Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLQLNGKDVKWKKDTGTIQDLLASYQLE-----------------NKIVIVERNKEIIGKERYHEVELCDRDVIEIVHFVGGG 3DWG Chain:C ((21-93)) --------VSA-SG-DTLGAVISDLEANYSGISERLMDPSSPGKLHRFVNIYVNDEDVRFSGGLATAIADGDSVTILPAVAGG

General information: TITO was launched using: RESULT: Template: 3DWG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 184 -25302 -137.51 -451.81 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain C : 0.64 3D Compatibility (PKB) : -137.51 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.450

(partial model without unconserved sides chains): PDB file : Tito_3DWG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DWG-query.scw PDB file : Tito_Scwrl_3DWG.pdb: