Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKKGVFYIGAVLMVGCTTLPDHSAPKEKTPPVSEKKKSESSSGVKITPYDHPEIQRKSLQVI------APQQKKPQRFNDDGSQLPAFKTLMQKTEQAY--KNQQWSEAERYALQAQRLAPQAAETYLFLAL-TANHKQQYSNAESLARRGLSFAQSQAMKKQLWLVILKAGQQRNNPKTVQEAQQALKAF 2QKI Chain:A ((134-273)) -----------LLPVGRTVMVNIENP-EGIPVKQDSLSSQNQLGVLPLSWDIPELVNMGQWKIRAYYENSPQQVFSTEFEVKEYVLPSFEVIVEPTEKFYYIYNEKGLEV---TITARFLYGKKVEGTAFVIFGIQDGEQRISLPESLKR------------------------------------------

General information: TITO was launched using: RESULT: Template: 2QKI.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 : 302 23988 79.43 190.38 target 2D structure prediction score : 0.29 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 79.43 2D Compatibility (Sec. Struct. Predict.) : 0.29 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.114

(partial model without unconserved sides chains): PDB file : Tito_2QKI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QKI-query.scw PDB file : Tito_Scwrl_2QKI.pdb: