Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTRESSVGLKFRKFNRFYTNVLGFLNEHIYDSPFSLTETRILFEIYNTPNCTAKALQDKLGLDRGYVSRIVKQFEKEDLIYKQRSKDDARHHYIFVTETGKTIYKKLEEKANEQVELMLKVINQKEQHKLAEAMAEIEAILSQSLSARASEISIRDYFLSEDLQLLIEKQRQFYAEAHGWDDTFLAYLQETFDADIEKIWIAESGGKFAGSVG--LVKHDEKTVQLR-WFLVDADFRGRGLGTQ-LLEHLVAYCQDMKFDRIFLWTVSTMAEARPLYKKFGFRISEVK---------QEAPLWGQQLTEERWDLELS 2PSW Chain:A ((2-156)) ---------------------------------------------------------------------------------------------------------------------------------------------------SKGSRIELGD-VTPHNIKQLKRLNQVIFPVSYN-DKFYKDVLEVG-----ELAKLAYFNDIAVGAVCCRVDHSQNQKRLYIMTLGCLAPYRRLGIGTKMLNHVLNICEKDGTFDNIYLHVQISNESAIDFYRKFGFEIIETKKNYYKRIEPADAHVLQKNLK---------

General information: TITO was launched using: RESULT: Template: 2PSW.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 : 600 -72622 -121.04 -511.42 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -121.04 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.480

(partial model without unconserved sides chains): PDB file : Tito_2PSW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PSW-query.scw PDB file : Tito_Scwrl_2PSW.pdb: