Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTPGSVFFDQQFSFHDGE-SGEKLFVILGWD--N---GIAIVAKTTSQQHGRGTTFGCQPKDRFHNFYLPQNSCYFRKCTWVCLDEFYELNAVEVLQKRFSGLINPVCNLTNEMLRKLQDCALESDDLSGRQESIIRSSLV 4HKE Chain:B ((3-114)) VKRGDVYFADLSPVVGSEQGGVRPVLVIQNDIGNRFSPTVIVAAITAQIQKAK-LPTH--------VEIDAKKYGFERDSVILLEQIRTIDKQRLT--------DKITHLDEVMMIRVDEALQISLGLI------------

General information: TITO was launched using: RESULT: Template: 4HKE.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 490 -5297 -10.81 -49.97 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -10.81 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.457

(partial model without unconserved sides chains): PDB file : Tito_4HKE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HKE-query.scw PDB file : Tito_Scwrl_4HKE.pdb: