Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSEALTFESKYALLYLGGGLLAMIYGLITFFMAFPA----FTSRGNVIFTIKTGPSGEIFLRK------RSVLFSEVKRLYMGRHQYSLKGIFFEDIIIEKTDGKIVRIPTWNIITNPLFFEAVERYILPHLNEEAQNNWISQFTEVQRKAYLKEFENHPKL 1MIX Chain:A ((305-365)) ----------------------LKTYGVSFFLVKEKMKGKNKL-VPRLLGIT--KECVMRVDEKTKEVIQEWSLTNIKRWAASPKS----------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1MIX.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 : 127 -17676 -139.18 -346.58 target 2D structure prediction score : 0.29 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : -139.18 2D Compatibility (Sec. Struct. Predict.) : 0.29 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.298

(partial model without unconserved sides chains): PDB file : Tito_1MIX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1MIX-query.scw PDB file : Tito_Scwrl_1MIX.pdb: