Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKQFAVIGNPIEQSRSPELHHAFAEKTGVDLNYQKRLAPLDGFESSMRSFFAEGGSGMNVTVPFKEQAFALCNVLTERAQIAKAVNTLWMENGKLHGDNTDGQGLVAAIQALEWNLENTTILILGAGGATRGVIYPLVQAGAKKIVIANRTLARAEQLVDDLKTAVPQAQLQAISLNDLEGDFDIVINATSASLSG-DALQLPEKL--KFKYAYEMAYGKP--SSFLDQAKQRNVPYAEGFGMLVGQAIEAFSIWNGVRPQLKDFL 2D5C Chain:A ((3-248)) ---RFAVLGHPVAHSLSPAMHAFALESLGLEGSYEAWDTPLEALPGRLKEV-RRAFRGVNLTLPLKEAALAHLDWVSPEAQRIGAVNTVLQVEGRLFGFNTDAPGFLEALKAGGIPLKGPA-LVLGAGGAGRAVAFALREAGL-EVWVWNRTPQRALALAEEFG-------LRAVPLEKAR-EARLLVNATRVGLEDPSASPLPAELFPEEGAAVDLVY-RPLWTRFLREAKAKGLKVQTGLPMLAWQGALAFRLWTGLLP------

General information: TITO was launched using: RESULT: Template: 2D5C.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1424 -113914 -80.00 -472.67 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -80.00 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.463

(partial model without unconserved sides chains): PDB file : Tito_2D5C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2D5C-query.scw PDB file : Tito_Scwrl_2D5C.pdb: