Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------MLVYIGNGHYCYSNSTAMFLSSIGENVSPQLVEILTGVG--------LGAMIEYEKNLYFSMRDPDDG-------------INYALNILGFTAEEHQQASDLDDPFPLLKQ--QIKQNPVILGPLDMGELTYHPNHKNLNGSDH---------YVLGYQMDNENIYVQDPAGFPFVPLSLDQFKKAWMAERIPYRKGINKYWSTA-----KKVVTLDNNEIYERAIDYFKRTY----RKFEKVDIGLIGRE-------AICFYADQLLNAP-ITADTIRHTTFFLFQL-SARRANDYAMYFKDRHSHLSVLKTEQAKVFGICHSMSVNKDWKGISEKLMKLADLEDNFRLELLKVGY 3ZPJ Chain:A ((1-356)) MTTLEEINLLVERGYYEEALAKVYEIEDPIEQVQ-VLTKIVVTIYQHDGPMEWIPSIMEDAMYIAKKLRDPANKAVAYSIIASTLAIMEYEEDAMDFFNRAIDEANEIESPIEKGMVLSTLAYHLAIAGYPDNALEIFNIAFDTIIGAETSYTHKVDGILRIGDLLEKAGDTLPSNEAMDFYKMAFDIFDKLHVNQRAAIVEKKIELAKTVYDVGLPQIRAALLKGKNHYALAIIKKKYSGVMRLIGELEVALWMKRVNNMEYLDVVDKAFECCESPRFTDVNVQHIARLLTELGNLRRALKFAKEIQNIHKRSEALKAIALELVRRKKFEEVKKIIESIPDPKIREEALNEIGTIE------

General information: TITO was launched using: RESULT: Template: 3ZPJ.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 : 1351 22282 16.49 74.27 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 16.49 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.114

(partial model without unconserved sides chains): PDB file : Tito_3ZPJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZPJ-query.scw PDB file : Tito_Scwrl_3ZPJ.pdb: