Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKSFMHSKAVIFSFTMAFFLILAACSGKNEADSKDTGWEQIKDKGKIVVATSGTLYPTSYHDTDSGSDKLTGYEVEVVREAAKRLGLKVEFKEMGIDGMLTAVNSGQVDAAANDIDVTKDREEKFAFSTPYKYSYGTAIVRKDDLSGIKTLKDLKGKKAA---GAATTVYM-EVARKYGAKEVIYDNATNEQYLKDVANGRTDVILNDYYLQTLALAAFPDLNITIHPDIKYMPNKQALVMKKSNAALQKKMNEALKEMSKDGSLTKLSKQFFNKADVSKKIDADVQDVDL 4ZV1 Chain:A ((9-232)) -------------------------------------------RGTLRVGTEATFPPFGFKDENG---KLVGFDIDLAKAIAKKLGVKVEFKPMDFDGIIPALQSGKIDVVIAGMTITEERKKQVDFSDPY-FEAGQAIVVKKGNDSIKSLEDLKGKKVGVQLGSTSEQHVKKVAKDAGVKVKKFDNFS--EAFQELKSGRVDAVVTDNAVALAYVKQNPNAGVKIVGET-FSGEPYGIAVRKGNSELLEKINKALEEMKKDGTYDKIYEKWFG-----------------

General information: TITO was launched using: RESULT: Template: 4ZV1.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 : 1155 -103403 -89.53 -470.01 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -89.53 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.685

(partial model without unconserved sides chains): PDB file : Tito_4ZV1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ZV1-query.scw PDB file : Tito_Scwrl_4ZV1.pdb: