Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------MNGDHMVLGSSVTDKKAIILVTIL-------LLLRLVAIAGNGFITAALGVEWVLRRMLLPCDKLLVSLGASRFCLQSVVMGKTIYVFLHPMAFPYNPVLQFLAFQWDFLNAATLWSSTWLSVFYCVKIATFTHPVFFW-----------LKHKLSGWLPWMLFSSVGLSSFTTILFFIG----NHRMYQNYLRNH-------------------------------------------LQPWNVTGDSIR---------------------SYCEKFYLFPLKMITWT-----------MPTAVFFICMILLITSLG--RHRKKALLTTSGFREPSVQAH--IKALLALLSFAMLFISYFLSLVFSAAGI----------FPPLDFKFWVWESVIYLCA--------AVHPIILLFSNCRLRAVL----KSRRSSRCGTP------------- |
4BIJ Chain:A ((1-476)) | MSTQSNRNALVVAQLKGDFVAFLFVLWKALNLPVPTKCQIDMAKVLANGDNKKFILQAFRGIGKSFITCAFVVWSLWRDPQL--KILIVSASKERADANSIFIKNIIDLLPFLSELKPRPGQRDSVISFDVGPANPDHSPSVKSVGITGQLTGSRADIIIADDVEIPSNSATMGAREKLWTLVQEFAALLKPLPSSRVIYLGTPQTEMTLYKELEDNRGYTTIIWPALYPRTREENLYYSQRLAMLRAEYDENPEALAGTPTDPVRFDRDDLRERELEYGKAGFTLQFMLNPNLSDAEKYPLRLRDAIVAALDLEKAMHYQWLPNRQNIIEDLPNVGLKGDDLHTYHDCSNNSGQYQQKILVIDPSGRGKDETGYAVLYTLNGYIYLMEAGGFRDGYSDKTLELLAKKAKQWGVQTVVYESNFGDGMFGKVFSPILLKHHNCAMEEIRARGMKEMRICDTLEPVMQTHRLVIRDEV |
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General information:
TITO was launched using:
| RESULT:
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Template: 4BIJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -211637 for 2226 contacts (-95.1/contact) +
2D Compatibility (PS) -31703 + (NN) 5666 + (LL) -84
1D Compatibility (HY) -4800 + (ID) 3050
Total energy: -245608.0 ( -110.34 by residue)
QMean score : 0.065
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