Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYNSAMKILVTSGGTSEAIDSVRSITNHSTGHLGKIITETLLSAGHEVCLITTKRALKPEPHPNLSI--REVTNTKDLLIEMQERVQDYQVLIHSMAVSDYTPVYMTGLEEVQASSNLKEFLSKQNHQAKISSTDEVQVLFLKKTPKIISLVKEWNPTIHLIGFKLLVDVTEDHLVDIARKSLIKNQADLIIANDLTQISADQHRAIFVEKNQLQTVQTKEEIAELLLEKIQAYHS 4JGB Chain:B ((5-76)) ----MLKIALFGA----------------TGMIGSRIAAEAARRGHQVTALSRNP-------ANVQAKAADLFDPASIAAALA----GQDVVASAYGPK-----------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4JGB.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 : 277 -28193 -101.78 -427.16 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : -101.78 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.632

(partial model without unconserved sides chains): PDB file : Tito_4JGB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4JGB-query.scw PDB file : Tito_Scwrl_4JGB.pdb: