Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRIAISGGGTGGHIYPALAFIKEVQRRHPNVEFLYIGTENGLEKKIVERENIPFRSIEITGFKRK----------------LSFENVKT----VMRF-LKGVKKSKSYLAEFKPDAVIGTGGYVCGPVVYAAAKMGIPTIVHEQNSLP------GI---TNKFLS-------KYVNKVAICFEEAKSHFP---SEKVVFTGNPRASEVVSIKTGRSLAEFGLSEDKKTVLIFGGSRGAAPINRAVIDMQDVLKT----RDYQVLYITGEVHYEKVMNELKSKGAADNMVTKPFLHQMPEYLKAIDVIVARAGATTIAEITALGIPSVLIPSPYVTANHQEVNARSLGQHDAAIVLKETELSGEKLIEALDRIVLNEQTLKEMSERTKSLGVPDAAARLYSVLEELKK 2P6P Chain:A ((1-377)) MRILFVAAGSPATVFALAPLATAAR-NA-GHQVVMAANQDM-GPVVTGV-GLPAV--ATTDLPIRHFITTDREGRPEAIPSDPVAQARFTGRWFARMAASSLPRMLDFSRAWRPDLIVGGTMSY--VAPLLALHLGVPHARQTWDAVDADGIHPGADAELRPELSELGLERLPAPDLFIDICPPSLRPANAAPARMMRHVATSRQCPLE--P------WMYTRDTRQRVLVTSGSRVAKESYDRNFDFLRGLAKDLVRWDVE-LIVAAPDTVAEALR-----AEVPQARV-GWT-PLDVVAPTCDLLVHHAGGVSTLTGLSAGVPQLLIPKG----SVLEAPARRVADYGAAIALLPGEDSTEAIADSCQELQAKDTYARRAQDLSREISGMPLPATVVTALEQL--

General information: TITO was launched using: RESULT: Template: 2P6P.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 : 1968 -216076 -109.79 -648.88 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -109.79 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.469

(partial model without unconserved sides chains): PDB file : Tito_2P6P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2P6P-query.scw PDB file : Tito_Scwrl_2P6P.pdb: