Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAVNFNMRLEAELKEQVTPILEDYGLTMPQAFKLFLNQIVKTKAIPLSFDYARETALTPKAAAKLLQSLKEIENGEYTEYETVEEAIKAMSEEAHG 4FXE Chain:B ((2-79)) ---GSINLRIDDELKARSYAALEKMGVTPSEALRLMLEYIADNERLPFKQTL--LSDEDAELVEIVKERLRN---PKP-VRVTLDEL----------

General information: TITO was launched using: RESULT: Template: 4FXE.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 64 -10947 -171.05 -140.35 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -171.05 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.519

(partial model without unconserved sides chains): PDB file : Tito_4FXE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4FXE-query.scw PDB file : Tito_Scwrl_4FXE.pdb: