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



Input alignment information:
Query sequenceMRPLLFSALLLLSGHTQASEWNDSQAVDKLFGAAGVKGTFVLYDVQRQRYVGHDRERAETRFVPASTYKVANSLIGLSTGAVRSADEVLPYGGKPQRFKAWEHDMSLRDAIKASNVPVYQELARRIGLERMRANVSRLGYGNAEIGQVVDNFWLVGPLKISAMEQTRFLLRLAQGELPFPAPVQSTVRAMTLLESGPGWELHGKTGWC---FDCTPELGWWVGWVKRNERLYGFALNIDMPGGEADIGKRVELGKASLKALGILP
2WKH Chain:A ((5-246))---------------TENTSWN------KEFSAEAVNGVFVLCKSSSKSCATNDLARASKEYLPASTFCIPNAIIGLETGVIKNEHQVFKWDGKPRAMKQWERDLTLRGAIQVSAVPVFQQIAREVGEVRMQKYLKKFSYGNQNISGGIDKFWLEGQLRISAVNQVEFLESLYLNKLSASKENQLIVKEALVTEAAPEYLVHSKTGFSGVGTESNPGVAWWVGWVEKETEVYFFAFNMDID-NESKLPLRKSIPTKIMESEGII-


General information:
TITO was launched using:
RESULT:

Template: 2WKH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -124574 for 1959 contacts (-63.6/contact) +
2D Compatibility (PS) -25609 + (NN) -10869 + (LL) 1280
1D Compatibility (HY) -20400 + (ID) 4400
Total energy: -184572.0 ( -94.22 by residue)
QMean score : 0.546

(partial model without unconserved sides chains):
PDB file : Tito_2WKH.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2WKH-query.scw
PDB file : Tito_Scwrl_2WKH.pdb: