Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRTVAAPAPALAEVACFSRDLCKE-LVKEWSSLDSSCFSISTVSGGITNMLLKVSVKEGS----DSESSVTVRLYGPNTDLVIDRERELQGSGLGYLEYLRMEWFRHSSMLGHYHLQVYTQRLL--FCTHRCMETGEPAINASANNMKEPRIAAEIAKQLQKFHQVDIPGSKEPQ-LWNDIFKFLKKASVLKFEDNEKQKRYETISFREIQDEVKELKDLSDLLHAPVVFAHNDLLSGNLML-----NDLEEKLYFIDFEYGSYSYRGFDIANHFNE---------YAGFECDYNLYPDKDVQYHFFRNYLSDRPSELKNRLFASICEKRNVGYLAFVQYKVQEQDLDDLYTETNTFRLASHLYWALWALIQARVSPIDFDYLGYFFLRRHVVPNRKLYNL 4DA5 Chain:A ((95-440)) ---------------------CKEFLPGAWRGLREDEFHISVIRGGLSNMLFQCSLPDTTATLGDEPRKVLLRLY----------------AEAMVLESVMFAILAERS-LGPKLYGIFPQGRLEQFIPSRRLDTEELSL---------PDISAEIAEKMATFHGMKMPFNKEPKWLFGTMEKYLKEVLRIKFTEESRIKKLHKLLSYNLPLELENLRSLLESTPSPVVFCHNDCQEGNILLLEGRENSEKQKLMLIDFEYSSYNYRGFDIGNHFCEWMYDYSYEKYPFFRANIRKYPTKKQQLHFISSYLPAFQNDFEN---LSTEEKSIIK--------------EEMLLEVNRFALASHFLWGLWSIVQAKISSIEFGYMDY----------------

General information: TITO was launched using: RESULT: Template: 4DA5.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 : 1189 19850 16.69 66.39 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : 16.69 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.317

(partial model without unconserved sides chains): PDB file : Tito_4DA5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4da5-query.scw PDB file : Tito_Scwrl_4DA5.pdb: