Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKIVEGVSLHLIKNQQFKTNHLTFRFSGDFNN---KTVARRSLVAQMLVTANAKYPKVQEFREKLASLYGASLSTKISTKGLVHIVDIDIVFVKNTFTLEQENIVEQIITFLEDMLFSPLISLEQYQTSIFDTEKKNLIQYLEADIEDNFYSSDLALKSLFYNNKTLRLPKYGTASLVESENSFTAYQEFQKMLKEDQLDIFVVGDFDDYRMIQAF-NRMAFEPRHKVLAFD-YTQTYENIT---RSQVEDKDVNQSIMQLAYHLPITYKDEDYFALIVFNGLFGAF-----------AHSLLFTEIREKQGLAYTIGSQFDS--FTGLFTIYAGIDKENRERFLKLINKQFNN-IK--MGRFSSTLLKQTKDILKMNYVLASDNPKVIVDHIYHEHYL-DQFHTSALFIDKVDDVTKSDIVSVATKLKLQAFYFLEGN |
1HR6 Chain:A ((9-416)) | SSLANGLKVATSNTPG-HFSALGLYIDAGSRFEGRNLKGCTHILDRLAFKSTEHVE-GRAMAETLELL-GGNYQCTSSRE----NLMYQASVFNQ--------DVGKMLQLMSETVRFP-----KITEQELQEQKLSAEYEIDEVWMKPELVLPELLHTAAYSGETLGSPLICPRGLIPSISKYYLLDYRNKFYTPENTVAAFVG-VPHEKALELTGKYLGDWQSTHPPITKKVAQYTGGESCIPPAPVFGNLPELFHIQIGFEGLP-IDHPDIYALATLQTLLGGGGSFSAGGPGKGMYSRLYTHVLNQYYFVENCVAFNHSYSDSGIFGISLSCIPQAAPQAVEVIAQQMYNTFANKDLRLTEDEVSRAKNQLKSSLLMNLESKLVELEDMGRQVLMHGRKIPVNEMISKIEDLKPDDISRVAEMIFTGNVNNAGNG |
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General information:
TITO was launched using:
| RESULT:
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Template: 1HR6.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -165125 for 3009 contacts (-54.9/contact) +
2D Compatibility (PS) -40289 + (NN) -7259 + (LL) 1796
1D Compatibility (HY) -11600 + (ID) 2500
Total energy: -224977.0 ( -74.77 by residue)
QMean score : 0.437
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