Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MEPRKNVTDFVLLGFTQNPKEQKVLFVMFLLFYILTMVG---NLLIVVTVTVSETLGSPMSFFLAGLTFIDII-----YSSSISPRLISDLFFGNNSISFQSFMAQLFIEHLFGGSEVFL--LLVMAYDRYVAICKPL--------HYLV-IMRQWV----CVLLLVVSWVGGFLQSVFQLSIIYGLPFCGPNVIDHFFCDMYPLLKLACTDTHVIGLLVVANGGLSCTIAFLLLLISYGVILHSLKKLSQKGR-----QKAHSTCSSHITVVVFFFVPC--------IFMCARPARTFS-IDKSVSVFYTVITPMLNPLIYTLRNSEMTSAMKKL |
4J4Q Chain:A ((45-317)) | --------------------------------FLLIMLGFPINFLTLYVTVQHKKLRTPLNYILLNLAVADLFMVFGGFTTTLYTSLHGYFVFGPTGCNLEGFFATL-------GGEIALWSLVVLAIERYVVVCKPMSNFRFGENHAIMGVAFTWVMALACAAPPLVGW-SRYIPEGMQCS-------CG--------IDYYTPHEETNNESFVIYMFVV-----HFIIPLIVIFFCYGQLVFTVKEAAAQQQESATTQKAEKEVTRMVIIMVIAFLICWLPYAGVAFYIFTHQGSDFGPIFMTIPAFFAKTSAVYNPVIYIMMNKQFRNCMVTT |
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General information:
TITO was launched using:
| RESULT:
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Template: 4J4Q.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -199630 for 1686 contacts (-118.4/contact) +
2D Compatibility (PS) -23613 + (NN) -5633 + (LL) 4492
1D Compatibility (HY) -31600 + (ID) 3150
Total energy: -259134.0 ( -153.70 by residue)
QMean score : 0.240
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