Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDYADYDK-ALYYTHRS-QW--DNLLILMVRTE--DDLLSKRIEHFLH-AYHFEQDYAVLEKMLYSLLRYIDHATELTYEDQIALLT 1KXO Chain:A ((104-160)) ---TDNKNYIIGYFCSYDKKGHMDLVWVLSRSMVLTGEAKTAVENYLIGSPVVDSQ-------------------------------

General information: TITO was launched using: RESULT: Template: 1KXO.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 : 104 -14852 -142.80 -322.86 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : -142.80 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.189

(partial model without unconserved sides chains): PDB file : Tito_1KXO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1KXO-query.scw PDB file : Tito_Scwrl_1KXO.pdb: