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



Input alignment information:
Query sequenceMTFIKRLEDAYETLLGNYPAGVSSTSTSKYNEIRKIVSEAFLIGENEVYVTGTSRRISNLDTRFAQGNQRNKHTRMAVAFISIPSVDDSELDELIIRTRNSAITTSSKFCNGEERGTIFDGILLFLVFEGETKVYPLAFLVFENDFELKEKAEELIPGIELKEYPRANQSPAQENNKSAKNEDEESA----KSYVVFLDIEEDGSIVEFVEDKDKTYRIGDMIWTASHTNGSSAITRRLEVIEVVENLVVCKIKHKYNEPVDKNSLLKFVNIEQDLISFLDLHPNVQNGSEGFVSGDIVDENATTSSDDLPEDFENN
3K4E Chain:A ((199-293))------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SEDQESILNELKDFIPYL-----------IQDQYGNYVIQYVLQQDQFTN-KEMVDIKQEIIETVANNVVEYSKHKFASNVVEKSILYGSKNQKDLI----------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3K4E.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 : 282 -17990 -63.79 -222.09
target 2D structure prediction score : 0.51
Monomeric hydrophicity matching model chain A : 0.58

3D Compatibility (PKB) : -63.79
2D Compatibility (Sec. Struct. Predict.) : 0.51
1D Compatibility (Hydrophobicity) : 0.58
QMean score : 0.107

(partial model without unconserved sides chains):
PDB file : Tito_3K4E.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3K4E-query.scw
PDB file : Tito_Scwrl_3K4E.pdb: