Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVETITIFVLAIFVGYYVVWGVTPALHTPLMAVTNALSSIIVVGAMLQTVGLPVLGVDANVAFQSVNVVSVLGAIAVFLASINIFGGFAVTARMLEMFKPKQKK 4KQM Chain:A ((520-557)) ---------LGVFPSYYEPWGYTPAECT-VMGVPSITTNVSGFGSYME--------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4KQM.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 : 137 -16481 -120.30 -433.70 target 2D structure prediction score : 0.13 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : -120.30 2D Compatibility (Sec. Struct. Predict.) : 0.13 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.202

(partial model without unconserved sides chains): PDB file : Tito_4KQM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KQM-query.scw PDB file : Tito_Scwrl_4KQM.pdb: