Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRTYAYVRIEPNLQFEFSRYISFFSEYGYKIQKNRLVVEEVSVDKSIVYRDKFLNLISYSLEEGDILVIKSMDCLGNSFEEILDIVNKIDQKKIRLICLDYSKSEINGDLKIFFLHFLKLSAEFEK---LFKSDKKNFKDHKPTRKVGRPEILNNEQKSRVIELFKKGYSVYSLAKEFSVTRTVIQRILNNASKTNIL 5CY1 Chain:A ((1-181)) MRIFGYARVSTSQQ-SLDIQIRALKDAGVK--ANRIFTDKAS-----TDREG-LDLLRMKVEEGDVILVKKLDRLGRDTADMIQLIKEFDAQGVAVRFIDDGIS-TDGDMGQMVVTILSAVAQAERRRILERTNEGRQEAKLKGIKFGRRRTVD---RNVVLTLHQKGTGATEIAHQLSIARSTVYKILED-------

General information: TITO was launched using: RESULT: Template: 5CY1.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 584 -66423 -113.74 -379.56 target 2D structure prediction score : 0.78 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -113.74 2D Compatibility (Sec. Struct. Predict.) : 0.78 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.634

(partial model without unconserved sides chains): PDB file : Tito_5CY1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CY1-query.scw PDB file : Tito_Scwrl_5CY1.pdb: