Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDQKDFRENLELKPVTQEHIDQFNELLSYVFQVTEADIEESGFENKRAFIRSKKPILEV-SKVFGW-FHENKLISQIAIYPCEVNI-HGARYKMGGVTGVGTYPEYANHGLMQDLIIVALDNMRKNKQWISYLYPYSIPYYRRKGWEIMSDKLSFKIRDTQLPK--QIPVSGMVERLP-VDH-PDVFSVYDKFAQQNHGALFRSDFHWEEYWRFENE---DERTAAVYYDSNHEPRGVLFYWVAE-----EIFHVKEMFYLDQEARNGLWNFISAHFSMIYWVHGDIYKNEPLAFLIEDSQI--KEQIEPYFMARIVDVKEFLQRFPFVGTADAFHFIIEDPVAPWNNGVFALTWDEQGQVRVLNEPIGKSVRLDIQTLTCLMMNYRRASYLARIERLET-DEETLKSLERIIPNMEAYFSDYF 3SXN Chain:B ((21-418)) -----MITPRTLHTITDDDWTRIALLARFAFGDIEPEQT-------QAAWR---SMVPEDATVVVPDETDDAFVGQSLYLDMQLTVPGGEVLPVAGISFVAVAPTHRRRGVLRAMYTELHDRIARAGYPLAVLTASEGGIYGRFGYGVATIEQHVSVDRRLAQFHPAAPDPGGVRMLVPADHRDGLADIYDRWRRRTPGGLVRPDALWDDLLADRPESRRGGGELFA----FGHQDGYALYRVDRGPDGRRSAHVVELTAVTADAHAALWRALLGLDL-IDRVSIGTHPHDPLPYLLTDPRQAQVTASADDLWIRIMNVPAALEARRYQAD-LDVVLDVADGFR-SDGGRFALQISGG-RARCTTTDAPADIEIDLDVLGGLYLGAHRVDGFAAANRLRSKDSELLQQFGAAFAGDMPAEL---

General information: TITO was launched using: RESULT: Template: 3SXN.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2025 -30925 -15.27 -81.38 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain B : 0.71 3D Compatibility (PKB) : -15.27 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.412

(partial model without unconserved sides chains): PDB file : Tito_3SXN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3SXN-query.scw PDB file : Tito_Scwrl_3SXN.pdb: