Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMQTILSNGIAMVLIILIINIVYVSFFTIRMILTLKGQRYLAAGISTIEILVYVTGLSLVLDNLDQIQNVIAYALGYGLGVIVGMKIEEKLALGYIMVNVITKE-LDLDLPKQLREKGY-GVTNW--VAGGLE----------------GDRTALQILTPRRYELQLYDTIKTLDS-----KAFIIAYEPKTIHGGFWVKAVKKRRIKE 3NCQ Chain:A ((4-102)) -------------------------------------------------------------------------------------------------IEAIVRAEKFPEVKAALEERGFYGMTVTDVKGRGQQGGMQIQFRGRTMEVTLLPKVKLEIVVKDDAVEEVIGLIVNSAFTGSPGDGKIFIIPVEDVVRI-------------

General information: TITO was launched using: RESULT: Template: 3NCQ.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 : 265 -40620 -153.28 -548.92 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.48 3D Compatibility (PKB) : -153.28 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.48 QMean score : 0.401

(partial model without unconserved sides chains): PDB file : Tito_3NCQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3NCQ-query.scw PDB file : Tito_Scwrl_3NCQ.pdb: