Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFKKMLTLAAIGLSGFGLVACGNQSAASKQSASGTIEVISRENGSGTRGAFTEITGILKKDGDKKIDNTAKTAVIQNSTEGVLSAVQGNANAIGYISLGSLTKSVKALEIDGVKASRDTVLDGEYPLQRPFNIVWSSNLSKLGQDFISFIHSKQGQQVVTDNKFIEAKTETTEYTSQHLSGKLSVVGSTSVSSLMEKLAEAYKKENPEVTIDITSNGSSAGITAVKEKTADIGMVSRELTPEE--GKSLTHDAIALDGIAVVVNNDN-KAS--QVSMAELADVFSGKLTTWDKIK 1IXH Chain:A ((2-114)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ASLTGAGATFPAPVYAKWADTYQK-ETGNKVNYQGIGSSGGVKQIIANTVDFGASDAPLSDEKLAQEGLFQFPTVIGGVVLAVNIPGLKSGELVLDGKTLGDIYLGKIKKWDDE-

General information: TITO was launched using: RESULT: Template: 1IXH.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 : 311 -15656 -50.34 -144.96 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -50.34 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_1IXH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1IXH-query.scw PDB file : Tito_Scwrl_1IXH.pdb: