Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREPDFLNHFLKKGYFKKHAKAVLALSGGLDSMFLFKVLSTYQKELEIELILAHVNHKQRIESDWEEKEL-------RKLAAEAELPIYISNFSG------E-----FSEARARNFRYDFFQEVMKKTGATALVTAHHADDQVETIFMRLIRGTRLRYLSGIKEKQVVGEIEIIRPFLHFQKKDF------PSIFHF-----EDTSNQENHYFRNRIRN---SYLPELEKENPRFRDAILGIGNEILDYDLAIAELSNNINVEDLQQLFSYSESTQRVLLQTYLNRFPDLNLTKAQFAEVQQILKFKSQYRHPIKNGYELIKEYQQFQICKISPQADEKEDELVLHYQNQVAYQGYLFSFGLPLEGELIQQIPVSRETSIHIRHRKTGDVLIKNGHRKKLRRLFIDLKIPMEKRNSALIIEQFGEIVSILGIATNNLSKKTKNDIMNTVLYIEKIDR 4KR6 Chain:B ((171-383)) ---------------VGTGGKAVLLLSGGIDSPVAGWYALKR----GVLIESVTFVSPPFTS-EGAVEKVRDILRVLREFSGGHPLRLHIVNLTKLQLEVKKRVPDKYSLIMYRRSMFRIAEKIAEETGAVAFYTGENIGQVASQTLENLWSIES---------V---TTRPVIRPLSGFDKTEIVEKAKEIGTYEISIKPYQDSCVF--FAPKNPATRSHPSILEKLEQQVPDLPVLEEEAFTSRK------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4KR6.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 : 932 -21814 -23.41 -120.52 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : -23.41 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_4KR6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KR6-query.scw PDB file : Tito_Scwrl_4KR6.pdb: