Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVELAPALEEVLRPVLGD-VTVENLQRLTGGASRTTWAFSAHARSRSGTAHARSESDTAHARSESDTAQTGGAGRPLILRTGARDD-IHASMELEAKVQQRAAAAGAPVPHIVNADNSPAAVGAPYLICDAIAGE-TIVRRIFRGLDDGGRARLLEQCATALAAIHRADPAGIGLT-SPDDLAGWRSRLDEIGD--TTATFEWTFRRLADARP-EPSPMRLVHGDFRMGNLIVDESGLAAVLDWELTHIGEIYEDLAWFCIRAWRFGAPETLGAGGLGSVETFLQAYESAADTSLDRNTFRWWLTVATLRWGVICRHQAERHLSGESPSVELAAIGRRVSETEWDLLELLSGGGPR 4R78 Chain:A ((19-278)) --SHMEKIIKEKISSLLSQEEEVLSVEQL-GGMTNQNYLAKTTN---K----------------------------QYIVKFFGKGTEKLINRQDEKYNLELLKDLGLDVKNYLFDIE------AGIKVNEYIESAITLDSTS--------IKTKFDKIAPILQTIHTSAKELRGEFAPFEEIKKYESLIEEQIPYANYESVRNAVFSLEKRLADLGVDRKSCHIDLVPENFIESPQGRLYLIDWEYSSMNDPMWDLAALFLES-EFT---------SQEEETFLSHYESDQTP-VSHEKIAIYKILQDTIWSLWTVYK--------------------------------------

General information: TITO was launched using: RESULT: Template: 4R78.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 : 1162 -19704 -16.96 -77.88 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -16.96 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.301

(partial model without unconserved sides chains): PDB file : Tito_4R78.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4r78-query.scw PDB file : Tito_Scwrl_4R78.pdb: