Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKPLGDRVVIELVESEEKTASGIVLPDSAKEKPQEGKIVAAGSGRVLESGERVALEVKEGDRIIFSKYAGTEVKYEGTEYLILRESDILAVIG 1WNR Chain:A ((1-94)) MIKPLGDRVVVKRI-------------------PQKGKVIAVGTGRVLENGQRVPLEVKEGDIVVFAKYGGTEIEIDGEEYVILSERDLLAVLQ

General information: TITO was launched using: RESULT: Template: 1WNR.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 : 329 -31937 -97.07 -425.82 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.87 3D Compatibility (PKB) : -97.07 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.87 QMean score : 0.681

(partial model without unconserved sides chains): PDB file : Tito_1WNR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WNR-query.scw PDB file : Tito_Scwrl_1WNR.pdb: