CreatePredAlphaCost pred_alpha2k alpha11 T0221.t2k.alpha.rdb 2 alpha alpha_prev sum CreatePredAlphaCost pred_alpha04 alpha11 T0221.t04.alpha.rdb 2 alpha alpha_prev sum SetCost wet6.5 9 near_backbone 3 way_back 3 dry5 10 dry6.5 20 dry8 9 dry12 4 \ phobic_fit 4 \ sidechain 7 \ bystroff 5 \ soft_clashes 50 backbone_clashes 2 \ break 100 \ pred_alpha2k 3 \ pred_alpha04 3 \ hbond_geom 0.1 \ hbond_geom_backbone 0.2 # constraints 2 \ # no beta, so hbond_geom_beta_pair turned off # hbond_geom_beta 0.4 \ # hbond_geom_beta_pair 1 // Add the following for extra-cellular proteins: # known_ssbond 0.5 # and put ssbond command in constraints file # maybe_ssbond 0.5 ## include T0221.t2k.dssp-ehl2.constraints ## include T0221.t2k.dssp-ebghstl.constraints ## include T0221.t2k.stride-ebghtl.constraints ## include T0221.t2k.str2.constraints ## include T0221.t2k.alpha.constraints ## include T0221.t2k.bys.constraints ## include T0221.t04.dssp-ehl2.constraints ## include T0221.t04.dssp-ebghstl.constraints ## include T0221.t04.stride-ebghtl.constraints ## include T0221.t04.str2.constraints ## include T0221.t04.alpha.constraints ## include T0221.t04.bys.constraints