Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTILINNVVLVGRLTKDPDLRYTASGTAVATFTLAVNRNFTNQ-SG--NREADFINCVIWRK-SAETLANYARKGTLLGVTGRIQTRSYDNQQGQRVYVTEVVAD----NFQLLESRSASENRQQSGGFQSSGQSAGGFGGNNNSNQTSQSSNGMPDFDRDTSDPFGSSSTIDISDDDLPF 3ULP Chain:A ((78-194)) NEKSLNKIMLIGRVGCEPDIKILNGGDKVATFSLATNEFWRDRNTNELKSKTDWHRIVVYDQNIVDLIDKYLRKGRRVYVQGSLHTRKWHT--SQPKQITEIILSYNKGDLIFLD------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3ULP.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 : 370 -16906 -45.69 -161.01 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -45.69 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.665

(partial model without unconserved sides chains): PDB file : Tito_3ULP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ULP-query.scw PDB file : Tito_Scwrl_3ULP.pdb: