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



Input alignment information:
Query sequenceMNFARQHFRKHQAKSAAEQAAEFGSMKNATAYELQLMQLNNDRARLKQIQSTENKIKLKAELLPTYAPYIDGILEAQSGVQDEILTEIMIWNIDTSNFSRALQIAEYVLVHNLALPDRFERTPACVITEEISAAFLKQLKTNVEID-IDVLKQLESLMTNPDLPEKTLDMPDQVKAKMYLALGKAEIRFISDKDKPDLVHTKAAADYLQKAVELDDKCGGRGDLNMVQKLLDKFAPATEANKGDAAASS
3GW4 Chain:B ((71-188))-------------------------------------------------------------------------------------HQVGMVERMAGNWDAARRCFLEERELLASLPEDPLAASAN-----AYEVATVALHFGDLAGARQEYEKSLVYAQQ-------AD-DQVAIACAFRGLGDLAQQEKN---------LLEAQQHWLRARDIFAELEDSEAVN------------------------


General information:
TITO was launched using:
RESULT:

Template: 3GW4.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 : 461 -13066 -28.34 -111.68
target 2D structure prediction score : 0.60
Monomeric hydrophicity matching model chain B : 0.58

3D Compatibility (PKB) : -28.34
2D Compatibility (Sec. Struct. Predict.) : 0.60
1D Compatibility (Hydrophobicity) : 0.58
QMean score : 0.431

(partial model without unconserved sides chains):
PDB file : Tito_3GW4.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3GW4-query.scw
PDB file : Tito_Scwrl_3GW4.pdb: