Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDQKDFRENLELKPVTQEHIDQFNELLSYVFQVTEAD----IEESGFENKRAFIRSKKPILEVSKVFGWFHENKLISQIAIYPCEVNIHGARYKMGGVTGVGTYPEYANHGLMQDLIIVALDNMRKNKQWISYLYPYSIPYYRRKG---------WEIMSDKLSFKIRDTQLPKQIPVSGMVERLPVDHPDVFSVYDKFAQQNHGALFRSDFHWEEYWRFENEDERTAAVYYDSNHEPRGVLFYWVAE----EIFHVKEMFYLDQEARNGLWNFISAHFSMIYWVHGDIYKNEPLAFLIEDSQIKEQIEPYFMARIVDVKEFLQRFPF-VGTADAFHFIIEDPVAPWNNGVFALTWDEQGQVRVLNEPIGKSVRLDIQTLTCLMMNYRRASYLARIERLETDEETLKSLERIIPNMEAYFSDYF 2OZG Chain:A ((15-396)) --------------ASQENIQQLGNILEQCFVMSFGDSEIYVKGIGLENFRVIYR----------------EQKVAGGLAILPMGQWWGGQRVPMAGIAAVGIAPEYRGDGAAIALIQHTLQEISEQDIPISVLYPATQRLYRKAGYEQAGSSCVWEIPTD--SIQIQHASLPLE-PV--VLKNNPIFH----ELYQQQAQLTHGYLDRHPAIWQGLNRTLDTETLYSYLIGDKD-KPQGYIIFTQERTRDGSILRIRDWVTLSNPAVQSFWTFIANHRSQIDKVTWKSSVIDALTLLLPEQSATIRSQDRWMLRIVNVCKALEARGYPLGVEAELHLEVQDDLLATNQGKFILS-VANGKSEVTKGGKGE-LQLDIKGLASLYTSLFTPRQLQLTGKLQATETALLKATQIFAGESPWMIDFF

General information: TITO was launched using: RESULT: Template: 2OZG.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 : 1896 -30104 -15.88 -82.70 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -15.88 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.421

(partial model without unconserved sides chains): PDB file : Tito_2OZG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2OZG-query.scw PDB file : Tito_Scwrl_2OZG.pdb: