Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGENMFKKEKVTEYIWTILIPTIITFIISWVGSYYNGTSTVSIGQPTKVSGQYITPINISPYHDIKELRITFPQKLDVKQISSNEPINVKSDKNNIGVESNSTFEIAKIVENNSVQLLITTQKKLNDKEIRIDKNGNNISVNYESQIVNPAKKQLINLIITSSIYFIMLNILALIMNKRWDKYYAKMKNEIKEFEDNAKDLDKKSKKKSEELSELRKTLNQAFEETDRIKYHEKKKQILLLAKLNDYKKELTFWRNTIRKVLYELPDGDKKADKLIGTVTSSLKTYGTVEKNEHDYESLKVAAALLNDSDKRS 5D7C Chain:A ((66-184)) ----------------------------------------------------------------------------------------------------------------NQIEVVIE-----KDNWIKVTDNGRGIPVDIQEKMGRPA----VEVILTSSVVNALSQDLEVYVHRNETIYHQAYKKGVPQF-----DLKEVGTTDKTGTVIRFKADGEIFTETTVYNYETLQQRIRELAFLN--------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5D7C.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 : 452 -13784 -30.50 -115.83 target 2D structure prediction score : 0.29 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -30.50 2D Compatibility (Sec. Struct. Predict.) : 0.29 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.084

(partial model without unconserved sides chains): PDB file : Tito_5D7C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5D7C-query.scw PDB file : Tito_Scwrl_5D7C.pdb: