Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKEIKFLHMADLHLDSPFIGLSTLPQPLFSAIQESTFQSLERITTVAIKEAVDFVLIAGDIYDSEDQSVRAQARFAKEMKRLE---------------VANIPVFMIHGNHDFIEK-H-KE---KLALPSNVHVFSE--QVE-----VMLHKTATGVSVNIYGFSYNERHI-----RSSRIDEYKVQ--GDADFHIALLHGSEVSSSEEHDVYAPFRVQEISKKGFDYWALGHIHKRQLLAE-----SPSIYYPGNIQGRNRKE--SGEKGASIINLSEASTTIDFIGTSP-IIWEEIIIPLPKNS---------EINAFYREITNVLESY-----------QGRSHSYFLHIIIQMASSQKINTNDWLQMLQEEVELSNTTFVWVHKLTTEITNRSNLQTWYESHLAGEEIRRSFEQLQDESAFYQSVEALYLESGANRYLDDLSEQERERLLENALMELGMTLAEVEGDEK |
3T1I Chain:A ((31-393)) | -NTFKILVATDIHLGFMEKDA---------VRGNDTFVTLDEILRLAQENEVDFILLGGDLFHENKPSRKTLHTCLELLRKYCMGDRPVQFEILSDQLNISIPVFSIHGNHDDPTGADALCALDILSCAGFVNHFGRSMSVEKIDISPVLLQK-GSTKIALYGLGSIPDERLYRMFVNKKVTMLRPKEDENSWFNLFVIHQNRSK-HG-STNFIP---EQFLDDFIDLVIWGHEHECKIAPTKNEQQLFYISQPGSSVVTSLSPGEAVKKHVGLLRIKGRKMNMHKIPLHTVRQFFMEDIVLANHPDIFNPDNPKVTQAIQSFCLEKIEEMLENAERERLGNSHQPEKPLVRLRVDYSGGF---------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3T1I.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -134809 for 2172 contacts (-62.1/contact) +
2D Compatibility (PS) -30703 + (NN) -12469 + (LL) 10540
1D Compatibility (HY) -12400 + (ID) 2550
Total energy: -182391.0 ( -83.97 by residue)
QMean score : 0.476
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