Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKDIYVEFRGKYKVDGESRDSEHKGWLEVNSWSHNIRQPKSATSSSVGGHTAERVEHSDMVFVKDLDATSPKLWEACSAGYTFDEVQIDFYRANGDKRIKYLQIKLKHVLVSSVTPTVNEEGVPTEAFGLKYAAVEWTYNQQDINGTAKG-AVTKKWSLSNNTASYAA 4W64 Chain:C ((3-168)) MKDIYVEFRGKYKVDGESRDSEHKGWLEVNSWSHNIRQPKSATSSSVGGHTAERVEHSDMVFVKDLDATSPKLWEACSAGYTFDEVQIDFYRANGDKRIKYLQIKLKHVLVSSVTPTVNEEGVPTEAFGLKYAAVEWTYNQQDINGT-AKGAVTKKWSLSNNTASYA-

General information: TITO was launched using: RESULT: Template: 4W64.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 723 -33144 -45.84 -200.87 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain C : 0.99 3D Compatibility (PKB) : -45.84 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.99 QMean score : 0.524

(partial model without unconserved sides chains): PDB file : Tito_4W64.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4W64-query.scw PDB file : Tito_Scwrl_4W64.pdb: