Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSEQKDMYVLGIETSCDETAAAIV-KNGKEIISNVVASQIESHKRFGGVVPEIASRHHVEQITLVIEEAFRKAGMTYSDIDAIAVTEGPGLVGALLIGVNAAKALSFAYNIPLVGVHHIAGHIYANRLVED---IVFPALALVVSGGHTELVYMKEHGSFEVIGETLDDAAGEAYDKVARTMGLPYPGGPQIDKLAEKG-NDNI------------PLPRAWLEEGSYNFSFSGLKSAVINTLHNASQKGQEIAPE----DLSASFQNSVIDVLVTK-----TARAAKEYDVKQVLLAGGVAANRGLRAALEKEFAQHEGITLV---IPPLALCTDNAAMIAAAGTIAFEKGIRGAYDMNGQPGLELTSYQSLTR 3WUH Chain:A ((7-363)) ----KGYKVLAIETSCDDTCVSVLDRFSKSAAPNVLANLKDTLD--------KAHIHHQARIGPLTERALIESN-AREGIDLICVTRGPGMPGSLSGGLDFAKGLAVAWNKPLIGVHHMLGHLLIPRMGTNGKVPQFPFVSLLVSGGHTTFVLSRAIDDHEILCDTIDIAVGDSLDKCGRELGF---KGTMIAREMEKFINQDINDQDFALKLEMP--------RNMLSFSFSAFITALRTNLTKLGKT-----PEREIRSIAYQVQESVFDHIINKLKHVLKSQPEKFKNVREFVCSGGVSSNQRLRTKLETEL--------FNFYYPPMDLCSDNSIMIGWAG-IEIWESLRLVSDLDICP------------

General information: TITO was launched using: RESULT: Template: 3WUH.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 : 1595 -177779 -111.46 -600.60 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -111.46 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.505

(partial model without unconserved sides chains): PDB file : Tito_3WUH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WUH-query.scw PDB file : Tito_Scwrl_3WUH.pdb: