Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------MAHTNTQLSQWLESKVGQTL-------DIRKGELTH--DEEISDLDQI-------VLH-------LQKVAI---RSTNHPDDYVAKEELVLEGEGTTFTEDGNVPLPQNAYEIPLL-GELHIHQENE--GLKVVTDRAVYTIDIQHS-------- 4QGL Chain:A ((1-174)) GAAAMAQIRIHEVNTRIENEVKVSKFLQEEGVLYEKWNISKLPPHLNENYSLTDENKAEILAVFSKEIADVSARRGYKAHDVISLSNSTPNLDELLINFQKEHHHTDDEV---RFIVSGHGIFAIE----GKDGTFFDVELEPGDLISVPENARHYFTLQDDRQVVAIRIFVTTEGWVPIY

General information: TITO was launched using: RESULT: Template: 4QGL.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 : 388 -38818 -100.05 -349.71 target 2D structure prediction score : 0.45 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -100.05 2D Compatibility (Sec. Struct. Predict.) : 0.45 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.374

(partial model without unconserved sides chains): PDB file : Tito_4QGL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QGL-query.scw PDB file : Tito_Scwrl_4QGL.pdb: