Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKTTNGWINGFIGVLIFSGSLPATRLAVSDFDPLFLTVCRAAIAGVLAGGLLLIFRQQHPAKRDLISLLVVAFGVVIGFPLLTALALQHVTSAHAIVFIGLLPLATAVFGVLRGGERPRPVFWIFSAAGSLLVAGFALIQGGGSSPL--GDAYMLASIVVCGL-----GYAEGAKLSRRLGNWQVISWALVLSLPLMLPLSFFFTPDSWSAIGVPALLSLAYVSLFSMLIGFVFWYRGLAQGGIAAVGQLQLLQPFFGLLLASVILHEKVGWALVAVNIAVIMCVAAARRFAK 4JCD Chain:E ((193-259)) ----------------------------------------------------------------------------------------------------------TRYFGTLTGGENVPPVLHITNTATTVLLDEF------GVGPLCKGDNLYLSAVDVCGMFTNRSGYQQWRGLSR-------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4JCD.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 75 -4953 -66.03 -82.54 target 2D structure prediction score : 0.32 Monomeric hydrophicity matching model chain E : 0.45 3D Compatibility (PKB) : -66.03 2D Compatibility (Sec. Struct. Predict.) : 0.32 1D Compatibility (Hydrophobicity) : 0.45 QMean score : -0.109

(partial model without unconserved sides chains): PDB file : Tito_4JCD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4JCD-query.scw PDB file : Tito_Scwrl_4JCD.pdb: