Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKSYKFLKEVLHRLKNIENTLKVLDQSQLNVEDKVEQMGLLEEIRHEIISHNIIKESLAEAGTPSNKKKGDSWQLKLIERMHKSNSAIPIDLVKSLSKVKIECQNLRRLSQSEPSS--LEKLKERFADLVKLIRGVVSIKSQQLKCSKYDSLLA-DYDSDITEKDVKEIFPKLGKFFSDNIDRIIEKQKKDKI---TNTQK----IATQK---------QIELGSLCLQQIG---------------VTSH-------HT---------FYHHPIDYDESDFCYGLFLLLRYSGHEIYQRCLAQNS--ISSSFTRYIMCETQGLFMERMIGTSREFIEFIQPYIKEKLTIKGKVNAKINSVENLYLIFNKVNLSSPLKKADEFSLLANIMLRTKLEQDIINGT-LEVKDLHDAWLEGMEHYKIPVKAKNE------LDTYFQDEYWVSGTMGYFPIKIIALIIAVQIFSFIKKNHYEFLGAIIKGDFGLLIGWLSQNVCS--AKCGFLDLLKKVTG-KGLDVECCSSYLSEKYDLSQ |
3AHN Chain:A ((174-550)) | ------------------------------------------------------------------------------------------------------RKRASEARFTFF-QEHEEKFDEIYDQLVKVRTAIAQKLGFK---NFVELGYARLGRTDYNAEMVAKFRKQVEKHIVPIAVKLRERQRERIGVEKLKYYDEAFVFPTGNPMPKGDANWIIENGKKMYEELSPETGEFFRYMIEHELMDLVAKKGKASGGYCTYIENYKAPFIFSNFT--GTSGDIDVLTHEAGHAFQVYESRHYEIPEYNW-PTLEACEIHSMSMEFFTWPW----------MKLFFK---E------DAEKYQ----------FYHLSDALLFLPYGVAVDEFQHFVYENPNATPAERKQAWRAIERKYMP-TKDYDGNDYLERGGFWQRQSHIYTTAF-YYIDYTLAQICAFQFWKRSRENYKEA-----------WNDYL--TLCRQGGSKPFTELVRVANLISPFEDGCVQSVVGGIEGWLN |
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General information:
TITO was launched using:
| RESULT:
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Template: 3AHN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -148810 for 2416 contacts (-61.6/contact) +
2D Compatibility (PS) -33348 + (NN) -12113 + (LL) 11304
1D Compatibility (HY) -3600 + (ID) 2200
Total energy: -188767.0 ( -78.13 by residue)
QMean score : 0.430
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