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



Input alignment information:
Query sequenceMLKRFLALVWLRCQIILSNKSIL---LQVLVPFAFTYFYKYLMETQGKVNDQQALVLLMMCLPFSLALAVGSPITIILSEEKEKYNLQTLLLSGVKGSEYILSTMFLPFLLTFVIMGTTPLILGVTIVHTFNYITIVLLTSLSIILFYLLIGLTAKSQVVAQVISLPAMILVAFLPMLSSLDKTVAKITDYSFMGLFTKFFTKWEGFSWNETLIPNLTLLIWIVLLLTLITITIRKKKIS
3IR3 Chain:A ((113-145))-LKRFIAIIAVSCSVIESKKTVMEGWVKVMVPEA--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3IR3.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 : 51 -13809 -270.76 -460.30
target 2D structure prediction score : 0.13
Monomeric hydrophicity matching model chain A : 0.40

3D Compatibility (PKB) : -270.76
2D Compatibility (Sec. Struct. Predict.) : 0.13
1D Compatibility (Hydrophobicity) : 0.40
QMean score : 0.529

(partial model without unconserved sides chains):
PDB file : Tito_3IR3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3IR3-query.scw
PDB file : Tito_Scwrl_3IR3.pdb: