Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLVLNDLLICCRQLEHDRATERKKEVEKFKRLIRDPETIKHLDRHSDSKQGKYLNWDAVFRFLQKYIQKETECLRIAKPNVSASTQASRQKKMQEISSLVKYFIKCANRRAPRLKCQELLNYIMDTVKDSSNGAIYGADCSNILLKDILSVRKYWCEISQQQWLELFSVYFRLYLKPSQDVHRVLVARIIHAVTKGCCSQTDGLNSKFLDFFSKAIQCARQEKSSSGLNHILAALTIFLKTLAVNFRIRVCELGDEILPTLLYIWTQHRLNDSLKEVIIELFQLQIYIHHPKGAKTQEKGAYESTKWRSILYNLYDLLVNEISHIGSRGKYSSGFRNIAVKENLIELMADICHQVFNEDTRSLEISQSYTTTQRESSDYSVPCKRKKIELGWEVIKDHLQKSQNDFDLVPWLQIATQLISKYPASLPNCELSPLLMILSQLLPQQRHGERTPYVLRCLTEVALCQDKRSNLESSQKSDLLKLWNKIWCITFRGISSEQIQAENFGLLGAIIQGSLVEVDREFWKLFTGSACRPSCPAVCCLTLALTTSIVPGTVKMGIEQNMCEVNRSFSLKESIMKWLLFYQLEGDLENSTEVPPILHSNFPHLVLEKILVSLTMKNCKAAMNFFQSVPECEHHQKDKEELSFSEVEELFLQTTFDKMDFLTIVRECGIEKHQSSIGFSVHQNLKESLDRCLLGLSEQLLNNYSSEITNSETLVRCSRLLVGVLGCYCYMGVIAEEEAYKSELFQKAKSLMQCAGESITLFKNKTNEEFRIGSLRNMMQLCTRCLSNCTKKSPNKIASGFFLRLLTSKLMNDIADICKSLASFIKKPFDRGEVESMEDDTNGNLMEVEDQSSMNLFNDYPDSSVSDANEPGESQSTIGAINPLAEEYLSKQDLLFLDMLKFLCLCVTTAQTNTVSFRAADIRRKLLMLIDSSTLEPTKSLHLHMYLMLLKELPGEEYPLPMEDVLELLKPLSNVCSLYRRDQDVCKTILNHVLHVVKNLGQSNMDSENTRDAQGQFLTVIGAFWHLTKERKYIFSVRMALVNCLKTLLEA-DPYSKWAILNVMGKDFPVNEVFTQFLADNHHQVRMLAAESINRLFQDTKGDSSRLLKALPLKLQQTAFENAYLKAQEGMREMSHSAENPETLDEIYNRKSVLLTLIAVVLSCSPICE-KQALFALCKSVKE-NGLEPHLVKKVLEKVSETFGYRRLEDFMASHLDYLVLEWLNLQ-DTEYNLSSFPFILLNYTNIEDFYRSCYKVLIPHLVIRSHFDEVKSIANQIQEDWK--------SLLTDCFPKILVNILPYFAYEGTRDSGMAQQRETATKVYDMLKSENLLGKQIDHLFISNLPEIVVELLMTLHEPA--NSSASQSTDLCDFSGDLDPAPNP--PHFP-----SHVIKATFAYISNCHKTKLKSILEILSKSPDSYQKILLAICEQAAET---NNVYKKHRILKIYHLFVSLLLKDIKSGLGGAWAFVLRDVIYTLIHYINQRPSCIMDVSLRSFSLCCDLLSQVCQTAVTYCKDALENHLHVIVGTLIPLVYEQV-EVQKQVLDLLKYLVIDNKDNENLYI--TIKLLDPFPDHVVFKDL------RITQQKIKYSRGPFSLLEEINHFLSVSVYDALPLTRLEGLKDLRRQLELHKDQMVDIMRASQDNPQDGIMVKLVVNLLQLSKMAINHTGEKEVLEAVGSCLGEVGPIDFSTIAIQHSKDASYTKALKLFE--DKELQWTFIMLTY-L-NNTLVEDCVKVRSAAVTCLKNILATKT----------------GHSFWEIYKMTTDPMLAYLQPFRTSRKKFLEVPRFDKENPFEGLDDINLWIPLSENHDIWIKTLTCAFLDSGGTKCEILQLLKPMCEVKTDFCQTVLPYLIHDILLQDTNE---SWRNLLSTHVQGFFTSCLRHFSQTSRSTTPANLDSESEHFFRCCLDKKSQRTMLAVVDYMRRQKRPSS-------G-----TIFNDAFWLD-------LNYLEVAKVAQSCAAHFTALLYAEIYADKKSMDDQEKRSLAFEEGSQSTTISSLSEKSKEETGISLQDLLLEIYRSIGEPDSLYGCGGGKM-LQPITRLRTYEHEAMWGKALVTYDLETAIPS-STRQAGIIQALQNLGLCHILSVYLKGLDYENKDWCPELEELHYQAAWRNMQWDHCTSVSKEV--------EGTSYHESLYNALQSLRDREFSTFYESLKYARVKEVEEMCKRSLES-VYSLYPTLSRLQAIGELESIGELFSRSVTHRQLSEVYIKWQKHSQLLKDSDFSFQEPIMALRTVILEILMEKEMDNSQRECIKDILTKHLVELSILARTFKNTQLPERAIFQIKQYNSVSCGVSEWQLEEAQVFWAKKEQSLALSILKQMIKKLDASCAANNPSLKLTYTECLRVCGNWLAETCLENPAVIMQTYLEKAVEVAGNYDGESSDELRNGKMKAFLSLARFSDTQYQRIENYMKSSEFENKQALLKRAKEEVGLLREHKIQTNRYTVKVQRELELDELALRALKEDRKRFLCKAVENYINCLLSGEEH-DMWVFRLCSLWLENSGV--------------SEVNGMMKRDGMKIPTYKFLPLMYQLAARMGTKMMGGLGFHEVLNNLISRISMDHPHHTLFIILALANANRDEFLTKPEVARRSRITKNVPKQSSQLDEDRTEAANRIICTIRS---RRPQMVRSVEALCDAYIILANLDATQWKTQRKGINIPADQ------PITKLKNLEDVVVPTMEIKVDHTGEY--GNLVTIQSFKAEFRLAGGVNLPKIIDCVGSDGKERRQLVKGRDDLRQDAVMQQVFQMCNTLLQRNTETRKRKLTICTYKVVPLSQRSGVLEWCTGTVPIGEFLVNNEDGAHKRYRPNDFSAFQCQKKMMEVQKKSFEEKYEVFMDVCQNFQPVFRYFCMEKFLDPAIWFEKRLAYTRSVATSSIVGYILGLGDRHVQNILINEQSAELVHIDLGVAFEQGKILPTPETVPFRLTRDIVDGMGITGVEGVFRRCCEKTMEVMRNSQETLLTIVEVLLYDPLFDWTMNPLKALYLQQRPEDETELHPTLNADDQECKRNLSDIDQSFNKVAERVLMRLQEKLKGVE--EGTVLSVGGQVNLLIQQAIDPKNLSRLFPGWKAWV 5X6O Chain:C ((535-2367)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FSESLLSGILFSLHRIFSHFQPPK---------QINKSFKLVQKCFMNSNRYLRLLSTRIIPLFNISDSHNS-----------EDEHTA----TLIKFL----QSQ-------KLPVVKENLVIAWTQLTLTTSNDVFDTLLLKLIDIFNSDDYSLRIMMTLQIKNMAKILKKTPY-QLLSPILPVLLRQLGKNLVERKVGFQNL-IELLGYS-SKTILDIFQRYIIPYAIIQYKSDVLSEIAKIMCDG-TSLINQMKVNLLKKNSRQIFAVALVKHGLFSL---------DILETLFLNR-A------YITAYLPD--Y-TLAEITKLYKNS-SDSENANMILCSLRFLITNFEKDKRHGSKYKNINWTDDQEQAFQKKLQDN-------ILGIFQ-----------VFSSDIHDVEGRTTYYEKLRVINGISFLIIYAPKKS-------IISALAQISICLQTGLGL---------KEVRYEAFRCWHLLVRHL---NDEELSTVIDSLIAFILQKWSEFNGKLRNIVYSILDTLIKEKSD--LILKLKPYTTLA-LVGKPELGILARDGQFARMVNKIR---S---TTDLIPIFANNLK-SSNKYVINQNLDDIEVYLRRKQTERSIDF----------DITLVLGALLDTSHKFR--NLDKDLCEKCAKCISMIGVLDVTKHEFKRTTYSE--NEVYDLNDSVQTIKFLIWVINDILVPAFWQSENPSKQLFVALVIQESLKYCGLSSESWDMNHKELYPNEAKLWEKFN---SVSKTTIYPLLSSLYLAQSWKE----Y--VPLKY-PSNNF--EGYKIWVKRFTLDLLKTGTTENHPLHVFSSLIR--GSLSNFLLPYISLDIIIKA---PYADILNGIIIEFDSIFTCNLEGM-----------------NNLQVDSLRMCYESIFRVFEYCKKWATEFKQNYSKLHGTFIIKDTKTTNMLLRIDEFLRTTPSDLLAQRSLETDSFERSALYLEQCYRQNPHDK-------------------------N-QNGQLLKNLQITYEEIGDIDSLDGVLRTFATGNLVSKIEELQYSENWKLAQDCFNVLGKF--DPKTTTRMLKSMYDHQLYSQIISNSSF--------VKEWYSIGLEAANLEGNVQTLKNWVEQIESLRNIDDREVLLQYNIAKALIAISNEDPLRTQKYIHNSFRLIGTNFITSSKETTLLKKQNLLMKLHSLYDLSFLSSAKDK----FEYKSNTTILDYRMERI-GADFVPNHYILSMRKSFDQLKMNE--------QADADLGKTFFTLAQLARNNARLDIASESLMHCLERRLP-----QAELEFAEILWKQGENDRALKIVQEIHEKYQENS----SVNARDRAAVLLKFTEWLDLSNNSASEQIIKQYQD-IFQI------------DSKWDKPYYSIGLYYSRLLERK----------------------------------------------------------GRFEYRAISYFLLAFEKNTAKVRENLPKVITFWLDIAAASISENRKEMLSKATEDICSHVEEALQH-PTYIWYFVLTQLLSRLL---------AQIIMHILLSLAVEYPSHILWYITALVNSN---------------------------SSKRVL---HILEKYRQHSQNPHDLVSSAL-----LTRVCLQDVKSITSR-SGKSLE---NVAPSAMVVPVRKNLDIISPLESN---S----PFRPVVSIIRFGSSYKVFSSLKKPKQLNIIGSDGNIYGIMCK-KEDVRQDNQYMQFATTMDFLLSKDIASRKRSLGINIYSVLSLREDCGILEMVPNVVTLRSILST----KYESLK---IKY-SLKSLHDRWQHTAVDGKLEFYMEQVDKFPPILYQWFLENFPDPINWFNARNTYARSYAVMAMVGHILGLGDRHCENILLDIQTGKVLHVDFDCLFEKGK---------FRLTPNLLDALGIIGTEGTFKKSSEVTLALMRKNEVALMNVIETIMYDRNMDHSI--------------------------------------------QKALKVLRNKIRGIDPQDGLVLSVAGQTETLIQEATSEDNLSKMYIGWLPF-

General information: TITO was launched using: RESULT: Template: 5X6O.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 6849 -54388 -7.94 -33.55 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain C : 0.62 3D Compatibility (PKB) : -7.94 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.177

(partial model without unconserved sides chains): PDB file : Tito_5X6O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5x6o-query.scw PDB file : Tito_Scwrl_5X6O.pdb: