Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLNVLKHFKEKQMPSFQSADAQINYQTFGE--PSSPALVFSNSLGTNYGMWQKQFNELKDQFFVICYDNRGHGSSSTPDGPYTVEQLGEDVVRLLDHLNISKAAFCGISMGGLTGQWLAIHYPNRFSHVVVANTAAKIGQEQ-AWLDRAKLV-REQGLQPIATTAASRWFTDPFIQSHPSIVNN----LCNDLSAG-SAMGYANCCEALAKADVREQLKDIKIPVLVIAGPQDPVTTVADGEFMQQRIPQSKLAEID-ASHISNVEQPEVFNKILKDFLVN 4Q3L Chain:G ((21-290)) -----------GVSIFTYQEKDIYYEIDGTLDINSDVIVILNGIMMSTKSWDAFVENFSKNHVLLRYDMFDQGQSSKIEESYTQTIQVELLKNLLEHLGIAQANIVGISYGASIALQFAAKYPTMIKRMVVANVVAKTSPWLKDIGDGWNEVAKTGNGLAYYHITIPYIYSPQFYTLHNDWMEKRKELLVPLFSTRTFLDRMIRLTKSAETHDVIKDLPNIKTPTLIISSEEDYLTPPFEQKYLQEHLQNAELVSIPNCGHASMYEVPKTFTALVLGFFGQ

General information: TITO was launched using: RESULT: Template: 4Q3L.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 1384 -19708 -14.24 -75.80 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain G : 0.72 3D Compatibility (PKB) : -14.24 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.473

(partial model without unconserved sides chains): PDB file : Tito_4Q3L.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Q3L-query.scw PDB file : Tito_Scwrl_4Q3L.pdb: