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



Input alignment information:
Query sequenceMRIRLLACSRVEYGRVGPLKQCFPLISPGLLAHTSSRDSVCASAEAHPVLSTTVVLLPSSLFSLCRCSVKASGEATVLNGEGGARVVSAVHQAHPHEPLVGLMTQPLPLSTILRHPLASKRCMMIFHQNGEETMELFELLSRYEAVGPIGQGSYGYVCSARDNDLVERFQAKPPEEYEDASLTLEEREEVYDTNTLVAIKKLRQLFENNQPRMWLCATREIQLMMAFQHDNVMSATDFFIPLGGVEMMTYDSILQLQHTFDGVYVVMKKMDYTLREVLDSTIVTAAELAPGYETWLRRLRLLMANCGEVNADVSSTPTPVRASRLNVKAEAQGEDQAAAAPHSSTEQSRSGGREDVEDEAGATVPSSLDYPVAAAAAAAAPTNDHDAPVAKTSTDGGFEGKGGGDDEGAPVCCPLTTVALHSLTRDYRKFILYQIFRGVGYLHLCPVIHRDLKPENIMLDRSYGTRITDFGQGRDVGLNATTDYVQTVLDNCTQWYAAPETLTVAINSPMGFIDHDSFHGVDVWSIGCIAAEMLIGRPLFYTTSMGGKSQLLSIFRVLGEPSASAIESIAEYRDKETRELFMNSVKKLVKTAPPSNTITPTLAELLRSPYGDEDEDEVGLIIDCLRWDPRERITIQAALQNPFFTKDGYDPVIDPEDTAKRVPSVRPEDISEPVSGRAFLWNLFLERHPEVKELWNSLVAKHEEELKVKKAAADT
3COI Chain:A ((17-312))--------------------------------------------------------------------------------------------------------------------------------------TAWELPKTYVSPTHVGSGAYGSVCSAIDKR----------------------------SGEKVAIKKLSRPFQS--EIFAKRAYRELLLLKHMQHENVIGLLDVFTPASSL------------RNFYDFYLVMPFMQTDLQKIMGL---------------------------------------------------------------------------------------------------------------------------------------------KFSEEKIQYLVYQMLKGLKYIHSAGVVHRDLKPGNLAVNEDCELKILDFGLARH---------------VVTRWYRAPEVILSW---------MHYNQTVDIWSVGCIMAEMLTGKTLFKGKD--YLDQLTQILKVTGVPGTEFVQKLNDKAAK----SYIQS---LPQ------TPRKD----FTQLFPRASPQAADLLEKMLELDVDKRLTAAQALTHPFFEPFR-------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3COI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1394 -168402 -120.80 -584.73
target 2D structure prediction score : 0.50
Monomeric hydrophicity matching model chain A : 0.62

3D Compatibility (PKB) : -120.80
2D Compatibility (Sec. Struct. Predict.) : 0.50
1D Compatibility (Hydrophobicity) : 0.62
QMean score : 0.445

(partial model without unconserved sides chains):
PDB file : Tito_3COI.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3COI-query.scw
PDB file : Tito_Scwrl_3COI.pdb: