121A,68A,56A,63A,66A,1X"/> </RESIDUE_SELECTORS> <TASKOPERATIONS> <InitializeFromCommandline name="init"/> <RestrictToRepacking name="rtr"/> <OperateOnResidueSubset name="fix_res" selector="ress_fix"> <PreventRepackingRLT/> </OperateOnResidueSubset> <OperateOnResidueSubset name="not_to_cst_sc"> <Not selector="ress_fix"/> <PreventRepackingRLT/> </OperateOnResidueSubset> </TASKOPERATIONS> <MOVERS> <SetupForSymmetry name="setup_symm" definition="5k21.sym"/> <AtomCoordinateCstMover name="fix_res_sc_cst" coord_dev="0.5" bounded="false" sidechain="true" task_operations="not_to_cst_sc"/> <SymPackRotamersMover name="soft_repack" scorefxn="soft_rep_full" task_operations="init,rtr,fix_res"/> <SymPackRotamersMover name="hard_repack" scorefxn="ref_full" task_operations="init,rtr,fix_res"/> <SymRotamerTrialsMover name="RTmin" scorefxn="ref_full" task_operations="init,rtr,fix_res"/> <SymMinMover name="soft_min" scorefxn="soft_rep_full" chi="1" bb="1" jump="0"/> <SymMinMover name="hard_min" scorefxn="ref_full" chi="1" bb="1" jump="0"/> <ConstraintSetMover name="add_CA_cst" cst_file="5k21.cst"/> <ParsedProtocol name="refinement_block"> #10 movers <Add mover_name="soft_repack"/> <Add mover_name="soft_min"/> <Add mover_name="soft_repack"/> <Add mover_name="hard_min"/> <Add mover_name="hard_repack"/> <Add mover_name="hard_min"/> <Add mover_name="hard_repack"/> <Add mover_name="RTmin"/> <Add mover_name="RTmin"/> <Add mover_name="hard_min"/> </ParsedProtocol> <LoopOver name="iter4" mover_name="refinement_block" iterations="4"/> #16 reacpk+min iterations total </MOVERS> <FILTERS> <ScoreType name="stability_score_full" scorefxn="ref_full" score_type="total_score" confidence="0" threshold="0"/> <ScoreType name="stability_without_pssm" scorefxn="ref_no_pssm" score_type="total_score" confidence="0" threshold="0"/> <ScoreType name="stability_pure" scorefxn="ref_pure" score_type="total_score" confidence="0" threshold="0"/> <Time name="timer"/> </FILTERS> <PROTOCOLS> <Add filter_name="timer"/> <Add mover_name="setup_symm"/> <Add mover_name="add_CA_cst"/> <Add mover_name="fix_res_sc_cst"/> <Add mover_name="iter4"/> <Add filter_name="stability_score_full"/> <Add filter_name="stability_without_pssm"/> <Add filter_name="stability_pure"/> <Add filter_name="timer"/> </PROTOCOLS> <OUTPUT scorefxn="ref_full"/> </ROSETTASCRIPTS>