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



Input alignment information:
Query sequence-----------------------MSGI---QWIKLSVNMFDD-EKIKLLEKMPEGNQMLIVWIRLLALA-GKTNDKGRIY---LNENVPYTEDMLATLFNRDVGIIRVTLHTLQSFGMIQKTENGLIEIENWEK-HQNVDGMERVREQTRKRVEKHREAMRQNRIASGDSKGNKECNVTSSVTVTQSNAIDIDKELDKDINNNNSDLNFKDFWEQNGFGMMLPVELEKLLAWVDDFAGNREIV------MKALEVTSEQGANKRNYAYVNKILKNW----------------ESRGFKTIADVDAAEKQRQIELEQ------KYNKPTYNKYNK------PVKEEVLPDWFDKDQKQTKQETSTTGSS--------------------------------------EDLEKQVAEIKAQLAARNEVQA-
4LYP Chain:A ((34-449))SEFAFVKIASDGKGFTRYGEPYLIRGANYWQGMNLGADDCSGGDRKRMELEIKQMAEMGINNLRVMASSEGPDDQPYRMRPSMMPQPGKYNEGVFVGLDYLLDTMDRYNMTAVMTLGNFWQWSGGFGQYVAWITGNQTIPYP--VGDVTYDEFTQFAARFYNDS--EIAPKANKLFKDHIYTVQNRRNTVN-GKIYKED-------PVIMSWQIANEPQEAPASWFEEISTFIKKGAPKHLVSAGLESKLDEYDFDRAHDHKNIDYTTCHCWVENWGIYDPADPDGLPHANEYMHDFLESRSKWAAQLNKPIVMEEFGMARDAWRNPEDETYKYLPSTPTSHKDEYYQKAFNQIVSLASNR-SFSGSNFWAYGGEGRSTYPPNPYGMVWLGDPPHEPHGWYSVYSNDTTVQIIKDYNANLLKVQKELSK


General information:
TITO was launched using:
RESULT:

Template: 4LYP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) 80806 for 2441 contacts (33.1/contact) +
2D Compatibility (PS) -32333 + (NN) -2714 + (LL) 588
1D Compatibility (HY) -8000 + (ID) 2300
Total energy: 36047.0 ( 14.77 by residue)
QMean score : 0.158

(partial model without unconserved sides chains):
PDB file : Tito_4LYP.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4LYP-query.scw
PDB file : Tito_Scwrl_4LYP.pdb: