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



Input alignment information:
Query sequenceMEHNGHDKLNGVLRGFLGDSFTLDGKEGGLNMSKMLEFIKKEKPKMNVLLMGATGVGKSSLINALFGKEITKTGVGKPITQHLEK--YIDEEKGLILWDTKGIEDKDYHDTMQSIKKEMEDSFKTLDEKEAIDVAYLCVKETSSRVQERERELLSFAKHWNIPTIVVFTHTQAEAGDAFVQETKGIIDEEWGFKGFVRAYVRVNSVAFSFRGLKVPVEGLEELVDETKKCLSDAEKNKKRHFLSIQRVKIQERKQAMIEECKTIIHVASGAAGVAGLIPIPFSDALAIAPIQAGMIYKMNDAFGMDLDKSVGASLVAGLLGVTAVAQVGRTLVNGFLKFIPVVGSVAGGATAAVITEGIGFAYLKVLEKCFNDETGEVNLPGEVGMITSLFKENYLNLDTIKKLKP
3A1S Chain:A ((3-167))------------------------------------------LHMVKVALAGCPNVGKTSLFNALTGTKQYVAN-WPGVTVEKKEGVFTYKGYTINLIDLPGTYSLGYSSI----DEKIARDY---LLKGDADLVILVADSVNPE---QSLYLLLEILEMEKKVILAMTAIDEAKKTGMKIDR-YELQKH-----LGIPVVFTSSV----TG-----EGLEELKEKIVEYAQKNTILHRMILDYGEKVESEIKKVENFLRDKKLRINPRYFALKYLSGDPEFYSEGVKLGLPELSEEERIGYRLLIAKRKREYVENVVKEAFA-----------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3A1S.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -31348 for 1287 contacts (-24.4/contact) +
2D Compatibility (PS) -17974 + (NN) -6532 + (LL) 10836
1D Compatibility (HY) -6000 + (ID) 1700
Total energy: -52718.0 ( -40.96 by residue)
QMean score : 0.460

(partial model without unconserved sides chains):
PDB file : Tito_3A1S.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3A1S-query.scw
PDB file : Tito_Scwrl_3A1S.pdb: