Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MGSPEFAINALNSLLKSKNEVVAVYTKAPKPSGRGQKLTKSPVHIIAEESGIEVCTPTSLKPLVEQ-----EKFKKFKPDVAVVAAYGLILPKEILNILKYSCINIHPSLLPRWRGAAPIQHTILAGDRKTGISIMQLDGGLDSGPILKQKKFLVEKNDNYKTLHDK-LSKLGSNLLMEVIDEIE--KHPPLEQSDDGACYA--DKIEDYKIYASDICEVAYRKVKAF--YPKAFVKIEHKRVRILDADFEVDASLTSGQGKIINDNMHISLKSGTLIPKIVQMEGRNSCNIKDFVRGLKFSMVKKFIE |
2BW0 Chain:A ((28-280)) | IGQSLFGQEVYCHLRKEGHEVVGVFT-VPDKDGKA-----DPLGLEAEKDGVPVFKYSRWRAKGQALPDVVAKYQALGAELNVLPFCSQFIPMEIISAPRHGSIIYHPSLLPRHRGASAINWTLIHGDKKGGFSIFWADDGLDTGDLLLQKECEVLPDDTVSTLYNRFLFPEGIKGMVQAVRLIAEGKAPRLPQPEEGATYEGIQKKETAKINWDQPAEAIHNWIRGNDKVPGAWTEACEQKLTFFNSTLNTSGLVPEGDALPIPGAHRPGVVTKAGLILFGNDDKMLLVKNIQLEDGKMILASNFFK- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2BW0.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -115937 for 1820 contacts (-63.7/contact) +
2D Compatibility (PS) -26097 + (NN) -12645 + (LL) 660
1D Compatibility (HY) -11600 + (ID) 3500
Total energy: -169119.0 ( -92.92 by residue)
QMean score : 0.425
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