Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKLEVKDNKKLVLKSVICKKLHDTKV-----EDVDQEINRFHQHLQLLKAQ--IFGPLIVKSCGTTIHDDGLITTDFEFYIQAHNAQQYSNIYDVQDSISVPYCLYVRFEDSP-EYLQYAYSKLDLYVYENDI-QTD-GIVYTVYVNSS--PEKMVVDIFIPIVSL 3LUR Chain:A ((7-158)) ---------QQLASLTLVGIKET-YENGRQAQQHIAGFWQRCYQEGVIADLQLKNNGDLAGILGLCIPEL--DGKMSYMIAVTGDNS-ADIAKYDVITLAS-SKYMVFEAQGAVPKAVQQKMEEVHHYIHQYQANTVKSAPFFELYQDGDTTSEKYITEIWMPVKG-

General information: TITO was launched using: RESULT: Template: 3LUR.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 : 551 14017 25.44 100.12 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 25.44 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.359

(partial model without unconserved sides chains): PDB file : Tito_3LUR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3LUR-query.scw PDB file : Tito_Scwrl_3LUR.pdb: