Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDAKMNLKQLAGIEAAKFVKDGMIVGLGTGSTAYYMVEEIGRRMREEGLRITGVTTSNATKEQAEKLGIPLKSIDEVPVVDLTIDGADEISA-DFQGIKGGGAALLFEKIVATYSKETIWIVDSSKLVDKLGK-FPLPVEVIPYGSQQLLHIFEEKRFQPVLRTDE-NGEVLTTDGGHYIIDLHLEVIEQPESLATYLDELVGVVEHGLFLNMVSKVVVGSEKGVEILDAIRRK 3IXQ Chain:C ((2-225)) --SNEDLKLKVAKEAVKLVKDGMVIGLGTGSTAALFIRELGNRIREEELTVFGIPTSFEAKMLAMQYEIPLVTLDEY-DVDIAFDGADEVEETTLFLIKGGGGCHTQEKIVDYNANEFVVLVDESKLVKKLGEKFPIPVEVIPSAYRVVIRALSEMGGEAVIRLGDRKRGPVITDNGNMIIDVFMN-IDDAIELEKEINNIPGVVENGIFTK-VDKVLVGTKKGVKTLK-----

General information: TITO was launched using: RESULT: Template: 3IXQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1307 -55555 -42.51 -251.38 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain C : 0.82 3D Compatibility (PKB) : -42.51 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.583

(partial model without unconserved sides chains): PDB file : Tito_3IXQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3IXQ-query.scw PDB file : Tito_Scwrl_3IXQ.pdb: