Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MQSLAEVSAPDAASVATAEELATLKQRMDEALALLKRAKLGGSERRNLYELPWYVIIGPPGSGKTTALMNSGLDFPLAAQMGAGAIRGVGGTRNCDWWFTDEAVLLDTAGRYTTQDSHAQVDKAAWLGFLDLLKTQRKRRPIDGAFIAISLSDLLLGSDAERAAHAQAIRARI---QELYQQLGVRFPIYVMLTK--FDLVPGFMEFFDSLNREERAQVWGMTFALDDGKSAEGPLAVFDSEFALLEQRLTARLVERLQQERDPARRDLVYGFPQQFAALRECLGEFLNGVFKPNPYEERPLLRGLYFTSGTQEGSPIDRLIGSMAQSMNLDRQHLARQTGTGRSYFIERLFREVAFGERGLVGTNPKVERRRKWLTIGALSATALVVLAVTAVWIASYRANQSYI---AAVDQRVDPLARGIESLSPAQRDVLAVLPQLNAVQNLAGDAPSWAEGYGLYQGDMLGEESASVYRKL------LIAVFAPRLVTRIEEQLRSGGSSDFLYEGLKAYLMLGSPDHYDADFI------KAWISLDWERNLPRDLSP---EQRQALHAHLDALLERRPPSARLD--QDLVEDLRRQLQQLPVAQRVYDRVKRQRLPKDVPDFRISDAAGRDAPLVFARKSGKPLTDPLSGFFTYRGYREVFLTASLSQAGTIAEEQWVLGRDLNDAGDAANLALDVRRLYFQDYLRQWDDLLADLTVVPITNVTQAADVLRILSGP--TSPFRKLLEAVA-----RETDLQKGDRLVAAQVKKAADGTVDKLKQRLGSLVGQEEEGAREQPRQVDSDPISAHFAELNSLV-SKGEGGNEPAPIDS---LLEDMNALYVQVSAMAGASGDSLLGDAKNQVAAAASRVALS-AERQPPVVQGLVKNVVNSTTSSMMGSVRNQLNAAWISDVVSVYRQSLAGRYPIAAGSSRD--ATLEDFGHFFGAGGV-MDSYFRQYLQPYVDTSASTWRWQPGAAQKLGINPGVLHTFQRAAAIRDAFFRSGGMQPTVRFELKPVTMDAAISQFILDLDGQQLTYDHGPSRPVAMQWPSANGLGVVRLTVTPPPSSGRSGLTLEGPWAWFRLLDQSDLERGNSPDRFTLRLRIDGSSIACELRASSAFNPFKSRVVSGFSLPERL------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- 3QMZ Chain:A ((1364-4092)) EFVIEKSLNRIKKFWKEAQEHSSGLKLVREWDVLEQACKEDLEELVSMKASNYYKIFEQDCLDLESKLTKLSEIQVNWVEVQFYWLDLYGILGENLDIQNFLPLETSKFKSLTSEYKMITTRAFQLDTTIEVIHIPNFDTTLKLTIDSLKMIKSSLSTFLERQRRDDLLKIIGSGKHHDQVSKFMKKMFGSDFITGVRSVEAQEWLNILDTEIKLSVFTQFRDCLGQLKDGTDIEVVVSKYIFQAILLSAQVMWTELVEKCKYWKEVDMKIKGLLDKLNKSDNVKKKIEALLVEYLHFNNVIGQRLLWAKVQKFYLNSVFISQSGYLLLIGFATLTDSLHQKYGGCFFGPAGTGKTETVKAFGQNLGRVVVVFNCDDSFDYQVLSRLLVGITQIGAWGCFDEFNRLDEKVLSAVSANIQQIQNGLQVGKSHITLLEEETPLSPHTAVFITLLPENLKKSFREFSMKSQSGTIAEMILQIMGFEDSKSLASKIVHFLELLSSKCSSMNHYHFGLRTLKGVLRNCSPLISEFGEGEKTVVESLKRVILPSLGDTDELVFKDELSKSKAIVQCLKDAGEEFLKKCMQFYYMQKTQQALILVGKAGCGKTATWKTVIDAMAIFDGHANVVYVIDTKVLTKESLYGSMLKATLEWRDGLFTSILRRVNDDITGTFKNSRIWVVFDSDLDPEYVEAMNSVLDDNKGERLPIPPNFRILFETDNLDHTTPATITRCGLLWFSSKIDHLLNKSYEALDNKLSMFELDKLKDLISDSFDMASLTNIFTCSNVRTFNKLETAVQLAVHLISSYRQWFQNLDDKSLKDVITLLIKRSLLYALAGDSTGESQRAFIQTINTYFGHDSQELSDDKLSFSSFCSEIPSVSLEAHEVMRPDIVIPTIDTIKHEKIFYDLLNSKRGIILCGPPGSGKTMIMNNALRNSSL------YDVVGINFSKD-----TTTEHILSALHRHTNYVIKNLVLFCVVLFLRQLMEKQGFWKTPENKWVTIERIHIVGACNPPTDPGRIPMSERFTRHAAIYPSGKSLSQIYEIYYKAIFKLVPEFRSYTEPFARASVHLYNECKARYSTGLQSH----------YLFSPRELTRLVRGVYTAINTGPRQTL----RSLIRLWAYEAWRIFAVKEKNSFEQLLYETVDKYLPNQDLGNISST---NKTDLVNFIEERFKTFCDEEPMVIHESMVDHILRIDRALK------QVQGHMMLIGA-SRTGKTILTRFVAWLNGLKIVQPKIHRHSNLSDFDMILKKAISDCSLKESRTCLIIDESNILETAFLERMNTLLANDLFQGEEYDKLLNNLRNKTRDTEQELYDWFVGEIAKNLHVVFTICDPTNN-----KSSAMISSPALFNRCIINWMTKTMSQVANNMVDVVPMEFTDFIVPEVNKELVFTEPIQTIRDPGYFIDGLRALVKLVTAKYQDLQENQR-FVNVGLEKLNESVLEASISLVKSLTFEKERWLNTTKQFSKTSQELIGNCIISSIYETYFGHLNERERGDMLVILKRLLGKFAVKY---DVNY-RFIDYLVTLDEKMKWL---ECGYFLENMSIVMNSQVPFLLDPSSHMITVISNYYGNKTVLLSFLEEGFVKRLENAVRFGSVVIIQDGEFF---DPIISRLISREFNRVTVEIGDHEVKLFIHSCDPSGDIPIFLRSRVRLVHFVTSIETRIFDITLTEENAEMQRKREDLIKLNTEYRLKLKNLEKRLLEELNNDELMVTLNNLKKEAMNIEKKLSESEEFFPQFDNLVEEYSIIGKHSVKIFSMLEKFGQFHWFYGISIGQFLSCFKRVFIKTRAARTRVDEILWLLYQ---EVYCQFSTALDKKFKMIMAMTMFCLYKFDIESEQLTVDTNDDLRYLWDYVTTKSYISALNWFKNWNIADVVA----------NSENNYFTMASEDGTFKLIELA--KASKESLKIIPLGSIENLNYAQEEISKSKIEG-GWILLQNIQMSLSWVKTYLHKHVEETKAAEEKMFMTCHLTGDKLPAPLLQRTDRVVYEDIPGILDTVKDLWGSQFFTGSGVWSVYCTFLLSWFHALITARDCDFQFASVYLENVLAPWAQVRDHIATIVYGGKIDEEKDLEVVAKLCAHVFCDNLQIVPGVRIPQPLLQQSEEEERARLTAIADSLSSWLQLPRESILDYERLQAKEVASSTEQLLQEM

General information: TITO was launched using: RESULT: Template: 3QMZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) 111589 for 7245 contacts (15.4/contact) + 2D Compatibility (PS) -108987 + (NN) -16143 + (LL) 4256 1D Compatibility (HY) -39200 + (ID) 7500 Total energy: -55985.0 ( -7.73 by residue) QMean score : 0.122

(partial model without unconserved sides chains): PDB file : Tito_3QMZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QMZ-query.scw PDB file : Tito_Scwrl_3QMZ.pdb: