Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNGRTLFFRRLFDYYKYQFKVLHAVIDWTVALYIVLPAIAFVIYQYIDLMNGRGLLYEWSEVAEWRWLYAVCVLIMFTGSIRTFLMEADKVFLLQKKEIIYQLKRYALLYSFLATLAKWLLLFFIVLPLISHSVLITFAESTALLCYLFGLHIFFLSLKQDRIRKPRSISRWIGDTLVRAILFAGSAILIVFTERHLLALFGILFLFFSVIRSLKKTASFTAFEAEVTEEKKSRLALAGLVMMMSQEAGMPKVKDRMRRKPLLYRNSKRIFKRRTICTGYKELFFKVMLRNGEYARQMYMLLSAFTVLIFVSPIWLKVIALLVYTGVCRYILTLIFDKVMDAPFLIGTDKESDEYYRARKSCINILHYAFAACCFLAAAVSLLFT 4I2Z Chain:A ((826-869)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------YSAEVEEERLSRASAAGFAILTEDENACARIMDEIKSWPEVFKD-----------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4I2Z.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 : 71 -3010 -42.39 -68.40 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.41 3D Compatibility (PKB) : -42.39 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.41 QMean score : 0.175

(partial model without unconserved sides chains): PDB file : Tito_4I2Z.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4I2Z-query.scw PDB file : Tito_Scwrl_4I2Z.pdb: