Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSIINSNFRSLGSYIMENIYKIPNYQREYSWEETELEDLWMDLSQIINGETESHFFGQIVIHVDKKEKAKLIIDGQQRTSTAVIFLAAMRELFTEMYNAGWDDAQFDAQDITTKFIGRYTQTRDERKLILGENDKSYFSNRIQSVSSEQLGLQKATKSQKRINFAYNYFYKKLEEEINSSDFLEDKYGLLKTFFSTFTEKCSVMFVETDDFNEAFIIFETLNARGKDLETADLLKNHLFKIANKKVGEVKKNWKQMLEFIG----TVDTTKYIRHFWNSQNVFIREKDLYKEIRKKITTQFEAIIFIDDLVRLSEVYG-GMKNPAEDNFFETDSQQVLNDLKRLGAKSFYPIILAMVKKDYGPNEIYEVLSAIEVLVVRN-----FVISGLVANKYETEFSKIAFKIYQEEVESVTEIINLIR-----TNIIADDVFLNNFSSFKTTNKLRLRYILKKINDSYSKEIAVLNDNNKIHLEHIMPIKADGWDIIKEEHEEYLWKIGNLTLLGSEYNKKSTNKIFNDKKDIYEYSEVQLTRKLLDYDEWNIDVIKERQVELAELAVNIWKV |
2Z82 Chain:A ((76-272)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LEHLDLSDNHLSSLSSSWFGPLSS--LKYLNLMGNPYQTLGVTSLFPNLTNLQTLRIGNVETFSEIRR---IDFAGLTSLNEL----EIKALSLRN------YQSQSLKSIRDIHHL--------TLHLSESAFLLEIFADILSSVRYLELRDTNLARFQFSPLPVDEVSSPMKKLAFRGSVLTDESFNELLKLLRYILELSEVEFDDCTLNGLGDFNPS------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2Z82.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -77010 for 1320 contacts (-58.3/contact) +
2D Compatibility (PS) -18201 + (NN) 7606 + (LL) 27748
1D Compatibility (HY) -14000 + (ID) 2300
Total energy: -76157.0 ( -57.69 by residue)
QMean score : 0.170
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