CreatePredAlphaCost pred_alpha2k alpha11 T0324.t2k.alpha.rdb 2 alpha alpha_prev sum CreatePredAlphaCost pred_alpha04 alpha11 T0324.t04.alpha.rdb 2 alpha alpha_prev sum CreatePredAlphaCost pred_alpha06 alpha11 T0324.t06.alpha.rdb 2 alpha alpha_prev sum SetCost wet6.5 15 near_backbone 5 way_back 5 dry5 35 dry6.5 40 dry8 25 dry12 5 \ phobic_fit 3 \ sidechain 8 \ n_ca_c 5 bad_peptide 20 \ bystroff 5 \ soft_clashes 120 backbone_clashes 2 \ break 400 \ pred_alpha2k 2 \ pred_alpha04 2 \ pred_alpha06 2 \ constraints 5 \ hbond_geom 5 \ hbond_geom_backbone 10 \ hbond_geom_beta 50 \ hbond_geom_beta_pair 150 \ missing_atoms 1 # props to keep crevice open: Constraint Y21.OH T104.OG1 7.0 8.3 20.0 1. Constraint Y21.CE2 T104.CG2 9.0 10.1 20. 1. Constraint Y21.CE2 K135.O 13. 13.8 30. 1. Constraint Y70.CE2 T104.CB 12.5 13.3 30. 1. Constraint Y70.CB A130.CB 14. 15.1 30 1. Constraint F45.CB D185.N 6 6.6 15. 1. Constraint F45.CB D162.CG 6.5 7.5 15. 1. Constraint P46.O K135.O 8.5 9.3 20.0 1. Constraint P46.O S105.CA 6.5 7.3 15. 1. Constraint M47.C S105.CA 7.0 8.8 20.0 1.