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



Input alignment information:
Query sequence------------MKNF----YDWIKEFVRDQGEFIAQQSGWLELERSSYAKLIAQTISHV---LNGGSLLVSADSS---------RRWFLNYILSNLN-------------PKDLKERPLLSVIDFNASSFYPKNDANLSLATIELTYQN--PMFWHVGRVENEGLKTLLLSKIPSFLWLFEELKEDCLLLKEHDSLLDYKLLQLF-KLFENALFSALYNKVAL--------------------
4E1S Chain:A ((1-242))QHYGTAEVNLQSGNNFDGSSLDFLLPFYDSEKMLAFGQVGARYIDSRFTANLGAGQRFFLPANMLGYNVFIDQDFSGDNTRLGIGGEYWRDYFKSSVNGYFRMSGWHESYNKKDYDERPA-NGFDIRFNGYLPSYPALGAKLIYEQYYGDNVALFNSDKLQSNPGAATVGVNYTPIPL-VTMGIDYRHGTGNENDLLYSMQFRYQFDKSWSQQIEPQYVNELRTLSGSRYDLVQRNNNIILEYK


General information:
TITO was launched using:
RESULT:

Template: 4E1S.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -28018 for 1123 contacts (-24.9/contact) +
2D Compatibility (PS) -17975 + (NN) 10887 + (LL) 332
1D Compatibility (HY) -4800 + (ID) 1850
Total energy: -41424.0 ( -36.89 by residue)
QMean score : 0.030

(partial model without unconserved sides chains):
PDB file : Tito_4E1S.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4E1S-query.scw
PDB file : Tito_Scwrl_4E1S.pdb: