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



Input alignment information:
Query sequence---MHEITLHEVRQLIASLRTVYAAQFNKQFPTSGESAIPLSVVEQIALKTLVGVQQN-QFNNALARLLTAGGRFMPSFAEFR-----------TWCIGESWMSPEEA-----WSRACKFTTDRTVVITQITKYALDEVMYLIEAGQMRAAQDNFFGTYNVMVAKAQLKGRQQEFYTPPLQLEHKEPEHTPVSNDEVQKQLKSLMERLKINGR----KPAPVQKLQAKEKEPELAKELGPDPFDNPHEYAEMCRREGMPIPRNILQLIEGANV
4WD8 Chain:A ((25-292))SKIIFRLLLNVLMSIIAIISYQWYEQLGIHLTVAPFSLLGIAIAIFLGFRNSASYSRFVEARNLWGTVLIAERTLVRQLRNILPAEHDAHRRIVSYLVAFSWSLKHQLRKTDPTADLRRLLPEERVTEILASSMPTNRILLLAGNEIGQLREAGKLSDITYGLMDNKLDELAHVLGGCERLATTPVPFAYTLILQRTVYLFCTLLPFALVGDLHYMTPFVSVFISYTFLSWDSLAEEL-EDPFGTAANDLP-LNAMCNTIERNLLDMTGQ---


General information:
TITO was launched using:
RESULT:

Template: 4WD8.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 : 841 -12776 -15.19 -52.36
target 2D structure prediction score : 0.47
Monomeric hydrophicity matching model chain A : 0.65

3D Compatibility (PKB) : -15.19
2D Compatibility (Sec. Struct. Predict.) : 0.47
1D Compatibility (Hydrophobicity) : 0.65
QMean score : 0.219

(partial model without unconserved sides chains):
PDB file : Tito_4WD8.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4WD8-query.scw
PDB file : Tito_Scwrl_4WD8.pdb: