RosettaScripts and commandline instructions #any improtant residues Command line options (wrapped in “flags” file) -use_input_sc -extrachi_cutoff 5 -ignore_unrecognized_res -use_occurrence_data -chemical:exclude_patches LowerDNA UpperDNA Cterm_amidation SpecialRotamer VirtualBB ShoveBB VirtualDNAPhosphate VirtualNTerm CTermConnect sc_orbitals pro_hydroxylated_case1 pro_hydroxylated_case2 ser_phosphorylated thr_phosphorylated tyr_phosphorylated tyr_sulfated lys_dimethylated lys_monomethylated lys_trimethylated lys_acetylated glu_carboxylated cys_acetylated tyr_diiodinated N_acetylated C_methylamidated MethylatedProteinCterm -linmem_ig 10 -ignore_zero_occupancy false -out:path:pdb pdb/ -out:path:score score/ -mute all -overwrite -parser:script_vars res_to_fix=-1 # residues prevented from repacking. use with the script_vars pdb_reference -database Rosetta/main/database/ Command line execution rosetta_scripts.default.linuxgccrelease @flags -s -parser:protocol