Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMLGQPTRAQLAALVDHTLLKPETTRADVAALVAEAAELGVYAVCVSPSMVPVAVQA-G--GVRVAAVTGFPSGKHVSSVKAHEAAAALASGASEIDMVIDIGAALCGDIDAVRSDIEAVRAAAAGAVLKVIVESAVLLGQSNAHTLVDACRAAEDAGADFVKTSTGCHPAGGATVRAVELMAETVGPRLGVKASGGIRTAADAVAMLNAGATRLGLSGTRAVLDGLS
3NGJ Chain:A ((22-238))----MDKATLAKYIDHTLLKADATEEQIRKLCSEAAEYKFASVCVNPTWVPLCAELLKGTGVKVCTVIGFPLGATPSEVKAYETKVAVEQGAEEVDMVINIGMVKAKKYDDVEKDVKAVVDASGKALTKVIIECCYLTN----EEKVEVCKRCVAAGAEYVKTSTGFGT-HGATPEDVKLMKDTVGDKALVKAAGGIRTFDDAMKMINNGASRIGASAGIAILNGI-


General information:
TITO was launched using:
RESULT:

Template: 3NGJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -158735 for 1933 contacts (-82.1/contact) +
2D Compatibility (PS) -24696 + (NN) -17394 + (LL) 604
1D Compatibility (HY) -17600 + (ID) 4800
Total energy: -222621.0 ( -115.17 by residue)
QMean score : 0.569

(partial model without unconserved sides chains):
PDB file : Tito_3NGJ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NGJ-query.scw
PDB file : Tito_Scwrl_3NGJ.pdb: