Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | -------------------------------------------------------------------------------------------------------------------MFLEIAKVYLQGLGL-ASITVILV------GIIWVFWRAKKNIDKTARERQSVLYDVLLIALMTAPILAFAFVAIILMIKA----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
4BWI Chain:A ((4-421)) | NRSLEDFLRNVINKFHRALTLRETLQVIVEEARIFLGVDRVKIYKFASDGSGEVLAEAVNRAALPSLLGLHFPVEDIPPQAREELGNQRKMIAVDVAHRRKKSHELSGRISGHYTTVDSCHIQYLLAMGVLSSLTVPVMQDQQLWGIMAVHHSKPRRFTEQEWETMALLSKEVSLAITQSQLSRQVHQQQVQEALVQRLETTVAQYGDRPETWQYALETVGQAVEADGAVLYIAPDLTGSVAQHYQWNLRFDWGNWLETSLWQELMRGQPSANCVPHGYTLGELEQRSDWIAPPESLSAENFQSFLIVPLAADQQWVGSLILLRKEKSLVKHWAGKRGNILPRLSFEAWEETQKLVPTWNRSERKLAQVASTQLYMAITQQ |
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General information:
TITO was launched using:
| RESULT:
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Template: 4BWI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -40215 for 342 contacts (-117.6/contact) +
2D Compatibility (PS) -8514 + (NN) -5258 + (LL) 0
1D Compatibility (HY) -800 + (ID) 600
Total energy: -55387.0 ( -161.95 by residue)
QMean score : 0.495
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