Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------MGITKEEVNSYYQKAGIVLTDEEVDQIQLM---DYGLGKERKVGLQL-----FVYVNTDR-YCSKELVLFPGQTCPEHRHPPVDGQEGKQETFRCRY---GKVYLYVEGEKTPLPKVLPPQEDREHYTVWHEIELEPGGQYTIPPNTKHWFQAGEEGAVVT-EMSSTSTDKHDIFTDPRI 4QGL Chain:A ((1-174)) GAAAMAQIRIHEVNTRIENEVKVSKFLQEEGVLYEKWNISKLPPHLNENYSLTDENKAEILAVFSKEIADVSARRGYKAHDVISLSNSTPNLDELLINFQKEHHHTDDEVRFIVSGHGIFAIEGKDGT----------------FFDVELEPGDLISVPENARHYFTLQDDRQVVAIRIFVTTEGWVPIY-----

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 : 554 -41011 -74.03 -280.90 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -74.03 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.369

(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: