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



Input alignment information:
Query sequenceMKLSKQLYKSLPLLTVVLCVGALQQNVEAKAKHYKTTSHVETQYVSTSSKKILPFTHNKQIKVGPLDNLGRATYSHIQLRDADEPKIKRERLTYNPTGWHNYKFTTEKGKTTWLMDRGHLVGYQFSGMN---N---VPENLVTMTKYLNTGFSENNPDGMLYYEN-RLDSWLANHKNFWLDYKVTPIYEGNNLVPSRVELQYVGIDKQGKLLEIKLGGGKEQTDEYGVTTVTLENTSPLAKIDYKTGMLIKEDGKQAEEGEDPNSDADENEAAIESASDIEENTNTNTSESDTNNVAPKNRIVYVANKGRSNTYWYSLENIKNANTANIVQMTEQEALNQHKHHSTTEAQ
3NKQ Chain:A ((635-702))-----------------------------------------------------------------------------------------------------------------QMSYGFLFPPYLSSSPEAKYDAFLVTNMVPMYPAFKR--------VWTYFQRVLVKKYASE--RNGVNVISGPIFDYNYNGLRDIEDEIKQYVEGSSIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYLHTYE-----------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3NKQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -12518 for 298 contacts (-42.0/contact) +
2D Compatibility (PS) -6497 + (NN) -652 + (LL) 9604
1D Compatibility (HY) -3600 + (ID) 550
Total energy: -14213.0 ( -47.69 by residue)
QMean score : 0.082

(partial model without unconserved sides chains):
PDB file : Tito_3NKQ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NKQ-query.scw
PDB file : Tito_Scwrl_3NKQ.pdb: