Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIPIYICEDDPKQLEVLSTVIKNRIMIENLDSYVHISTSDPEELLNAAKIRTSSFGIYFLDIELEDSEMDGVAIGKLIRELDPLGKIIYVTSHTEMSMKILKSNIEPTDYIVKEDLYDL-KENVEHILSKIFEDFQM---SQIQKDIFKIEFNDEIKFLPIKDIQYFSTSLGAPHKLEVHLTH--AQLQFYEKIKEIEKMH-R--NFIRCHKSYVINTQNVRSINKKTREVTLANGETIPASIRGLKKLIS 4CBV Chain:F ((2-241)) --KVLILEDVIEHQVRLERILDEISKESNIPISYK-TTGKVREFEEYIEND-EVNQLYFLAIDIHGIEKKGFEVAQLIRHYNPYAIIVFITSRSEFATLTYKYQVSALDFVDKDINDE-FKKRIEQN---IFYTKS-LLENEDVVDYFDYNYKGNDLKIPYHDILYIET-TG--VSHKLRIIGKNFAKEFYGT-TDIQEKDKHTQRFYSPHKSFLVNIGNIREIDRKNLEIVFYEDHRCPISRLKIRKLK-

General information: TITO was launched using: RESULT: Template: 4CBV.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 5 588 117.60 2.58 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain F : 0.71 3D Compatibility (PKB) : 117.60 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.017

(partial model without unconserved sides chains): PDB file : Tito_4CBV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CBV-query.scw PDB file : Tito_Scwrl_4CBV.pdb: