Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --KCVIKRVFSDGSSVKIPAQPAQSTTIS-----KQAVWVYGNCQ-PFPVVLNDGSKLSGEIET-------PAVTPVES 2WKD Chain:A ((0-88)) GTIITVTAQANEKNTRTVSTAKGDKKIISVPLFEKEVKVAYGSAFMPDFIQMGDTVTVSGRVQAKNYNFVFPTVEKVFI

General information: TITO was launched using: RESULT: Template: 2WKD.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 : 205 1303 6.36 20.36 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 6.36 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.327

(partial model without unconserved sides chains): PDB file : Tito_2WKD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2WKD-query.scw PDB file : Tito_Scwrl_2WKD.pdb: