Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence WYNKSISRDKAEKLLLDTGKEGAFMVRDSRTAGTYTVSVFTKAVVSENNPCIKHYHIKETNDNPKRYYVAEKYVFDSIPLLINYH 3S9K Chain:A ((11-94)) WYNKSISRDKAEKLLLDTGKEGAFMVRDSRTPGTYTVSVFTKAIISE-NPCIKHYHIKETNDSPKRYYVAEKYVFDSIPLLIQYH

General information: TITO was launched using: RESULT: Template: 3S9K.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 : 246 -15572 -63.30 -185.38 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.99 3D Compatibility (PKB) : -63.30 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.99 QMean score : 0.449

(partial model without unconserved sides chains): PDB file : Tito_3S9K.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3S9K-query.scw PDB file : Tito_Scwrl_3S9K.pdb: