Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MALFLQRSNQHSNNNRLKRMKSHLRVHYFQHIAGEGFGSCYSFLKAHHATITATEFFALPVDLPLEIEALPYIEDVDLLLIMGGTMSVNDEANYPWLKIEKRWIRRYLAAGKPAIGLCLGGQLIANALGAAVSRNRYQELGWSTVQRVPNLPKESFL--LPEKINVMQWHSETF-EIPKGAIHLAENSVCRNQMYQIG-SNVLGFQFHPEMTPKVLNLLLENEQELSIFKGEYVQSLDELHHCDIQKFEQGNQLLNRAIEFVVNQ 2A9V Chain:B ((13-184)) ----------------------MLKIYVVDNGG-QWTHREWRVLRELG--VDTKIV--PND---I---DSSELDGLDGLVLSGGAPNID--EELDKL---GSVGKYIDDHNYPILGICVGAQFIALHFGASVVKAKHPEFGKTKVSVMHS---ENIFGGLPSEITVWENHNDEIINLPDDFTLAASSATCQVQGFYHKTRPIYATQFHPEVEH----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2A9V.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 893 -61892 -69.31 -368.40 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : -69.31 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.329

(partial model without unconserved sides chains): PDB file : Tito_2A9V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2A9V-query.scw PDB file : Tito_Scwrl_2A9V.pdb: