Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQIDSIDFQILQLLNKNARIQWKEIGEKIHMTGQAVGNRIKKMEDNGIIKAYSIVVDELKMGFSFTAFVFFFMNA--YMHDDLLKFIATRNEISEAHRVSGDACYLLKVTVHSQEVLNHLLN-DLLKYG---NYQLYLSIKEVKKHYNTSLMSDE 2P5V Chain:A ((7-159)) -TLDKTDIKILQVLQENGRLTNVELSERVALSPSPCLRRLKQLEDAGIVRQYAALLSPESVNLGLQAFIRVSIRKAKDAREDFAASVRKWPEVLSCFALTGETDYLLQAFFTDMNAFSHFVLDTLLSHHGVQDAQSSFVLKEIKHTTSLPLNHL-

General information: TITO was launched using: RESULT: Template: 2P5V.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 : 464 -98714 -212.75 -671.52 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -212.75 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.471

(partial model without unconserved sides chains): PDB file : Tito_2P5V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2P5V-query.scw PDB file : Tito_Scwrl_2P5V.pdb: