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



Input alignment information:
Query sequenceMSWLSSLKSVFSPAQEVKEEEIQTVLQNYLLPDSKDALKERISQLQVQGRVLQLTINTFPDEKEYLQQIHDDLAGALQKCGIEELNLHVVQQKRPTQESSGQGCSSKAPKENSNLPPVLDASPKSEPDPNNPPIQKAALQQRDVPLHPR---IKNVILVSSGKGGVGKSTTTVNLALALQKMGLKVGVLDADIYGPSIPTMLGNAGKTPLIESENFVPLDAYGMAVLSIGHLTGDNNTPVAWRGPKATGALMQLFNQTLWPDLDVLMIDMPPGTGDIQLTLAQRIPVTGSIIVTTPQNVALLDATKGIELFNKVGIPVLGVVENMSTHICSNCGHEEQIFGIGGGDKLSEQYHIPLLARLPLNAQIREHADQGKPSVVAMDDAADSYIDIAKAVWQQIEKIPQRTRDDKRIF
5AUN Chain:B ((3-218))-----------------------------------------------------------------------------------------------------------------------------------------AIDPREIAINARLEGVKRIIPVVSGKGGVGKSLVSTTLALVLAEKGYRVGLLDLDFHGASDHVILGFEPKEFPEEDRGVVPPTVHGIKFMTIAYYTEDRPTPL--RGKEISDALIELLTITRWDELDYLVIDMPPGLGDQLLDVLRFLKRGEFLVVATPSKLSLNVVRKLIELLKEEGHKVIGVVENMKL---------KDV------EKLAEEFGVPYLVGIPF--------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 5AUN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1066 -29864 -28.01 -145.68
target 2D structure prediction score : 0.59
Monomeric hydrophicity matching model chain B : 0.69

3D Compatibility (PKB) : -28.01
2D Compatibility (Sec. Struct. Predict.) : 0.59
1D Compatibility (Hydrophobicity) : 0.69
QMean score : 0.528

(partial model without unconserved sides chains):
PDB file : Tito_5AUN.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-5AUN-query.scw
PDB file : Tito_Scwrl_5AUN.pdb: