Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEELLERVFSFSDVDKLIDFISYELQKPVILESADFFLLAYNSYYINHFDSANQQTIFSKKCPVQIFERFLKDGIIEKLKTEPEPFRVNKIESIGLNQRVVVSAKHKGEVMGYIWIQELDQNLTDEELDFLYETSFHVGKIIYKTNKLKQEKEEKAEDLIKRAIYQQFTSEKELRREAERINTVLPSMFSVVILHAANGDG--EAVEDLKENIRSYLNLRDKVSHVLTIESNIVIVVASFSQKSSVSSAASEFINKLLTHFHFQKIPTPIYIGIGNEYNHLLKLGKSYTEALEVIKAAEITGNQENIPYEYAKLGIYRYLESIEQKNEFLEYENKDLALLKAKDEESSTELLKTLEIYLLNNCKTKPAAEQLFIHQNTLNYRIKQITEMTSIDLSDFRTRCQLYLDLMLMKKK 3ONQ Chain:A ((20-259)) ------------------------------------------------------------------------------------------------------------------------------------------------------DDTTIERLAFECLLTNMTDD--RVVSLMNILGWQ--GDFNCFAIGGVPSASLASTSLAIRKAVRDLG---GEHVVIGTYGTFLLALACQMGAVT-----PEVTCTAVMPA----FS-EDEPLYLSPVRSGVAGASHALRETMFSLQAAPALS-TPSRPLRADELLPERALLGDD--YAREELYRNVYQVLRGEN--PDDPTYLTVSTFLKYGSSLENTAKELNVHPNTVRYRLKRAAETTGWDATDPRDAYVLTTALAIGRM-

General information: TITO was launched using: RESULT: Template: 3ONQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1175 -133094 -113.27 -559.22 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -113.27 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.534

(partial model without unconserved sides chains): PDB file : Tito_3ONQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ONQ-query.scw PDB file : Tito_Scwrl_3ONQ.pdb: