Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIPIYICEDDPKQLEVLSTVIKNRIMIENLDSYVHISTSDPEELLNAAKIRTSSFGIYFLDIELEDSEMDGVAIGKLIRELDPLGKIIYVTSHTEMSMKILKSNIEPTDYIVKEDLYDLKENVEHILSKIFEDFQMSQIQKDIFKIEFNDEIKFLPIKDIQYFSTSLGAPHKLEVHLTHAQLQFYEKIKEIEKMHRNFIRCHKSYVINTQNVRSINKKTREVTLANGETIPASIRGLKKLIS 4XQQ Chain:B ((15-100)) ---------------------------------------------------------------------------------------------------------------------------------------------------------YVQYDDIMFFESSTKS-HRLIAHLDNRQIEFYGNLKELSQLDDRFFRCHNSFVVNRHNIESIDSKERIVYFKNKEHCYASVRNVKKI--

General information: TITO was launched using: RESULT: Template: 4XQQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 383 -47029 -122.79 -546.84 target 2D structure prediction score : 0.34 Monomeric hydrophicity matching model chain B : 0.62 3D Compatibility (PKB) : -122.79 2D Compatibility (Sec. Struct. Predict.) : 0.34 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.366

(partial model without unconserved sides chains): PDB file : Tito_4XQQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4XQQ-query.scw PDB file : Tito_Scwrl_4XQQ.pdb: