Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDEFDLIHSITPRTIHHSSVDVGIGDDAAL--YTAKHGVQEIVCVDTMVEDVHFKLHYSSPEDIGYKALAVNISDIAAMGGIPKFYLVSLAVPSKWTESEIKAMYEGMNELAKLYHMDLIGGDTVSTADKLVVTVTVIGEIEKGQACLRSLAKPNDIVFVTGEIGSSAAGLSLLLEETNPQNSSVETDYFIHRHKRPEPRVSVGRLCSIFKRAALNDVSDGLASELNEIAEASCVSIEIVESMLPIHSDLP----KLHPNWKEWALFGGEDFELTGTVSNEEWEVLKQECAALHLPITKIGYVREKTKSKVILKTDQTSMILEKKGYNHFK 3C9T Chain:B ((42-342)) LGEFGLIDLI--KKTLESKV---IGDDTAPVEYCSK---KLLLTTDVLNEGVHFLRSYI-PEAVGWKAISVNVSDVIANGGLPKWALISLNLPEDLEVSYVERFYIGVKRACEFYKCEVVGGN-ISKSEKIGISVFLVGETERFVG--RDGARLGDSVFVSGTLGDSRAGLELLLMEKEEYEPFELA--LIQRHLRPTARIDYVKHIQKYANASM-DISDGLVADANHLAQRSGVKIEILSEKLPLSNELKMYCEKYGKNPIEYALFGGEDYQLLFTHPKERWNPF--------LDMTEIGRVEEGEGVFVDGKK------VEPKGWKHF-

General information: TITO was launched using: RESULT: Template: 3C9T.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1673 -113686 -67.95 -385.37 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain B : 0.78 3D Compatibility (PKB) : -67.95 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.311

(partial model without unconserved sides chains): PDB file : Tito_3C9T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3C9T-query.scw PDB file : Tito_Scwrl_3C9T.pdb: