Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MHIHYNTNQT-----TLPLEISSFLPQDHLVFTIEKVVNTDEKEVNHLIKYAMFDKEQKRGYKQSARNL---ANWHYNDKEDSYTHPD------GWYYRFHHTKYQKTQTDFQQEIKVYYADEPE-------SAPQKGLYMNERYQNLKAKEAFICPKTDFRSTQD 2W5E Chain:A ((1-162)) KHHHHHHIKPGALCVIDTPEGKGTGFFSGNDIVTAAHVVGNNT-FVNVCYEGLMYEAKVRYMPEKDIAFITCPGDLHPTARLKLSKNPDYSCVTVMAYVNEDLVVSTAAAMVYGNTLSYAVRTQDGMSGAPVCDKYCRVLAVHQTNTGYTGGAVIIDPTDFHP----

General information: TITO was launched using: RESULT: Template: 2W5E.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 : 705 11850 16.81 84.64 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 16.81 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.134

(partial model without unconserved sides chains): PDB file : Tito_2W5E.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2W5E-query.scw PDB file : Tito_Scwrl_2W5E.pdb: