Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKGFLVSLEGPEGAGKTSVLEALLPILEEKGVEVLTTREPGGVLIGEKIREVILDPSHTQMDAKTELLLYIASRRQHLVEKVLPALEAGKLVIMDRFIDSSVAYQGFGRGLDIEAIDWLNQFATDGLKPDLTLYFDIEVEEGLARIAANSDREVNRLDLEGLDLHKKVRQGYLSLLDKEGNRIVKIDASLPLEQVVETTNAVLFDGMGLAK 4DWJ Chain:F ((28-218)) -----FITFEGPEGSGKTTVINEVYHRLV-KDYDVIMTREPGGVPTGEEIRKIVLEGN--DMDIRTEAMLFAASRREHLVLKVIPALKEGKVVLCDRYIDSSLAYQGYARGIGVEEVRALNEFAINGLYPDLTIYLNVSAEVGRERIIKNS-RDQNRLDQEDLKFHEKVIEGYQEIIH--SQRFKSVNADQPLENVVEDT------------

General information: TITO was launched using: RESULT: Template: 4DWJ.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 : 878 -64449 -73.40 -341.00 target 2D structure prediction score : 0.79 Monomeric hydrophicity matching model chain F : 0.83 3D Compatibility (PKB) : -73.40 2D Compatibility (Sec. Struct. Predict.) : 0.79 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.612

(partial model without unconserved sides chains): PDB file : Tito_4DWJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DWJ-query.scw PDB file : Tito_Scwrl_4DWJ.pdb: