Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAFRQALQLAACGLAGGSAAVLFSAVAVGKPRAGGDAEPRPAEPPAWAGGARPGPGVWDPNWDRREPLSLINVRKRNVESGEEELASKLDHYKAKATRHIFLIRHSQYHVDG--SLEKDRTLTPLGREQAELTGLRLASLGLKFNKIVHSSMTRAIETTDIISRHLPGVCKVSTDLLREGA-------PIEPDP----P-VSHW-------KPEAVQYYEDGARIEAAFRNYIHRADA---RQEEDSYEIFICHANVIRYIVCRALQFPPEGWLRL-SLNNGSITHLVIRPN---GRVALRTLGDTGFMPPDKITRS 4PZA Chain:A ((3-219)) ------------------------------------------------------------------------------------------------ARRLVMLRHGQTD---RMQGQLDTELSELGRTQAVAAAEVLGK--RQPLLIVSSDLRRAYDTAVKLGERTG-LVVRVDTRLRETHLGDWQGLTHAQIDADAPGARLAWREDATWAPHGGESRVDVAARSRPLVAELVASEPEWGGADEPDRPVVLVAHGGLIAALSAALLKLPVANWPALGGMGNASWTQLSGHW-FESIRWRLDVWNASAQVS-------

General information: TITO was launched using: RESULT: Template: 4PZA.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 : 870 21509 24.72 120.16 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 24.72 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.574

(partial model without unconserved sides chains): PDB file : Tito_4PZA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PZA-query.scw PDB file : Tito_Scwrl_4PZA.pdb: