Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------------------------------------------------------MSEAALTPAFEEPEAPRASPRSRSTLLKRLADVVCLPSSRINAFERSMTADLLVE--MLRDANVGEREKVARRLAMLN--------EMPGVLVRLLLRDELPVARALLVDSEKLSDADLISCLYQATTEHRRLIAQRRG-----VSEVVADALIEV--GEPAVIETLLRNELVKLSHQGVENIVAATRDA-QHLIPLLLRRAELRPSHAYVM----------------FWWADSEARRVILQRFAV----SREIL---QDAVGDVFALASAEGWQDPLSRKALQFIERRQ--RNRAAIAKSPFNSLDEAVAAGEGGFN-----REIAEEISYLSGL----------KPMTGAKIFTDPGGEPLAILCKATGL-------------------PRGCVRQLWRGLRRQE--VDRTGATDPNLERVLTVYDAIAV--------DRAQTVLRYWNWSLTSALTPALLKAIRDGDEAAVDEYSAPQRAAMLALSRDFGR--------------------- |
2CBI Chain:A ((11-594)) | VLVPNLNPTPENLEVVGDGFKITSSINLVGEEEADENAVNALREFLTANNIEINSENDPNSTTLIIGEVDDDIPELDEALNGTTAENLKEEG-YALVSNDGKIAIEGKDGDGTFYGVQTFKQLVKESNIPEVNITDYPTVSARGIVEGFYGTPWTHQDRLDQIKFYGENKLNTYIYAPKDDPYHREKWREPYPESEMQRMQELINASAENKVDFVFGISPGIDIRFDGDAGEEDFNHLITKAESLYDMGVRSFAIYWDDIQDKSAAKHAQVLNRFNEEFVKAKGDVKPLITVPTEYDTGAMVSNGQPRAYTRIFAETVDPSIEVMWTGPGVVTNEIPLSDAQLISGIYNRNMAVWWNYPVTDYFKGKLALGPMHGLDKGLNQYVDFFTVNPMEHAELSKISIHTAADYSWNMDNYDYDKAWNRAIDMLYGDLAEDMKVFANHSTRMDNKTWAKSGREDAPELRAKMDELWNKLSSKEDASALIEELYGEFARMEEACNNLKANLPEVALEECSRQLDELITLAQGDKASLDMIVAQLNEDTEAYESAKEIAQNKLNTALSSFAVISEKVAQSFIQEALSFDLTLI |
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General information:
TITO was launched using:
| RESULT:
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Template: 2CBI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -54262 for 2904 contacts (-18.7/contact) +
2D Compatibility (PS) -41685 + (NN) -3109 + (LL) 100
1D Compatibility (HY) 0 + (ID) 2450
Total energy: -101406.0 ( -34.92 by residue)
QMean score : 0.240
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