Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLFKLSKEKIELGLSRLSPARRIFLSFALVILLGSLLLSLPFVQVESSRATYFDHLFTAVSAVCVTGLSTLPVAHTYNIWGQIICLLLIQIGGLGLMTFIGVFYIQSKQKLSLRSRATIQDSFSYGETRSLRKFVYSIFLTTFLVESLGAILLSFRLIPQLGWGRGLFSSIFLAISAFCNAGFDNLGSTSLFAFQTDLLVNLVIAGLIITGGLGFMVWFDLA----G--H-V-GR--------KKKGRLHFHTKLVLLLTIGLLLFGTATTLFLEWNNAGTIGNLPVADKVLVSFFQTVTM-RTAGFSTIDYT--QA--HPVTLLIYILQMFLGGAPGGTAGGLKITTFFVLLVFARSELLGLPHANVARRTIAPRTVQKSFSVFIIFLMSFLIGLILLGITA----------KGNPPFIHLVFETISALSTVGVTANLTPDLGKLALSVIMPLMFMGR--------IGPLTLFVSLADYHPEKKDMIHYMKADISIG 4J7C Chain:I ((36-353)) -------------------------------------------------------------------------------------------------------------------------------------PPQVLAIGFFLTIIIGAVLLMLPIST--TKPLSWIDALFTAASATTVTGLAVVD-T-GTQFTV--FGQTVIMGLIQIGGLGFMTFAVLIVMIL-KIGLKERMLVQEALNQPTIGGVIGLVKVLFLFSISIELIAALILSIRLVPQ------YGWSSGLFASLFHAISAFNNAGFSLWPDNLMSYVGDPTVNLVITFLFITGGIGFT---------------VLFDVMKNR-RF---KTFSLHTKLMLT-----GTLMLNAIAMLTVFILEYSNPGTLGHLHIVDKLWASYFQAVTP-RTAGFNSLDFGSMREGTIVFTLLLMFIGAGSASTASGIKLTTFIVILTSVIA-YLRGK----------

General information: TITO was launched using: RESULT: Template: 4J7C.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain I - contact count / total energy / energy per contact / energy per residue : 1229 -158288 -128.79 -571.44 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain I : 0.56 3D Compatibility (PKB) : -128.79 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.307

(partial model without unconserved sides chains): PDB file : Tito_4J7C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J7C-query.scw PDB file : Tito_Scwrl_4J7C.pdb: