Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MVLFLSIFKKSFNDFLSARMLLINLGPILLSLAFFGAIFYYNGGSIVNYCQTLLPQSLNDYAHSQGFFAGVFAWVFKALVYFLIFWIVILLSLVINIFASIFYTPLVVSYLHQKYYPHVVLEEFGSILFSIKYFLKSLTFMLLFLAVLTPLYFIPFIGVFGVFFSIVPHFLFFKNTMSLDIASMIFNHQSYQNLLKQHRLKHYRFSFFCYLFSLIPFFNFFATLLQTLMLTHYFFIFKEKEC |
2KJG Chain:A ((3-18)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ILEDPEFVKL-RQFKGKVNFNLVMQILDEIELDLRGSDNIKTSIIYVYSSHLDEIRKN |
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General information:
TITO was launched using:
| RESULT:
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Template: 2KJG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 88 for 56 contacts (1.6/contact) +
2D Compatibility (PS) -1627 + (NN) 636 + (LL) 17268
1D Compatibility (HY) -1200 + (ID) 200
Total energy: 14965.0 ( 267.23 by residue)
QMean score : 0.058
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