Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTPAIRRTVTFPEISMERLKSILGAYNGHLKQIEQRLDVKITHRGDVFYIDGEIDAVGRAEALLQRLYEETEASQQISADLLHLLIQSSQTERNFELVGEEMDEHDAPMDVYFQTRKGRINPRGANQKRYVQRILQSDISFGVGPAGTGKTYLAVAAAVDMLERNEIQRILLVRPAVEAGEKLGFLPGDLTQKIDPYLRPLYDALYEMLGFEKVAKLIERQVIEVAPLAYMRGRTLNHSFVILDEAQNTTPEQMKMFLTRLGFGSRAVITGDITQVDLPRGQQSGLAHALRVLENIKEIHITRFHSRDVVRHQLVQKIVEAYEAWDGE--QQRLNAEARAERKARQEALIAENDTAADLQHQDA 2P9I Chain:F ((118-157)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ITNFHTEQMYKHKLVDFVIHFMEEIDKEISEMKLSVNARA------------------------

General information: TITO was launched using: RESULT: Template: 2P9I.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 : 20 -3955 -197.73 -104.07 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain F : 0.56 3D Compatibility (PKB) : -197.73 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.712

(partial model without unconserved sides chains): PDB file : Tito_2P9I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2P9I-query.scw PDB file : Tito_Scwrl_2P9I.pdb: