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



Input alignment information:
Query sequenceMATNKKEIIRLLEEIATYMELKGENSFKISAFRKAAQAI-ELDSRSLSEIDD-----FTKISGIGKTTGEIIQRYLDSGECPELEELKKEVPAGLVPLLDVPGLGGKKLSRLYHELGVVDKDTLLQEAENGHIEALKGFGKKSAEKMAEAVREMGERPDRYPLNDVLPIIQKVEAYLAEIAPIETFAQAGSLRRLRETVKDLDYVIATEKPEDVQKALLAFPLITDVIGAGETKVSAVLEDNITISVDFRLVEKKAFATTLHHFTGSKDHNIKMRQLAKQSNEKISEYGVEQEDGTVRHFESEKTFFEHFKIPFLPPEVRRDGTEIERVTKD--TKFLELSDIRGDLHMHTTWSDGAYAIPEMIEACIAKGYEYMVITDHGKFLRVANGLDEKRLLEQQAEIKKIAAKYPEIDVYSGVEMDILADGSLDFDDETLKQLDFVIASIHSSFQQSEEEIMKRLKTACENPYVRLIAHPTGRIVVKRKPYHVNMKELIQLAKSTGTALELNANPQRLDLNREHLEMAHAAGVPIAINTDAHDTKHLDFMSIGVRAATKAWLGKSAILNTKTAAEFKQFLQNK
3AU2 Chain:A ((2-572))---RNQELARIFEEIGLMSEFLGDNPFRVRAYHQAARTLYDLDT-PIEEIAEKGKEALMELPGVGPDLAEKILEFLRTGKVRKHEELSRKVPRGVLEVMEVPGVGPKTARLLYEGLGIDSLEKLKAALDRGDLTRLKGFGPKRAERIREGLALAQAAGKRRPLGAVLSLARSLLEAIRALPGVERAELCGSARRYKDTVGDLDFLVASREGERAVEGFVRLPQVKEVYAKGKERATVFLKNGL--QVDLRVVPPESYGAGLQYLTGSKAHSIRLRALAQEKGLKLSEYGVFRGEKRIAG-ETEEEVYAALGLPWIPPPLREDQGEVEAALEGRLPKLLELPQVKGDLQVHSTYSDGQNTLEELWEAAKTMGYRYLAVTDHSPAVRVAGGPSPEEALKRVGEIRRFNETHGPPYLLAGAEVDIHPDGTLDYPDWVLRELDLVLVSVHSRFNLPKADQTKRLLKALENPFVHVLAHPTARLLGRRAPIEADWEAVFQKAKEKGVAVEIDGYYDRMDLPDDLARMAYGMGLWISLSTDAHQTDHLRFMELAVGTAQRAWIGPERVLNTLDYEDLLSWLKAR


General information:
TITO was launched using:
RESULT:

Template: 3AU2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -245643 for 4830 contacts (-50.9/contact) +
2D Compatibility (PS) -61924 + (NN) -32818 + (LL) 892
1D Compatibility (HY) -45200 + (ID) 9450
Total energy: -394143.0 ( -81.60 by residue)
QMean score : 0.548

(partial model without unconserved sides chains):
PDB file : Tito_3AU2.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3AU2-query.scw
PDB file : Tito_Scwrl_3AU2.pdb: