Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLTKRLLTIYIMLLGLIAWFPGAAQAEEKQPAVPAVFLMKTIEGEDISIPN-KGQKTILHFWTSWCPPCKKELPQFQSFYDAHPSDSVKLVTVNLVNSEQNQQVVEDFIKANKLTFPIVLDSKGELMKEY------HIITIPTSFLLNEKGEIEKTKIGPMTAEQLKEWTEE 3OR5 Chain:A ((28-168)) --------------------------ADARPTPAPSFSGVTVDGKPFSSASLKGKAYIVNFFATWCPPCRSEIPDMVQVQKTWASRGFTFVGIAVNE---QLPNVKNYMKTQGIIYPVMMATP-ELIRAFNGYIDGGITGIPTSFVIDASGNVSGVIVGPRSKADFDRIVK-

General information: TITO was launched using: RESULT: Template: 3OR5.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 : 614 -90033 -146.63 -671.89 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -146.63 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.642

(partial model without unconserved sides chains): PDB file : Tito_3OR5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OR5-query.scw PDB file : Tito_Scwrl_3OR5.pdb: