Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------------------------------------------------------------------------------------------------------------------------------MLKINDFPHDNN--------FWKVEWIGGVYNDIDGEPRIRIY---LAQIKSNI---ERQKTLYNS---SLEVRNQQNISSVHDVKIG----LIQFIPIGSVWKNGILDQSFTA--QYEQFNFNSDTPSEVCFQSQYGGIAETGLNNTTEWNNHLNDFHYRIVNSEARALGNYINVFYDYNGLSRIYIPSIVILQACYITSPKSARHIIFGQINKLLDPETSGFIDKETFRIHLHRDYKDIEA------PMIANLATNFNAKMGLRT-LRQSLVKESNITSISTPKRLKISFPFSNDFSI---KVKGKYIMENNKIYG----FFVTQIIEFSTKFDF-TKLVIFRKNSNQKGKEKAENLQNAYEGCNAVRPSHSESLDDKDESQPLIFTHDQ-----VSNQNLPQSIDFPLCSNISNLEVLKE-----------DKDIQYY---QNASYTNLNLRPSNTTSTGPAISSNNGVSELQIEPSLPVDL-----EYFF---------DVLEILNKLGYQFKSIAVNNSRDHPRGIINQFNRFIKNLHKW--HLQDDDQTPRPFIVAEM-IYKGAFYYLLDIA------PRKGAALSAQLIRAYTGEQITPTAFAILLNDVARTSP-----KGWSVLDHAKYSQKWQHFRIEHNRNNKP----ELVAKNIIKKLG---------------------------------------------- 4ZUZ Chain:A ((8-864)) DVIKFKEPERCDYLYVDENNKVHILLPIVGGDEIGLDNTCQTAVELITFFYGSAHSGVTKYSAEHQLSEYKRQLEEDIKAINSQKKISPHAYDDLLKEKIERLQQIEKYIELIQVLKKQYDEQNDIRQLRTGGIPQLPSGVKEIIKSSENAFAVRLSPYDNDKFTRFDDPLFNVKRNISKYDTPSRQAPIPIYEGLGYRLRSTLFPEDKTPTPINKKSLRDKVKSTVLSHYKDEDRIDGEKKDEKLNELITNLQNELVKELVKSDPQYSKLSLSKD-PRGKEINYDYLVNSLMLVDNDSEIGDWIDTILDATVDSTVWAVQASSPFYQGAKEISSDRDADKISIRVQYLL----AEANIYCKTNKLSDANFGEFFDKEPHATEIAKRVKEGFTQGADIEPIIYDYINSNHAELGLKSPLTGKQQQEITDKFTKHYNTIKES-PHFDEFFVADPDKKGNIFSHQGRISCHFLDFFTRQTKGKHPLGDLASHQEALQEGTSNRLHHKNEVVAQGYEKLDQFKKEVVKLLAENKPKELLDYLVATSPTGVPNYSMLSKETQNYIAYNRNWPAIQKELEKATSIPESQKQDLSRLLSRDNLQHDNLSAITWSKYSSKPLLDVELNKIAEGLELTAKIYNEKRGREWWFAGSRNEARKTQCEELQRVSKEINTLLQSESLTKSQ-VLEKVLNSIETLDKIDRDISAESNWFQSTLQKEVRLFRDQLKDICQLDKYYFKSTKLDEIISLEMEEQFQ--KIQDPAVQQIVRDLPSHCHNDEAIEFFKTLNPEEAAKVASYLSLEYREINKSTDKKTLLEQDIPRLFKEVNTQLLSKLKEEKAIDEQVHEKLSQLADKIAPEHFTRNNIIKWST

General information: TITO was launched using: RESULT: Template: 4ZUZ.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 : 2628 155580 59.20 271.99 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 59.20 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.147

(partial model without unconserved sides chains): PDB file : Tito_4ZUZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ZUZ-query.scw PDB file : Tito_Scwrl_4ZUZ.pdb: