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



Input alignment information:
Query sequence-----------------------------------MLEGEIPEKYRSVDEEEINRSFGGSLPAVHAVVKSYLQIIWVTKWTE------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4BVA Chain:A ((24-334))KRAPAFLSAEEVQDHLRSSSLLIPPLEAALANFSKGPDGGVMQPVRTVVPVAKHRGFLGVMPAYSAA-EDALTTKLVTFYESHQASVLLFDPSNGSLLAVMDGNVITAKRTAAVSAIATKLLKPPGSDVLCILGAGVQAYSHYEIFTEQFSFKEVRMWNRTRENAEKFASTVQGDVRVCSSVQEAVTGADVIITVTMATEPILFGEWVKPGAHINAVGASRPDWRELDDELMRQAVLYVDSREAALKESGDVLLSGADIFAELGEVISGAKPAHCEKTTVFKSLGMAVEDLVAAKLVYDSWSSG


General information:
TITO was launched using:
RESULT:

Template: 4BVA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -308 for 216 contacts (-1.4/contact) +
2D Compatibility (PS) -4778 + (NN) 1241 + (LL) 192
1D Compatibility (HY) -1200 + (ID) 600
Total energy: -5453.0 ( -25.25 by residue)
QMean score : -0.004

(partial model without unconserved sides chains):
PDB file : Tito_4BVA.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4BVA-query.scw
PDB file : Tito_Scwrl_4BVA.pdb: