Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGIRITGTGLFHPTEIISNEELADSLNAYVEQYNQENAEKIAAGELEELRGSSAEFIEKASGIKRRYVIEKSGILDPTRLRPRLSERSNDELSIQAEWGVIAAKQAMENAGVTAEDIDVVILACSNMQRAYPAVAIEIQSALGI-QGYAYDMNVACSAATFGLKQAADAIR-SGARRVLLVNVEITSGHLDYRNRDCHFIFGDVATASIIEETTTKTGFEILDIHLFTQFSNNIR-NNFGFLNRSEDAVVDDKLFRQDGRKVFKDVCPLVAKIINAQLEKMQLTANDIKRFWLHQANANMNELILKYVAGKDADLSRTPIILDEFANTSSAGVIIALHRTGHE--VDDGEYGVISSFGAGYSVGSIVVQKHVA 4WZU Chain:A ((8-319)) ----ITGWGKCLPPATLSNHDLSTFLD------------------------TSDEWIQSRTGIEQR----------------RISHVNTSDLA------TVAAQHAIACAGVSVEEIDLIIVATCSPDSLIPNIASRVQQNLGIPSAAAFDLNAACTGFLYGLETATRLMQASHYRHALVIGAERLSFYLDWTKRDTAVLFGDGAGAVVLSKTEQKVGLQDAQIGCDAQGRDILAVPKFGTAMDRFDADNGYWAFDFVGKEIFKRAVRGMGAAAQQVLARSGLSTEEIDVVIPHQANIRIIQTLCD-LAGIAQD--KAFVNIHRYGNTSAATVPIALCEALEQGKIKPHDDLLVAAFGAGLTWGA--------

General information: TITO was launched using: RESULT: Template: 4WZU.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 : 1863 -115312 -61.90 -375.61 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -61.90 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.548

(partial model without unconserved sides chains): PDB file : Tito_4WZU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WZU-query.scw PDB file : Tito_Scwrl_4WZU.pdb: