Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MHRASHHELRAMFRALLDSSRCYHTASVFDPMSARIAADLGFECGILGGSVASLQVLAAPDFALITLSEFVEQATRIGRVARLPVIADADHGYGNALNVMRTVVELERAGIAALTIEDTLLPAQFGRKS--TDLICVEEGVGKIRAALEARVDPALTIIARTNAE-L-IDVDAVIQRTLAYQEAGADGICLVG-VRDFAHLEAIAEHLH--IPLMLVTYGNPQLRDDARLARLGVRVVVNGHAAYFAAIKATYDCLREERGAVA-SD-----LTASELSKKYTFPEEYQAWARDYMEVKE |
1S2W Chain:A ((4-278)) | -----KVKKTTQLKQMLNSKDLEFIMEAHNGLSARIVQEAGFKGIWGSGLSVS-AQL---------WTQVVEVLEFMSDASDVPILLDADTGYGNFNNARRLVRKLEDRGVAGACLEDKLF-------GRAQPLADIEEFALKIKACKDSQTDPDFCIVARVEAFIAGWGLDEALKRAEAYRNAGADAILMHSKKADPSDIEAFMKAWNNQGPVVIVPT-KYYKTPTDHFRDMGVSMVIWANHNLRASVSAIQQTTKQIYDDQSLVNVEDKIVSVKEI-FRL------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1S2W.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -173822 for 1984 contacts (-87.6/contact) +
2D Compatibility (PS) -26953 + (NN) -9887 + (LL) 3168
1D Compatibility (HY) -7600 + (ID) 3150
Total energy: -218244.0 ( -110.00 by residue)
QMean score : 0.560
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