Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEVFDMSQVITDKTFNEETDKGLVLIDFWATWCGPCRMQAPILDQLEQEYDEEEFRIAKMDVDENPETPQQFGIMSIPTLMLKKDGQVVEKAVGVHSKEQLRQMIDQYL 2O85 Chain:A ((6-104)) ---------VTDADFDSKVESGVQLVDFWATWCGTCKMIAPVLEELAADY-EGKADILKLDVDENPSTAAKYEVMSIPTLIVFKDGQPVDKVVGFQPKENLAEVLDKHL

General information: TITO was launched using: RESULT: Template: 2O85.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 : 407 -57245 -140.65 -578.23 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.84 3D Compatibility (PKB) : -140.65 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.84 QMean score : 0.560

(partial model without unconserved sides chains): PDB file : Tito_2O85.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2O85-query.scw PDB file : Tito_Scwrl_2O85.pdb: