Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLAAIWAQDENGLIGKEDRLPWRLPNDLKFFKQMTEANTLVMGRKTFEGMGSRPLPNRQTIVLTRDSSYKAEGVHVMHSVEDVLALEKETDGIFFIAGGSAVYQEFLPFCTILYRTVIHHVFDGDAYFPPVDWSDWSLINTSQGEMDEKNRYPHQFETYQRNENPVKSGTGELTI 4ELG Chain:F ((2-162)) IVSFMVAMDENRVIGKDNNLPWRLPSELQYVKKTTMGHPLIMGRKNYEAIG-RPLPGRRNIIVTRNEGYHVEGCEVAHSVEEVFELCKNEEEIF-IFGGAQIYDLFLPYVDKLYITKIHHAFEGDTFFPEMDMTNWKEVFVEKGLTDEKNPYTYYYHVYEKQQ------------

General information: TITO was launched using: RESULT: Template: 4ELG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 750 -116687 -155.58 -724.76 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain F : 0.82 3D Compatibility (PKB) : -155.58 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.543

(partial model without unconserved sides chains): PDB file : Tito_4ELG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ELG-query.scw PDB file : Tito_Scwrl_4ELG.pdb: