Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------MPKFLSIIRIRKKAKTFFVFAPTKMFQLFSFFIPVFLIFRMTG 1DFE Chain:A ((1-37)) MKVRASVKRICDKCKVIRRHGRVYVICENPKHK------------QRQG

General information: TITO was launched using: RESULT: Template: 1DFE.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 : 60 5662 94.37 182.65 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.50 3D Compatibility (PKB) : 94.37 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.50 QMean score : 0.268

(partial model without unconserved sides chains): PDB file : Tito_1DFE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1DFE-query.scw PDB file : Tito_Scwrl_1DFE.pdb: