Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLILTRRVGETLMIG----------------DQVSVTVLGVKGNQVRIGVNAPKEVSVHREEIYQRIQHERAMHEHLQHLDQDYQVSYEDDNYAQKNFNR 4KRW Chain:A ((11-73)) FLILSRREGEGITLSLKADYPAEELIRQLREGGIRILVTDIIGNQARVGIEAPRGVLIVRDEL-------------------------------------

General information: TITO was launched using: RESULT: Template: 4KRW.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 : 62 -2417 -38.98 -51.41 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -38.98 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.654

(partial model without unconserved sides chains): PDB file : Tito_4KRW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KRW-query.scw PDB file : Tito_Scwrl_4KRW.pdb: