Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELNLKEDWSKKMKTALNRTPASFPVRRMDYNFEDTPRYWCNHEPSL------------THYFTGLSTLFPEGESYFVRSV--RALRAKAKENEILDREIGAFIG-------QEAMHSKEHHAFHVSAQQYGLNPESLEKATGIVLKAIEKVFSKKWNLL-VTVGLEHYTAVLVVSMMQSVNE--LMTENTIRNLWLW-------HSVEETEHKAVAYDLYQHLYGNGLDAYIPRVGIFTFSLVLITA-FSTIYHIVLMKRDKQLTNFKTWRNFFKFASKQYKVLIPKFLEYYRFDFHPNQTDEKALVAATKVKLGINDRSLLLS 4Q3O Chain:A ((31-347)) -EVPIPQSISAEFKAALAQYPTP-SVEEARSFVPTTAAQWRDYVQATNKMQKTKIKNMRKHY--GVTVELLDIKGVTVRKITPKSLSPEFKDHVYIDIHGGAYVLFAGLPSIEEGILIAHRLGIVVYSVDYRMPPAYPFPAALDDVKHVYRVLSQQYDANHIFMGGTSAGGGLLLAFVQGLIENGVATPRAIYAGTPWADLTKTGDSLYTNEGIDRILITYDGTLGASARLYAGNTPLTHPKLSPIYGDFTDFPPTFLVTGTRDMFLSDTVRVNRKMRDAGVTTVLDVYEGLSHADYLVSHQTPESQSVYRQLKRFLVGFT----

General information: TITO was launched using: RESULT: Template: 4Q3O.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 : 1517 -24211 -15.96 -84.95 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -15.96 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.69 QMean score : ?

(partial model without unconserved sides chains): PDB file : Tito_4Q3O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Q3O-query.scw PDB file : Tito_Scwrl_4Q3O.pdb: