Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKEIKFLHMADLHLDSPFIGLSTLPQPLFSAIQESTFQSLERITTVAIKEAVDFVLIAGDIYDSEDQSVRAQARFAKEMKRLEVA---NIPVFMIHGNHDFIEKHKEKLALPSN---VHVFSEQVEVMLHKTAT------------GV--SVNIYGFSY-NERHIRSSRIDEYKVQGDADFHIALLHGS--EVSSSEEHDVYAPFRVQEISKKGFDYWALGHIHKRQLLAESPS-IYYPGNIQGRNRKESGEKGASIINLSEASTTIDFIGTSPIIWEEIIIPLPKNSEINAFYREITNVLESYQGRSHSYFLHIIIQMASSQKINTNDWLQMLQEEVELSNTTFVWVHKLTTEITNRSNLQTWYESHLAGEEIRRSFEQLQDESAFYQSVEALYLESGANRYLDDLSEQERERLLENALMELGMTLAEVEGDEK |
1S8E Chain:A ((1-227)) | ---MKFAHLADIHL-----GYEQFHKP---QREEEFAEAFKNALEIAVQENVDFILIAGDLFHSSRPS---PGTLKKAIALLQIPKEHSIPVFAIEGNLVRTQRGPSVLNLLEDFGLVYVIGMRKEKVENEYLTSERLGNGEYLVKGVYKDLEIHGMKYMSSAWFEANKEILKRLFRPTDNAILMLHQGVREVSEARGED-YFEIGLGDLP-EGYLYYALGHIHKRYETSYSGSPVVYPGSLE------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1S8E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -102735 for 1561 contacts (-65.8/contact) +
2D Compatibility (PS) -22046 + (NN) -9509 + (LL) 16188
1D Compatibility (HY) -15600 + (ID) 3300
Total energy: -137002.0 ( -87.77 by residue)
QMean score : 0.421
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