Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKITALLFALCATVTHAELQTLDNDALQAINGQAGADLSLMLNLNQTSNGIFDNGSGGVCENVEFCHIGLAINKRFVQADTTKPSGWAENSDSGNKLW-------LVFKGVQGTLNIQKMG----LDGADLKYLDKSNTEIIKLAIQLSFSAAQPILIRNFGFNALSIEQDNFTSSTTTQGSSANMYDYAYFKKPTYAATANSANQQVATATPSAYDYGRETGFMGLMMNGNMAIQGKVMVFSCDGSHPRC 4PIB Chain:A ((53-166)) -----------------------------------------------------------------------SIGHKYIYMSSDDPRGWSV--DPGNITLNAHVGDTLSFFCASTSDNSEYAAFIYRLTGGD-PHLDPSHVEVIKLQ-----NAAQPTPSNGYPFTTAPVAFSSCDAKVAQQGQAKNFYVWA-------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4PIB.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 : 296 4323 14.60 42.80 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 14.60 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.228

(partial model without unconserved sides chains): PDB file : Tito_4PIB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PIB-query.scw PDB file : Tito_Scwrl_4PIB.pdb: