Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEHHKTYHSANIKTATGSLLIEGPVSPEDLAGYEFHKDLTAFRPPREQHEALVDIAGLPEGRIIIARDGRTIVGYVTYLYPDPLERWSEGNMEDLIELGAIEVAPDYRGCAVGKTLLTVSMMDEQMENYIVMTTEYYWHWDLKGMKKDVWEYRKIMEKMMNAGGLVWFATDEPEISSHPANCLMARIGKNVSQESIEQFDRLRFYHRYMY 4E8O Chain:A ((21-167)) --------GMNIMPISES---------QLSDWLALRCLLWPDHEDVHLQEMRQLITQAHRLQLLAYTDTQQAIAMLEASIR--YEYVNGTQTSPVAFLEGIFVLPEYRRS---------------------------------GIATGLVQQVEIWAKQFACTEFASDAAL----DNQISHAMHQALGFH-------ETERVVYFKKNIG

General information: TITO was launched using: RESULT: Template: 4E8O.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 : 555 -71073 -128.06 -483.49 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -128.06 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.301

(partial model without unconserved sides chains): PDB file : Tito_4E8O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4E8O-query.scw PDB file : Tito_Scwrl_4E8O.pdb: