Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIDVIISTSRNPRHARSKPAFPVVYSTL-SPQALVEQVLSNYSIE-----PITNCLLWNRG-LSDVYLVETEQ----------EYYVLRVSHHHWRSRLDIEFELELLDFLYQNSLPVAYPLRTRADDLFVTVEALEGDRYAALFPYAKGTVPLG--DLTIAQSEIFGRSLAKLHQIGTKFRPSHHSLILEKLTNKTLSLEYLLDHSLTTIAPFLE--ERPEDLKYLRDNITQIKAELKIL---PRQSPLWTACWGDPHSGNIHFTEDNQITLFDFDQCGYGWRAFDIAKFLQVSLRA---------------GMNRKIRDAFFEGYQTVQKLTSEEEDCLQALTQTAHIWAWAININASVIHCWSRLDYRYFSKRLETLKRLNSPDWQLF 3C5I Chain:D ((11-293)) ---------------------------LTDPLYIKKICLEKVPEWNHFTEDNLRVKQIL--LTNQLFEVGLKEETANNYNSIRTRVLFRIYGKHVDELYNTISEFEVYKTMSKYKI-APQLLNTF--------------NGGRIEEWLYGDPLRIDDLKNPTILIGIANVLGKFHTLSRKRHLPEHWD-------RTPCIFKMMEKWKNQLFKYKNIEKYNCDIHKYIKESDKFIKFMKVYSKSDNLANTIVFCHNDLQENNIINTN-KCLRLIDFEYSGFNFLATDIANFFIETSIDYSVSSYPFFEIDKKKYISYENRKLFITAYLSNY------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3C5I.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 916 -196 -0.21 -0.81 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain D : 0.60 3D Compatibility (PKB) : -0.21 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.298

(partial model without unconserved sides chains): PDB file : Tito_3C5I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3c5i-query.scw PDB file : Tito_Scwrl_3C5I.pdb: