Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSESSARTEMKI-SLPENLVAELDGVAMREKRSRNELISQAVRAYVSERTTRHNRDLMRRGYMEMAKINLNISSEAHFAECEAETTVERLVSGG 3H87 Chain:C ((2-45)) -------SDVLIRDIPDDVLASLDAIAARLGLSRTEYIRRRLAQDAQTARV-------------------------------------------

General information: TITO was launched using: RESULT: Template: 3H87.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 53 -9888 -186.56 -229.94 target 2D structure prediction score : 0.81 Monomeric hydrophicity matching model chain C : 0.65 3D Compatibility (PKB) : -186.56 2D Compatibility (Sec. Struct. Predict.) : 0.81 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.593

(partial model without unconserved sides chains): PDB file : Tito_3H87.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3H87-query.scw PDB file : Tito_Scwrl_3H87.pdb: