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



Input alignment information:
Query sequenceMTYNIVALPGDGIGPEILNGSLSLLEIISNKYNFNYQIEHHEFGGASIDTFGE-PLTEKTLNACKRADAILLGAIGGPKWTDPNNR---PEQGLLKLRKSLNLFANIRPTTVVKGASSLSPLKEERVEGTDLVIVRELTSGIYFGEPRHFNNHEALDSL---------TYTREEIERIVHVAFKLAASR-RGKLTSVDKENVLASSKLWRKVVNEVSQLY--PEVTVNHLLVDACSMHLITNPKQFDVIVCENLFGDILSDEASVIPGSLGLSPSASFSNDGPRLYEPIHGSAPDIAGKNVANPFGMILSLAMCLRESLNQPDAADELEQHIYNMIEHGQTTADL----GGKLNTTDIFEILSQKLNH
2AYQ Chain:A ((1-356))MKMKLAVLPGDGIGPEVMDAAIRVLKTVLDNDGHEAVFENALIGGAAIDEAG-TPLPEETLDICRRSDAILLGAVGGPKWDHNPASLRPE-KGLLGLRKEMGLFANLRPVKAYATLLNASPLKRERVENVDLVIVRELTGGLYFGRPSERR-GP-----GENEVVDTLAYTREEIERIIEKAFQLAQIRR-KKLASVDKANVLESSRMWREIAEETAK-KYP-DVELSHMLVDSTSMQLIANPGQFDVIVTENMFGDILSDEASVITGSLGMLPSASLRSDRFGMYEPVHGSAPDIAGQGKANPLGTVLSAALMLRYSFGLEKEAAAIEKAVDDVLQDGYCTGDLQVANGKVVSTIELTDRLIEKLN-


General information:
TITO was launched using:
RESULT:

Template: 2AYQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -185436 for 2939 contacts (-63.1/contact) +
2D Compatibility (PS) -36343 + (NN) -21353 + (LL) 700
1D Compatibility (HY) -29200 + (ID) 8650
Total energy: -280282.0 ( -95.37 by residue)
QMean score : 0.568

(partial model without unconserved sides chains):
PDB file : Tito_2AYQ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2AYQ-query.scw
PDB file : Tito_Scwrl_2AYQ.pdb: