Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLEALNALNQLNALHSKNAAHHFNATLPILLKVLEKQDKDLFLLQVGNRIIPTKSEQELKINQPYFAIMQRNQLGDIVLKNLVPAPKILDALDDLPVIEMKKLKEILSAKDNTPLKEYKELLSEKLIH---AKSSQEFLNTANMLLSLQSQVLSFVVENERKKAFLQMKAKKQSVDFYALYPNLGEIGGVIYLKEKEKQLFLKTTLQRTKEVLKEAQNTLLGFSFVEIVCEKTPMLFAFEDRLLDTLG |
3BY6 Chain:A ((20-92)) | ------------------------------------------------------------------------------IKNEV-ATDVLSANDQLPSVRETALQEKINP--NTVAKAYKELEAQKVIRTIPGKGTFITGNTASVKNSNQNRLLADLSQVIAELIKSGVKGERIKKIVNDILG------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3BY6.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -5389 for 454 contacts (-11.9/contact) +
2D Compatibility (PS) -7297 + (NN) -2699 + (LL) 12392
1D Compatibility (HY) -1200 + (ID) 1350
Total energy: -5543.0 ( -12.21 by residue)
QMean score : 0.248
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