Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MWIKNKVFNRRAFILGGIQLTISTIFSCRLYSLQIRNRQKYEKLADNNRIRVAAIMPKRGRILDRNGIELAVDKISYIVLFDKQKISSEEVDWETLSEIESNVTKSSETKITALYKRHYPFGSICSHTLGYTKKQQGINEAGISGIEYTYDHILKGKPGRSEQEINSKKRIVRELSSIPQQDGQDVQLTIDIDLQEKI------AEIF-KGHKGSVTAIDVGNGEILTLYNSPSYDNNLFANKLSNEAWEGLNTPSLPLVNRALSYQIPPGSIFKIIVALAGLKDGIITPEEKFSCVGYMKIGERRFCCLKSKVHGYVSLNEAMALSCNTYFYNIGKKISVDSLVEMARKFGIGSGPLIGAFKEEAPGLLPDKDWRTRKLYSEWYLGDTVNLVIGQGYVLTTPLQLAVLAARIATGKEVIPRIEMSKTMQDFPDIDIAHEHLSIVRKAMFNMVNIK---AGTYRKGLSSIRIAGKTGTP-EINSKGESHKLFIAY----GPYHDPRYAISVFIE----YGKAPRQDV--AMANEILRYMLKG |
4BJP Chain:A ((100-495)) | -------------------------------------------------------------------------------------------------------------------RRYYPSGEVTAHLIGFTN----VDSQGIEGVEKSFDKWLT---------------------------AHNLALSIDERLQALVYRELNNAVAFNKAESGSAVLVDVNTGEVLAMANSPSYNPNNLS-----------GTPKEAMRNRTITDVFEPGSTVKPMVVMTALQRGVVRENSVLNTIPYRINGHEIKDVAR---YSELTLTGVLQKSSNVGVSKLALAMPSSALVDTYSRFGLGKATNLGLVGERS-GLYPQKQ--------RWSDIERATFSFGYG-LMVTPLQLARVYATIGSYGIYRP-LSITKVDPPVPGERVFPE--SIVRTVVHMMESVALPGGGGVKAAIKGYRIAIKTGTAKKVGPDGRYINKYIAYTAGVAPASQPRFALVVVINDPQA----VSAPVFGAIMGGVLRTMNIE |
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General information:
TITO was launched using:
| RESULT:
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Template: 4BJP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -158521 for 2944 contacts (-53.8/contact) +
2D Compatibility (PS) -36618 + (NN) -19015 + (LL) 13020
1D Compatibility (HY) -19200 + (ID) 5200
Total energy: -225534.0 ( -76.61 by residue)
QMean score : 0.403
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