Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGENMFKKEKVTEYIWTILIPTIITFIISWVGSYYNGTSTVSIGQPTKVSGQYITPINISPYHDIKELRITFPQKLDVKQISSNEPINVKSDKNNIGVESNSTFEIAKIVENNSVQLLITTQKKLNDKEIRIDKNGNNISVNYESQIVNPAKKQLINLIITSSIYFIMLNILALIMNKRWDKYYAKMKNEIKEFEDNAKDLDKKSKKKSEELSELRKTLNQAFEETDRIKYHEKKKQILLLAKLNDYKKELTF---------WRNTIRKVLYELPDGDKKADKLIGTVTSSLKTYGTVEKNEHDYESLKVAAALLNDSDKRS 4YS0 Chain:A ((691-773)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KNWD--IESLKNSLSFFPAGLFDLDEKQFSSSEELHDY--LFNRLWEE-----YQRKKQEI-----GEDYRKVIRFLMLRIIDDHWRRYLEEV----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4YS0.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 : 90 -6339 -70.43 -90.55 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : -70.43 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_4YS0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YS0-query.scw PDB file : Tito_Scwrl_4YS0.pdb: