Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSFSSLQDKGMKNSEFLKGEVSFEQKAKILLEALSSIPNFVGETFVIKCGGITISDETLFNTFVHNVVLLKQLGINPVIVHDGEYEIDSVLKILGINSKFVNDIRLTDKDTMRIIEMVLCGSINKKIVQHINSAGGSAIGLCGKDGNLIKAEKISTTLRENGSNNVEKILDMGFIGIPTEINPDILFFIEESDFIPVIAPIGHGKNGETYHIDADGAAGAIAVAVSASKMIIFSDVCEEMDKIDGRKISVKNLNAS---INCGKIKGERFVEKLTACAKMVEECAGIAHIVNGRIPN-IMIDLFTESNSSVSIVNDL |
2BTY Chain:B ((8-271)) | ----------------------------VLLEALPYIKEFYGKTFVIKFGGSAMKQENAKKAFIQDIILLKYTGIKPIIVHGGGPAISQMMKDLGIEPVFKNGHRVTDEKTMEIVEMVLVGKINKEIVMNLNLHGGRAVGICGKDSKLIVAEKET------------KHGDIGYVGKVKKVNPEILHALIENDYIPVIAPVGIGEDGHSYNINADTAAAEIAKSLMAEKLILLTDVDGVLK--DGKLISTLTPDEAEELIRDGTVTG-GMIPKVECAVSAVRGGVGAVHIINGGLEHAILLEIFSRKGIGTMIKELE |
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General information:
TITO was launched using:
| RESULT:
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Template: 2BTY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -191409 for 2108 contacts (-90.8/contact) +
2D Compatibility (PS) -28352 + (NN) -11188 + (LL) 2444
1D Compatibility (HY) -23600 + (ID) 5600
Total energy: -257705.0 ( -122.25 by residue)
QMean score : 0.477
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