Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQEEPSPSWSMRGLRKWLGTAPETRDELLKLVQNSRRFLEPDTVAMLEGVLDLPATKIREVMTPRTAMISMQEDDQLLDILHVLVESAHSRFPVFSADQPDNVVGILLAKDLLPFLTEPNTKLDIGSLMRQPLFVPESARSDQVLRMLKHTQTHIAIVIDEYGSTAGLVTLEDILEEIVGEIEDEHDTADEDAQYIVPDNDHTIANAWMVQALTPIEHFNTVLDADFSDDEVETVGGLLLQEIGLVSDLQGQTVELGNWLFTIVEADARTIHLIRAVRQ 3JTF Chain:A ((7-128)) ---------------------------------------------------------VADIMVPRSRMDLLDISQPLPQLLATIIETAHSRFPVYEDDR-DNIIGILLAKDLLRYMLEP--ALDIRSLVRPAVFIPEVKRLNVLLREFRASRNHLAIVIDE-GGISGLVTMEDVLEQIVGDI-------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3JTF.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 : 463 -90634 -195.75 -749.04 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -195.75 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.549

(partial model without unconserved sides chains): PDB file : Tito_3JTF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3JTF-query.scw PDB file : Tito_Scwrl_3JTF.pdb: