Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRFAKDAELLQYMVPGSTLADIVSSEEDADDYDAYFDAPAAKAEGVSGVVPGEGSAGTGTNAQGVATSLSKFQPAQHKNADAKVLGRIHIDDYYDGHGSGGGASGGAQSNQRVLNELRDMTMSSRFAQNAASKNVDRSERATVENVLDPRTRLILYKLVN-SGILSEINGCVSTGKEANVYYAVSG-DGSPAALKVYKTSILSFKD-RDQYVSGEFRFQRYCKSNPRKMVRTWAEKEARNLIRLQDG-GV----LAPAVK---------LLRQHVLIMEFLGEDGWPAPRLKE--------VTFPSAKALDKCYLDLCCTMRKMYARSHLIHGDLSEYNLLLYR-GRVVVIDVSQSVEYDHPRS-----MSF-----LR---RDIVNVNSFFRSRGLTGLFTLQDLFHFITADPAKSGWQRCQGPPNDEELMARLKEIRDDYGEGGAVPVDAEQAKVDEQVFLNITVPRSLNEICDRAGPNKEVAVFVEGMTAAPAAAQTEDHSGADGEGDGDGDDEDSEADDADSPMKAKAAPQAVLANMTKEERKEHRKAVKEANREKRAEKKKNNANRKKKGRK 4LV5 Chain:A ((35-295)) ----------------------------------------------------------------------------------------------------------------------------------------AMVEAVTATVWPQNAETTVDSLLSQGERKLKLVEPLRVGDRSVVFLVRDVERLEDFALKVFTMGAENSRSELERLHEATFAAA-----------------------RLLLPSDAVAVQSQPPFAQLSPGQDDYAVANYLLLMPAAS--VDLELLFSTLDFVYVFRGDEGILA-LHILTAQLIRLAANL-QSKGLVHGHFTPDNLFIMPDGRLMLGDVSALWKVGTRGPASSVPVTYAPREFLNASTATFTHALNAWQ-LGLS-------IYRVWCLFLPFGL---------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4LV5.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 : 922 -33154 -35.96 -159.39 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -35.96 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.207

(partial model without unconserved sides chains): PDB file : Tito_4LV5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LV5-query.scw PDB file : Tito_Scwrl_4LV5.pdb: