Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MANEHLNLFSLENSDYIYADYNATFPVSDSVKESILEVLSKQVLNPSSLHRKGQEARRILQDARDNIRSAIGVPSNKEIVFTSGATEANSLVMKGIAGFQH-----------VISAVEHPSIL--------NSACNPHIIPVNQGGIVDLLALERILSELKGNRVIVSVMMANNETGVVQPVKEIAEIAHKFETI----------YHTDAAQSVGKIKVNMEDLGMDLLTLSAHKFGG--IAGSGVLIFNKDLVIEPIIVGGGQEKGLRGGTENIVAIAGLSAALQSIS-NLLSKMDEIKELRDQLEYELLNLASGIKIFGKNSK-----RLPNTSLIYMPGVKSDVQLMNFDLNNIAVSNGSACSSGKVE-PSHVLLAMGATREQAECSIRVSIGPQTKPRDIRKIVDCWYNIYEKNILDMRK |
3A9Z Chain:A ((20-418)) | ----------------VYMDYNATTPLEPEVIQAVTEAMKEAWGNPSSSYVAGRKAKDIINTARASLAKMIG-GKPQDIIFTSGGTESNNLVIHSTVRCFHEQQTLQTRPHFITCTVEHDSIRLPLEHLVEDQVAEVTFVPVSK--VNGQVEVEDILAAVRPTTCLVTIMLANNETGVIMPISEISRRIKALNQIRAASGLPRVLVHTDAAQALGKRRVDVEDLGVDFLTIVGHKFYGPRIGALYVRGVGKLTPLYPMLFGGGQERNFRPGTENTPMIAGLGKAADLVSENCETYEAHMRDIRDYLE-ERLEAEFGKRIH-LNSRFPGVERLPNTCNFSIQGSQLRGYMVLAQCQTLLASVGASCHSDHEDRPSPVLLSCGIPVDVARNAVRLSVGRSTTRAEVDLIVQDLKQAVNQLEGPV-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3A9Z.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -128413 for 3057 contacts (-42.0/contact) +
2D Compatibility (PS) -38403 + (NN) -16732 + (LL) 732
1D Compatibility (HY) -21600 + (ID) 6400
Total energy: -210816.0 ( -68.96 by residue)
QMean score : 0.459
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