Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------MYKMTRRSTMLETYLEKSIFRQVYICEQ--LHEK-----------GTIQI--------REIAD----QLNVCPLTVTNDLECITDILHQQIISVEKSRSSFTVAFDSSFSRLALTQLIYQRSDFFN------------VLGHYLSGEHNWSNIAD------------TTF-----ISLSKVYNLRNELINFFKQMQYLNADGHFEIPEKDYRSLLLTIIYETNRT---ELIQLNKSIIQSGQQLIDYVE--------KHFFS--RSYPTVEKQFILLGIAIGLQRSKTNPIYFSQEEKRVARHTPLFQLIQKGLEQLSFSLCHDEDECLYIYFLFNSRNYLCDNFELLQKDLNVVYQNHVADNPLVIEL--SQKLILSLNISEENQILFDKALLPFIRSLWADIQIFQPDKTYLLNEEQRALYLEVHEILEQWRK-------QNNLFLRWNENSIRKLTISLSLLNEHKRKSPIEV--FIVAPSDFRYLYYRQQLEDILGEHFSISNIICKQLREIVDDTFFCTQRIILCD-----SSLYQEGLGSEKTIIYPITFQTIHTVIDQLNKQI---------------------------------------------- 4NFU Chain:A ((15-633)) AFEALTGINGDLITRSWSASKQAYLTERYHKEEAGAVVIFAFQPSFSEKDFFDPDNKSSFGEIKLNRVQFPCMRKIGKGDVATVNEAFLKNLEAVIDPRTSFQASVEMAVRSRKQIVFTGHSSGGATAILATVWYLEKYFIRNPNVYLEPRCVTFGAPLVGDSIFSHALGREKWSRFFVNFVTRFDIVPRITLARKASVEETLPHVLAQLDPRNSSVQE--SEQRITEFYTSVMRDTSTVANQAVCELTGSAEAILETLSSFLELSPYRPAGTFVFSTEKRLVAVNNSDAILQMLFYTCQASDEQEWSLIPFRSIRDHHSYEELVQS-MGMKLFNHLDGENS---IESSLNDLG-VSTRGRQYVQAALEEEKKRVENQKKIIQVIQQERFLKKLAWIEDE---YKPKCQAHKNGYYDSFKVSNEENDFKANVKRAELAGVFDEVLGLLKKCQLPDEFEGDIDWIKLATRYRRLVEPLDIANYHRHLKNEDTGPYMKRGRPTRYIYAQRGYEHHILKPNGM--IAEDVFWNKVNGLNLGLQLEEIQETLKNSGSECGSCFWAEVEELKGKPYEEVEVRVKTLEGMLREWITAGEVDEKEIFLEGSTFRKWWITLPKNHKSHSPLRDYMMDEI

General information: TITO was launched using: RESULT: Template: 4NFU.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 : 2458 72123 29.34 151.84 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 29.34 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.197

(partial model without unconserved sides chains): PDB file : Tito_4NFU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NFU-query.scw PDB file : Tito_Scwrl_4NFU.pdb: