Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVKVGLVDDYRVDLEKLEAIVSRMQDVEIVFSTDSAKEAYRRV-KNGDIDLLLADIEMPHMSGYELADLIKSHSL--DVDVIFVTGHGGYA--VHAFDLNVHDYIMKPYYADRLAASFDRYLKKKTETSLNGRILIKQKSEMHVLQKKDIIFAERTGRSTTIVTTAEEVQTYQTLNDIKGDLPEKDFLRSHRSFIINIHYIKHFSAYTKHSFTVSFEGTSKKAMITKQQLDYFQNYYF 3H1E Chain:A ((6-125)) -MKLLVVDDSSTMRRIIKNTLSRLG-YEDVLEAEHGVEAWEKLDANADTKVLITDWNMPEMNGLDLVKKVRSDSRFKEIPIIMITTEGGKAEVITALKAGVNNYIVKPFTPQVLKEKLEVVL--------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3H1E.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 : 545 -76522 -140.41 -665.41 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -140.41 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.582

(partial model without unconserved sides chains): PDB file : Tito_3H1E.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3H1E-query.scw PDB file : Tito_Scwrl_3H1E.pdb: