Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | LNERIFRENTRPVQVGNLTIGGSEELTIQSMTTTKTHDVEATVAEIHRLEEAGCQIVRVACPDERAANALSAIKKK-----IHIPLVADIHFDYRLALK---AIDAGVDKIRINPGNIGR-RDRVE---KVVNAAKAKNIPIRIGVNAGSLEKKIIQKYGYPTA-------------DGMVESAL-AHIKILE-DLDFYDIIVSLKASDVNLAIEAYDKASRAFNYPLHLGITESGTQFAGGIKSAAGLGAILSLGIGNTLRVSLSADPVE----EIKVAREVLKSFGLSSNAAMLISCPTCGRIEIDLIR-IANEVENYIAKIEVP-----------IKVAVLGCAVNGPGEAREADIGI----AGSNGEGLLFRHGKIIRKVPEAIMIDELKKEIDILAEEFFVKKIDLESLR |
4S23 Chain:B ((4-378)) | -----MRRPTPTVYVGRVPIGGAHPIAVQSMTNTPTRDVEATTAQVLELHRAGSEIVRLTVNDEEAAKAVPEIKRRLLAEGVEVPLVGDFHFNGHLLLRKYPKMAEALDKFRINPGTLGRGRHKDEHFAEMIRIAMDLGKPVRIGANWGSLDPALLTELMDRNASRPEPKSAHEVVLEALVESAVRAYEAALEMGLGEDKLVLSAKVSKARDLVWVYRELARRTQAPLHLGLTEAGMGVKGIVASAAALAPLLLEGIGDTIRVSLTPSPKEPRTKEVEVAQEILQALGLRAFAPEVTSCPGCGRTTSTFFQELAEEVSRRL-KERLPEWRARYPGVEELKVAVMGCVVNGPGESKHAHIGISLPGAGEEPKAPVYADGKLL---------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4S23.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -142873 for 2663 contacts (-53.7/contact) +
2D Compatibility (PS) -36387 + (NN) -21800 + (LL) 4264
1D Compatibility (HY) -24800 + (ID) 6900
Total energy: -228496.0 ( -85.80 by residue)
QMean score : 0.487
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