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



Input alignment information:
Query sequenceMPDTSPDLPAMSPLAVYRQAVEQRGFAPDEAQRRAAEALERCFQALHEAHRHGAIQGVYLWGPVGRGKTWLMDHFYQCLRVPARRQHFHHFMQWVHQRQFELTGT-ADPLRALARELARDVRVLCFDELFVSDIGD-AILLGSLLRI----MFEEGVVLVATSNQPPEQLYADGFNRERFLPAIEAIQRHMAVVAVDGGQDHRLHPGRAEQRYWVVEAGQASGFAELFARLSAGEAASTQPIELGHRPLAVHRHSESVLWCSYAQLCEAPLSALDFIGLCDRYRAILMDDLPCLSASQREGRIARGTEDGAQLVEAGDRELPQLSVHDDGVRRFIALVDECYDRKVPLYLEARVPLEALYTEGYLAFAFRRTLSRLREMQLARFGSDSAG
2VHJ Chain:A ((121-238))----------------------------------------------------YASGMVIVTGKGNSGKTPLVHALGEALGGKDKYATV-----RFGEPLSGYNTDFNVFVDDIARA-MLQHRVIVIDSLKNVI---ISRGAFDLLSDIGAMAASRGCVVIASLN--PTSN----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 2VHJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -63647 for 702 contacts (-90.7/contact) +
2D Compatibility (PS) -11179 + (NN) -6419 + (LL) 20820
1D Compatibility (HY) -1600 + (ID) 1050
Total energy: -63075.0 ( -89.85 by residue)
QMean score : 0.364

(partial model without unconserved sides chains):
PDB file : Tito_2VHJ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2VHJ-query.scw
PDB file : Tito_Scwrl_2VHJ.pdb: