Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLLAAGIIGLLTVSIASPSFAAEKQADTNVAVLFDGSGSMVQKTGGERKIDIAKKSVKSFAELLPKDTNLMLRVFGHAGNNKLSGKALSCSTTETIYGLHPYEGSLFDNSLSELKPTGWTPIAKALADTRKEFEAFDADG--KNVVYLITDGEETCGGDPAAEIEKLRASNVDTIVNIIGFNFDVKGNEEM-KQAAVAGGGEYISANSADEFEQAWEKEAQKFTE------------------------------------------------------ 4HQO Chain:A ((6-262)) ----------------DEVKYSEEVCNEQVDLYLLVDGSGSIGYPNWITKVIPMLNGLINSL-SLSRDTINLYMNLFGSYTTELIRLGSGQSIDKRQALSKVTELRKTY-------TPYGTTSMTAALDEVQKHLNDRVNREKAIQLVILMTDGVPNSKYRALEVANKLKQRNVRLAVIGIGQGINHQFNRLIAGCRPREPNCKFYSYADWNEAVALIKPFIAKVCTEVERVANCGPWDPWTACSVTCGRGTHSRSRPSLHEKCTTHMVSECEEGECPHHH

General information: TITO was launched using: RESULT: Template: 4HQO.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 : 1019 -45348 -44.50 -226.74 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -44.50 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.413

(partial model without unconserved sides chains): PDB file : Tito_4HQO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HQO-query.scw PDB file : Tito_Scwrl_4HQO.pdb: