Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------------------------------------------------------------------------TDLTETDTIAGADTRLVPGCLVKLYRPPKYIGCFDRSILVGAKCIPVQTTWKIKGHDISVWNGC----STV-KGINLPKGWFVKGESAQCKVWHRKQ---------------------------- 1QRE Chain:A ((38-247)) TVDEFSNIRENPVTPWNPEPSAPVIDPTAYIDPQASVIGEVTIGANVMVSPMASIRSDEGMPIFVGDRSNVQDGVVLHALETINEEGEPIEDNIVEVDGKEYAVYIGNNVSLAHQSQV---HGPAAVG--DDTF-IGMQAFVFKSKV---GNNCVLEPRSAAIGVTIPDGRYIPAGMVVTS-QAEADKL-PEVTDDYAYSHTNEAVVYVNVHLAEGYKETS

General information: TITO was launched using: RESULT: Template: 1QRE.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 : 372 -7753 -20.84 -95.71 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -20.84 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.452

(partial model without unconserved sides chains): PDB file : Tito_1QRE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QRE-query.scw PDB file : Tito_Scwrl_1QRE.pdb: