Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence METFKSILHEAQRIVVLTGAGMSTESGIPDFRSAGGIWTEDASRMEAMSLDYFLSYPRLFWPKFKE-LFQMKMSGSFEPNEGHLLLAELEKQGKQVDIFTQNIDGLHKKAGSRHVYELHGSIQTAACPACGARYDLPHLLER----EVPECTAAGNNGDICGTVLKTDVVLFGDAVMHFDTLYEKL---DQADLLLVIGTSLEVAPARFVPEDASLIPGMKKVIINLEPTYCDSLFDMVIHQKIGEFARSLGMKK 4BUZ Chain:A ((3-239)) MKEFLDLLNESRLTVTLTGAGISTPSGIPDF---------YSQNV--FDIDFFYSHPEEFYRFAKEGIFPMLQA---KPNLAHVLLAKLEEKGLIEAVITQNIDRLHQRAGSKKVIELHGNVEEYYCVRCEKKYTVEDVIKKLESSDVPLC-------DDCNSLIRPNIVFFGENLPQ-DALREAIGLSSRASLMIVLGSSLVVYPAAELPL-ITVRSGGKLVIVNLGETPFDDIATLKYNMDVVEFARRV----

General information: TITO was launched using: RESULT: Template: 4BUZ.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 : 1185 -143650 -121.22 -652.95 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -121.22 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.550

(partial model without unconserved sides chains): PDB file : Tito_4BUZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4BUZ-query.scw PDB file : Tito_Scwrl_4BUZ.pdb: