Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDFREVIEQRYHQLLSRYIAELTETSLYQAQKFSRKTIEHQIPPEEIISIHRKVLKELYPSLPEDVFHSLDFLIEVMIGYGMAYQEHQTLRGIQQEIKSEIEIAANVQQTLLGTKVPQEEALDIGAISVPAKQMSGDYY-HFVKDKESINIAIADVIGKGIPAALCMSMIKYAM----------DSLPETGIHPSQVLKNLNRVVEQNVDASMFITMFYANYNMDKHQFTYASAGHEPGFYYSQKDNTFYDLEAKGLVLGISQDYDYKQFDQHLEKGDMIVLFSDGVTECRTENGFLERPDLQKLIEEHMCSSAQEM--VKNIYDSLLKLQDFQLHDDFTLIVLRRKV 3EQ2 Chain:A ((175-390)) -----------------------------------------------------------------------------------------------------------------------EGLEFSHRII-----SGDFVDYFRVDERRVAFYLADVSGHGASSAFVTVLLKFMTTRLLYESRRNGTLPE--FKPSEVLAHINRGL-INTKLGKHVTMLGGVIDLEKNSLTYSIGGHLPLPVLFVEGQAGY-LEGR--PVGLFDDA--DDRVMELPPSFSLSLFSDGILD-----TLKEK---EASLPEQVAAAG--LDGLRQVF-GLANLA--E--DDIALLVLS---

General information: TITO was launched using: RESULT: Template: 3EQ2.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 : 906 -106315 -117.34 -574.67 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -117.34 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.375

(partial model without unconserved sides chains): PDB file : Tito_3EQ2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3EQ2-query.scw PDB file : Tito_Scwrl_3EQ2.pdb: