Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence WYFGKITRRESERLLLNAENPRGTFLVRESETTKGAYCLSVSDFDNAKGLNVKHYKIRKLDSGGFYITSRTQFNSLQQLVAYY 1HCS Chain:B ((9-91)) WYFGKITRRESERLLLNAENPRGTFLVRESETTKGAYCLSVSDFDNAKGLNVKHYKIRKLDSGGFYITSRTQFNSLQQLVAYY

General information: TITO was launched using: RESULT: Template: 1HCS.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 296 -47142 -159.26 -567.98 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 1.00 3D Compatibility (PKB) : -159.26 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 1.00 QMean score : 0.693

(partial model without unconserved sides chains): PDB file : Tito_1HCS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1HCS-query.scw PDB file : Tito_Scwrl_1HCS.pdb: