Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELNPTEKDKLLIFTAGLVAERRKARGLKLNYPEAVAFISAALLEGARDGMTVSELMHFGTTLLKRKDVMDGVPEMIAEVQVEATFPDGSKLVTVHQPIV 4AC7 Chain:A ((5-99)) --LNPAEKEKLQIFLASELLLRRKARGLKLNYPEAVAIITSFIMEGARDGKTVAMLMEEGKHVLTRDDVMEGVPEMIDDIQAEATFPDGTKLVTVHNPI-

General information: TITO was launched using: RESULT: Template: 4AC7.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 : 364 2468 6.78 25.97 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : 6.78 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.078

(partial model without unconserved sides chains): PDB file : Tito_4AC7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4AC7-query.scw PDB file : Tito_Scwrl_4AC7.pdb: