Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDPSVMVGQYTLGKQIGSGNFSKVRLGTDP-QGRTWAIKIVDKRRLKKENMEDQMLREVAIMRSLRQQNVVKLQEVLQSSNHYYLVLELVTGGELFDKIVAA-KRFDEPTARRYFHQLIAGMYYCHSKGFAHRDLKPENLLL--DANGTLKISDFGLSNLQQDV-LLQTICGTPNYVAPEVLMERGYNGLSADIWSCGVVLYVMLAGRLPFEDRNMNVLLGKIERGDY----QMIRHISDPAKDLVARMLTVDPRKRISMEDVINHPWFQIDWNPRLLST 2X4F Chain:A ((89-352)) -------YTVSKTEILG-----QVHKCEETATGLKLAAKIIKTRGMK---DKEEVKNEISVMNQLDHANLIQLYDAFESKNDIVLVMEYVDGGELFDRIIDESYNLTELDTILFMKQICEGIRHMHQMYILHLDLKPENILCVNRDAKQIKIIDFGLARRYKPREKLKVNFGTPEFLAPEVVNYDFV-SFPTDMWSVGVIAYMLLSGLSPFLGDNDAETLNNILACRWDLEDEEFQDISEEAKEFISKLLIKEKSWRISASEALKHPWLSDHKLH-----

General information: TITO was launched using: RESULT: Template: 2X4F.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 : 1205 -6702 -5.56 -26.81 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -5.56 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.427

(partial model without unconserved sides chains): PDB file : Tito_2X4F.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2X4F-query.scw PDB file : Tito_Scwrl_2X4F.pdb: