Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSNSHHATESLSQDKKHAGKVGKMKLKQLPLEYQKAIPVLKKLENAGYEAYFVGGSVRDILLNQPIHDVDIATSA----FPEEIKQLFPKTIDIGIEH----GTVLVLENDEQYEITTFRTESTYQDYRRPDHVEFVRSLSEDLKRRDFTINAFALKED----GEIIDLFDGLQDLEEQILRAVGNPHERFHEDALRMMRGLRFVSQLGFKLEEETFYAIKENHELLGKISVERINVEFIKMLLGNERAAGIHAFIETECYICCPGLKEEGEALLRLLNYHPSH 3H3A Chain:A ((37-205)) -------------------------------------------------VYVVGGFVRDLLLGIKNLDIDIVVEGNALEFAEYAKRFLPGKL---VKHDKFMTASLFLKGGLRIDIATA---------------E-MSTIKKDLYRRDFTINAMAIKLNPKDFGLLIDFFGGYRDLKEGVIRVLHTLS--FVDDPTRILRAIRFEQRFDFRIEETTERLLKQAVE-----------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3H3A.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 : 622 -617 -0.99 -4.31 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -0.99 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.434

(partial model without unconserved sides chains): PDB file : Tito_3H3A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3H3A-query.scw PDB file : Tito_Scwrl_3H3A.pdb: