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



Input alignment information:
Query sequenceMNSAKLIDHTLLKPESTRTQIDQIIDEAKAYHFKSVCVNPTHVKYAAERLADSEVLVCTVIGFPLGASTTATKAFETEDAIQNGADEIDMVINIGALKDGRFDDVQQDIEAVVKAAKGHTVKVIIET----VLLDHDEIVKASELTKVAGADFVKTSTGF-AGGGATAEDVKLMKDTVGADVEVKASGGVRNLEDFNKMVEAGATRIGASAGVQIMQGLEADSDY
3NG3 Chain:B ((13-226))---AAFVDHTLLKPEATAADVAALVTEAAELGVYAVCVSPPMVPAAVQ--A----RVASVAGFPSGKHVSAVKAHEAALAVASGAAEIDMVIDVGAALAGDLDGVRADIAAVRGAVGGAVLKVIVESSALLALADEHTLVRVCRAAEDAGADFVKTSTGFHPSGGASVRAVALMAEAVGGRLGVKASGGIRTAADALAMLDAGATRLGLSGTRAVLDGL------


General information:
TITO was launched using:
RESULT:

Template: 3NG3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -90773 for 1832 contacts (-49.5/contact) +
2D Compatibility (PS) -22853 + (NN) -9176 + (LL) 728
1D Compatibility (HY) -13600 + (ID) 4700
Total energy: -140374.0 ( -76.62 by residue)
QMean score : 0.577

(partial model without unconserved sides chains):
PDB file : Tito_3NG3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NG3-query.scw
PDB file : Tito_Scwrl_3NG3.pdb: