Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------MKKIAVDAMGGDYAPQAIVEGVNQALSDFSDIEVQLYGDEAKIKQYLTATERVSIIHTDEKIDSDDEPTRAIRNKKNASMVLAAKAVKDGEADAVLSAGNTGALL-AAGFFIVGRIKNIDRPGLMSTLPTVDGKGFDMLDLGANAE-NTAQHLHQYAVLGSFYAKNVR--GIAQPRVGLLNNGTESSKGDPL-RKETYELLAADESLNFIGNVEARDLMNGVADVVVADGFTGNAVLKSIEGTAMGIMGLLKTAITGGGLRAKLGALLLKDSLRGLKKQLNYSDVGG----AVLFGVKAPVVKTHGSSDAKAVYSTIRQIRTMLETDVVAQTAREFSGE 3TNG Chain:A ((5-291)) TKSRFFSDVAETSSFVFAVAGADDEVVLETIRLALKQKL-----GKFLLFGKKEDKTL--TANESVTWIQTDT---------------AEAAAQGAILAVKNKEADILVKGFIPTATLMHH---VLKKENGLRTDQLLSQIAIFDIPTYHKPLLITDCAMNVAPKTKEKIAITENALAVAHQIGITNPKIALL---SAVEEVTAKMP----------------STLEAQEVVQHFGNQISVSGPLALDVAISKEAALHK---GITDSSAG-----EADILIAPNIETGNALYKSLVYFAGAKVGSAVVGAKVPIVISSRNDSPENKLASFILTVRLVEK-------------

General information: TITO was launched using: RESULT: Template: 3TNG.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 : 1428 6312 4.42 23.82 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 4.42 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.364

(partial model without unconserved sides chains): PDB file : Tito_3TNG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TNG-query.scw PDB file : Tito_Scwrl_3TNG.pdb: