Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSEVVTAAPAPPVVRLPPAVRGPKLFQGLAFVVSRRRLLGRFVRRYGKAFTANILMYGRVVVVADPQLARQVFTSSPEELG--NIQPNLSRMFGSGSVFALDGDDHRRRRRLLAPPFHGKSMKNYETIIEEETLR-ETANWPQGQA-FATLPSMMHITLNAILRAIFGAGGSELDELRRLIPPWVTLGSRL--AALPKPKRDYGRLSPWGRLAEWRRQYDTVIDKLIEAERADPNFADRT--DVLALMLRSTYDDGSIMSRKDIGDELLTLLAAGHETTAATLGWAFERLSRHPDV--LAALVEEVDNGGHELRQAAIL-EVQRARTVIDFAARRVNPPVYQL----------GEWVIPRGYSIIINIAQIHGDPDVFPQPDRFDPQRYIGSKPSPFAWIPFGGGTRRCVGAAFANMEMDVVLRTVLRHFTLETTTAAGERSHGRGVAFTPKDGGRVVMRRR |
4BJK Chain:A ((48-426)) | -------------------------------------------------FTINIV-GKRVTIVGDPHEHSRFFLPRNEVLSPREVYSFMVPVFGEGVAYAAPYPRMREQLNFLAEELTIAKFQNFVPAIQHEVRKFMAANWDKDEGEINLLEDCSTMIINTACQCLFGEDLRKRLDARRFAQLLAKMESSLIPAAVFLPILLKLPLPQSARCHEARTELQKILSEIIIARKAAAVNKDSSTSDLLSGLLSAVYRDGTPMSLHEVCGMIVAAMFAGQHTSSITTTWSMLHLMHPANVKHLEALRKEIEEFPAQLNYNNVMDEMPFAERCARESIRR-DPPLLMLMRKVMADVKVGSYVVPKGDIIACSPLLSHHDEEAFPEPRRWDPER---DEKVEGAFIGFGAGVHKCIGQKFGLLQVKTILATAFRSYDFQ----------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4BJK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -161208 for 2755 contacts (-58.5/contact) +
2D Compatibility (PS) -39770 + (NN) -31041 + (LL) 5384
1D Compatibility (HY) -21600 + (ID) 4800
Total energy: -253035.0 ( -91.85 by residue)
QMean score : 0.416
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