Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSDHLTACAAVHPGPLVSHLSVMHRFRIYVDIAVVVLVLVLTNLIAHFTTPWASIATVPAAAVGLVILVRSRGLGWAELGLSRQHWKSGLVYALAAVALVVAVISVGVLLPITRPMFMNHHYATISGAVIASMVMIPLQTVIPEELAFRGVLHGALNR-----AWGFRGVAVAGSVLFGLWHIATSLGLTSSNVGFTRLFGGGIIGLVAGVMLAVLATGVAGFVFSWLRRRSGSLIAPIALHWSLNGMGALAAALVWHLST |
3EON Chain:A ((219-288)) | --------------------------------------------------------------------------------------------------------------------------ASITGEIVLDEAFVPEENILPHVKGLRGPFT-CLNSARYGIAWGALGAAES------CWHIARQYVLDRKQFG------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EON.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -12133 for 198 contacts (-61.3/contact) +
2D Compatibility (PS) -6327 + (NN) -2042 + (LL) 16840
1D Compatibility (HY) -3600 + (ID) 1000
Total energy: -8262.0 ( -41.73 by residue)
QMean score : -0.388
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