Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVLKPGLLTTVQDIGRTGYQKYGVLASGAMDT----VSLRIANLLIGNGENEAGLEITMMG----------PGPSFHFSKQTLIAVTGADFTLRINDEEAPL--------WKPVLIKENS--TVSFGPCKLGSRAYLAAAG---GIEVPAVMESK--STYVRGSIGGLHGRALQKEDELNIGEMSAL--SQTILSRLSSQLGKQG----FAAPKWSVSRGRFLPLKKNPVIRVL-------EGKQF----AFFTEESKTRFYEEA------------------------FR--VTPQSDRMGYRLKGEPLEL-KAPLEMVSEAVSFGTVQVPPDGNP---IILLADRQTTG-GYPRIAHIISADLPIVSQIMPGEHVQFEPVSLQEAEALA----VEREQHIKELKTRMKMEWLT 4N0N Chain:A ((22-422)) -----SAVCTVCGAAPVAKSACGGWFCGNCVPYHAGHCHTTSLFANCGHDIMYRSTYCTMCEGSPKQMVPKVPHPILDHLLCHIDYGSKEELTLVVADGRTTSPPGRYKVGHKVVAVVADVGGNIVFG-CGPGSHIAVPLQDTLKGVVVNKALKNAAASEYVEGPPGSGKTFHLVKDVLAVVGSATLVVPTHASMLDCINKLKQAGADPYFVVPKYTVLD---FPRPGSGNITVRLPQVGTSEGETFVDEVAYFSPVDLARILTQGRVKGYGDLNQLGCVGPASVPRNLWLRHFVSLEPLRVCHRFGAAVCDLIKGIYPYYEPAPHTTKVVFVPNPDFEKGVVITAYHKDRGLGHRTIDSIQGCTFPVVTLRLP------TPQSLTRPRAVVAVTRASQELYIYDPFDQLSGLLKF

General information: TITO was launched using: RESULT: Template: 4N0N.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 : 1350 -114385 -84.73 -357.45 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -84.73 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.080

(partial model without unconserved sides chains): PDB file : Tito_4N0N.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4N0N-query.scw PDB file : Tito_Scwrl_4N0N.pdb: