Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEKLVKANLRRKEQAFIDVVSPLLQDVGINPSLVQGIDVKVGRNQS--AVLEVDG-NQQYFVKLIQGSDG-VARFRRSKDFENWVINKSIKFATPKLLAFSKDQRALMFEFARCDTNLGEMLGDKFIDSVTAMKVAVAIGSLHTSTVSISDNIES---------DLPVL-PPQF-P-GLISL--DYFENATIGERNLWRILQNDAELLEALDL----LVDSRINFVPIHGDFRPDQVFFRA--DEVVLLDFEEFRLGDPARDLGSFIGDLFYHKMSWIAVGAQGTDGRLTHESLLERGVDLLGQVRPIIQSFWEKYCIFCCGAQSETWKMTQPNLANRVTGYAGWHLFDRSLARSALSGRLTANDRALNGIGRNLIINSGMFAQELGLGE 2QG7 Chain:E ((111-420)) ----------------------------------LEFQIING-ITNILIKVKDMSKQAKYLIRLYGPKTDEIINREREKKISCIL--YNKNIA-KKIYVFFTN--GRIEEFMDG-YALSRED---IKNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYFHLLNEERKKICSF-DAKANILK-LIDFDVLRDSIVEVESLCKRENSPIVLCHCDLLSSNIINTVGGDSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDL-----------------------TPSKEEEYHFIMHYLGTDDEE-------LINQLIREIQPFYICSHI------------------------------------------

General information: TITO was launched using: RESULT: Template: 2QG7.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 : 977 -22842 -23.38 -92.10 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain E : 0.60 3D Compatibility (PKB) : -23.38 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.192

(partial model without unconserved sides chains): PDB file : Tito_2QG7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2qg7-query.scw PDB file : Tito_Scwrl_2QG7.pdb: