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



Input alignment information:
Query sequenceMSQTLIAALQNPALYPHPVERFEVIETHISWVLLTGPYAYKIKKPMDFGFLDFTSLDKRRFYCNEELRLNQRLTDDLYLEVLPITGSEEAPRIGGDGEAIEYLLKMRQFPQDN-LLAAIQGRGELSNQHIDELAEQIAHFHQNTPKVPLEHPLGTAESCMAPVRQNFEQVRPLLKDKADLQQLDALEAWAESSFERLLPVLQERKAKGFIRECHGDIHLGNAALIDGRVVLFDCIEFNEPFRFTDVCADFAFLAMDLEDRGLKCHARRFVSLYLEHTGDYQALELLNFYKAYRAMVRAKVALFSLGYQTDAVQRAATLRQYRNYANLAESYSAIPSRFLAVTHGVSAVGKSQVAMRLVEALGAVRLRSDIERKRLFGEQPEHDRGQFAAGIYSSQASEATYAHLHQLAAKILQAGYPVVIDAAYLKQNQRQAACHIAEETGVPFLILDCQAPEAVIAGWLAQRQAEGKDPSDATLDVIRTQQATREPLTAAETVQSKRVDTHDAASLDGLVDGIRQRLPGL
3DXQ Chain:B ((23-265))---------------------LERLGGLTNLVFRAGDLCLRIP------------------NRANEAVAAREAAKAGVS-PEVLHVDPA-----------TGVM-VTRYIAGAQTMSPEKF--KTRPGSPARAGEAFRKLHGSGAVFPFRFE------LFAMIDDYLKVLSTKNVTL--PAGYHDVVREAGGVRSALA----A--HPLPLAACHCDPLCENFLDTGERMWIVDWEYSGM----NDPLWDLGDLSVEGKF--NANQDEELMRAYFGGEARPAERGRVVIYKAMCDLLWTLWGLIQLANDN--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


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 : 1089 -50806 -46.65 -217.12
target 2D structure prediction score : 0.62
Monomeric hydrophicity matching model chain B : 0.59

3D Compatibility (PKB) : -46.65
2D Compatibility (Sec. Struct. Predict.) : 0.62
1D Compatibility (Hydrophobicity) : 0.59
QMean score : 0.157

(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: