Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTILINNVVLVGRLTKDPDLRYTASGTAVATFTLAVNRNFTNQ-SG--NREADFINCVIWRK-SAETLANYARKGTLLGVTGRIQTRSYDNQQGQRVYVTEVVADN----FQLLESRSASENRQQSGGFQSSGQSAGGFGGNNNSNQTSQSSNGMPDFDRDTSDPFGSSSTIDISDDDLPF 3PGZ Chain:B ((23-136)) -AGSLNKVILIGNLGADPEIRRLNSGDQVANLRIATSESWRDRNTNERKERTEWHNIVIFNENLVKVVEQYLKKGSKIYIEGQLQTRKWQDQNGNDRYTTEIVLQKYRGELQMLD------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3PGZ.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 : 366 -4592 -12.55 -43.32 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -12.55 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.693

(partial model without unconserved sides chains): PDB file : Tito_3PGZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3PGZ-query.scw PDB file : Tito_Scwrl_3PGZ.pdb: