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



Input alignment information:
Query sequenceMSQDEQVRAWLERELDG-TVVAFER-Q-ERWRAAWFAELKNQGELRSYYVRGHRGGNFREMITLGQEADINRVLHRHGVPVPRVHGMIDDPPAIVMDRLPGR-VNLATALDDAEREAVLDQYVDAMCRMHAIDVNEFGALGLPVPADNRAAALNMYATGERNYRRAKT---APSPMIEFMWRWLCRNVPAGRTQQGLIQADAA--QFLFEQGRMTGLIDFEAAYIGDPIAEFAAMRSRDCEEPLGDIGRIARRYEAVTGEPVDRDAVEFHTAGWSLMTPFQWEDSVRNPAPGDSWLEYFTWLVGCGRWALEAIAAVAGAPLPTVEAPAQRPSSYSSAAYTNLMSLLDEWPTASAYEGFRADSARAVTRFAEHVHAFGADLEGAAVEEISELLGTRQPDLATAEAALEQFVLRASPDLDVALVQYFHRWTQRQQFLIAGTGARHEKLIHLSLQPLTADAWQAEGQSRRHA
3DXQ Chain:B ((3-261))---TDEARAKLAAIPMLAGYTGPLERLGGLTNLVFRA---G-----DLCLRIP---------NRANEAVAAREAAKAGVS-PEVLHVDPATGVMVTRYIAGAQTMSPEKFK--TRPGSPARAGEAFRKLHGSGAVFPFRF------ELF----AMIDDYLKVLSTKNVTLPAGYHDVVREAGGVRSALAAHPLPLAACHCDPLCENFLDTG-ERMWIVDWEYSGMNDPLWDLGDLSVEGK-FNANQDEELMRAYFGGEARPAERGRVVIYKAMCDLLWTLWGLIQL---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3DXQ.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 : 1133 -1016 -0.90 -4.20
target 2D structure prediction score : 0.47
Monomeric hydrophicity matching model chain B : 0.58

3D Compatibility (PKB) : -0.90
2D Compatibility (Sec. Struct. Predict.) : 0.47
1D Compatibility (Hydrophobicity) : 0.58
QMean score : 0.185

(partial model without unconserved sides chains):
PDB file : Tito_3DXQ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3dxq-query.scw
PDB file : Tito_Scwrl_3DXQ.pdb: