Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKGFLVSLEGPEGAGKTSVLEALLPILEE-KGVE-VLTTREPGGVLIGEKIREVILDPSHTQMDAKTELLLYIASRRQHLVEKVLPALEAGKLVIMDRFIDSSVAYQGFGRGLDIEAIDWLNQFATDGLKPDLTLYFDIEVEEGLARIAANSDREVNRLDLEGLDLHKKVRQGYLSLLDKEGNRIVKIDASLPLEQVVETTNAVLFDGMGLAK 3LD9 Chain:D ((23-198)) -----FITFEGIDGSGKTTQSHLLAEYLSEIYGVNNVVLTREPGGTLLNESVRNLLFKAQ--GLDSLSELLFFIAMRREHFVKIIKPSLMQKKIVICDRFIDSTIAYQGYGQGIDCSLIDQLNDLVID-VYPDITFIIDVD----------------------DMEFYYRVRDGFYDIAKKNPHRC----------------------------

General information: TITO was launched using: RESULT: Template: 3LD9.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 649 -1981 -3.05 -12.86 target 2D structure prediction score : 0.79 Monomeric hydrophicity matching model chain D : 0.76 3D Compatibility (PKB) : -3.05 2D Compatibility (Sec. Struct. Predict.) : 0.79 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.483

(partial model without unconserved sides chains): PDB file : Tito_3LD9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3LD9-query.scw PDB file : Tito_Scwrl_3LD9.pdb: