Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------MKFAVIVL-PGSNCDIDMYHAVKDELGHEVEYVW----------HEETSLDGFDGVLIPGGFSYGDYLRCGAIARFANIMPAV-KQAAAEGKPVLGVCNGFQILQELGLLPGAMRRNKDLK-FICRPVELIVQNDETLFTASYEKGESITIPVAHGEGNFYCDDETLATLKENNQIAFTYGSNINGSVSDIAGVVNEKGNVLGMMPHPERAVDELLGSADGLK----------------------------LFQSIVKNWRETHVTTA- 2GHR Chain:A ((18-298)) EENIFVMTKERAETQDIRALKIAILNLMPTKQETEAQLLRLIGNTPLQLDVHLLHMESSFYKTFRDIENEKFDGLIITGAPVETLSFEE---VDYWEELKRIMEYSKTNVTSTLHICWGAQAG--LYHHYGVQKYPLKEKMFGVFEHEVREQHVKLLQGFD----ELFFAPHSRHTEV------RESDIREVKELTLLANSEEAG----VHLVIGQEGRQVFALGHSEYSCDTLKQEYERDRDKGLNIDVPKNYFKHDNPNEKPLVRWRSHGNLLFSNWLNYYVYQET

General information: TITO was launched using: RESULT: Template: 2GHR.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 : 1088 -118044 -108.50 -567.52 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -108.50 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.365

(partial model without unconserved sides chains): PDB file : Tito_2GHR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2GHR-query.scw PDB file : Tito_Scwrl_2GHR.pdb: