Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQLSKYKNQSVAVFGLGKTGLSVINVLIKSGAKAYAWDDSKEQMANAKTMYKECNFIHPKKYDWHEIKALILSPGVPISYPKPHWIVKLARSFDCKIKSDIELFLEAKAKNQKIVGVTGTNGKSTTTSLIGHILKSAGKKVAIGGNL------------GVPILD-----------------------------L----EKDAEIYVIEISSFQLELINMPAVIPVHDHTFFSGSQYRAAWMIKRVSEMTKKMTEVTKRMAGMIKVDISVLLNITLDHIDRHG-SMENYIAVKSKLIGGSKVAVIGCDN-EI-TADIFNKFTGNKI------PISGVRSLLDDKKGAEIQEISLKLENHNLSASDAKINLTSNAENIAASCAVCKL--LKVDSSTIIDGIKSFSGLKHRNELLGKIENVLFVNDSKATNAESSKKAILSYK----NIYWIVGGRSKEGGIESLSKHF-ARIRKALLIGES------TEVFASTMENKVDYVRCCNLEDAFRLAFEEAIKSKEKTTILLSPACASFDQWRNFEERGEAFCRMFEKLRDSFTITRVV |
3NRS Chain:A ((51-434)) | --------------------------------------------------------------------------------------------------------------APKIFTVAGTNGKGTTCCTLEAILLAAGLRVGVYSSPHLLRYTERVRIQGQELSEAEHSHSFAQIEAGRGDISLTYFEFGTLSALQLFKQAKLDVVILEVGLGGRL-----------DA-------------------------------TNIVDSDVAAITSIALDHTDWLGYDRESIGREKAGVFRGGKPAVVGEPDMPQSIADVAAEL-GAQLYRRDVAWKFSQ------------NGWHWQCGE--RQLTGLPVPN-VPLANAATALAVLHYSELPLSDEAIRQGLQAA-SLPGRFQVVSE--QPLLILD-VAHNPHAARYLVNRLAQVIGKVRAVVGMLS-DKDIAGTLACLSERVDEWYCAPLEGPRGASAGQLAEHLV---SARQFSDVETAWRQAMQ---DADTQDVVIVCGSFHTVAHVMAALHL--------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3NRS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -133390 for 2540 contacts (-52.5/contact) +
2D Compatibility (PS) -32005 + (NN) -7421 + (LL) 15540
1D Compatibility (HY) -13200 + (ID) 2950
Total energy: -173426.0 ( -68.28 by residue)
QMean score : 0.444
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