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



Input alignment information:
Query sequenceMLPELQRSITWIQGTALTIGAVLGCGILILPSVTADTAGPASLFVWVFMSFLSFFLVGTLARLVKIAPSAGGITAYVQLAFQKKAGAILGWIMLGSVPIGVPIIALTGAHYVSYITEAADWQITLIAGCMLAISILLHMRGIQLSANISTLVICVIVFLLVTSIAVSLPHVTIAEFKPFLPHGWSAAGSVSVMIFFSFVGWE---MITPLAEEFHRPEKDVPLSLFLAASCVAGLYIMLSFVTVGTHSYGE----NGEIASLAMLISKGAGESGVYVTVCLALFITFATIHANIAGFSRMVYALAREGHIPVFFGKLSATKRTPIRVLTAMAAVFGLVLAAHGLFQIDLTTLLKGPSAAFIASYICTMAAALKLLGRRDIGWWMALGAFVACAVIYSFSGWALLYPAVLAAAGYFYMKTKGGHKKKLDHVL
4HFJ Chain:A ((98-181))-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LVWGMTGWEEYSIITP---LFKIHDKDVPLSYYTGILGMPGMTAYAGFHEVCSPKKGETVFVSAASGAVGQLVGQFAKMLGCYV----------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 4HFJ.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 : 202 -35576 -176.12 -480.76
target 2D structure prediction score : 0.57
Monomeric hydrophicity matching model chain A : 0.43

3D Compatibility (PKB) : -176.12
2D Compatibility (Sec. Struct. Predict.) : 0.57
1D Compatibility (Hydrophobicity) : 0.43
QMean score : 0.165

(partial model without unconserved sides chains):
PDB file : Tito_4HFJ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4HFJ-query.scw
PDB file : Tito_Scwrl_4HFJ.pdb: