Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAFDKQKLDVTNDVTGRFQNGRLS-LYHDNEMIGQMTSM--NEYELKSGYSFENEKFYKTADVVSGDDAKYVDCDYENGWC----- 3R84 Chain:A ((4-84)) -GYIQERLKSLNDIETQLC----SMLQEASQVTFIFGELKRGNESVKPQFENHVKQFYERLDKSTTQLRKEIQLLDENVGTRLLPI

General information: TITO was launched using: RESULT: Template: 3R84.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 : 116 9037 77.90 123.79 target 2D structure prediction score : 0.19 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 77.90 2D Compatibility (Sec. Struct. Predict.) : 0.19 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.024

(partial model without unconserved sides chains): PDB file : Tito_3R84.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3R84-query.scw PDB file : Tito_Scwrl_3R84.pdb: