Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAAWTPHVTVATVVEKDGRYLFVEEHSEGFVHTVFNQPAGHVECGETLTEAAIRETLEETGHHIDIDALLGIYTYTPPMFPDRT-YYRFCFLAHVTHVESDPKLDTGIVSAVWMTLDELKESARARSPLVIKAIEDAMKGQHYPLALI--YEHPFSPSLTSHLDA 3SHD Chain:A ((4-149)) -----PHVTVACVVHAEGKFLVVEETING--KALWNQPAGHLEADETLVEAAARELWEETGISAQPQHFIRMHQW---IAPDKTPFLRFLFAIELEQICPTQPHDSDIDCCRWVSAEEILQASNLRSPLVAESIRCYQSGQRYPLEMIGDFNWPFT---------

General information: TITO was launched using: RESULT: Template: 3SHD.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 : 706 -61661 -87.34 -431.19 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -87.34 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.486

(partial model without unconserved sides chains): PDB file : Tito_3SHD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3SHD-query.scw PDB file : Tito_Scwrl_3SHD.pdb: