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


Input alignment information:
Query sequenceMLKPLLIRISPLDNVAIVVNDGGLPSSTYIEEYQLTLVDEVPQGHKVLLEPLKQGEAIVRYGEIIGYANKDLTAGSWVNEAVTQMPEAPELDDLELATRPDPKLPPLTGYTFKGYKNKDGSIGTKNILGITTSVNCVEGIIDYVVKIIERDLLPKYPNVDGVVGLNHLYGCGVAIDAPAAIVPIRTIHNLALNPNFGGEITVASLGCEKMQPERLLNIPKENKYIPLANEDIIQLQDERHNGFESMVNHILTVAEQHLEKLNQRTREEVPASNLVVGMQCGGSDAFSGVTSNPAVGFAADLIVQCGGTVMFSEVTEVRDGIHLLTPRAANEQVAKDLIREMKWYDDYLAAGQVDRSANTTPGNKKGGLNNIVEKAMGSIAKSGRSPIVEVLAPGQRPTKKGLIFAATPSSDFICGTQQMASGITVQVFTTGHGTPYGLAAVPVIKMASRNNIANRWYDLIDISAGDIAIGKKTIEEVGWELFEMILRVASGEQQTWSDRWGIHNSLAVFNPAPVT
3K3S Chain:D ((25-102))------IKIHALDNVAVALADLAEGTEVSVDNQTVTLRQDVARGHKFALTDIAKGANVIKYGLPIGYALADIAAGEHVHAHNTR-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3K3S.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output 		Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 356 -24371 -68.46 -312.44
target 2D structure prediction score : 0.49
Monomeric hydrophicity matching model chain D : 0.54

3D Compatibility (PKB) : -68.46
2D Compatibility (Sec. Struct. Predict.) : 0.49
1D Compatibility (Hydrophobicity) : 0.54
QMean score : 0.317

(partial model without unconserved sides chains):
PDB file : Tito_3K3S.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3K3S-query.scw
PDB file : Tito_Scwrl_3K3S.pdb: