Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAANVIVYSTSVCPYCVRAKQLLERKGVAYKEVNLSVEAPEVRAELMQRTNHRTVPQIFINDQFIGGFDQLYALEREGKLDELLA 4MJE Chain:A ((14-97)) VSAKIEIYTWSTCPFCMRALALLKLKGVEFQEYCIDGDNEAREAMAARANGKRSLPQIFIDDQHIGGCDDIYALDGAGKLDPLL-

General information: TITO was launched using: RESULT: Template: 4MJE.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 : 327 -52897 -161.76 -629.73 target 2D structure prediction score : 0.81 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -161.76 2D Compatibility (Sec. Struct. Predict.) : 0.81 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.661

(partial model without unconserved sides chains): PDB file : Tito_4MJE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MJE-query.scw PDB file : Tito_Scwrl_4MJE.pdb: