Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLVLNDLLICCRQLEHDRATERKKEVEKFKRLIRDPETIKHLDRHSDSKQGKYLNWDAVFRFLQKYIQKETECLRIAKPNVSASTQASRQKKMQEISSLVKYFIKCANRRAPRLKCQELLNYIMDTVKD---SSNGAIYGADCSNILLKDILSVRKYWCEISQQQWLELFSVYFRLYLK-PSQDVHRVLVARIIHA---VTKGCCSQTDGLNSKFLDFFSKAIQCARQEKSSSGLNHILAALTIFLKTLAVNFRIRVCELGDEILPTLLYIWTQHRLNDSLKEVIIELFQLQ---IYIHHPKGAKTQEKGAYESTKWRSILYNLYDLLVNEI----S---------HI-G--S----RGKYSSGFRNIAVKE-NLIELMADICHQVFNEDTRSLEISQSYTTTQRESSDYSVPCKRKKIELG-----WEVIKDHLQ-KSQNDFDLVPWLQIATQLISKYPASLPNCELSPLLMILSQLLPQQRHGERTPYVLRCLTEVALCQDKRSNLESSQKSDLLKLWNKIWCITFRGISSEQIQAENFGLLGAIIQGSLV------EVDREFWK-LFTGSACRPSCPAVCCLTLALTTSIVPGTVKMGIEQNMCEVNRSFSLKESIMKWLLFYQLEGDLENSTEVPPILHSNFPHLVLEKILVSLTMKNCKAAMNFFQSVPECEH-HQKDKEELSFSEVEELFLQTTFDKMDFLTIVRECGIEKHQSSIG-FSVHQNLKESLDRCLLGLSEQLLNNYSSEITNSETLVRCSRLLVGVLGCYCYMGVIAEEEAYKSELFQKAKSLMQCAGESITLFKNKTNEEFRIGSLRNMMQLCTRCLSNCTKKSPNKIASGFFLRLLTSKLMNDIADICKSLASFIKKPFDRGEVESMEDDTNGNLMEVEDQSSMNLFNDYPDSSVSDANEPGESQSTIGAINPLAEEYLSKQDLLFLDMLKFLCLCVTTAQTNTVSFRAADIRRKLLMLIDSSTLEPTKSLHLHMYLMLLKELPGEEY---PLPMEDVLELLKPLSNVCSLY--RRDQDVCKTI---LNHVLHVVKNLGQSNMDSENTRDAQGQFLTVIGAFWH-LTKERKYIFSVRMALVNCLKTLLE-ADPYSKWAILNVMGKDFPVNEVFTQFLADNHHQVRMLAAESINRLFQDTKGDSSRLLKALPLKLQQTAFENAYLKAQEGMREMSHSAENPETLDEIYNRKSVLLTLIAVVLSCSPICEKQALFALCKSVKENGLEPHLVKKVLEKVSETFGYRRLEDFMASHLDYLVLEWLNLQDTEYNLSSFPFILLNYTNIEDFYRSCYKVLIPHLVIRS-HFDEVKS-IANQIQEDWKSLLTDCFPKILVNILPYFAYEGTRDSGMAQQRETATKVYDMLKS---ENLLG--KQIDHLFISNLPEIVVELLMTLHEPA-NSSAS----QS-TDLCDFSGDLDPAPNPPHFPSHVIKATFAYISNCHKTKLKSILEILSKSPDSYQKILLAICEQAAETNNVYKKHRILKIYHLFVSLLLKDIKSGLGGAWAFVLRDVIYTLIHYINQRPSCIMDVSLRSFSLCCDLLSQVCQTAVTYCKDALEN----HLHVIVGTLIPLVYEQVE------VQKQVLDLLKYLVIDNKDNENLYITIKLLDPFPDHVVFKDLRITQQKIKYSRGPFSLLEEINHFLSVSVYDALPLTRLEGLKDLRRQLELHKDQMVDIMR---------ASQDNPQDGIMVKLVVNLLQLSKMAINHTGEKEVLEAVGSCLGEVGPIDFSTIAIQHSKDASYTKALKLFEDKELQWTFIMLTYLNNTLVE-DCVKVRSAAVTCLKNILATKTGH-S---FWEI-YKMTTDPMLAYLQPFRTSRKKFLEVPRFDKENPFEGLDDINLWIPLSENHDIWIKTLTCAFLDSGGTKCEILQLLKPMCEVKTDFCQTVLPYLIHDILLQDTNESWRNLLSTHVQGFFTSCLRHFSQTSRSTTPANLDSESEHFFRCCLDKKSQRTMLAVVDYMRRQKRPSSGTIFNDAFWLDLNYLEVAKVAQSCAAHFTALLYAEIYADKKSMDDQEKRSLAFEEGSQSTTISSLSEKSKEETGISLQDLLLEIYRSIGEPDSLYGCGGGKMLQPITRLRTYEH-EAMWGKALVT----YDLETAIPSSTRQAGIIQALQNLGLCHILSVYLKGLDYENKDWCPELEELHYQAAWRNMQWDHCTSVSKEVEGTSYHESLYNALQSLRDREFSTFYESLKYARVKEVEEMCKRSLESVYSLYPTLSRLQAIGELESIGELFSRSVT-HRQLSEVYIKWQKHSQLLKDSDFSFQEPIMALRTVILEILMEKEMDNS--QRECIKDILTKHLVELSILARTFKNTQLPERAIFQIKQYNSVSC-----------GVSEWQLEEAQVFWAKKEQSLALSILKQMIKKLDASCAA------NNPSLKLTYTECLRVCGNWLAETCLENPAVIMQTYLEKAVEVAGNYDGESSDELRNGKMKAFLSLARFSDTQYQRIENYMKSSEFENKQALLKRAKEEVGLLREHKIQT-NRYTVKVQRELELDELALRALKEDRKRFLCKAVENYINCLLSGEEHDMW-VFRLCSLWLENSGVSEVNGMMKRDGMKIPTYKFLPLMYQLAARMGTKMMGGLGFHEVLNNLISRISMDHPHHTLFIILALANANRDEFLTKPEVARRSRITKNVPKQSSQLDEDRTEAANRIICTIRSR-----RPQMVRSVEALCDAYIILANLDATQWKTQRKGINIPA-DQPITKLKNLEDVVVPTMEIKVD--HTGEYGNLVTIQSFKAEFRLA-GGVNLPKIIDCVGSDGKERRQLVKG-RDDLRQDAVMQQVFQMCNTLLQRNTETRKRKLTICTYKVVPLSQRSGVLEWCTGTVPIGEFLVNNEDGAHKRYRPNDFSAFQCQKKMMEVQKKSFEEKYEVFMDVCQNFQPVFRYFCMEKFLDPAIWFEKRLAYTRSVATSSIVGYILGLGDRHVQNILINEQSAELVHIDLGVAFEQGKILPTPETVPFRLTRDIVDGMGITGVEGVFRRCCEKTMEVMRNSQETLLTIVEVLLYDPLFDWTMNPLKALYLQQRPEDETELHPTLNADDQECKRNLSDIDQSFNKVAERVLMRLQEKLKGVEEGTVLSVGGQVNLLIQQAIDPKNLSRLFPGWKAWV 6JXC Chain:A ((6-2787)) -------IVETLNFLSSTKIKERNNALDELTTIL------------------PTKALSTTA---VELLASEHTKYCDLLR------LSLSENRLSTISYVLRLFVEKSCER-------LLLAVVPELMVKDGSK-----------------------------------LVDKICEYFQSQMKLSMV----TNFISILLNLLALDTVGIFQVTRTITWTVIDFLRLSK------NTRLIMSLINQLILKCHCFSVIDTLMLIKEAWSYNLTIGCTSN--ELVQDQLSLFDVMSSELMNHKLPYMIGQENYVE-------------YREYILLRLSNYKPQLFTVNHVEFSYIRGSRDKNSWFA----------WLKILGITKSLLTYFALNRKNE--------------NYSLLFKRRKCDSDIPSIL--TFLIHLLEENS-----------------------------SFAEQLKELLF------------------------------------NGDMARLFKVCLP----------SCLLLANSIK----SDEKTINQIYDLYELS---------NESFMLWGYLQY----------------------ISSADRIFEWLKSKWN------------------QFCNFISWLGN--------------WDESHKIWQHF-------QEQ-RE--------------------------LDLTRYNEILYRLLENI------------------------NLCGDSTFSE----------FIAAYKRTTLIT---------------------------------------IRT---I-NVDHLVLDKIN---MKEIVNDFIRMQKNKS------QTG----------------------------------------------------------STIDKAVRAYL--------------------------------------------------LKQAIGEKSSYNKILEEFTEVLGEKLLCNHYSSSNQAMLLLTSYIEA----------------------SDCNDILDWIISRFEDNSFTGVAPTVNLSMLLLSLLQNHDLSHGS----IRGGKQRVFATFIKCLQKLDSSNIINIMNSISSYMAQVSYK---------------NQSIIFYEIKSLF-G--PPQ-------QSIEKSAFYSLAMSMLSLVSYPSLVFSLEDMMTYSG-FNHTRAFIQQALNKITVAFRYQNLTELFEYCKFDLIMYWF----------------------HEFLGRYFVEISAIYFSQGFNQKWILDMLHAITGNGDAYLVDNSYYLCIPLAFISGGVNE----L----------IFDILPQISGKTTVKYHKKYRLLMLKWI--IRFTDLGSLTELRSTVEKLFPTSYLSPYLFENSSVSM-RYQYPLHIPLALGATL--VQTQF--A-HEK-----NNTHEFKLLFLSVITDLEKTSTYIGKLRCARELKYLFVLYENVLVK------SSTLNFIIIRLSKFLIDT-------------QIHDEVITIFSSLLNLADKNTFEIEPSLPNLFCKIFIY-LRENKQLSPSFQQAIKLLEHRDLIK----------IKTWKYCLD---AIFGNIVQD------------DIYENTELLD-AS-DCGVD---------DVVL------VSLLFSYARRPVASKIGCSLSKAAAINILKHHVPKEY-L----S--KNFKLWFAALSRRILQQE----------HLKNFEMVFRHPEQPHMIYQRISTF-NKEAELYDSTEVFFISECILTYLVGYSIGNSESEFCFRDNIMN--EN-KDKVAPLDKDVLNAIY-PLAN-NFGMESFIC-DTYLSVNEPYNCWLSKFARSLIHQISFNIPPIVCLYPLCKGSTAFCELVLTDLFFLSTTYDP-KSCLNWSNRIFTQIAMLLH------------------------VKDSEIKLKMLFNVIKMIRMGSRCKERNCL--RIYSSLDLQEICQISLKIKEFKFGYLLFEEMNMPNIRE-------------------------------MNINTLQKIYECINDGDFLAGLPVPHSI--EGVLNSINRIDSDTWKRFLFNNADFDANYTTSLEEEKESLIKATEDSGFYGLTSLL-ESR--L-S----G-SSDVYKWNLELGDWKLLTPKVV----DSKAKGLYYAIKNLPQDV-GFAEKSLEKSLLTIFDSRQ-----HFISQTEWMDTLNAIIEFIKIAAIPQDVTSFPQTLMSIM-KADK--ERLNTIDFYDHKTTLKSRHTLMNVLSRNSLDENVKCSKYLRLGSIIQLANYVQLAIANGAPQDALRNATLMSKTVKNIAKLYDDPSVVSQIEKLASFTSANALWESREYKAPVMIMRDLLAQNEKNISESILYDDFKLLINVPMDQIKARLVKWSSESRLEPAAAIYEKIIVNWDINV---------EDHESCSDVFYTLGSFLDEQAQKLR---SNGEIEDREHRSYTGKSTLKALELIYK--AKRHYNRVLLQYNRDSEVLKALLLQKEKFLWHALHFYLNTLVFSNRYDNDIIDKFCGLWFENDDNSKINQLLYKEIGTIPSWKFLPWVNQIASKISMEE---NEFQKPLQLTMKRLLYKLPYDSLYSVMSILLYEKQSNK-------------------DTNISQKIQAVKKILLELQGYDRGAFAKKYLLPVQEFCEMSVELANLKFVQNTKTLRLANLKIGQYWLKQLNM-EKLPLPTSNFTVKSSADGRKA-RPYIVSVNETVGITTTGLSLPKIVTFNISDGTTQKALMKGSNDDLRQDAIMEQVFQQVNKVLQNDKVLRNLDLGIRTYKVVPLGPKAGIIEFVANSTSLHQILSK----LHTN---DKITFDQARKGMKAVQTKSNEERLKAYLKITNEIKPQLRNFFFDSFPDPLDWFEAKKTYTKGVAASSIVGYILGLGDRHLNNILLDCSTGEPIHIDLGIAFDQGKLLPIPELVPFRLTRDIVDGFGVTGVDGLFRRSCERVYAVLRKDYVKVMCVLNILKWDPLYSWVMSPVKKYEHLFE---------------------------NENQESYRALKGVEEKLMG----NGLSVESSVQDLIQQATDPSNLSVIYMGWSPFY

General information: TITO was launched using: RESULT: Template: 6JXC.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 : 9865 -90606 -9.18 -40.92 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -9.18 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.156

(partial model without unconserved sides chains): PDB file : Tito_6JXC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-6jxc-query.scw PDB file : Tito_Scwrl_6JXC.pdb: