data_6711 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6711 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 '1H, 13C, and 15N Chemical Shift Assignments for Human Ubc7' 'Structure analysis' ; 1H, 13C, and 15N chemical shift assignments for human ubiquitin-conjugating enzyme, Ubc7 ; 6711 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID 1 'NMR resonance assignment' 6711 1 1 'Ubiquitin-conjugating enzyme' 6711 1 stop_ loop_ _Study_entry_list.Study_ID _Study_entry_list.BMRB_accession_code _Study_entry_list.BMRB_entry_description _Study_entry_list.Details _Study_entry_list.Entry_ID _Study_entry_list.Study_list_ID 1 7117 'Assigned chemical shift entry' 'Near complete 1H, 13C, and 15N chemical shift assignments (missing M1,A2,G3,P20,P68 and aromatic sidechain resonances)' 6711 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6711 _Entry.Title ; NMR assignment of Human Ubiquitin Conjugating Enzyme (Ubc7) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-06-30 _Entry.Accession_date 2005-06-30 _Entry.Last_release_date 2005-06-30 _Entry.Original_release_date 2005-06-30 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.2.6 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details '1H, 13C, and 15N chemical shift resonance assignments for Human Ubc7' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Kathryn Briggman . B. . . 6711 2 Ananya Majumdar . . . . 6711 3 Catherine Coleman . S. . . 6711 4 Vincent Chau . . . . 6711 5 Joel Tolman . R. . . 6711 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6711 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 645 6711 '15N chemical shifts' 147 6711 '1H chemical shifts' 923 6711 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-10-26 . original BMRB . 6711 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6711 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16211496 _Citation.Full_citation . _Citation.Title ; NMR Assignment of Human Ubiquitin Conjugating Enzyme Ubc7 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 32 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 340 _Citation.Page_last 340 _Citation.Year 2005 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Kathryn Briggman . B. . . 6711 1 2 Ananya Majumdar . . . . 6711 1 3 Catherine Coleman . S. . . 6711 1 4 Vincent Chau . . . . 6711 1 5 Joel Tolman . R. . . 6711 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'ubiquitin conjugating enzyme' 6711 1 stop_ save_ save_reference_1 _Citation.Sf_category citations _Citation.Sf_framecode reference_1 _Citation.Entry_ID 6711 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 9048545 _Citation.Full_citation ; Cook, W.J., Martin, P.D., Edwards, B.F.P., Yamazaki, R.K., and Chau, V. (1997) Biochemistry, 36, 1621-1627. ; _Citation.Title ; Crystal structure of a class I ubiquitin conjugating enzyme (Ubc7) from Saccharomyces cerevisiae at 2.9 angstroms resolution. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1621 _Citation.Page_last 1627 _Citation.Year 1997 _Citation.Details 'X-ray crystal structure of yeast Ubc7' loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 William Cook . J. . . 6711 2 2 Philip Martin . D. . . 6711 2 3 Brian Edwards . F.P. . . 6711 2 4 Russell Yamazaki . K. . . 6711 2 5 Vincent Chau . . . . 6711 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6711 _Assembly.ID 1 _Assembly.Name Ubc7 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 18504 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Ubc7 1 $Human_Ubquitin_Conjugating_Enzyme_7 . . yes native no no . . . 6711 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'ubiquitin conjugating enzyme' 6711 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Human_Ubquitin_Conjugating_Enzyme_7 _Entity.Sf_category entity _Entity.Sf_framecode Human_Ubquitin_Conjugating_Enzyme_7 _Entity.Entry_ID 6711 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name hUbc7 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAGTALKRLMAEYKQLTLNP PEGIVAGPMNEENFFEWEAL IMGPEDTCFEFGVFPAILSF PLDYPLSPPKMRFTCEMFHP NIYPDGRVCISILHAPGDDP MGYESSAERWSPVQSVEKIL LSVVSMLAEPNDESGANVDA SKMWRDDREQFYKIAKQIVQ KSLGL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 165 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18504 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 6711 1 2 . ALA . 6711 1 3 . GLY . 6711 1 4 . THR . 6711 1 5 . ALA . 6711 1 6 . LEU . 6711 1 7 . LYS . 6711 1 8 . ARG . 6711 1 9 . LEU . 6711 1 10 . MET . 6711 1 11 . ALA . 6711 1 12 . GLU . 6711 1 13 . TYR . 6711 1 14 . LYS . 6711 1 15 . GLN . 6711 1 16 . LEU . 6711 1 17 . THR . 6711 1 18 . LEU . 6711 1 19 . ASN . 6711 1 20 . PRO . 6711 1 21 . PRO . 6711 1 22 . GLU . 6711 1 23 . GLY . 6711 1 24 . ILE . 6711 1 25 . VAL . 6711 1 26 . ALA . 6711 1 27 . GLY . 6711 1 28 . PRO . 6711 1 29 . MET . 6711 1 30 . ASN . 6711 1 31 . GLU . 6711 1 32 . GLU . 6711 1 33 . ASN . 6711 1 34 . PHE . 6711 1 35 . PHE . 6711 1 36 . GLU . 6711 1 37 . TRP . 6711 1 38 . GLU . 6711 1 39 . ALA . 6711 1 40 . LEU . 6711 1 41 . ILE . 6711 1 42 . MET . 6711 1 43 . GLY . 6711 1 44 . PRO . 6711 1 45 . GLU . 6711 1 46 . ASP . 6711 1 47 . THR . 6711 1 48 . CYS . 6711 1 49 . PHE . 6711 1 50 . GLU . 6711 1 51 . PHE . 6711 1 52 . GLY . 6711 1 53 . VAL . 6711 1 54 . PHE . 6711 1 55 . PRO . 6711 1 56 . ALA . 6711 1 57 . ILE . 6711 1 58 . LEU . 6711 1 59 . SER . 6711 1 60 . PHE . 6711 1 61 . PRO . 6711 1 62 . LEU . 6711 1 63 . ASP . 6711 1 64 . TYR . 6711 1 65 . PRO . 6711 1 66 . LEU . 6711 1 67 . SER . 6711 1 68 . PRO . 6711 1 69 . PRO . 6711 1 70 . LYS . 6711 1 71 . MET . 6711 1 72 . ARG . 6711 1 73 . PHE . 6711 1 74 . THR . 6711 1 75 . CYS . 6711 1 76 . GLU . 6711 1 77 . MET . 6711 1 78 . PHE . 6711 1 79 . HIS . 6711 1 80 . PRO . 6711 1 81 . ASN . 6711 1 82 . ILE . 6711 1 83 . TYR . 6711 1 84 . PRO . 6711 1 85 . ASP . 6711 1 86 . GLY . 6711 1 87 . ARG . 6711 1 88 . VAL . 6711 1 89 . CYS . 6711 1 90 . ILE . 6711 1 91 . SER . 6711 1 92 . ILE . 6711 1 93 . LEU . 6711 1 94 . HIS . 6711 1 95 . ALA . 6711 1 96 . PRO . 6711 1 97 . GLY . 6711 1 98 . ASP . 6711 1 99 . ASP . 6711 1 100 . PRO . 6711 1 101 . MET . 6711 1 102 . GLY . 6711 1 103 . TYR . 6711 1 104 . GLU . 6711 1 105 . SER . 6711 1 106 . SER . 6711 1 107 . ALA . 6711 1 108 . GLU . 6711 1 109 . ARG . 6711 1 110 . TRP . 6711 1 111 . SER . 6711 1 112 . PRO . 6711 1 113 . VAL . 6711 1 114 . GLN . 6711 1 115 . SER . 6711 1 116 . VAL . 6711 1 117 . GLU . 6711 1 118 . LYS . 6711 1 119 . ILE . 6711 1 120 . LEU . 6711 1 121 . LEU . 6711 1 122 . SER . 6711 1 123 . VAL . 6711 1 124 . VAL . 6711 1 125 . SER . 6711 1 126 . MET . 6711 1 127 . LEU . 6711 1 128 . ALA . 6711 1 129 . GLU . 6711 1 130 . PRO . 6711 1 131 . ASN . 6711 1 132 . ASP . 6711 1 133 . GLU . 6711 1 134 . SER . 6711 1 135 . GLY . 6711 1 136 . ALA . 6711 1 137 . ASN . 6711 1 138 . VAL . 6711 1 139 . ASP . 6711 1 140 . ALA . 6711 1 141 . SER . 6711 1 142 . LYS . 6711 1 143 . MET . 6711 1 144 . TRP . 6711 1 145 . ARG . 6711 1 146 . ASP . 6711 1 147 . ASP . 6711 1 148 . ARG . 6711 1 149 . GLU . 6711 1 150 . GLN . 6711 1 151 . PHE . 6711 1 152 . TYR . 6711 1 153 . LYS . 6711 1 154 . ILE . 6711 1 155 . ALA . 6711 1 156 . LYS . 6711 1 157 . GLN . 6711 1 158 . ILE . 6711 1 159 . VAL . 6711 1 160 . GLN . 6711 1 161 . LYS . 6711 1 162 . SER . 6711 1 163 . LEU . 6711 1 164 . GLY . 6711 1 165 . LEU . 6711 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6711 1 . ALA 2 2 6711 1 . GLY 3 3 6711 1 . THR 4 4 6711 1 . ALA 5 5 6711 1 . LEU 6 6 6711 1 . LYS 7 7 6711 1 . ARG 8 8 6711 1 . LEU 9 9 6711 1 . MET 10 10 6711 1 . ALA 11 11 6711 1 . GLU 12 12 6711 1 . TYR 13 13 6711 1 . LYS 14 14 6711 1 . GLN 15 15 6711 1 . LEU 16 16 6711 1 . THR 17 17 6711 1 . LEU 18 18 6711 1 . ASN 19 19 6711 1 . PRO 20 20 6711 1 . PRO 21 21 6711 1 . GLU 22 22 6711 1 . GLY 23 23 6711 1 . ILE 24 24 6711 1 . VAL 25 25 6711 1 . ALA 26 26 6711 1 . GLY 27 27 6711 1 . PRO 28 28 6711 1 . MET 29 29 6711 1 . ASN 30 30 6711 1 . GLU 31 31 6711 1 . GLU 32 32 6711 1 . ASN 33 33 6711 1 . PHE 34 34 6711 1 . PHE 35 35 6711 1 . GLU 36 36 6711 1 . TRP 37 37 6711 1 . GLU 38 38 6711 1 . ALA 39 39 6711 1 . LEU 40 40 6711 1 . ILE 41 41 6711 1 . MET 42 42 6711 1 . GLY 43 43 6711 1 . PRO 44 44 6711 1 . GLU 45 45 6711 1 . ASP 46 46 6711 1 . THR 47 47 6711 1 . CYS 48 48 6711 1 . PHE 49 49 6711 1 . GLU 50 50 6711 1 . PHE 51 51 6711 1 . GLY 52 52 6711 1 . VAL 53 53 6711 1 . PHE 54 54 6711 1 . PRO 55 55 6711 1 . ALA 56 56 6711 1 . ILE 57 57 6711 1 . LEU 58 58 6711 1 . SER 59 59 6711 1 . PHE 60 60 6711 1 . PRO 61 61 6711 1 . LEU 62 62 6711 1 . ASP 63 63 6711 1 . TYR 64 64 6711 1 . PRO 65 65 6711 1 . LEU 66 66 6711 1 . SER 67 67 6711 1 . PRO 68 68 6711 1 . PRO 69 69 6711 1 . LYS 70 70 6711 1 . MET 71 71 6711 1 . ARG 72 72 6711 1 . PHE 73 73 6711 1 . THR 74 74 6711 1 . CYS 75 75 6711 1 . GLU 76 76 6711 1 . MET 77 77 6711 1 . PHE 78 78 6711 1 . HIS 79 79 6711 1 . PRO 80 80 6711 1 . ASN 81 81 6711 1 . ILE 82 82 6711 1 . TYR 83 83 6711 1 . PRO 84 84 6711 1 . ASP 85 85 6711 1 . GLY 86 86 6711 1 . ARG 87 87 6711 1 . VAL 88 88 6711 1 . CYS 89 89 6711 1 . ILE 90 90 6711 1 . SER 91 91 6711 1 . ILE 92 92 6711 1 . LEU 93 93 6711 1 . HIS 94 94 6711 1 . ALA 95 95 6711 1 . PRO 96 96 6711 1 . GLY 97 97 6711 1 . ASP 98 98 6711 1 . ASP 99 99 6711 1 . PRO 100 100 6711 1 . MET 101 101 6711 1 . GLY 102 102 6711 1 . TYR 103 103 6711 1 . GLU 104 104 6711 1 . SER 105 105 6711 1 . SER 106 106 6711 1 . ALA 107 107 6711 1 . GLU 108 108 6711 1 . ARG 109 109 6711 1 . TRP 110 110 6711 1 . SER 111 111 6711 1 . PRO 112 112 6711 1 . VAL 113 113 6711 1 . GLN 114 114 6711 1 . SER 115 115 6711 1 . VAL 116 116 6711 1 . GLU 117 117 6711 1 . LYS 118 118 6711 1 . ILE 119 119 6711 1 . LEU 120 120 6711 1 . LEU 121 121 6711 1 . SER 122 122 6711 1 . VAL 123 123 6711 1 . VAL 124 124 6711 1 . SER 125 125 6711 1 . MET 126 126 6711 1 . LEU 127 127 6711 1 . ALA 128 128 6711 1 . GLU 129 129 6711 1 . PRO 130 130 6711 1 . ASN 131 131 6711 1 . ASP 132 132 6711 1 . GLU 133 133 6711 1 . SER 134 134 6711 1 . GLY 135 135 6711 1 . ALA 136 136 6711 1 . ASN 137 137 6711 1 . VAL 138 138 6711 1 . ASP 139 139 6711 1 . ALA 140 140 6711 1 . SER 141 141 6711 1 . LYS 142 142 6711 1 . MET 143 143 6711 1 . TRP 144 144 6711 1 . ARG 145 145 6711 1 . ASP 146 146 6711 1 . ASP 147 147 6711 1 . ARG 148 148 6711 1 . GLU 149 149 6711 1 . GLN 150 150 6711 1 . PHE 151 151 6711 1 . TYR 152 152 6711 1 . LYS 153 153 6711 1 . ILE 154 154 6711 1 . ALA 155 155 6711 1 . LYS 156 156 6711 1 . GLN 157 157 6711 1 . ILE 158 158 6711 1 . VAL 159 159 6711 1 . GLN 160 160 6711 1 . LYS 161 161 6711 1 . SER 162 162 6711 1 . LEU 163 163 6711 1 . GLY 164 164 6711 1 . LEU 165 165 6711 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6711 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Human_Ubquitin_Conjugating_Enzyme_7 . 9606 organism no . human . . Eukaryota Metazoa Homo sapien . . . . . . . . . . . . . 6711 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 6711 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Human_Ubquitin_Conjugating_Enzyme_7 . 'recombinant technology' . 'E. coli' . . Escherichia coli . . . . . . . . . . 6711 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6711 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1mM, uniformly 13C, 15N labeled Ubc7, 50mM Tris-HCl buffer, pH 7.5, 2mM TCEP, 0.05% NaN3, 10% D20 (v/v)' _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 hUbc7 '[U-13C; U-15N]' 1 . 1 $Human_Ubquitin_Conjugating_Enzyme_7 . . 1 . . mM . . . . 6711 1 2 'Tris buffer' . . . . . . . 50 . . mM . . . . 6711 1 3 TCEP . . . . . . . 2 . . mM . . . . 6711 1 4 NaN3 . . . . . . . 0.05 . . % . . . . 6711 1 5 D2O . . . . . . . 10 . . % . . . . 6711 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6711 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1mM, uniformly 2H, 13C, 15N labeled Ubc7, 50mM Tris-HCl buffer, pH 7.5, 2mM TCEP, 0.05% NaN3, 10% D20 (v/v)' _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 hUbc7 '[U-2H; U-13C; U-15N]' . . 1 $Human_Ubquitin_Conjugating_Enzyme_7 . . 1 . . mM . . . . 6711 2 2 'Tris buffer' . . . . . . . 10 . . mM . . . . 6711 2 3 TCEP . . . . . . . 2 . . mM . . . . 6711 2 4 NaN3 . . . . . . . 0.05 . . % . . . . 6711 2 5 D2O . . . . . . . 10 . . % . . . . 6711 2 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6711 _Sample_condition_list.ID 1 _Sample_condition_list.Details '1mM, uniformly 13C, 15N labeled Ubc7, 50mM Tris-HCl buffer, pH 7.5, 2mM TCEP, 0.05% NaN3, 10% D20 (v/v)' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 5 mM 6711 1 pH 7.5 0.1 pH 6711 1 temperature 298 2 K 6711 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 6711 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'One Moon Scientific, Inc.' . http://onemoonscientific.com/nmrview/ 6711 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'assignment analysis' 6711 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 6711 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID NIH . http://spin.niddk.nih.gov/bax/software/NMRPipe/ 6711 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data processing' 6711 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 6711 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 6711 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6711 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '1H15N HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 2 HNCO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 3 HNCA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 2 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 4 HNCACB no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 5 HN(CA)CO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 6 HN(CO)CA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 7 CBCA(CO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 8 HMQC-NOESY-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 2 $800MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 9 HBHA(CO)NH no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 10 H(CCCO)NH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 11 CC(CO)NH-TOCSY no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 12 (H)CC(CO)NH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 13 15N-edited_NOESY-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 6711 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6711 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Referenced 1H to water, used PSSI to reference 13C and 15N PSSI is used to get the chemical shift offsets for the indirect referencing ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 water protons . . . . ppm 4.75 internal direct 1.0 . . . . . 6711 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6711 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '1H15N HSQC' 1 $sample_1 isotropic 6711 1 2 HNCO 1 $sample_1 isotropic 6711 1 3 HNCA 1 $sample_1 isotropic 6711 1 4 HNCACB 1 $sample_1 isotropic 6711 1 5 HN(CA)CO 1 $sample_1 isotropic 6711 1 6 HN(CO)CA 1 $sample_1 isotropic 6711 1 7 CBCA(CO)NH 1 $sample_1 isotropic 6711 1 8 HMQC-NOESY-HSQC 1 $sample_1 isotropic 6711 1 9 HBHA(CO)NH 1 $sample_1 isotropic 6711 1 10 H(CCCO)NH-TOCSY 1 $sample_1 isotropic 6711 1 11 CC(CO)NH-TOCSY 2 $sample_2 isotropic 6711 1 12 (H)CC(CO)NH-TOCSY 1 $sample_1 isotropic 6711 1 13 15N-edited_NOESY-HSQC 1 $sample_1 isotropic 6711 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRView . . 6711 1 2 $NMRPipe . . 6711 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 GLY HA2 H 1 4.10 0.02 . 1 . . . . 3 GLY HA2 . 6711 1 2 . 1 1 3 3 GLY HA3 H 1 4.10 0.02 . 1 . . . . 3 GLY HA3 . 6711 1 3 . 1 1 3 3 GLY C C 13 175.34 0.02 . 1 . . . . 3 GLY C . 6711 1 4 . 1 1 3 3 GLY CA C 13 46.04 0.02 . 1 . . . . 3 GLY CA . 6711 1 5 . 1 1 4 4 THR H H 1 8.07 0.02 . 1 . . . . 4 THR H . 6711 1 6 . 1 1 4 4 THR HA H 1 4.39 0.02 . 1 . . . . 4 THR HA . 6711 1 7 . 1 1 4 4 THR HB H 1 4.05 0.02 . 1 . . . . 4 THR HB . 6711 1 8 . 1 1 4 4 THR HG21 H 1 1.28 0.02 . 1 . . . . 4 THR HG2 . 6711 1 9 . 1 1 4 4 THR HG22 H 1 1.28 0.02 . 1 . . . . 4 THR HG2 . 6711 1 10 . 1 1 4 4 THR HG23 H 1 1.28 0.02 . 1 . . . . 4 THR HG2 . 6711 1 11 . 1 1 4 4 THR C C 13 176.46 0.02 . 1 . . . . 4 THR C . 6711 1 12 . 1 1 4 4 THR CA C 13 65.02 0.02 . 1 . . . . 4 THR CA . 6711 1 13 . 1 1 4 4 THR CB C 13 68.85 0.02 . 1 . . . . 4 THR CB . 6711 1 14 . 1 1 4 4 THR CG2 C 13 21.93 0.02 . 1 . . . . 4 THR CG2 . 6711 1 15 . 1 1 4 4 THR N N 15 115.42 0.02 . 1 . . . . 4 THR N . 6711 1 16 . 1 1 5 5 ALA H H 1 8.42 0.02 . 1 . . . . 5 ALA H . 6711 1 17 . 1 1 5 5 ALA HA H 1 4.32 0.02 . 1 . . . . 5 ALA HA . 6711 1 18 . 1 1 5 5 ALA HB1 H 1 1.90 0.02 . 1 . . . . 5 ALA HB . 6711 1 19 . 1 1 5 5 ALA HB2 H 1 1.90 0.02 . 1 . . . . 5 ALA HB . 6711 1 20 . 1 1 5 5 ALA HB3 H 1 1.90 0.02 . 1 . . . . 5 ALA HB . 6711 1 21 . 1 1 5 5 ALA C C 13 179.07 0.02 . 1 . . . . 5 ALA C . 6711 1 22 . 1 1 5 5 ALA CA C 13 56.06 0.02 . 1 . . . . 5 ALA CA . 6711 1 23 . 1 1 5 5 ALA CB C 13 20.02 0.02 . 1 . . . . 5 ALA CB . 6711 1 24 . 1 1 5 5 ALA N N 15 126.14 0.02 . 1 . . . . 5 ALA N . 6711 1 25 . 1 1 6 6 LEU H H 1 8.43 0.02 . 1 . . . . 6 LEU H . 6711 1 26 . 1 1 6 6 LEU HA H 1 3.79 0.02 . 1 . . . . 6 LEU HA . 6711 1 27 . 1 1 6 6 LEU HB2 H 1 1.75 0.02 . 1 . . . . 6 LEU HB2 . 6711 1 28 . 1 1 6 6 LEU HB3 H 1 1.75 0.02 . 1 . . . . 6 LEU HB3 . 6711 1 29 . 1 1 6 6 LEU HG H 1 1.48 0.02 . 1 . . . . 6 LEU HG . 6711 1 30 . 1 1 6 6 LEU HD11 H 1 0.84 0.02 . 1 . . . . 6 LEU HD1 . 6711 1 31 . 1 1 6 6 LEU HD12 H 1 0.84 0.02 . 1 . . . . 6 LEU HD1 . 6711 1 32 . 1 1 6 6 LEU HD13 H 1 0.84 0.02 . 1 . . . . 6 LEU HD1 . 6711 1 33 . 1 1 6 6 LEU HD21 H 1 0.84 0.02 . 1 . . . . 6 LEU HD2 . 6711 1 34 . 1 1 6 6 LEU HD22 H 1 0.84 0.02 . 1 . . . . 6 LEU HD2 . 6711 1 35 . 1 1 6 6 LEU HD23 H 1 0.84 0.02 . 1 . . . . 6 LEU HD2 . 6711 1 36 . 1 1 6 6 LEU C C 13 178.27 0.02 . 1 . . . . 6 LEU C . 6711 1 37 . 1 1 6 6 LEU CA C 13 57.96 0.02 . 1 . . . . 6 LEU CA . 6711 1 38 . 1 1 6 6 LEU CB C 13 41.63 0.02 . 1 . . . . 6 LEU CB . 6711 1 39 . 1 1 6 6 LEU CG C 13 26.83 0.02 . 1 . . . . 6 LEU CG . 6711 1 40 . 1 1 6 6 LEU CD1 C 13 25.33 0.02 . 2 . . . . 6 LEU CD1 . 6711 1 41 . 1 1 6 6 LEU CD2 C 13 24.03 0.02 . 2 . . . . 6 LEU CD2 . 6711 1 42 . 1 1 6 6 LEU N N 15 117.62 0.02 . 1 . . . . 6 LEU N . 6711 1 43 . 1 1 7 7 LYS H H 1 7.85 0.02 . 1 . . . . 7 LYS H . 6711 1 44 . 1 1 7 7 LYS HA H 1 3.87 0.02 . 1 . . . . 7 LYS HA . 6711 1 45 . 1 1 7 7 LYS HB2 H 1 1.87 0.02 . 1 . . . . 7 LYS HB2 . 6711 1 46 . 1 1 7 7 LYS HB3 H 1 1.87 0.02 . 1 . . . . 7 LYS HB3 . 6711 1 47 . 1 1 7 7 LYS HG2 H 1 1.62 0.02 . 1 . . . . 7 LYS HG2 . 6711 1 48 . 1 1 7 7 LYS HG3 H 1 1.62 0.02 . 1 . . . . 7 LYS HG3 . 6711 1 49 . 1 1 7 7 LYS HD2 H 1 1.44 0.02 . 1 . . . . 7 LYS HD2 . 6711 1 50 . 1 1 7 7 LYS HD3 H 1 1.44 0.02 . 1 . . . . 7 LYS HD3 . 6711 1 51 . 1 1 7 7 LYS C C 13 179.77 0.02 . 1 . . . . 7 LYS C . 6711 1 52 . 1 1 7 7 LYS CA C 13 59.64 0.02 . 1 . . . . 7 LYS CA . 6711 1 53 . 1 1 7 7 LYS CB C 13 32.24 0.02 . 1 . . . . 7 LYS CB . 6711 1 54 . 1 1 7 7 LYS CG C 13 25.4 0.02 . 1 . . . . 7 LYS CG . 6711 1 55 . 1 1 7 7 LYS CD C 13 29.20 0.02 . 1 . . . . 7 LYS CD . 6711 1 56 . 1 1 7 7 LYS CE C 13 41.81 0.02 . 1 . . . . 7 LYS CE . 6711 1 57 . 1 1 7 7 LYS N N 15 117.01 0.02 . 1 . . . . 7 LYS N . 6711 1 58 . 1 1 8 8 ARG H H 1 7.88 0.02 . 1 . . . . 8 ARG H . 6711 1 59 . 1 1 8 8 ARG HA H 1 4.36 0.02 . 1 . . . . 8 ARG HA . 6711 1 60 . 1 1 8 8 ARG HB2 H 1 2.26 0.02 . 1 . . . . 8 ARG HB2 . 6711 1 61 . 1 1 8 8 ARG HB3 H 1 2.26 0.02 . 1 . . . . 8 ARG HB3 . 6711 1 62 . 1 1 8 8 ARG C C 13 177.81 0.02 . 1 . . . . 8 ARG C . 6711 1 63 . 1 1 8 8 ARG CA C 13 58.24 0.02 . 1 . . . . 8 ARG CA . 6711 1 64 . 1 1 8 8 ARG CB C 13 28.95 0.02 . 1 . . . . 8 ARG CB . 6711 1 65 . 1 1 8 8 ARG CG C 13 29.58 0.02 . 1 . . . . 8 ARG CG . 6711 1 66 . 1 1 8 8 ARG CD C 13 42.52 0.02 . 1 . . . . 8 ARG CD . 6711 1 67 . 1 1 8 8 ARG N N 15 120.33 0.02 . 1 . . . . 8 ARG N . 6711 1 68 . 1 1 9 9 LEU H H 1 8.76 0.02 . 1 . . . . 9 LEU H . 6711 1 69 . 1 1 9 9 LEU HA H 1 4.06 0.02 . 1 . . . . 9 LEU HA . 6711 1 70 . 1 1 9 9 LEU HB2 H 1 1.80 0.02 . 1 . . . . 9 LEU HB2 . 6711 1 71 . 1 1 9 9 LEU HB3 H 1 1.80 0.02 . 1 . . . . 9 LEU HB3 . 6711 1 72 . 1 1 9 9 LEU HG H 1 1.25 0.02 . 1 . . . . 9 LEU HG . 6711 1 73 . 1 1 9 9 LEU C C 13 179.79 0.02 . 1 . . . . 9 LEU C . 6711 1 74 . 1 1 9 9 LEU CA C 13 58.60 0.02 . 1 . . . . 9 LEU CA . 6711 1 75 . 1 1 9 9 LEU CB C 13 42.60 0.02 . 1 . . . . 9 LEU CB . 6711 1 76 . 1 1 9 9 LEU CG C 13 27.03 0.02 . 1 . . . . 9 LEU CG . 6711 1 77 . 1 1 9 9 LEU CD1 C 13 23.33 0.02 . 2 . . . . 9 LEU CD1 . 6711 1 78 . 1 1 9 9 LEU CD2 C 13 21.27 0.02 . 2 . . . . 9 LEU CD2 . 6711 1 79 . 1 1 9 9 LEU N N 15 121.19 0.02 . 1 . . . . 9 LEU N . 6711 1 80 . 1 1 10 10 MET H H 1 8.61 0.02 . 1 . . . . 10 MET H . 6711 1 81 . 1 1 10 10 MET HA H 1 4.04 0.02 . 1 . . . . 10 MET HA . 6711 1 82 . 1 1 10 10 MET HB2 H 1 1.91 0.02 . 1 . . . . 10 MET HB2 . 6711 1 83 . 1 1 10 10 MET HB3 H 1 1.91 0.02 . 1 . . . . 10 MET HB3 . 6711 1 84 . 1 1 10 10 MET HG2 H 1 2.06 0.02 . 1 . . . . 10 MET HG2 . 6711 1 85 . 1 1 10 10 MET HG3 H 1 2.06 0.02 . 1 . . . . 10 MET HG3 . 6711 1 86 . 1 1 10 10 MET HE1 H 1 1.35 0.02 . 1 . . . . 10 MET HE . 6711 1 87 . 1 1 10 10 MET HE2 H 1 1.35 0.02 . 1 . . . . 10 MET HE . 6711 1 88 . 1 1 10 10 MET HE3 H 1 1.35 0.02 . 1 . . . . 10 MET HE . 6711 1 89 . 1 1 10 10 MET C C 13 178.85 0.02 . 1 . . . . 10 MET C . 6711 1 90 . 1 1 10 10 MET CA C 13 59.65 0.02 . 1 . . . . 10 MET CA . 6711 1 91 . 1 1 10 10 MET CB C 13 32.24 0.02 . 1 . . . . 10 MET CB . 6711 1 92 . 1 1 10 10 MET CG C 13 31.29 0.02 . 1 . . . . 10 MET CG . 6711 1 93 . 1 1 10 10 MET N N 15 117.85 0.02 . 1 . . . . 10 MET N . 6711 1 94 . 1 1 11 11 ALA H H 1 7.80 0.02 . 1 . . . . 11 ALA H . 6711 1 95 . 1 1 11 11 ALA HA H 1 4.23 0.02 . 1 . . . . 11 ALA HA . 6711 1 96 . 1 1 11 11 ALA HB1 H 1 1.61 0.02 . 1 . . . . 11 ALA HB . 6711 1 97 . 1 1 11 11 ALA HB2 H 1 1.61 0.02 . 1 . . . . 11 ALA HB . 6711 1 98 . 1 1 11 11 ALA HB3 H 1 1.61 0.02 . 1 . . . . 11 ALA HB . 6711 1 99 . 1 1 11 11 ALA C C 13 181.36 0.02 . 1 . . . . 11 ALA C . 6711 1 100 . 1 1 11 11 ALA CA C 13 55.21 0.02 . 1 . . . . 11 ALA CA . 6711 1 101 . 1 1 11 11 ALA CB C 13 17.72 0.02 . 1 . . . . 11 ALA CB . 6711 1 102 . 1 1 11 11 ALA N N 15 123.29 0.02 . 1 . . . . 11 ALA N . 6711 1 103 . 1 1 12 12 GLU H H 1 8.99 0.02 . 1 . . . . 12 GLU H . 6711 1 104 . 1 1 12 12 GLU HA H 1 4.23 0.02 . 1 . . . . 12 GLU HA . 6711 1 105 . 1 1 12 12 GLU HB2 H 1 2.40 0.02 . 1 . . . . 12 GLU HB2 . 6711 1 106 . 1 1 12 12 GLU HB3 H 1 2.40 0.02 . 1 . . . . 12 GLU HB3 . 6711 1 107 . 1 1 12 12 GLU HG2 H 1 2.81 0.02 . 1 . . . . 12 GLU HG2 . 6711 1 108 . 1 1 12 12 GLU HG3 H 1 2.81 0.02 . 1 . . . . 12 GLU HG3 . 6711 1 109 . 1 1 12 12 GLU C C 13 179.46 0.02 . 1 . . . . 12 GLU C . 6711 1 110 . 1 1 12 12 GLU CA C 13 61.28 0.02 . 1 . . . . 12 GLU CA . 6711 1 111 . 1 1 12 12 GLU CB C 13 30.38 0.02 . 1 . . . . 12 GLU CB . 6711 1 112 . 1 1 12 12 GLU CG C 13 38.98 0.02 . 1 . . . . 12 GLU CG . 6711 1 113 . 1 1 12 12 GLU N N 15 119.64 0.02 . 1 . . . . 12 GLU N . 6711 1 114 . 1 1 13 13 TYR H H 1 8.89 0.02 . 1 . . . . 13 TYR H . 6711 1 115 . 1 1 13 13 TYR HA H 1 4.45 0.02 . 1 . . . . 13 TYR HA . 6711 1 116 . 1 1 13 13 TYR HB2 H 1 3.45 0.02 . 2 . . . . 13 TYR HB2 . 6711 1 117 . 1 1 13 13 TYR HB3 H 1 3.18 0.02 . 2 . . . . 13 TYR HB3 . 6711 1 118 . 1 1 13 13 TYR C C 13 177.52 0.02 . 1 . . . . 13 TYR C . 6711 1 119 . 1 1 13 13 TYR CA C 13 60.41 0.02 . 1 . . . . 13 TYR CA . 6711 1 120 . 1 1 13 13 TYR CB C 13 38.20 0.02 . 1 . . . . 13 TYR CB . 6711 1 121 . 1 1 13 13 TYR N N 15 119.66 0.02 . 1 . . . . 13 TYR N . 6711 1 122 . 1 1 14 14 LYS H H 1 8.23 0.02 . 1 . . . . 14 LYS H . 6711 1 123 . 1 1 14 14 LYS HA H 1 3.73 0.02 . 1 . . . . 14 LYS HA . 6711 1 124 . 1 1 14 14 LYS HB2 H 1 1.95 0.02 . 1 . . . . 14 LYS HB2 . 6711 1 125 . 1 1 14 14 LYS HB3 H 1 1.95 0.02 . 1 . . . . 14 LYS HB3 . 6711 1 126 . 1 1 14 14 LYS HG2 H 1 1.48 0.02 . 1 . . . . 14 LYS HG2 . 6711 1 127 . 1 1 14 14 LYS HG3 H 1 1.48 0.02 . 1 . . . . 14 LYS HG3 . 6711 1 128 . 1 1 14 14 LYS HD2 H 1 1.68 0.02 . 1 . . . . 14 LYS HD2 . 6711 1 129 . 1 1 14 14 LYS HD3 H 1 1.68 0.02 . 1 . . . . 14 LYS HD3 . 6711 1 130 . 1 1 14 14 LYS HE2 H 1 2.93 0.02 . 1 . . . . 14 LYS HE2 . 6711 1 131 . 1 1 14 14 LYS HE3 H 1 2.93 0.02 . 1 . . . . 14 LYS HE3 . 6711 1 132 . 1 1 14 14 LYS C C 13 178.78 0.02 . 1 . . . . 14 LYS C . 6711 1 133 . 1 1 14 14 LYS CA C 13 59.22 0.02 . 1 . . . . 14 LYS CA . 6711 1 134 . 1 1 14 14 LYS CB C 13 31.70 0.02 . 1 . . . . 14 LYS CB . 6711 1 135 . 1 1 14 14 LYS CG C 13 24.67 0.02 . 1 . . . . 14 LYS CG . 6711 1 136 . 1 1 14 14 LYS CD C 13 29.02 0.02 . 1 . . . . 14 LYS CD . 6711 1 137 . 1 1 14 14 LYS CE C 13 42.04 0.02 . 1 . . . . 14 LYS CE . 6711 1 138 . 1 1 14 14 LYS N N 15 120.35 0.02 . 1 . . . . 14 LYS N . 6711 1 139 . 1 1 15 15 GLN H H 1 7.85 0.02 . 1 . . . . 15 GLN H . 6711 1 140 . 1 1 15 15 GLN HA H 1 4.03 0.02 . 1 . . . . 15 GLN HA . 6711 1 141 . 1 1 15 15 GLN HB2 H 1 2.28 0.02 . 1 . . . . 15 GLN HB2 . 6711 1 142 . 1 1 15 15 GLN HB3 H 1 2.28 0.02 . 1 . . . . 15 GLN HB3 . 6711 1 143 . 1 1 15 15 GLN HG2 H 1 2.56 0.02 . 1 . . . . 15 GLN HG2 . 6711 1 144 . 1 1 15 15 GLN HG3 H 1 2.56 0.02 . 1 . . . . 15 GLN HG3 . 6711 1 145 . 1 1 15 15 GLN C C 13 178.33 0.02 . 1 . . . . 15 GLN C . 6711 1 146 . 1 1 15 15 GLN CA C 13 58.91 0.02 . 1 . . . . 15 GLN CA . 6711 1 147 . 1 1 15 15 GLN CB C 13 28.05 0.02 . 1 . . . . 15 GLN CB . 6711 1 148 . 1 1 15 15 GLN CG C 13 33.37 0.02 . 1 . . . . 15 GLN CG . 6711 1 149 . 1 1 15 15 GLN N N 15 117.72 0.02 . 1 . . . . 15 GLN N . 6711 1 150 . 1 1 16 16 LEU H H 1 8.18 0.02 . 1 . . . . 16 LEU H . 6711 1 151 . 1 1 16 16 LEU HA H 1 4.09 0.02 . 1 . . . . 16 LEU HA . 6711 1 152 . 1 1 16 16 LEU HB2 H 1 2.06 0.02 . 2 . . . . 16 LEU HB2 . 6711 1 153 . 1 1 16 16 LEU HB3 H 1 1.74 0.02 . 2 . . . . 16 LEU HB3 . 6711 1 154 . 1 1 16 16 LEU HD11 H 1 1.07 0.02 . 1 . . . . 16 LEU HD1 . 6711 1 155 . 1 1 16 16 LEU HD12 H 1 1.07 0.02 . 1 . . . . 16 LEU HD1 . 6711 1 156 . 1 1 16 16 LEU HD13 H 1 1.07 0.02 . 1 . . . . 16 LEU HD1 . 6711 1 157 . 1 1 16 16 LEU HD21 H 1 1.07 0.02 . 1 . . . . 16 LEU HD2 . 6711 1 158 . 1 1 16 16 LEU HD22 H 1 1.07 0.02 . 1 . . . . 16 LEU HD2 . 6711 1 159 . 1 1 16 16 LEU HD23 H 1 1.07 0.02 . 1 . . . . 16 LEU HD2 . 6711 1 160 . 1 1 16 16 LEU C C 13 178.20 0.02 . 1 . . . . 16 LEU C . 6711 1 161 . 1 1 16 16 LEU CA C 13 57.35 0.02 . 1 . . . . 16 LEU CA . 6711 1 162 . 1 1 16 16 LEU CB C 13 42.31 0.02 . 1 . . . . 16 LEU CB . 6711 1 163 . 1 1 16 16 LEU CG C 13 27.30 0.02 . 1 . . . . 16 LEU CG . 6711 1 164 . 1 1 16 16 LEU CD1 C 13 25.74 0.02 . 2 . . . . 16 LEU CD1 . 6711 1 165 . 1 1 16 16 LEU CD2 C 13 24.55 0.02 . 2 . . . . 16 LEU CD2 . 6711 1 166 . 1 1 16 16 LEU N N 15 120.07 0.02 . 1 . . . . 16 LEU N . 6711 1 167 . 1 1 17 17 THR H H 1 7.73 0.02 . 1 . . . . 17 THR H . 6711 1 168 . 1 1 17 17 THR HA H 1 3.96 0.02 . 1 . . . . 17 THR HA . 6711 1 169 . 1 1 17 17 THR HG21 H 1 0.91 0.02 . 1 . . . . 17 THR HG2 . 6711 1 170 . 1 1 17 17 THR HG22 H 1 0.91 0.02 . 1 . . . . 17 THR HG2 . 6711 1 171 . 1 1 17 17 THR HG23 H 1 0.91 0.02 . 1 . . . . 17 THR HG2 . 6711 1 172 . 1 1 17 17 THR C C 13 176.31 0.02 . 1 . . . . 17 THR C . 6711 1 173 . 1 1 17 17 THR CA C 13 64.49 0.02 . 1 . . . . 17 THR CA . 6711 1 174 . 1 1 17 17 THR CB C 13 69.05 0.02 . 1 . . . . 17 THR CB . 6711 1 175 . 1 1 17 17 THR CG2 C 13 21.2 0.02 . 1 . . . . 17 THR CG2 . 6711 1 176 . 1 1 17 17 THR N N 15 109.93 0.02 . 1 . . . . 17 THR N . 6711 1 177 . 1 1 18 18 LEU H H 1 7.61 0.02 . 1 . . . . 18 LEU H . 6711 1 178 . 1 1 18 18 LEU HA H 1 4.19 0.02 . 1 . . . . 18 LEU HA . 6711 1 179 . 1 1 18 18 LEU HB2 H 1 1.70 0.02 . 2 . . . . 18 LEU HB2 . 6711 1 180 . 1 1 18 18 LEU HB3 H 1 1.53 0.02 . 2 . . . . 18 LEU HB3 . 6711 1 181 . 1 1 18 18 LEU HD11 H 1 0.84 0.02 . 1 . . . . 18 LEU HD1 . 6711 1 182 . 1 1 18 18 LEU HD12 H 1 0.84 0.02 . 1 . . . . 18 LEU HD1 . 6711 1 183 . 1 1 18 18 LEU HD13 H 1 0.84 0.02 . 1 . . . . 18 LEU HD1 . 6711 1 184 . 1 1 18 18 LEU HD21 H 1 0.84 0.02 . 1 . . . . 18 LEU HD2 . 6711 1 185 . 1 1 18 18 LEU HD22 H 1 0.84 0.02 . 1 . . . . 18 LEU HD2 . 6711 1 186 . 1 1 18 18 LEU HD23 H 1 0.84 0.02 . 1 . . . . 18 LEU HD2 . 6711 1 187 . 1 1 18 18 LEU C C 13 177.45 0.02 . 1 . . . . 18 LEU C . 6711 1 188 . 1 1 18 18 LEU CA C 13 56.59 0.02 . 1 . . . . 18 LEU CA . 6711 1 189 . 1 1 18 18 LEU CB C 13 42.53 0.02 . 1 . . . . 18 LEU CB . 6711 1 190 . 1 1 18 18 LEU CG C 13 26.65 0.02 . 1 . . . . 18 LEU CG . 6711 1 191 . 1 1 18 18 LEU CD1 C 13 24.80 0.02 . 2 . . . . 18 LEU CD1 . 6711 1 192 . 1 1 18 18 LEU CD2 C 13 23.13 0.02 . 2 . . . . 18 LEU CD2 . 6711 1 193 . 1 1 18 18 LEU N N 15 121.40 0.02 . 1 . . . . 18 LEU N . 6711 1 194 . 1 1 19 19 ASN H H 1 7.61 0.02 . 1 . . . . 19 ASN H . 6711 1 195 . 1 1 19 19 ASN C C 13 180.37 0.02 . 1 . . . . 19 ASN C . 6711 1 196 . 1 1 19 19 ASN CA C 13 50.85 0.02 . 1 . . . . 19 ASN CA . 6711 1 197 . 1 1 19 19 ASN CB C 13 39.50 0.02 . 1 . . . . 19 ASN CB . 6711 1 198 . 1 1 19 19 ASN N N 15 114.86 0.02 . 1 . . . . 19 ASN N . 6711 1 199 . 1 1 21 21 PRO HA H 1 4.59 0.02 . 1 . . . . 21 PRO HA . 6711 1 200 . 1 1 21 21 PRO HB2 H 1 2.40 0.02 . 2 . . . . 21 PRO HB2 . 6711 1 201 . 1 1 21 21 PRO HB3 H 1 1.82 0.02 . 2 . . . . 21 PRO HB3 . 6711 1 202 . 1 1 21 21 PRO HG2 H 1 1.99 0.02 . 1 . . . . 21 PRO HG2 . 6711 1 203 . 1 1 21 21 PRO HG3 H 1 1.99 0.02 . 1 . . . . 21 PRO HG3 . 6711 1 204 . 1 1 21 21 PRO C C 13 176.27 0.02 . 1 . . . . 21 PRO C . 6711 1 205 . 1 1 21 21 PRO CA C 13 61.56 0.02 . 1 . . . . 21 PRO CA . 6711 1 206 . 1 1 21 21 PRO CB C 13 31.42 0.02 . 1 . . . . 21 PRO CB . 6711 1 207 . 1 1 21 21 PRO CG C 13 27.18 0.02 . 1 . . . . 21 PRO CG . 6711 1 208 . 1 1 21 21 PRO CD C 13 50.51 0.02 . 1 . . . . 21 PRO CD . 6711 1 209 . 1 1 22 22 GLU H H 1 8.56 0.02 . 1 . . . . 22 GLU H . 6711 1 210 . 1 1 22 22 GLU HA H 1 4.10 0.02 . 1 . . . . 22 GLU HA . 6711 1 211 . 1 1 22 22 GLU HB2 H 1 1.96 0.02 . 1 . . . . 22 GLU HB2 . 6711 1 212 . 1 1 22 22 GLU HB3 H 1 1.96 0.02 . 1 . . . . 22 GLU HB3 . 6711 1 213 . 1 1 22 22 GLU HG2 H 1 2.28 0.02 . 1 . . . . 22 GLU HG2 . 6711 1 214 . 1 1 22 22 GLU HG3 H 1 2.28 0.02 . 1 . . . . 22 GLU HG3 . 6711 1 215 . 1 1 22 22 GLU C C 13 177.61 0.02 . 1 . . . . 22 GLU C . 6711 1 216 . 1 1 22 22 GLU CA C 13 57.31 0.02 . 1 . . . . 22 GLU CA . 6711 1 217 . 1 1 22 22 GLU CB C 13 29.27 0.02 . 1 . . . . 22 GLU CB . 6711 1 218 . 1 1 22 22 GLU CG C 13 36.08 0.02 . 1 . . . . 22 GLU CG . 6711 1 219 . 1 1 22 22 GLU N N 15 121.78 0.02 . 1 . . . . 22 GLU N . 6711 1 220 . 1 1 23 23 GLY H H 1 8.57 0.02 . 1 . . . . 23 GLY H . 6711 1 221 . 1 1 23 23 GLY HA2 H 1 4.22 0.02 . 2 . . . . 23 GLY HA2 . 6711 1 222 . 1 1 23 23 GLY HA3 H 1 3.76 0.02 . 2 . . . . 23 GLY HA3 . 6711 1 223 . 1 1 23 23 GLY C C 13 173.13 0.02 . 1 . . . . 23 GLY C . 6711 1 224 . 1 1 23 23 GLY CA C 13 45.82 0.02 . 1 . . . . 23 GLY CA . 6711 1 225 . 1 1 23 23 GLY N N 15 110.47 0.02 . 1 . . . . 23 GLY N . 6711 1 226 . 1 1 24 24 ILE H H 1 7.33 0.02 . 1 . . . . 24 ILE H . 6711 1 227 . 1 1 24 24 ILE HA H 1 4.89 0.02 . 1 . . . . 24 ILE HA . 6711 1 228 . 1 1 24 24 ILE HB H 1 1.59 0.02 . 1 . . . . 24 ILE HB . 6711 1 229 . 1 1 24 24 ILE HG21 H 1 0.81 0.02 . 4 . . . . 24 ILE HG2 . 6711 1 230 . 1 1 24 24 ILE HG22 H 1 0.81 0.02 . 4 . . . . 24 ILE HG2 . 6711 1 231 . 1 1 24 24 ILE HG23 H 1 0.81 0.02 . 4 . . . . 24 ILE HG2 . 6711 1 232 . 1 1 24 24 ILE HD11 H 1 0.81 0.02 . 4 . . . . 24 ILE HD1 . 6711 1 233 . 1 1 24 24 ILE HD12 H 1 0.81 0.02 . 4 . . . . 24 ILE HD1 . 6711 1 234 . 1 1 24 24 ILE HD13 H 1 0.81 0.02 . 4 . . . . 24 ILE HD1 . 6711 1 235 . 1 1 24 24 ILE C C 13 174.76 0.02 . 1 . . . . 24 ILE C . 6711 1 236 . 1 1 24 24 ILE CA C 13 59.67 0.02 . 1 . . . . 24 ILE CA . 6711 1 237 . 1 1 24 24 ILE CB C 13 41.96 0.02 . 1 . . . . 24 ILE CB . 6711 1 238 . 1 1 24 24 ILE CG1 C 13 27.12 0.02 . 1 . . . . 24 ILE CG1 . 6711 1 239 . 1 1 24 24 ILE CG2 C 13 19.0 0.02 . 1 . . . . 24 ILE CG2 . 6711 1 240 . 1 1 24 24 ILE CD1 C 13 14.31 0.02 . 1 . . . . 24 ILE CD1 . 6711 1 241 . 1 1 24 24 ILE N N 15 116.98 0.02 . 1 . . . . 24 ILE N . 6711 1 242 . 1 1 25 25 VAL H H 1 8.25 0.02 . 1 . . . . 25 VAL H . 6711 1 243 . 1 1 25 25 VAL HA H 1 4.32 0.02 . 1 . . . . 25 VAL HA . 6711 1 244 . 1 1 25 25 VAL HB H 1 1.95 0.02 . 1 . . . . 25 VAL HB . 6711 1 245 . 1 1 25 25 VAL HG11 H 1 0.92 0.02 . 1 . . . . 25 VAL HG1 . 6711 1 246 . 1 1 25 25 VAL HG12 H 1 0.92 0.02 . 1 . . . . 25 VAL HG1 . 6711 1 247 . 1 1 25 25 VAL HG13 H 1 0.92 0.02 . 1 . . . . 25 VAL HG1 . 6711 1 248 . 1 1 25 25 VAL HG21 H 1 0.92 0.02 . 1 . . . . 25 VAL HG2 . 6711 1 249 . 1 1 25 25 VAL HG22 H 1 0.92 0.02 . 1 . . . . 25 VAL HG2 . 6711 1 250 . 1 1 25 25 VAL HG23 H 1 0.92 0.02 . 1 . . . . 25 VAL HG2 . 6711 1 251 . 1 1 25 25 VAL C C 13 174.87 0.02 . 1 . . . . 25 VAL C . 6711 1 252 . 1 1 25 25 VAL CA C 13 61.52 0.02 . 1 . . . . 25 VAL CA . 6711 1 253 . 1 1 25 25 VAL CB C 13 34.60 0.02 . 1 . . . . 25 VAL CB . 6711 1 254 . 1 1 25 25 VAL CG1 C 13 20.81 0.02 . 1 . . . . 25 VAL CG1 . 6711 1 255 . 1 1 25 25 VAL CG2 C 13 20.81 0.02 . 1 . . . . 25 VAL CG2 . 6711 1 256 . 1 1 25 25 VAL N N 15 125.25 0.02 . 1 . . . . 25 VAL N . 6711 1 257 . 1 1 26 26 ALA H H 1 8.52 0.02 . 1 . . . . 26 ALA H . 6711 1 258 . 1 1 26 26 ALA HA H 1 5.45 0.02 . 1 . . . . 26 ALA HA . 6711 1 259 . 1 1 26 26 ALA HB1 H 1 1.39 0.02 . 1 . . . . 26 ALA HB . 6711 1 260 . 1 1 26 26 ALA HB2 H 1 1.39 0.02 . 1 . . . . 26 ALA HB . 6711 1 261 . 1 1 26 26 ALA HB3 H 1 1.39 0.02 . 1 . . . . 26 ALA HB . 6711 1 262 . 1 1 26 26 ALA C C 13 176.50 0.02 . 1 . . . . 26 ALA C . 6711 1 263 . 1 1 26 26 ALA CA C 13 51.46 0.02 . 1 . . . . 26 ALA CA . 6711 1 264 . 1 1 26 26 ALA CB C 13 22.50 0.02 . 1 . . . . 26 ALA CB . 6711 1 265 . 1 1 26 26 ALA N N 15 126.67 0.02 . 1 . . . . 26 ALA N . 6711 1 266 . 1 1 27 27 GLY H H 1 8.18 0.02 . 1 . . . . 27 GLY H . 6711 1 267 . 1 1 27 27 GLY HA2 H 1 3.63 0.02 . 1 . . . . 27 GLY HA2 . 6711 1 268 . 1 1 27 27 GLY HA3 H 1 3.63 0.02 . 1 . . . . 27 GLY HA3 . 6711 1 269 . 1 1 27 27 GLY CA C 13 45.69 0.02 . 1 . . . . 27 GLY CA . 6711 1 270 . 1 1 27 27 GLY N N 15 105.73 0.02 . 1 . . . . 27 GLY N . 6711 1 271 . 1 1 28 28 PRO HA H 1 4.03 0.02 . 1 . . . . 28 PRO HA . 6711 1 272 . 1 1 28 28 PRO HB2 H 1 0.97 0.02 . 1 . . . . 28 PRO HB2 . 6711 1 273 . 1 1 28 28 PRO HB3 H 1 0.97 0.02 . 1 . . . . 28 PRO HB3 . 6711 1 274 . 1 1 28 28 PRO HG2 H 1 0.85 0.02 . 1 . . . . 28 PRO HG2 . 6711 1 275 . 1 1 28 28 PRO HG3 H 1 0.85 0.02 . 1 . . . . 28 PRO HG3 . 6711 1 276 . 1 1 28 28 PRO C C 13 176.82 0.02 . 1 . . . . 28 PRO C . 6711 1 277 . 1 1 28 28 PRO CA C 13 62.1 0.02 . 1 . . . . 28 PRO CA . 6711 1 278 . 1 1 28 28 PRO CB C 13 31.2 0.02 . 1 . . . . 28 PRO CB . 6711 1 279 . 1 1 28 28 PRO CG C 13 25.8 0.02 . 1 . . . . 28 PRO CG . 6711 1 280 . 1 1 28 28 PRO CD C 13 47.7 0.02 . 1 . . . . 28 PRO CD . 6711 1 281 . 1 1 29 29 MET H H 1 8.34 0.02 . 1 . . . . 29 MET H . 6711 1 282 . 1 1 29 29 MET HA H 1 4.50 0.02 . 1 . . . . 29 MET HA . 6711 1 283 . 1 1 29 29 MET HB2 H 1 2.05 0.02 . 1 . . . . 29 MET HB2 . 6711 1 284 . 1 1 29 29 MET HB3 H 1 2.05 0.02 . 1 . . . . 29 MET HB3 . 6711 1 285 . 1 1 29 29 MET HG2 H 1 2.48 0.02 . 1 . . . . 29 MET HG2 . 6711 1 286 . 1 1 29 29 MET HG3 H 1 2.48 0.02 . 1 . . . . 29 MET HG3 . 6711 1 287 . 1 1 29 29 MET C C 13 176.03 0.02 . 1 . . . . 29 MET C . 6711 1 288 . 1 1 29 29 MET CA C 13 55.61 0.02 . 1 . . . . 29 MET CA . 6711 1 289 . 1 1 29 29 MET CB C 13 32.28 0.02 . 1 . . . . 29 MET CB . 6711 1 290 . 1 1 29 29 MET CG C 13 32.97 0.02 . 1 . . . . 29 MET CG . 6711 1 291 . 1 1 29 29 MET N N 15 123.51 0.02 . 1 . . . . 29 MET N . 6711 1 292 . 1 1 30 30 ASN H H 1 8.56 0.02 . 1 . . . . 30 ASN H . 6711 1 293 . 1 1 30 30 ASN HA H 1 4.56 0.02 . 1 . . . . 30 ASN HA . 6711 1 294 . 1 1 30 30 ASN HB2 H 1 2.79 0.02 . 1 . . . . 30 ASN HB2 . 6711 1 295 . 1 1 30 30 ASN HB3 H 1 2.79 0.02 . 1 . . . . 30 ASN HB3 . 6711 1 296 . 1 1 30 30 ASN C C 13 175.12 0.02 . 1 . . . . 30 ASN C . 6711 1 297 . 1 1 30 30 ASN CA C 13 52.41 0.02 . 1 . . . . 30 ASN CA . 6711 1 298 . 1 1 30 30 ASN CB C 13 40.21 0.02 . 1 . . . . 30 ASN CB . 6711 1 299 . 1 1 30 30 ASN N N 15 125.40 0.02 . 1 . . . . 30 ASN N . 6711 1 300 . 1 1 31 31 GLU H H 1 8.78 0.02 . 1 . . . . 31 GLU H . 6711 1 301 . 1 1 31 31 GLU HA H 1 3.53 0.02 . 1 . . . . 31 GLU HA . 6711 1 302 . 1 1 31 31 GLU HB2 H 1 2.05 0.02 . 1 . . . . 31 GLU HB2 . 6711 1 303 . 1 1 31 31 GLU HB3 H 1 2.05 0.02 . 1 . . . . 31 GLU HB3 . 6711 1 304 . 1 1 31 31 GLU HG2 H 1 2.23 0.02 . 1 . . . . 31 GLU HG2 . 6711 1 305 . 1 1 31 31 GLU HG3 H 1 2.23 0.02 . 1 . . . . 31 GLU HG3 . 6711 1 306 . 1 1 31 31 GLU C C 13 175.81 0.02 . 1 . . . . 31 GLU C . 6711 1 307 . 1 1 31 31 GLU CA C 13 58.49 0.02 . 1 . . . . 31 GLU CA . 6711 1 308 . 1 1 31 31 GLU CB C 13 28.92 0.02 . 1 . . . . 31 GLU CB . 6711 1 309 . 1 1 31 31 GLU CG C 13 36.58 0.02 . 1 . . . . 31 GLU CG . 6711 1 310 . 1 1 31 31 GLU N N 15 120.60 0.02 . 1 . . . . 31 GLU N . 6711 1 311 . 1 1 32 32 GLU H H 1 8.23 0.02 . 1 . . . . 32 GLU H . 6711 1 312 . 1 1 32 32 GLU HA H 1 4.28 0.02 . 1 . . . . 32 GLU HA . 6711 1 313 . 1 1 32 32 GLU HB2 H 1 1.98 0.02 . 1 . . . . 32 GLU HB2 . 6711 1 314 . 1 1 32 32 GLU HB3 H 1 1.98 0.02 . 1 . . . . 32 GLU HB3 . 6711 1 315 . 1 1 32 32 GLU HG2 H 1 2.23 0.02 . 1 . . . . 32 GLU HG2 . 6711 1 316 . 1 1 32 32 GLU HG3 H 1 2.23 0.02 . 1 . . . . 32 GLU HG3 . 6711 1 317 . 1 1 32 32 GLU C C 13 176.30 0.02 . 1 . . . . 32 GLU C . 6711 1 318 . 1 1 32 32 GLU CA C 13 57.07 0.02 . 1 . . . . 32 GLU CA . 6711 1 319 . 1 1 32 32 GLU CB C 13 29.91 0.02 . 1 . . . . 32 GLU CB . 6711 1 320 . 1 1 32 32 GLU CG C 13 36.39 0.02 . 1 . . . . 32 GLU CG . 6711 1 321 . 1 1 32 32 GLU N N 15 116.16 0.02 . 1 . . . . 32 GLU N . 6711 1 322 . 1 1 33 33 ASN H H 1 7.93 0.02 . 1 . . . . 33 ASN H . 6711 1 323 . 1 1 33 33 ASN HA H 1 5.23 0.02 . 1 . . . . 33 ASN HA . 6711 1 324 . 1 1 33 33 ASN HB2 H 1 2.77 0.02 . 1 . . . . 33 ASN HB2 . 6711 1 325 . 1 1 33 33 ASN HB3 H 1 2.77 0.02 . 1 . . . . 33 ASN HB3 . 6711 1 326 . 1 1 33 33 ASN C C 13 174.83 0.02 . 1 . . . . 33 ASN C . 6711 1 327 . 1 1 33 33 ASN CA C 13 51.46 0.02 . 1 . . . . 33 ASN CA . 6711 1 328 . 1 1 33 33 ASN CB C 13 38.13 0.02 . 1 . . . . 33 ASN CB . 6711 1 329 . 1 1 33 33 ASN N N 15 116.75 0.02 . 1 . . . . 33 ASN N . 6711 1 330 . 1 1 34 34 PHE H H 1 9.43 0.02 . 1 . . . . 34 PHE H . 6711 1 331 . 1 1 34 34 PHE HA H 1 3.93 0.02 . 1 . . . . 34 PHE HA . 6711 1 332 . 1 1 34 34 PHE HB2 H 1 2.77 0.02 . 1 . . . . 34 PHE HB2 . 6711 1 333 . 1 1 34 34 PHE HB3 H 1 2.77 0.02 . 1 . . . . 34 PHE HB3 . 6711 1 334 . 1 1 34 34 PHE C C 13 174.78 0.02 . 1 . . . . 34 PHE C . 6711 1 335 . 1 1 34 34 PHE CA C 13 60.07 0.02 . 1 . . . . 34 PHE CA . 6711 1 336 . 1 1 34 34 PHE CB C 13 39.55 0.02 . 1 . . . . 34 PHE CB . 6711 1 337 . 1 1 34 34 PHE N N 15 124.03 0.02 . 1 . . . . 34 PHE N . 6711 1 338 . 1 1 35 35 PHE H H 1 8.15 0.02 . 1 . . . . 35 PHE H . 6711 1 339 . 1 1 35 35 PHE HA H 1 4.36 0.02 . 1 . . . . 35 PHE HA . 6711 1 340 . 1 1 35 35 PHE HB2 H 1 3.21 0.02 . 1 . . . . 35 PHE HB2 . 6711 1 341 . 1 1 35 35 PHE HB3 H 1 3.21 0.02 . 1 . . . . 35 PHE HB3 . 6711 1 342 . 1 1 35 35 PHE C C 13 174.87 0.02 . 1 . . . . 35 PHE C . 6711 1 343 . 1 1 35 35 PHE CA C 13 59.40 0.02 . 1 . . . . 35 PHE CA . 6711 1 344 . 1 1 35 35 PHE CB C 13 38.06 0.02 . 1 . . . . 35 PHE CB . 6711 1 345 . 1 1 35 35 PHE N N 15 113.17 0.02 . 1 . . . . 35 PHE N . 6711 1 346 . 1 1 36 36 GLU H H 1 7.03 0.02 . 1 . . . . 36 GLU H . 6711 1 347 . 1 1 36 36 GLU HA H 1 5.48 0.02 . 1 . . . . 36 GLU HA . 6711 1 348 . 1 1 36 36 GLU HB2 H 1 1.80 0.02 . 1 . . . . 36 GLU HB2 . 6711 1 349 . 1 1 36 36 GLU HB3 H 1 1.80 0.02 . 1 . . . . 36 GLU HB3 . 6711 1 350 . 1 1 36 36 GLU HG2 H 1 2.16 0.02 . 1 . . . . 36 GLU HG2 . 6711 1 351 . 1 1 36 36 GLU HG3 H 1 2.16 0.02 . 1 . . . . 36 GLU HG3 . 6711 1 352 . 1 1 36 36 GLU C C 13 174.99 0.02 . 1 . . . . 36 GLU C . 6711 1 353 . 1 1 36 36 GLU CA C 13 55.22 0.02 . 1 . . . . 36 GLU CA . 6711 1 354 . 1 1 36 36 GLU CB C 13 31.65 0.02 . 1 . . . . 36 GLU CB . 6711 1 355 . 1 1 36 36 GLU CG C 13 35.48 0.02 . 1 . . . . 36 GLU CG . 6711 1 356 . 1 1 36 36 GLU N N 15 118.90 0.02 . 1 . . . . 36 GLU N . 6711 1 357 . 1 1 37 37 TRP H H 1 9.95 0.02 . 1 . . . . 37 TRP H . 6711 1 358 . 1 1 37 37 TRP HA H 1 5.33 0.02 . 1 . . . . 37 TRP HA . 6711 1 359 . 1 1 37 37 TRP HB2 H 1 3.14 0.02 . 1 . . . . 37 TRP HB2 . 6711 1 360 . 1 1 37 37 TRP HB3 H 1 3.14 0.02 . 1 . . . . 37 TRP HB3 . 6711 1 361 . 1 1 37 37 TRP C C 13 175.15 0.02 . 1 . . . . 37 TRP C . 6711 1 362 . 1 1 37 37 TRP CA C 13 54.94 0.02 . 1 . . . . 37 TRP CA . 6711 1 363 . 1 1 37 37 TRP CB C 13 31.89 0.02 . 1 . . . . 37 TRP CB . 6711 1 364 . 1 1 37 37 TRP N N 15 126.57 0.02 . 1 . . . . 37 TRP N . 6711 1 365 . 1 1 38 38 GLU H H 1 8.64 0.02 . 1 . . . . 38 GLU H . 6711 1 366 . 1 1 38 38 GLU HA H 1 5.24 0.02 . 1 . . . . 38 GLU HA . 6711 1 367 . 1 1 38 38 GLU HB2 H 1 2.04 0.02 . 1 . . . . 38 GLU HB2 . 6711 1 368 . 1 1 38 38 GLU HB3 H 1 2.04 0.02 . 1 . . . . 38 GLU HB3 . 6711 1 369 . 1 1 38 38 GLU C C 13 174.90 0.02 . 1 . . . . 38 GLU C . 6711 1 370 . 1 1 38 38 GLU CA C 13 54.40 0.02 . 1 . . . . 38 GLU CA . 6711 1 371 . 1 1 38 38 GLU CB C 13 32.44 0.02 . 1 . . . . 38 GLU CB . 6711 1 372 . 1 1 38 38 GLU CG C 13 36.41 0.02 . 1 . . . . 38 GLU CG . 6711 1 373 . 1 1 38 38 GLU N N 15 119.28 0.02 . 1 . . . . 38 GLU N . 6711 1 374 . 1 1 39 39 ALA H H 1 8.96 0.02 . 1 . . . . 39 ALA H . 6711 1 375 . 1 1 39 39 ALA HA H 1 5.45 0.02 . 1 . . . . 39 ALA HA . 6711 1 376 . 1 1 39 39 ALA HB1 H 1 1.13 0.02 . 1 . . . . 39 ALA HB . 6711 1 377 . 1 1 39 39 ALA HB2 H 1 1.13 0.02 . 1 . . . . 39 ALA HB . 6711 1 378 . 1 1 39 39 ALA HB3 H 1 1.13 0.02 . 1 . . . . 39 ALA HB . 6711 1 379 . 1 1 39 39 ALA C C 13 175.14 0.02 . 1 . . . . 39 ALA C . 6711 1 380 . 1 1 39 39 ALA CA C 13 49.96 0.02 . 1 . . . . 39 ALA CA . 6711 1 381 . 1 1 39 39 ALA CB C 13 22.61 0.02 . 1 . . . . 39 ALA CB . 6711 1 382 . 1 1 39 39 ALA N N 15 124.40 0.02 . 1 . . . . 39 ALA N . 6711 1 383 . 1 1 40 40 LEU H H 1 9.05 0.02 . 1 . . . . 40 LEU H . 6711 1 384 . 1 1 40 40 LEU HA H 1 4.70 0.02 . 1 . . . . 40 LEU HA . 6711 1 385 . 1 1 40 40 LEU HB2 H 1 1.56 0.02 . 1 . . . . 40 LEU HB2 . 6711 1 386 . 1 1 40 40 LEU HB3 H 1 1.56 0.02 . 1 . . . . 40 LEU HB3 . 6711 1 387 . 1 1 40 40 LEU HG H 1 1.33 0.02 . 1 . . . . 40 LEU HG . 6711 1 388 . 1 1 40 40 LEU HD11 H 1 0.75 0.02 . 1 . . . . 40 LEU HD1 . 6711 1 389 . 1 1 40 40 LEU HD12 H 1 0.75 0.02 . 1 . . . . 40 LEU HD1 . 6711 1 390 . 1 1 40 40 LEU HD13 H 1 0.75 0.02 . 1 . . . . 40 LEU HD1 . 6711 1 391 . 1 1 40 40 LEU HD21 H 1 0.75 0.02 . 1 . . . . 40 LEU HD2 . 6711 1 392 . 1 1 40 40 LEU HD22 H 1 0.75 0.02 . 1 . . . . 40 LEU HD2 . 6711 1 393 . 1 1 40 40 LEU HD23 H 1 0.75 0.02 . 1 . . . . 40 LEU HD2 . 6711 1 394 . 1 1 40 40 LEU C C 13 175.16 0.02 . 1 . . . . 40 LEU C . 6711 1 395 . 1 1 40 40 LEU CA C 13 54.27 0.02 . 1 . . . . 40 LEU CA . 6711 1 396 . 1 1 40 40 LEU CB C 13 43.95 0.02 . 1 . . . . 40 LEU CB . 6711 1 397 . 1 1 40 40 LEU CG C 13 26.8 0.02 . 1 . . . . 40 LEU CG . 6711 1 398 . 1 1 40 40 LEU CD1 C 13 24.10 0.02 . 1 . . . . 40 LEU CD1 . 6711 1 399 . 1 1 40 40 LEU CD2 C 13 24.10 0.02 . 1 . . . . 40 LEU CD2 . 6711 1 400 . 1 1 40 40 LEU N N 15 122.55 0.02 . 1 . . . . 40 LEU N . 6711 1 401 . 1 1 41 41 ILE H H 1 8.26 0.02 . 1 . . . . 41 ILE H . 6711 1 402 . 1 1 41 41 ILE HA H 1 4.51 0.02 . 1 . . . . 41 ILE HA . 6711 1 403 . 1 1 41 41 ILE HB H 1 2.34 0.02 . 1 . . . . 41 ILE HB . 6711 1 404 . 1 1 41 41 ILE HG21 H 1 0.84 0.02 . 4 . . . . 41 ILE HG2 . 6711 1 405 . 1 1 41 41 ILE HG22 H 1 0.84 0.02 . 4 . . . . 41 ILE HG2 . 6711 1 406 . 1 1 41 41 ILE HG23 H 1 0.84 0.02 . 4 . . . . 41 ILE HG2 . 6711 1 407 . 1 1 41 41 ILE HD11 H 1 0.84 0.02 . 4 . . . . 41 ILE HD1 . 6711 1 408 . 1 1 41 41 ILE HD12 H 1 0.84 0.02 . 4 . . . . 41 ILE HD1 . 6711 1 409 . 1 1 41 41 ILE HD13 H 1 0.84 0.02 . 4 . . . . 41 ILE HD1 . 6711 1 410 . 1 1 41 41 ILE C C 13 174.70 0.02 . 1 . . . . 41 ILE C . 6711 1 411 . 1 1 41 41 ILE CA C 13 59.36 0.02 . 1 . . . . 41 ILE CA . 6711 1 412 . 1 1 41 41 ILE CB C 13 39.65 0.02 . 1 . . . . 41 ILE CB . 6711 1 413 . 1 1 41 41 ILE CG1 C 13 27.90 0.02 . 1 . . . . 41 ILE CG1 . 6711 1 414 . 1 1 41 41 ILE CG2 C 13 18.24 0.02 . 1 . . . . 41 ILE CG2 . 6711 1 415 . 1 1 41 41 ILE CD1 C 13 13.20 0.02 . 1 . . . . 41 ILE CD1 . 6711 1 416 . 1 1 41 41 ILE N N 15 124.32 0.02 . 1 . . . . 41 ILE N . 6711 1 417 . 1 1 42 42 MET H H 1 8.36 0.02 . 1 . . . . 42 MET H . 6711 1 418 . 1 1 42 42 MET HA H 1 4.95 0.02 . 1 . . . . 42 MET HA . 6711 1 419 . 1 1 42 42 MET HB2 H 1 2.09 0.02 . 1 . . . . 42 MET HB2 . 6711 1 420 . 1 1 42 42 MET HB3 H 1 2.09 0.02 . 1 . . . . 42 MET HB3 . 6711 1 421 . 1 1 42 42 MET HG2 H 1 2.61 0.02 . 1 . . . . 42 MET HG2 . 6711 1 422 . 1 1 42 42 MET HG3 H 1 2.61 0.02 . 1 . . . . 42 MET HG3 . 6711 1 423 . 1 1 42 42 MET C C 13 177.47 0.02 . 1 . . . . 42 MET C . 6711 1 424 . 1 1 42 42 MET CA C 13 53.85 0.02 . 1 . . . . 42 MET CA . 6711 1 425 . 1 1 42 42 MET CB C 13 32.19 0.02 . 1 . . . . 42 MET CB . 6711 1 426 . 1 1 42 42 MET CG C 13 32.73 0.02 . 1 . . . . 42 MET CG . 6711 1 427 . 1 1 42 42 MET N N 15 126.06 0.02 . 1 . . . . 42 MET N . 6711 1 428 . 1 1 43 43 GLY H H 1 8.71 0.02 . 1 . . . . 43 GLY H . 6711 1 429 . 1 1 43 43 GLY HA2 H 1 3.99 0.02 . 1 . . . . 43 GLY HA2 . 6711 1 430 . 1 1 43 43 GLY HA3 H 1 3.99 0.02 . 1 . . . . 43 GLY HA3 . 6711 1 431 . 1 1 43 43 GLY CA C 13 43.86 0.02 . 1 . . . . 43 GLY CA . 6711 1 432 . 1 1 43 43 GLY N N 15 109.52 0.02 . 1 . . . . 43 GLY N . 6711 1 433 . 1 1 44 44 PRO HA H 1 4.41 0.02 . 1 . . . . 44 PRO HA . 6711 1 434 . 1 1 44 44 PRO HB2 H 1 2.33 0.02 . 2 . . . . 44 PRO HB2 . 6711 1 435 . 1 1 44 44 PRO HB3 H 1 1.95 0.02 . 2 . . . . 44 PRO HB3 . 6711 1 436 . 1 1 44 44 PRO C C 13 176.48 0.02 . 1 . . . . 44 PRO C . 6711 1 437 . 1 1 44 44 PRO CA C 13 62.58 0.02 . 1 . . . . 44 PRO CA . 6711 1 438 . 1 1 44 44 PRO CB C 13 31.10 0.02 . 1 . . . . 44 PRO CB . 6711 1 439 . 1 1 44 44 PRO CG C 13 27.09 0.02 . 1 . . . . 44 PRO CG . 6711 1 440 . 1 1 44 44 PRO CD C 13 51.66 0.02 . 1 . . . . 44 PRO CD . 6711 1 441 . 1 1 45 45 GLU H H 1 8.68 0.02 . 1 . . . . 45 GLU H . 6711 1 442 . 1 1 45 45 GLU HA H 1 3.76 0.02 . 1 . . . . 45 GLU HA . 6711 1 443 . 1 1 45 45 GLU HB2 H 1 1.91 0.02 . 1 . . . . 45 GLU HB2 . 6711 1 444 . 1 1 45 45 GLU HB3 H 1 1.91 0.02 . 1 . . . . 45 GLU HB3 . 6711 1 445 . 1 1 45 45 GLU HG2 H 1 2.26 0.02 . 1 . . . . 45 GLU HG2 . 6711 1 446 . 1 1 45 45 GLU HG3 H 1 2.26 0.02 . 1 . . . . 45 GLU HG3 . 6711 1 447 . 1 1 45 45 GLU C C 13 175.70 0.02 . 1 . . . . 45 GLU C . 6711 1 448 . 1 1 45 45 GLU CA C 13 57.1 0.02 . 1 . . . . 45 GLU CA . 6711 1 449 . 1 1 45 45 GLU CB C 13 29.91 0.02 . 1 . . . . 45 GLU CB . 6711 1 450 . 1 1 45 45 GLU CG C 13 36.22 0.02 . 1 . . . . 45 GLU CG . 6711 1 451 . 1 1 45 45 GLU N N 15 123.71 0.02 . 1 . . . . 45 GLU N . 6711 1 452 . 1 1 46 46 ASP H H 1 8.91 0.02 . 1 . . . . 46 ASP H . 6711 1 453 . 1 1 46 46 ASP HA H 1 4.27 0.02 . 1 . . . . 46 ASP HA . 6711 1 454 . 1 1 46 46 ASP HB2 H 1 2.98 0.02 . 2 . . . . 46 ASP HB2 . 6711 1 455 . 1 1 46 46 ASP HB3 H 1 2.80 0.02 . 2 . . . . 46 ASP HB3 . 6711 1 456 . 1 1 46 46 ASP C C 13 175.15 0.02 . 1 . . . . 46 ASP C . 6711 1 457 . 1 1 46 46 ASP CA C 13 55.67 0.02 . 1 . . . . 46 ASP CA . 6711 1 458 . 1 1 46 46 ASP CB C 13 39.08 0.02 . 1 . . . . 46 ASP CB . 6711 1 459 . 1 1 46 46 ASP N N 15 117.45 0.02 . 1 . . . . 46 ASP N . 6711 1 460 . 1 1 47 47 THR H H 1 7.20 0.02 . 1 . . . . 47 THR H . 6711 1 461 . 1 1 47 47 THR HA H 1 4.96 0.02 . 1 . . . . 47 THR HA . 6711 1 462 . 1 1 47 47 THR HB H 1 4.69 0.02 . 1 . . . . 47 THR HB . 6711 1 463 . 1 1 47 47 THR HG21 H 1 1.25 0.02 . 1 . . . . 47 THR HG2 . 6711 1 464 . 1 1 47 47 THR HG22 H 1 1.25 0.02 . 1 . . . . 47 THR HG2 . 6711 1 465 . 1 1 47 47 THR HG23 H 1 1.25 0.02 . 1 . . . . 47 THR HG2 . 6711 1 466 . 1 1 47 47 THR C C 13 176.57 0.02 . 1 . . . . 47 THR C . 6711 1 467 . 1 1 47 47 THR CA C 13 60.11 0.02 . 1 . . . . 47 THR CA . 6711 1 468 . 1 1 47 47 THR CB C 13 74.55 0.02 . 1 . . . . 47 THR CB . 6711 1 469 . 1 1 47 47 THR CG2 C 13 21.59 0.02 . 1 . . . . 47 THR CG2 . 6711 1 470 . 1 1 47 47 THR N N 15 105.12 0.02 . 1 . . . . 47 THR N . 6711 1 471 . 1 1 48 48 CYS H H 1 9.24 0.02 . 1 . . . . 48 CYS H . 6711 1 472 . 1 1 48 48 CYS HA H 1 3.59 0.02 . 1 . . . . 48 CYS HA . 6711 1 473 . 1 1 48 48 CYS HB2 H 1 2.90 0.02 . 1 . . . . 48 CYS HB2 . 6711 1 474 . 1 1 48 48 CYS HB3 H 1 2.90 0.02 . 1 . . . . 48 CYS HB3 . 6711 1 475 . 1 1 48 48 CYS C C 13 173.82 0.02 . 1 . . . . 48 CYS C . 6711 1 476 . 1 1 48 48 CYS CA C 13 59.36 0.02 . 1 . . . . 48 CYS CA . 6711 1 477 . 1 1 48 48 CYS CB C 13 27.26 0.02 . 1 . . . . 48 CYS CB . 6711 1 478 . 1 1 48 48 CYS N N 15 117.55 0.02 . 1 . . . . 48 CYS N . 6711 1 479 . 1 1 49 49 PHE H H 1 7.75 0.02 . 1 . . . . 49 PHE H . 6711 1 480 . 1 1 49 49 PHE HA H 1 3.76 0.02 . 1 . . . . 49 PHE HA . 6711 1 481 . 1 1 49 49 PHE HB2 H 1 2.49 0.02 . 1 . . . . 49 PHE HB2 . 6711 1 482 . 1 1 49 49 PHE HB3 H 1 2.49 0.02 . 1 . . . . 49 PHE HB3 . 6711 1 483 . 1 1 49 49 PHE C C 13 173.98 0.02 . 1 . . . . 49 PHE C . 6711 1 484 . 1 1 49 49 PHE CA C 13 57.98 0.02 . 1 . . . . 49 PHE CA . 6711 1 485 . 1 1 49 49 PHE CB C 13 39.40 0.02 . 1 . . . . 49 PHE CB . 6711 1 486 . 1 1 49 49 PHE N N 15 117.55 0.02 . 1 . . . . 49 PHE N . 6711 1 487 . 1 1 50 50 GLU H H 1 7.30 0.02 . 1 . . . . 50 GLU H . 6711 1 488 . 1 1 50 50 GLU HA H 1 3.32 0.02 . 1 . . . . 50 GLU HA . 6711 1 489 . 1 1 50 50 GLU HB2 H 1 1.81 0.02 . 1 . . . . 50 GLU HB2 . 6711 1 490 . 1 1 50 50 GLU HB3 H 1 1.81 0.02 . 1 . . . . 50 GLU HB3 . 6711 1 491 . 1 1 50 50 GLU HG2 H 1 1.53 0.02 . 1 . . . . 50 GLU HG2 . 6711 1 492 . 1 1 50 50 GLU HG3 H 1 1.53 0.02 . 1 . . . . 50 GLU HG3 . 6711 1 493 . 1 1 50 50 GLU C C 13 174.83 0.02 . 1 . . . . 50 GLU C . 6711 1 494 . 1 1 50 50 GLU CA C 13 57.47 0.02 . 1 . . . . 50 GLU CA . 6711 1 495 . 1 1 50 50 GLU CB C 13 29.54 0.02 . 1 . . . . 50 GLU CB . 6711 1 496 . 1 1 50 50 GLU CG C 13 34.32 0.02 . 1 . . . . 50 GLU CG . 6711 1 497 . 1 1 50 50 GLU N N 15 121.86 0.02 . 1 . . . . 50 GLU N . 6711 1 498 . 1 1 51 51 PHE H H 1 8.30 0.02 . 1 . . . . 51 PHE H . 6711 1 499 . 1 1 51 51 PHE HA H 1 4.14 0.02 . 1 . . . . 51 PHE HA . 6711 1 500 . 1 1 51 51 PHE HB2 H 1 3.53 0.02 . 2 . . . . 51 PHE HB2 . 6711 1 501 . 1 1 51 51 PHE HB3 H 1 3.27 0.02 . 2 . . . . 51 PHE HB3 . 6711 1 502 . 1 1 51 51 PHE C C 13 175.51 0.02 . 1 . . . . 51 PHE C . 6711 1 503 . 1 1 51 51 PHE CA C 13 59.83 0.02 . 1 . . . . 51 PHE CA . 6711 1 504 . 1 1 51 51 PHE CB C 13 36.25 0.02 . 1 . . . . 51 PHE CB . 6711 1 505 . 1 1 51 51 PHE N N 15 114.46 0.02 . 1 . . . . 51 PHE N . 6711 1 506 . 1 1 52 52 GLY H H 1 7.99 0.02 . 1 . . . . 52 GLY H . 6711 1 507 . 1 1 52 52 GLY HA2 H 1 3.65 0.02 . 2 . . . . 52 GLY HA2 . 6711 1 508 . 1 1 52 52 GLY HA3 H 1 3.23 0.02 . 2 . . . . 52 GLY HA3 . 6711 1 509 . 1 1 52 52 GLY C C 13 181.61 0.02 . 1 . . . . 52 GLY C . 6711 1 510 . 1 1 52 52 GLY CA C 13 45.82 0.02 . 1 . . . . 52 GLY CA . 6711 1 511 . 1 1 52 52 GLY N N 15 103.94 0.02 . 1 . . . . 52 GLY N . 6711 1 512 . 1 1 53 53 VAL H H 1 7.14 0.02 . 1 . . . . 53 VAL H . 6711 1 513 . 1 1 53 53 VAL HA H 1 4.00 0.02 . 1 . . . . 53 VAL HA . 6711 1 514 . 1 1 53 53 VAL HB H 1 1.74 0.02 . 1 . . . . 53 VAL HB . 6711 1 515 . 1 1 53 53 VAL HG11 H 1 0.76 0.02 . 1 . . . . 53 VAL HG1 . 6711 1 516 . 1 1 53 53 VAL HG12 H 1 0.76 0.02 . 1 . . . . 53 VAL HG1 . 6711 1 517 . 1 1 53 53 VAL HG13 H 1 0.76 0.02 . 1 . . . . 53 VAL HG1 . 6711 1 518 . 1 1 53 53 VAL HG21 H 1 0.76 0.02 . 1 . . . . 53 VAL HG2 . 6711 1 519 . 1 1 53 53 VAL HG22 H 1 0.76 0.02 . 1 . . . . 53 VAL HG2 . 6711 1 520 . 1 1 53 53 VAL HG23 H 1 0.76 0.02 . 1 . . . . 53 VAL HG2 . 6711 1 521 . 1 1 53 53 VAL C C 13 174.63 0.02 . 1 . . . . 53 VAL C . 6711 1 522 . 1 1 53 53 VAL CA C 13 61.91 0.02 . 1 . . . . 53 VAL CA . 6711 1 523 . 1 1 53 53 VAL CB C 13 33.08 0.02 . 1 . . . . 53 VAL CB . 6711 1 524 . 1 1 53 53 VAL CG1 C 13 21.33 0.02 . 2 . . . . 53 VAL CG1 . 6711 1 525 . 1 1 53 53 VAL CG2 C 13 20.56 0.02 . 2 . . . . 53 VAL CG2 . 6711 1 526 . 1 1 53 53 VAL N N 15 123.48 0.02 . 1 . . . . 53 VAL N . 6711 1 527 . 1 1 54 54 PHE H H 1 8.84 0.02 . 1 . . . . 54 PHE H . 6711 1 528 . 1 1 54 54 PHE C C 13 173.59 0.02 . 1 . . . . 54 PHE C . 6711 1 529 . 1 1 54 54 PHE CA C 13 53.27 0.02 . 1 . . . . 54 PHE CA . 6711 1 530 . 1 1 54 54 PHE CB C 13 40.81 0.02 . 1 . . . . 54 PHE CB . 6711 1 531 . 1 1 54 54 PHE N N 15 127.28 0.02 . 1 . . . . 54 PHE N . 6711 1 532 . 1 1 55 55 PRO HA H 1 5.33 0.02 . 1 . . . . 55 PRO HA . 6711 1 533 . 1 1 55 55 PRO HB2 H 1 2.16 0.02 . 1 . . . . 55 PRO HB2 . 6711 1 534 . 1 1 55 55 PRO HB3 H 1 2.16 0.02 . 1 . . . . 55 PRO HB3 . 6711 1 535 . 1 1 55 55 PRO C C 13 175.91 0.02 . 1 . . . . 55 PRO C . 6711 1 536 . 1 1 55 55 PRO CA C 13 61.60 0.02 . 1 . . . . 55 PRO CA . 6711 1 537 . 1 1 55 55 PRO CB C 13 32.47 0.02 . 1 . . . . 55 PRO CB . 6711 1 538 . 1 1 55 55 PRO CG C 13 27.50 0.02 . 1 . . . . 55 PRO CG . 6711 1 539 . 1 1 55 55 PRO CD C 13 52.19 0.02 . 1 . . . . 55 PRO CD . 6711 1 540 . 1 1 56 56 ALA H H 1 9.06 0.02 . 1 . . . . 56 ALA H . 6711 1 541 . 1 1 56 56 ALA HA H 1 5.14 0.02 . 1 . . . . 56 ALA HA . 6711 1 542 . 1 1 56 56 ALA HB1 H 1 0.55 0.02 . 1 . . . . 56 ALA HB . 6711 1 543 . 1 1 56 56 ALA HB2 H 1 0.55 0.02 . 1 . . . . 56 ALA HB . 6711 1 544 . 1 1 56 56 ALA HB3 H 1 0.55 0.02 . 1 . . . . 56 ALA HB . 6711 1 545 . 1 1 56 56 ALA C C 13 175.80 0.02 . 1 . . . . 56 ALA C . 6711 1 546 . 1 1 56 56 ALA CA C 13 50.03 0.02 . 1 . . . . 56 ALA CA . 6711 1 547 . 1 1 56 56 ALA CB C 13 24.02 0.02 . 1 . . . . 56 ALA CB . 6711 1 548 . 1 1 56 56 ALA N N 15 121.68 0.02 . 1 . . . . 56 ALA N . 6711 1 549 . 1 1 57 57 ILE H H 1 8.75 0.02 . 1 . . . . 57 ILE H . 6711 1 550 . 1 1 57 57 ILE HA H 1 5.05 0.02 . 1 . . . . 57 ILE HA . 6711 1 551 . 1 1 57 57 ILE HB H 1 1.59 0.02 . 1 . . . . 57 ILE HB . 6711 1 552 . 1 1 57 57 ILE HG21 H 1 0.87 0.02 . 4 . . . . 57 ILE HG2 . 6711 1 553 . 1 1 57 57 ILE HG22 H 1 0.87 0.02 . 4 . . . . 57 ILE HG2 . 6711 1 554 . 1 1 57 57 ILE HG23 H 1 0.87 0.02 . 4 . . . . 57 ILE HG2 . 6711 1 555 . 1 1 57 57 ILE HD11 H 1 0.87 0.02 . 4 . . . . 57 ILE HD1 . 6711 1 556 . 1 1 57 57 ILE HD12 H 1 0.87 0.02 . 4 . . . . 57 ILE HD1 . 6711 1 557 . 1 1 57 57 ILE HD13 H 1 0.87 0.02 . 4 . . . . 57 ILE HD1 . 6711 1 558 . 1 1 57 57 ILE C C 13 176.32 0.02 . 1 . . . . 57 ILE C . 6711 1 559 . 1 1 57 57 ILE CA C 13 58.95 0.02 . 1 . . . . 57 ILE CA . 6711 1 560 . 1 1 57 57 ILE CB C 13 40.90 0.02 . 1 . . . . 57 ILE CB . 6711 1 561 . 1 1 57 57 ILE CG1 C 13 27.1 0.02 . 1 . . . . 57 ILE CG1 . 6711 1 562 . 1 1 57 57 ILE CG2 C 13 17.2 0.02 . 1 . . . . 57 ILE CG2 . 6711 1 563 . 1 1 57 57 ILE CD1 C 13 12.8 0.02 . 1 . . . . 57 ILE CD1 . 6711 1 564 . 1 1 57 57 ILE N N 15 118.77 0.02 . 1 . . . . 57 ILE N . 6711 1 565 . 1 1 58 58 LEU H H 1 8.94 0.02 . 1 . . . . 58 LEU H . 6711 1 566 . 1 1 58 58 LEU HA H 1 4.94 0.02 . 1 . . . . 58 LEU HA . 6711 1 567 . 1 1 58 58 LEU HB2 H 1 1.67 0.02 . 1 . . . . 58 LEU HB2 . 6711 1 568 . 1 1 58 58 LEU HB3 H 1 1.67 0.02 . 1 . . . . 58 LEU HB3 . 6711 1 569 . 1 1 58 58 LEU HG H 1 1.22 0.02 . 1 . . . . 58 LEU HG . 6711 1 570 . 1 1 58 58 LEU HD11 H 1 0.67 0.02 . 1 . . . . 58 LEU HD1 . 6711 1 571 . 1 1 58 58 LEU HD12 H 1 0.67 0.02 . 1 . . . . 58 LEU HD1 . 6711 1 572 . 1 1 58 58 LEU HD13 H 1 0.67 0.02 . 1 . . . . 58 LEU HD1 . 6711 1 573 . 1 1 58 58 LEU HD21 H 1 0.67 0.02 . 1 . . . . 58 LEU HD2 . 6711 1 574 . 1 1 58 58 LEU HD22 H 1 0.67 0.02 . 1 . . . . 58 LEU HD2 . 6711 1 575 . 1 1 58 58 LEU HD23 H 1 0.67 0.02 . 1 . . . . 58 LEU HD2 . 6711 1 576 . 1 1 58 58 LEU C C 13 173.99 0.02 . 1 . . . . 58 LEU C . 6711 1 577 . 1 1 58 58 LEU CA C 13 53.96 0.02 . 1 . . . . 58 LEU CA . 6711 1 578 . 1 1 58 58 LEU CB C 13 45.26 0.02 . 1 . . . . 58 LEU CB . 6711 1 579 . 1 1 58 58 LEU CG C 13 28.2 0.02 . 1 . . . . 58 LEU CG . 6711 1 580 . 1 1 58 58 LEU CD1 C 13 25.3 0.02 . 1 . . . . 58 LEU CD1 . 6711 1 581 . 1 1 58 58 LEU CD2 C 13 25.3 0.02 . 1 . . . . 58 LEU CD2 . 6711 1 582 . 1 1 58 58 LEU N N 15 128.10 0.02 . 1 . . . . 58 LEU N . 6711 1 583 . 1 1 59 59 SER H H 1 8.40 0.02 . 1 . . . . 59 SER H . 6711 1 584 . 1 1 59 59 SER HA H 1 5.05 0.02 . 1 . . . . 59 SER HA . 6711 1 585 . 1 1 59 59 SER HB2 H 1 3.82 0.02 . 2 . . . . 59 SER HB2 . 6711 1 586 . 1 1 59 59 SER HB3 H 1 3.40 0.02 . 2 . . . . 59 SER HB3 . 6711 1 587 . 1 1 59 59 SER C C 13 174.40 0.02 . 1 . . . . 59 SER C . 6711 1 588 . 1 1 59 59 SER CA C 13 56.06 0.02 . 1 . . . . 59 SER CA . 6711 1 589 . 1 1 59 59 SER CB C 13 63.48 0.02 . 1 . . . . 59 SER CB . 6711 1 590 . 1 1 59 59 SER N N 15 117.94 0.02 . 1 . . . . 59 SER N . 6711 1 591 . 1 1 60 60 PHE H H 1 9.36 0.02 . 1 . . . . 60 PHE H . 6711 1 592 . 1 1 60 60 PHE HB2 H 1 2.86 0.02 . 1 . . . . 60 PHE HB2 . 6711 1 593 . 1 1 60 60 PHE HB3 H 1 2.86 0.02 . 1 . . . . 60 PHE HB3 . 6711 1 594 . 1 1 60 60 PHE C C 13 172.66 0.02 . 1 . . . . 60 PHE C . 6711 1 595 . 1 1 60 60 PHE CA C 13 56.20 0.02 . 1 . . . . 60 PHE CA . 6711 1 596 . 1 1 60 60 PHE CB C 13 39.97 0.02 . 1 . . . . 60 PHE CB . 6711 1 597 . 1 1 60 60 PHE N N 15 126.49 0.02 . 1 . . . . 60 PHE N . 6711 1 598 . 1 1 61 61 PRO HA H 1 4.69 0.02 . 1 . . . . 61 PRO HA . 6711 1 599 . 1 1 61 61 PRO HB2 H 1 2.28 0.02 . 1 . . . . 61 PRO HB2 . 6711 1 600 . 1 1 61 61 PRO HB3 H 1 2.28 0.02 . 1 . . . . 61 PRO HB3 . 6711 1 601 . 1 1 61 61 PRO HG2 H 1 2.04 0.02 . 1 . . . . 61 PRO HG2 . 6711 1 602 . 1 1 61 61 PRO HG3 H 1 2.04 0.02 . 1 . . . . 61 PRO HG3 . 6711 1 603 . 1 1 61 61 PRO C C 13 176.95 0.02 . 1 . . . . 61 PRO C . 6711 1 604 . 1 1 61 61 PRO CA C 13 61.45 0.02 . 1 . . . . 61 PRO CA . 6711 1 605 . 1 1 61 61 PRO CB C 13 32.50 0.02 . 1 . . . . 61 PRO CB . 6711 1 606 . 1 1 61 61 PRO CG C 13 27.28 0.02 . 1 . . . . 61 PRO CG . 6711 1 607 . 1 1 61 61 PRO CD C 13 50.75 0.02 . 1 . . . . 61 PRO CD . 6711 1 608 . 1 1 62 62 LEU H H 1 8.36 0.02 . 1 . . . . 62 LEU H . 6711 1 609 . 1 1 62 62 LEU HA H 1 3.96 0.02 . 1 . . . . 62 LEU HA . 6711 1 610 . 1 1 62 62 LEU HB2 H 1 1.49 0.02 . 1 . . . . 62 LEU HB2 . 6711 1 611 . 1 1 62 62 LEU HB3 H 1 1.49 0.02 . 1 . . . . 62 LEU HB3 . 6711 1 612 . 1 1 62 62 LEU HG H 1 0.74 0.02 . 1 . . . . 62 LEU HG . 6711 1 613 . 1 1 62 62 LEU HD11 H 1 0.39 0.02 . 1 . . . . 62 LEU HD1 . 6711 1 614 . 1 1 62 62 LEU HD12 H 1 0.39 0.02 . 1 . . . . 62 LEU HD1 . 6711 1 615 . 1 1 62 62 LEU HD13 H 1 0.39 0.02 . 1 . . . . 62 LEU HD1 . 6711 1 616 . 1 1 62 62 LEU HD21 H 1 0.39 0.02 . 1 . . . . 62 LEU HD2 . 6711 1 617 . 1 1 62 62 LEU HD22 H 1 0.39 0.02 . 1 . . . . 62 LEU HD2 . 6711 1 618 . 1 1 62 62 LEU HD23 H 1 0.39 0.02 . 1 . . . . 62 LEU HD2 . 6711 1 619 . 1 1 62 62 LEU C C 13 176.61 0.02 . 1 . . . . 62 LEU C . 6711 1 620 . 1 1 62 62 LEU CA C 13 56.76 0.02 . 1 . . . . 62 LEU CA . 6711 1 621 . 1 1 62 62 LEU CB C 13 41.42 0.02 . 1 . . . . 62 LEU CB . 6711 1 622 . 1 1 62 62 LEU CG C 13 26.95 0.02 . 1 . . . . 62 LEU CG . 6711 1 623 . 1 1 62 62 LEU CD1 C 13 24.64 0.02 . 2 . . . . 62 LEU CD1 . 6711 1 624 . 1 1 62 62 LEU CD2 C 13 22.46 0.02 . 2 . . . . 62 LEU CD2 . 6711 1 625 . 1 1 62 62 LEU N N 15 117.21 0.02 . 1 . . . . 62 LEU N . 6711 1 626 . 1 1 63 63 ASP H H 1 8.20 0.02 . 1 . . . . 63 ASP H . 6711 1 627 . 1 1 63 63 ASP HA H 1 4.69 0.02 . 1 . . . . 63 ASP HA . 6711 1 628 . 1 1 63 63 ASP HB2 H 1 3.01 0.02 . 2 . . . . 63 ASP HB2 . 6711 1 629 . 1 1 63 63 ASP HB3 H 1 2.40 0.02 . 2 . . . . 63 ASP HB3 . 6711 1 630 . 1 1 63 63 ASP C C 13 176.68 0.02 . 1 . . . . 63 ASP C . 6711 1 631 . 1 1 63 63 ASP CA C 13 51.88 0.02 . 1 . . . . 63 ASP CA . 6711 1 632 . 1 1 63 63 ASP CB C 13 39.35 0.02 . 1 . . . . 63 ASP CB . 6711 1 633 . 1 1 63 63 ASP N N 15 112.04 0.02 . 1 . . . . 63 ASP N . 6711 1 634 . 1 1 64 64 TYR H H 1 7.73 0.02 . 1 . . . . 64 TYR H . 6711 1 635 . 1 1 64 64 TYR C C 13 173.83 0.02 . 1 . . . . 64 TYR C . 6711 1 636 . 1 1 64 64 TYR CA C 13 58.50 0.02 . 1 . . . . 64 TYR CA . 6711 1 637 . 1 1 64 64 TYR CB C 13 39.52 0.02 . 1 . . . . 64 TYR CB . 6711 1 638 . 1 1 64 64 TYR N N 15 124.45 0.02 . 1 . . . . 64 TYR N . 6711 1 639 . 1 1 65 65 PRO HA H 1 3.87 0.02 . 1 . . . . 65 PRO HA . 6711 1 640 . 1 1 65 65 PRO HB2 H 1 0.86 0.02 . 1 . . . . 65 PRO HB2 . 6711 1 641 . 1 1 65 65 PRO HB3 H 1 0.86 0.02 . 1 . . . . 65 PRO HB3 . 6711 1 642 . 1 1 65 65 PRO C C 13 175.44 0.02 . 1 . . . . 65 PRO C . 6711 1 643 . 1 1 65 65 PRO CA C 13 63.41 0.02 . 1 . . . . 65 PRO CA . 6711 1 644 . 1 1 65 65 PRO CB C 13 32.85 0.02 . 1 . . . . 65 PRO CB . 6711 1 645 . 1 1 65 65 PRO CG C 13 24.62 0.02 . 1 . . . . 65 PRO CG . 6711 1 646 . 1 1 65 65 PRO CD C 13 48.75 0.02 . 1 . . . . 65 PRO CD . 6711 1 647 . 1 1 66 66 LEU H H 1 9.57 0.02 . 1 . . . . 66 LEU H . 6711 1 648 . 1 1 66 66 LEU HA H 1 4.14 0.02 . 1 . . . . 66 LEU HA . 6711 1 649 . 1 1 66 66 LEU HB2 H 1 1.99 0.02 . 1 . . . . 66 LEU HB2 . 6711 1 650 . 1 1 66 66 LEU HB3 H 1 1.60 0.02 . 1 . . . . 66 LEU HB3 . 6711 1 651 . 1 1 66 66 LEU HG H 1 0.92 0.02 . 4 . . . . 66 LEU HG . 6711 1 652 . 1 1 66 66 LEU HD11 H 1 0.92 0.02 . 4 . . . . 66 LEU HD1 . 6711 1 653 . 1 1 66 66 LEU HD12 H 1 0.92 0.02 . 4 . . . . 66 LEU HD1 . 6711 1 654 . 1 1 66 66 LEU HD13 H 1 0.92 0.02 . 4 . . . . 66 LEU HD1 . 6711 1 655 . 1 1 66 66 LEU HD21 H 1 0.92 0.02 . 4 . . . . 66 LEU HD2 . 6711 1 656 . 1 1 66 66 LEU HD22 H 1 0.92 0.02 . 4 . . . . 66 LEU HD2 . 6711 1 657 . 1 1 66 66 LEU HD23 H 1 0.92 0.02 . 4 . . . . 66 LEU HD2 . 6711 1 658 . 1 1 66 66 LEU C C 13 177.53 0.02 . 1 . . . . 66 LEU C . 6711 1 659 . 1 1 66 66 LEU CA C 13 57.76 0.02 . 1 . . . . 66 LEU CA . 6711 1 660 . 1 1 66 66 LEU CB C 13 40.65 0.02 . 1 . . . . 66 LEU CB . 6711 1 661 . 1 1 66 66 LEU CG C 13 27.36 0.02 . 1 . . . . 66 LEU CG . 6711 1 662 . 1 1 66 66 LEU CD1 C 13 25.09 0.02 . 2 . . . . 66 LEU CD1 . 6711 1 663 . 1 1 66 66 LEU CD2 C 13 22.52 0.02 . 2 . . . . 66 LEU CD2 . 6711 1 664 . 1 1 66 66 LEU N N 15 126.54 0.02 . 1 . . . . 66 LEU N . 6711 1 665 . 1 1 67 67 SER H H 1 6.71 0.02 . 1 . . . . 67 SER H . 6711 1 666 . 1 1 67 67 SER HA H 1 4.56 0.02 . 1 . . . . 67 SER HA . 6711 1 667 . 1 1 67 67 SER CA C 13 55.51 0.02 . 1 . . . . 67 SER CA . 6711 1 668 . 1 1 67 67 SER CB C 13 63.71 0.02 . 1 . . . . 67 SER CB . 6711 1 669 . 1 1 67 67 SER N N 15 112.72 0.02 . 1 . . . . 67 SER N . 6711 1 670 . 1 1 69 69 PRO HA H 1 4.42 0.02 . 1 . . . . 69 PRO HA . 6711 1 671 . 1 1 69 69 PRO HB2 H 1 0.67 0.02 . 1 . . . . 69 PRO HB2 . 6711 1 672 . 1 1 69 69 PRO HB3 H 1 0.67 0.02 . 1 . . . . 69 PRO HB3 . 6711 1 673 . 1 1 69 69 PRO HG2 H 1 1.10 0.02 . 1 . . . . 69 PRO HG2 . 6711 1 674 . 1 1 69 69 PRO HG3 H 1 1.10 0.02 . 1 . . . . 69 PRO HG3 . 6711 1 675 . 1 1 69 69 PRO C C 13 175.08 0.02 . 1 . . . . 69 PRO C . 6711 1 676 . 1 1 69 69 PRO CA C 13 61.02 0.02 . 1 . . . . 69 PRO CA . 6711 1 677 . 1 1 69 69 PRO CB C 13 31.07 0.02 . 1 . . . . 69 PRO CB . 6711 1 678 . 1 1 69 69 PRO CG C 13 26.26 0.02 . 1 . . . . 69 PRO CG . 6711 1 679 . 1 1 69 69 PRO CD C 13 48.16 0.02 . 1 . . . . 69 PRO CD . 6711 1 680 . 1 1 70 70 LYS H H 1 7.74 0.02 . 1 . . . . 70 LYS H . 6711 1 681 . 1 1 70 70 LYS HA H 1 4.23 0.02 . 1 . . . . 70 LYS HA . 6711 1 682 . 1 1 70 70 LYS HB2 H 1 1.77 0.02 . 2 . . . . 70 LYS HB2 . 6711 1 683 . 1 1 70 70 LYS HB3 H 1 1.49 0.02 . 2 . . . . 70 LYS HB3 . 6711 1 684 . 1 1 70 70 LYS HG2 H 1 1.33 0.02 . 1 . . . . 70 LYS HG2 . 6711 1 685 . 1 1 70 70 LYS HG3 H 1 1.33 . . 1 . . . . 70 LYS HG3 . 6711 1 686 . 1 1 70 70 LYS C C 13 175.15 0.02 . 1 . . . . 70 LYS C . 6711 1 687 . 1 1 70 70 LYS CA C 13 54.80 0.02 . 1 . . . . 70 LYS CA . 6711 1 688 . 1 1 70 70 LYS CB C 13 34.55 0.02 . 1 . . . . 70 LYS CB . 6711 1 689 . 1 1 70 70 LYS CG C 13 24.85 0.02 . 1 . . . . 70 LYS CG . 6711 1 690 . 1 1 70 70 LYS CD C 13 28.91 0.02 . 1 . . . . 70 LYS CD . 6711 1 691 . 1 1 70 70 LYS CE C 13 42.01 0.02 . 1 . . . . 70 LYS CE . 6711 1 692 . 1 1 70 70 LYS N N 15 116.15 0.02 . 1 . . . . 70 LYS N . 6711 1 693 . 1 1 71 71 MET H H 1 8.71 0.02 . 1 . . . . 71 MET H . 6711 1 694 . 1 1 71 71 MET HA H 1 5.24 0.02 . 1 . . . . 71 MET HA . 6711 1 695 . 1 1 71 71 MET HB2 H 1 1.21 0.02 . 1 . . . . 71 MET HB2 . 6711 1 696 . 1 1 71 71 MET HB3 H 1 1.21 0.02 . 1 . . . . 71 MET HB3 . 6711 1 697 . 1 1 71 71 MET HG2 H 1 1.57 0.02 . 1 . . . . 71 MET HG2 . 6711 1 698 . 1 1 71 71 MET HG3 H 1 1.57 0.02 . 1 . . . . 71 MET HG3 . 6711 1 699 . 1 1 71 71 MET C C 13 173.24 0.02 . 1 . . . . 71 MET C . 6711 1 700 . 1 1 71 71 MET CA C 13 54.3 0.02 . 1 . . . . 71 MET CA . 6711 1 701 . 1 1 71 71 MET CB C 13 35.84 0.02 . 1 . . . . 71 MET CB . 6711 1 702 . 1 1 71 71 MET CG C 13 33.03 0.02 . 1 . . . . 71 MET CG . 6711 1 703 . 1 1 71 71 MET N N 15 122.64 0.02 . 1 . . . . 71 MET N . 6711 1 704 . 1 1 72 72 ARG H H 1 8.50 0.02 . 1 . . . . 72 ARG H . 6711 1 705 . 1 1 72 72 ARG HA H 1 5.04 0.02 . 1 . . . . 72 ARG HA . 6711 1 706 . 1 1 72 72 ARG HB2 H 1 1.50 0.02 . 1 . . . . 72 ARG HB2 . 6711 1 707 . 1 1 72 72 ARG HB3 H 1 1.50 0.02 . 1 . . . . 72 ARG HB3 . 6711 1 708 . 1 1 72 72 ARG HG2 H 1 1.17 0.02 . 1 . . . . 72 ARG HG2 . 6711 1 709 . 1 1 72 72 ARG HG3 H 1 1.17 0.02 . 1 . . . . 72 ARG HG3 . 6711 1 710 . 1 1 72 72 ARG HD2 H 1 3.06 0.02 . 1 . . . . 72 ARG HD2 . 6711 1 711 . 1 1 72 72 ARG HD3 H 1 3.06 0.02 . 1 . . . . 72 ARG HD3 . 6711 1 712 . 1 1 72 72 ARG C C 13 175.30 0.02 . 1 . . . . 72 ARG C . 6711 1 713 . 1 1 72 72 ARG CA C 13 53.63 0.02 . 1 . . . . 72 ARG CA . 6711 1 714 . 1 1 72 72 ARG CB C 13 33.67 0.02 . 1 . . . . 72 ARG CB . 6711 1 715 . 1 1 72 72 ARG CG C 13 26.69 0.02 . 1 . . . . 72 ARG CG . 6711 1 716 . 1 1 72 72 ARG CD C 13 43.24 0.02 . 1 . . . . 72 ARG CD . 6711 1 717 . 1 1 72 72 ARG N N 15 125.65 0.02 . 1 . . . . 72 ARG N . 6711 1 718 . 1 1 73 73 PHE H H 1 9.07 0.02 . 1 . . . . 73 PHE H . 6711 1 719 . 1 1 73 73 PHE HA H 1 4.96 0.02 . 1 . . . . 73 PHE HA . 6711 1 720 . 1 1 73 73 PHE HB2 H 1 3.41 0.02 . 2 . . . . 73 PHE HB2 . 6711 1 721 . 1 1 73 73 PHE HB3 H 1 2.84 0.02 . 2 . . . . 73 PHE HB3 . 6711 1 722 . 1 1 73 73 PHE C C 13 174.16 0.02 . 1 . . . . 73 PHE C . 6711 1 723 . 1 1 73 73 PHE CA C 13 59.90 0.02 . 1 . . . . 73 PHE CA . 6711 1 724 . 1 1 73 73 PHE CB C 13 40.47 0.02 . 1 . . . . 73 PHE CB . 6711 1 725 . 1 1 73 73 PHE N N 15 124.05 0.02 . 1 . . . . 73 PHE N . 6711 1 726 . 1 1 74 74 THR H H 1 9.04 0.02 . 1 . . . . 74 THR H . 6711 1 727 . 1 1 74 74 THR HA H 1 4.50 0.02 . 1 . . . . 74 THR HA . 6711 1 728 . 1 1 74 74 THR HG21 H 1 1.08 0.02 . 1 . . . . 74 THR HG2 . 6711 1 729 . 1 1 74 74 THR HG22 H 1 1.08 0.02 . 1 . . . . 74 THR HG2 . 6711 1 730 . 1 1 74 74 THR HG23 H 1 1.08 0.02 . 1 . . . . 74 THR HG2 . 6711 1 731 . 1 1 74 74 THR C C 13 174.16 0.02 . 1 . . . . 74 THR C . 6711 1 732 . 1 1 74 74 THR CA C 13 61.27 0.02 . 1 . . . . 74 THR CA . 6711 1 733 . 1 1 74 74 THR CB C 13 67.4 0.02 . 1 . . . . 74 THR CB . 6711 1 734 . 1 1 74 74 THR CG2 C 13 21.89 0.02 . 1 . . . . 74 THR CG2 . 6711 1 735 . 1 1 74 74 THR N N 15 112.00 0.02 . 1 . . . . 74 THR N . 6711 1 736 . 1 1 75 75 CYS H H 1 7.51 0.02 . 1 . . . . 75 CYS H . 6711 1 737 . 1 1 75 75 CYS HA H 1 5.03 0.02 . 1 . . . . 75 CYS HA . 6711 1 738 . 1 1 75 75 CYS HB2 H 1 3.72 0.02 . 1 . . . . 75 CYS HB2 . 6711 1 739 . 1 1 75 75 CYS HB3 H 1 3.72 0.02 . 1 . . . . 75 CYS HB3 . 6711 1 740 . 1 1 75 75 CYS C C 13 173.07 0.02 . 1 . . . . 75 CYS C . 6711 1 741 . 1 1 75 75 CYS CA C 13 53.09 0.02 . 1 . . . . 75 CYS CA . 6711 1 742 . 1 1 75 75 CYS CB C 13 31.61 0.02 . 1 . . . . 75 CYS CB . 6711 1 743 . 1 1 75 75 CYS N N 15 116.41 0.02 . 1 . . . . 75 CYS N . 6711 1 744 . 1 1 76 76 GLU H H 1 8.59 0.02 . 1 . . . . 76 GLU H . 6711 1 745 . 1 1 76 76 GLU HA H 1 4.14 0.02 . 1 . . . . 76 GLU HA . 6711 1 746 . 1 1 76 76 GLU HB2 H 1 1.90 0.02 . 1 . . . . 76 GLU HB2 . 6711 1 747 . 1 1 76 76 GLU HB3 H 1 1.90 0.02 . 1 . . . . 76 GLU HB3 . 6711 1 748 . 1 1 76 76 GLU HG2 H 1 2.16 0.02 . 1 . . . . 76 GLU HG2 . 6711 1 749 . 1 1 76 76 GLU HG3 H 1 2.16 0.02 . 1 . . . . 76 GLU HG3 . 6711 1 750 . 1 1 76 76 GLU C C 13 176.22 0.02 . 1 . . . . 76 GLU C . 6711 1 751 . 1 1 76 76 GLU CA C 13 57.55 0.02 . 1 . . . . 76 GLU CA . 6711 1 752 . 1 1 76 76 GLU CB C 13 29.51 0.02 . 1 . . . . 76 GLU CB . 6711 1 753 . 1 1 76 76 GLU CG C 13 36.31 0.02 . 1 . . . . 76 GLU CG . 6711 1 754 . 1 1 76 76 GLU N N 15 122.38 0.02 . 1 . . . . 76 GLU N . 6711 1 755 . 1 1 77 77 MET H H 1 8.32 0.02 . 1 . . . . 77 MET H . 6711 1 756 . 1 1 77 77 MET HA H 1 4.68 0.02 . 1 . . . . 77 MET HA . 6711 1 757 . 1 1 77 77 MET HB2 H 1 1.825 0.02 . 1 . . . . 77 MET HB2 . 6711 1 758 . 1 1 77 77 MET HB3 H 1 1.41 0.02 . 1 . . . . 77 MET HB3 . 6711 1 759 . 1 1 77 77 MET C C 13 174.21 0.02 . 1 . . . . 77 MET C . 6711 1 760 . 1 1 77 77 MET CA C 13 52.88 0.02 . 1 . . . . 77 MET CA . 6711 1 761 . 1 1 77 77 MET CB C 13 36.41 0.02 . 1 . . . . 77 MET CB . 6711 1 762 . 1 1 77 77 MET CG C 13 32.4 0.02 . 1 . . . . 77 MET CG . 6711 1 763 . 1 1 77 77 MET N N 15 121.48 0.02 . 1 . . . . 77 MET N . 6711 1 764 . 1 1 78 78 PHE H H 1 7.36 0.02 . 1 . . . . 78 PHE H . 6711 1 765 . 1 1 78 78 PHE HA H 1 4.56 0.02 . 1 . . . . 78 PHE HA . 6711 1 766 . 1 1 78 78 PHE HB2 H 1 2.83 0.02 . 1 . . . . 78 PHE HB2 . 6711 1 767 . 1 1 78 78 PHE HB3 H 1 2.83 0.02 . 1 . . . . 78 PHE HB3 . 6711 1 768 . 1 1 78 78 PHE C C 13 180.82 0.02 . 1 . . . . 78 PHE C . 6711 1 769 . 1 1 78 78 PHE CA C 13 58.4 0.02 . 1 . . . . 78 PHE CA . 6711 1 770 . 1 1 78 78 PHE CB C 13 39.7 0.02 . 1 . . . . 78 PHE CB . 6711 1 771 . 1 1 78 78 PHE N N 15 121.35 0.02 . 1 . . . . 78 PHE N . 6711 1 772 . 1 1 79 79 HIS H H 1 8.81 0.02 . 1 . . . . 79 HIS H . 6711 1 773 . 1 1 79 79 HIS C C 13 173.29 0.02 . 1 . . . . 79 HIS C . 6711 1 774 . 1 1 79 79 HIS CA C 13 55.27 0.02 . 1 . . . . 79 HIS CA . 6711 1 775 . 1 1 79 79 HIS CB C 13 34.57 0.02 . 1 . . . . 79 HIS CB . 6711 1 776 . 1 1 79 79 HIS N N 15 124.39 0.02 . 1 . . . . 79 HIS N . 6711 1 777 . 1 1 80 80 PRO HA H 1 3.96 0.02 . 1 . . . . 80 PRO HA . 6711 1 778 . 1 1 80 80 PRO HB2 H 1 1.50 0.02 . 1 . . . . 80 PRO HB2 . 6711 1 779 . 1 1 80 80 PRO HB3 H 1 1.50 0.02 . 1 . . . . 80 PRO HB3 . 6711 1 780 . 1 1 80 80 PRO HG2 H 1 2.32 0.02 . 1 . . . . 80 PRO HG2 . 6711 1 781 . 1 1 80 80 PRO HG3 H 1 2.32 0.02 . 1 . . . . 80 PRO HG3 . 6711 1 782 . 1 1 80 80 PRO HD2 H 1 3.06 0.02 . 1 . . . . 80 PRO HD2 . 6711 1 783 . 1 1 80 80 PRO HD3 H 1 3.06 0.02 . 1 . . . . 80 PRO HD3 . 6711 1 784 . 1 1 80 80 PRO C C 13 176.02 0.02 . 1 . . . . 80 PRO C . 6711 1 785 . 1 1 80 80 PRO CA C 13 65.89 0.02 . 1 . . . . 80 PRO CA . 6711 1 786 . 1 1 80 80 PRO CB C 13 33.13 0.02 . 1 . . . . 80 PRO CB . 6711 1 787 . 1 1 80 80 PRO CG C 13 25.72 0.02 . 1 . . . . 80 PRO CG . 6711 1 788 . 1 1 80 80 PRO CD C 13 50.06 0.02 . 1 . . . . 80 PRO CD . 6711 1 789 . 1 1 81 81 ASN H H 1 11.02 0.02 . 1 . . . . 81 ASN H . 6711 1 790 . 1 1 81 81 ASN HA H 1 5.00 0.02 . 1 . . . . 81 ASN HA . 6711 1 791 . 1 1 81 81 ASN HB2 H 1 3.58 0.02 . 2 . . . . 81 ASN HB2 . 6711 1 792 . 1 1 81 81 ASN HB3 H 1 2.58 0.02 . 2 . . . . 81 ASN HB3 . 6711 1 793 . 1 1 81 81 ASN C C 13 172.20 0.02 . 1 . . . . 81 ASN C . 6711 1 794 . 1 1 81 81 ASN CA C 13 53.0 0.02 . 1 . . . . 81 ASN CA . 6711 1 795 . 1 1 81 81 ASN CB C 13 40.3 0.02 . 1 . . . . 81 ASN CB . 6711 1 796 . 1 1 81 81 ASN N N 15 114.82 0.02 . 1 . . . . 81 ASN N . 6711 1 797 . 1 1 82 82 ILE H H 1 7.49 0.02 . 1 . . . . 82 ILE H . 6711 1 798 . 1 1 82 82 ILE HA H 1 4.59 0.02 . 1 . . . . 82 ILE HA . 6711 1 799 . 1 1 82 82 ILE HB H 1 1.52 0.02 . 1 . . . . 82 ILE HB . 6711 1 800 . 1 1 82 82 ILE HG21 H 1 0.92 0.02 . 4 . . . . 82 ILE HG2 . 6711 1 801 . 1 1 82 82 ILE HG22 H 1 0.92 0.02 . 4 . . . . 82 ILE HG2 . 6711 1 802 . 1 1 82 82 ILE HG23 H 1 0.92 0.02 . 4 . . . . 82 ILE HG2 . 6711 1 803 . 1 1 82 82 ILE HD11 H 1 0.92 0.02 . 4 . . . . 82 ILE HD1 . 6711 1 804 . 1 1 82 82 ILE HD12 H 1 0.92 0.02 . 4 . . . . 82 ILE HD1 . 6711 1 805 . 1 1 82 82 ILE HD13 H 1 0.92 0.02 . 4 . . . . 82 ILE HD1 . 6711 1 806 . 1 1 82 82 ILE C C 13 176.02 0.02 . 1 . . . . 82 ILE C . 6711 1 807 . 1 1 82 82 ILE CA C 13 59.63 0.02 . 1 . . . . 82 ILE CA . 6711 1 808 . 1 1 82 82 ILE CB C 13 39.76 0.02 . 1 . . . . 82 ILE CB . 6711 1 809 . 1 1 82 82 ILE CG1 C 13 27.39 0.02 . 1 . . . . 82 ILE CG1 . 6711 1 810 . 1 1 82 82 ILE CG2 C 13 17.3 0.02 . 1 . . . . 82 ILE CG2 . 6711 1 811 . 1 1 82 82 ILE CD1 C 13 14.0 0.02 . 1 . . . . 82 ILE CD1 . 6711 1 812 . 1 1 82 82 ILE N N 15 119.23 0.02 . 1 . . . . 82 ILE N . 6711 1 813 . 1 1 83 83 TYR H H 1 9.33 0.02 . 1 . . . . 83 TYR H . 6711 1 814 . 1 1 83 83 TYR HA H 1 4.63 0.02 . 1 . . . . 83 TYR HA . 6711 1 815 . 1 1 83 83 TYR HB2 H 1 3.1 0.02 . 1 . . . . 83 TYR HB2 . 6711 1 816 . 1 1 83 83 TYR HB3 H 1 3.1 0.02 . 1 . . . . 83 TYR HB3 . 6711 1 817 . 1 1 83 83 TYR C C 13 176.85 0.02 . 1 . . . . 83 TYR C . 6711 1 818 . 1 1 83 83 TYR CA C 13 59.24 0.02 . 1 . . . . 83 TYR CA . 6711 1 819 . 1 1 83 83 TYR CB C 13 38.26 0.02 . 1 . . . . 83 TYR CB . 6711 1 820 . 1 1 83 83 TYR N N 15 125.80 0.02 . 1 . . . . 83 TYR N . 6711 1 821 . 1 1 84 84 PRO HA H 1 4.57 0.02 . 1 . . . . 84 PRO HA . 6711 1 822 . 1 1 84 84 PRO HB2 H 1 2.52 0.02 . 1 . . . . 84 PRO HB2 . 6711 1 823 . 1 1 84 84 PRO HB3 H 1 2.13 0.02 . 1 . . . . 84 PRO HB3 . 6711 1 824 . 1 1 84 84 PRO C C 13 176.16 0.02 . 1 . . . . 84 PRO C . 6711 1 825 . 1 1 84 84 PRO CA C 13 65.6 0.02 . 1 . . . . 84 PRO CA . 6711 1 826 . 1 1 84 84 PRO CB C 13 31.8 0.02 . 1 . . . . 84 PRO CB . 6711 1 827 . 1 1 84 84 PRO CG C 13 28.1 0.02 . 1 . . . . 84 PRO CG . 6711 1 828 . 1 1 84 84 PRO CD C 13 50.7 0.02 . 1 . . . . 84 PRO CD . 6711 1 829 . 1 1 85 85 ASP H H 1 7.49 0.02 . 1 . . . . 85 ASP H . 6711 1 830 . 1 1 85 85 ASP HA H 1 4.59 0.02 . 1 . . . . 85 ASP HA . 6711 1 831 . 1 1 85 85 ASP HB2 H 1 3.07 0.02 . 2 . . . . 85 ASP HB2 . 6711 1 832 . 1 1 85 85 ASP HB3 H 1 2.60 0.02 . 2 . . . . 85 ASP HB3 . 6711 1 833 . 1 1 85 85 ASP C C 13 176.7 0.02 . 1 . . . . 85 ASP C . 6711 1 834 . 1 1 85 85 ASP CA C 13 53.39 0.02 . 1 . . . . 85 ASP CA . 6711 1 835 . 1 1 85 85 ASP CB C 13 39.97 0.02 . 1 . . . . 85 ASP CB . 6711 1 836 . 1 1 85 85 ASP N N 15 112.93 0.02 . 1 . . . . 85 ASP N . 6711 1 837 . 1 1 86 86 GLY H H 1 8.71 0.02 . 1 . . . . 86 GLY H . 6711 1 838 . 1 1 86 86 GLY HA2 H 1 4.90 0.02 . 2 . . . . 86 GLY HA2 . 6711 1 839 . 1 1 86 86 GLY HA3 H 1 3.60 0.02 . 2 . . . . 86 GLY HA3 . 6711 1 840 . 1 1 86 86 GLY C C 13 175.80 0.02 . 1 . . . . 86 GLY C . 6711 1 841 . 1 1 86 86 GLY CA C 13 45.2 0.02 . 1 . . . . 86 GLY CA . 6711 1 842 . 1 1 86 86 GLY N N 15 108.65 0.02 . 1 . . . . 86 GLY N . 6711 1 843 . 1 1 87 87 ARG H H 1 8.03 0.02 . 1 . . . . 87 ARG H . 6711 1 844 . 1 1 87 87 ARG HA H 1 4.49 0.02 . 1 . . . . 87 ARG HA . 6711 1 845 . 1 1 87 87 ARG HB2 H 1 2.07 0.02 . 1 . . . . 87 ARG HB2 . 6711 1 846 . 1 1 87 87 ARG HB3 H 1 2.07 0.02 . 1 . . . . 87 ARG HB3 . 6711 1 847 . 1 1 87 87 ARG HG2 H 1 1.60 0.02 . 1 . . . . 87 ARG HG2 . 6711 1 848 . 1 1 87 87 ARG HG3 H 1 1.60 0.02 . 1 . . . . 87 ARG HG3 . 6711 1 849 . 1 1 87 87 ARG HD2 H 1 3.2 0.02 . 1 . . . . 87 ARG HD2 . 6711 1 850 . 1 1 87 87 ARG HD3 H 1 3.2 0.02 . 1 . . . . 87 ARG HD3 . 6711 1 851 . 1 1 87 87 ARG C C 13 175.81 0.02 . 1 . . . . 87 ARG C . 6711 1 852 . 1 1 87 87 ARG CA C 13 57.84 0.02 . 1 . . . . 87 ARG CA . 6711 1 853 . 1 1 87 87 ARG CB C 13 30.77 0.02 . 1 . . . . 87 ARG CB . 6711 1 854 . 1 1 87 87 ARG CG C 13 27.8 0.02 . 1 . . . . 87 ARG CG . 6711 1 855 . 1 1 87 87 ARG CD C 13 43.1 0.02 . 1 . . . . 87 ARG CD . 6711 1 856 . 1 1 87 87 ARG N N 15 121.39 0.02 . 1 . . . . 87 ARG N . 6711 1 857 . 1 1 88 88 VAL H H 1 8.18 0.02 . 1 . . . . 88 VAL H . 6711 1 858 . 1 1 88 88 VAL HA H 1 3.87 0.02 . 1 . . . . 88 VAL HA . 6711 1 859 . 1 1 88 88 VAL HB H 1 1.65 0.02 . 1 . . . . 88 VAL HB . 6711 1 860 . 1 1 88 88 VAL HG11 H 1 0.82 0.02 . 1 . . . . 88 VAL HG1 . 6711 1 861 . 1 1 88 88 VAL HG12 H 1 0.82 0.02 . 1 . . . . 88 VAL HG1 . 6711 1 862 . 1 1 88 88 VAL HG13 H 1 0.82 0.02 . 1 . . . . 88 VAL HG1 . 6711 1 863 . 1 1 88 88 VAL HG21 H 1 0.82 0.02 . 1 . . . . 88 VAL HG2 . 6711 1 864 . 1 1 88 88 VAL HG22 H 1 0.82 0.02 . 1 . . . . 88 VAL HG2 . 6711 1 865 . 1 1 88 88 VAL HG23 H 1 0.82 0.02 . 1 . . . . 88 VAL HG2 . 6711 1 866 . 1 1 88 88 VAL C C 13 175.0 0.02 . 1 . . . . 88 VAL C . 6711 1 867 . 1 1 88 88 VAL CA C 13 63.66 0.02 . 1 . . . . 88 VAL CA . 6711 1 868 . 1 1 88 88 VAL CB C 13 33.18 0.02 . 1 . . . . 88 VAL CB . 6711 1 869 . 1 1 88 88 VAL CG1 C 13 22.87 0.02 . 1 . . . . 88 VAL CG1 . 6711 1 870 . 1 1 88 88 VAL CG2 C 13 22.87 0.02 . 1 . . . . 88 VAL CG2 . 6711 1 871 . 1 1 88 88 VAL N N 15 123.17 0.02 . 1 . . . . 88 VAL N . 6711 1 872 . 1 1 89 89 CYS H H 1 8.64 0.02 . 1 . . . . 89 CYS H . 6711 1 873 . 1 1 89 89 CYS HA H 1 4.87 0.02 . 1 . . . . 89 CYS HA . 6711 1 874 . 1 1 89 89 CYS HB2 H 1 2.39 0.02 . 1 . . . . 89 CYS HB2 . 6711 1 875 . 1 1 89 89 CYS HB3 H 1 2.39 0.02 . 1 . . . . 89 CYS HB3 . 6711 1 876 . 1 1 89 89 CYS C C 13 181.68 0.02 . 1 . . . . 89 CYS C . 6711 1 877 . 1 1 89 89 CYS CA C 13 58.1 0.02 . 1 . . . . 89 CYS CA . 6711 1 878 . 1 1 89 89 CYS CB C 13 27.1 0.02 . 1 . . . . 89 CYS CB . 6711 1 879 . 1 1 89 89 CYS N N 15 130.75 0.02 . 1 . . . . 89 CYS N . 6711 1 880 . 1 1 90 90 ILE H H 1 6.98 0.02 . 1 . . . . 90 ILE H . 6711 1 881 . 1 1 90 90 ILE HA H 1 4.83 0.02 . 1 . . . . 90 ILE HA . 6711 1 882 . 1 1 90 90 ILE HB H 1 2.1 0.02 . 1 . . . . 90 ILE HB . 6711 1 883 . 1 1 90 90 ILE HG21 H 1 0.81 0.02 . 1 . . . . 90 ILE HG2 . 6711 1 884 . 1 1 90 90 ILE HG22 H 1 0.81 0.02 . 1 . . . . 90 ILE HG2 . 6711 1 885 . 1 1 90 90 ILE HG23 H 1 0.81 0.02 . 1 . . . . 90 ILE HG2 . 6711 1 886 . 1 1 90 90 ILE HD11 H 1 0.81 0.02 . 1 . . . . 90 ILE HD1 . 6711 1 887 . 1 1 90 90 ILE HD12 H 1 0.81 0.02 . 1 . . . . 90 ILE HD1 . 6711 1 888 . 1 1 90 90 ILE HD13 H 1 0.81 0.02 . 1 . . . . 90 ILE HD1 . 6711 1 889 . 1 1 90 90 ILE C C 13 177.04 0.02 . 1 . . . . 90 ILE C . 6711 1 890 . 1 1 90 90 ILE CA C 13 59.42 0.02 . 1 . . . . 90 ILE CA . 6711 1 891 . 1 1 90 90 ILE CB C 13 41.1 0.02 . 1 . . . . 90 ILE CB . 6711 1 892 . 1 1 90 90 ILE CG1 C 13 25.0 0.02 . 1 . . . . 90 ILE CG1 . 6711 1 893 . 1 1 90 90 ILE CG2 C 13 18.6 0.02 . 1 . . . . 90 ILE CG2 . 6711 1 894 . 1 1 90 90 ILE N N 15 116.75 0.02 . 1 . . . . 90 ILE N . 6711 1 895 . 1 1 91 91 SER H H 1 8.82 0.02 . 1 . . . . 91 SER H . 6711 1 896 . 1 1 91 91 SER HA H 1 4.30 0.02 . 1 . . . . 91 SER HA . 6711 1 897 . 1 1 91 91 SER HB2 H 1 2.39 0.02 . 1 . . . . 91 SER HB2 . 6711 1 898 . 1 1 91 91 SER HB3 H 1 2.39 0.02 . 1 . . . . 91 SER HB3 . 6711 1 899 . 1 1 91 91 SER C C 13 176.72 0.02 . 1 . . . . 91 SER C . 6711 1 900 . 1 1 91 91 SER CA C 13 59.34 0.02 . 1 . . . . 91 SER CA . 6711 1 901 . 1 1 91 91 SER CB C 13 62.18 0.02 . 1 . . . . 91 SER CB . 6711 1 902 . 1 1 91 91 SER N N 15 121.69 0.02 . 1 . . . . 91 SER N . 6711 1 903 . 1 1 92 92 ILE H H 1 7.71 0.02 . 1 . . . . 92 ILE H . 6711 1 904 . 1 1 92 92 ILE HA H 1 4.01 0.02 . 1 . . . . 92 ILE HA . 6711 1 905 . 1 1 92 92 ILE HB H 1 1.86 0.02 . 1 . . . . 92 ILE HB . 6711 1 906 . 1 1 92 92 ILE HG21 H 1 0.80 0.02 . 1 . . . . 92 ILE HG2 . 6711 1 907 . 1 1 92 92 ILE HG22 H 1 0.80 0.02 . 1 . . . . 92 ILE HG2 . 6711 1 908 . 1 1 92 92 ILE HG23 H 1 0.80 0.02 . 1 . . . . 92 ILE HG2 . 6711 1 909 . 1 1 92 92 ILE HD11 H 1 0.80 0.02 . 1 . . . . 92 ILE HD1 . 6711 1 910 . 1 1 92 92 ILE HD12 H 1 0.80 0.02 . 1 . . . . 92 ILE HD1 . 6711 1 911 . 1 1 92 92 ILE HD13 H 1 0.80 0.02 . 1 . . . . 92 ILE HD1 . 6711 1 912 . 1 1 92 92 ILE C C 13 172.81 0.02 . 1 . . . . 92 ILE C . 6711 1 913 . 1 1 92 92 ILE CA C 13 63.57 0.02 . 1 . . . . 92 ILE CA . 6711 1 914 . 1 1 92 92 ILE CB C 13 38.34 0.02 . 1 . . . . 92 ILE CB . 6711 1 915 . 1 1 92 92 ILE CG1 C 13 28.1 0.02 . 1 . . . . 92 ILE CG1 . 6711 1 916 . 1 1 92 92 ILE CG2 C 13 17.2 0.02 . 1 . . . . 92 ILE CG2 . 6711 1 917 . 1 1 92 92 ILE CD1 C 13 13.86 0.02 . 1 . . . . 92 ILE CD1 . 6711 1 918 . 1 1 92 92 ILE N N 15 117.83 0.02 . 1 . . . . 92 ILE N . 6711 1 919 . 1 1 93 93 LEU H H 1 7.09 0.02 . 1 . . . . 93 LEU H . 6711 1 920 . 1 1 93 93 LEU HA H 1 4.55 0.02 . 1 . . . . 93 LEU HA . 6711 1 921 . 1 1 93 93 LEU HB2 H 1 1.74 0.02 . 1 . . . . 93 LEU HB2 . 6711 1 922 . 1 1 93 93 LEU HB3 H 1 1.74 0.02 . 1 . . . . 93 LEU HB3 . 6711 1 923 . 1 1 93 93 LEU HG H 1 1.40 0.02 . 1 . . . . 93 LEU HG . 6711 1 924 . 1 1 93 93 LEU HD11 H 1 0.68 0.02 . 1 . . . . 93 LEU HD1 . 6711 1 925 . 1 1 93 93 LEU HD12 H 1 0.68 0.02 . 1 . . . . 93 LEU HD1 . 6711 1 926 . 1 1 93 93 LEU HD13 H 1 0.68 0.02 . 1 . . . . 93 LEU HD1 . 6711 1 927 . 1 1 93 93 LEU HD21 H 1 0.68 0.02 . 1 . . . . 93 LEU HD2 . 6711 1 928 . 1 1 93 93 LEU HD22 H 1 0.68 0.02 . 1 . . . . 93 LEU HD2 . 6711 1 929 . 1 1 93 93 LEU HD23 H 1 0.68 0.02 . 1 . . . . 93 LEU HD2 . 6711 1 930 . 1 1 93 93 LEU C C 13 176.29 0.02 . 1 . . . . 93 LEU C . 6711 1 931 . 1 1 93 93 LEU CA C 13 52.98 0.02 . 1 . . . . 93 LEU CA . 6711 1 932 . 1 1 93 93 LEU CB C 13 41.28 0.02 . 1 . . . . 93 LEU CB . 6711 1 933 . 1 1 93 93 LEU CG C 13 26.2 0.02 . 1 . . . . 93 LEU CG . 6711 1 934 . 1 1 93 93 LEU CD1 C 13 22.5 0.02 . 1 . . . . 93 LEU CD1 . 6711 1 935 . 1 1 93 93 LEU CD2 C 13 22.5 0.02 . 1 . . . . 93 LEU CD2 . 6711 1 936 . 1 1 93 93 LEU N N 15 113.7 0.02 . 1 . . . . 93 LEU N . 6711 1 937 . 1 1 94 94 HIS H H 1 7.94 0.02 . 1 . . . . 94 HIS H . 6711 1 938 . 1 1 94 94 HIS HA H 1 4.72 0.02 . 1 . . . . 94 HIS HA . 6711 1 939 . 1 1 94 94 HIS HB2 H 1 3.21 0.02 . 1 . . . . 94 HIS HB2 . 6711 1 940 . 1 1 94 94 HIS HB3 H 1 3.21 0.02 . 1 . . . . 94 HIS HB3 . 6711 1 941 . 1 1 94 94 HIS C C 13 174.76 0.02 . 1 . . . . 94 HIS C . 6711 1 942 . 1 1 94 94 HIS CA C 13 55.7 0.02 . 1 . . . . 94 HIS CA . 6711 1 943 . 1 1 94 94 HIS CB C 13 31.0 0.02 . 1 . . . . 94 HIS CB . 6711 1 944 . 1 1 94 94 HIS N N 15 119.85 0.02 . 1 . . . . 94 HIS N . 6711 1 945 . 1 1 95 95 ALA H H 1 8.88 0.02 . 1 . . . . 95 ALA H . 6711 1 946 . 1 1 95 95 ALA HB1 H 1 1.38 0.02 . 1 . . . . 95 ALA HB . 6711 1 947 . 1 1 95 95 ALA HB2 H 1 1.38 0.02 . 1 . . . . 95 ALA HB . 6711 1 948 . 1 1 95 95 ALA HB3 H 1 1.38 0.02 . 1 . . . . 95 ALA HB . 6711 1 949 . 1 1 95 95 ALA C C 13 175.54 0.02 . 1 . . . . 95 ALA C . 6711 1 950 . 1 1 95 95 ALA CA C 13 50.16 0.02 . 1 . . . . 95 ALA CA . 6711 1 951 . 1 1 95 95 ALA CB C 13 18.22 0.02 . 1 . . . . 95 ALA CB . 6711 1 952 . 1 1 95 95 ALA N N 15 128.9 0.02 . 1 . . . . 95 ALA N . 6711 1 953 . 1 1 96 96 PRO HA H 1 4.32 0.02 . 1 . . . . 96 PRO HA . 6711 1 954 . 1 1 96 96 PRO HB2 H 1 2.32 0.02 . 2 . . . . 96 PRO HB2 . 6711 1 955 . 1 1 96 96 PRO HB3 H 1 1.99 0.02 . 2 . . . . 96 PRO HB3 . 6711 1 956 . 1 1 96 96 PRO C C 13 177.38 0.02 . 1 . . . . 96 PRO C . 6711 1 957 . 1 1 96 96 PRO CA C 13 64.2 0.02 . 1 . . . . 96 PRO CA . 6711 1 958 . 1 1 96 96 PRO CB C 13 31.5 0.02 . 1 . . . . 96 PRO CB . 6711 1 959 . 1 1 96 96 PRO CG C 13 27.7 0.02 . 1 . . . . 96 PRO CG . 6711 1 960 . 1 1 96 96 PRO CD C 13 50.4 0.02 . 1 . . . . 96 PRO CD . 6711 1 961 . 1 1 97 97 GLY H H 1 8.57 0.02 . 1 . . . . 97 GLY H . 6711 1 962 . 1 1 97 97 GLY HA2 H 1 3.96 0.02 . 1 . . . . 97 GLY HA2 . 6711 1 963 . 1 1 97 97 GLY HA3 H 1 3.96 0.02 . 1 . . . . 97 GLY HA3 . 6711 1 964 . 1 1 97 97 GLY C C 13 174.18 0.02 . 1 . . . . 97 GLY C . 6711 1 965 . 1 1 97 97 GLY CA C 13 44.88 0.02 . 1 . . . . 97 GLY CA . 6711 1 966 . 1 1 97 97 GLY N N 15 109.46 0.02 . 1 . . . . 97 GLY N . 6711 1 967 . 1 1 98 98 ASP H H 1 7.95 0.02 . 1 . . . . 98 ASP H . 6711 1 968 . 1 1 98 98 ASP HA H 1 4.61 0.02 . 1 . . . . 98 ASP HA . 6711 1 969 . 1 1 98 98 ASP HB2 H 1 2.62 0.02 . 1 . . . . 98 ASP HB2 . 6711 1 970 . 1 1 98 98 ASP HB3 H 1 2.62 0.02 . 1 . . . . 98 ASP HB3 . 6711 1 971 . 1 1 98 98 ASP C C 13 175.83 0.02 . 1 . . . . 98 ASP C . 6711 1 972 . 1 1 98 98 ASP CA C 13 53.96 0.02 . 1 . . . . 98 ASP CA . 6711 1 973 . 1 1 98 98 ASP CB C 13 41.0 0.02 . 1 . . . . 98 ASP CB . 6711 1 974 . 1 1 98 98 ASP N N 15 120.81 0.02 . 1 . . . . 98 ASP N . 6711 1 975 . 1 1 99 99 ASP H H 1 8.30 0.02 . 1 . . . . 99 ASP H . 6711 1 976 . 1 1 99 99 ASP HB2 H 1 2.71 0.02 . 1 . . . . 99 ASP HB2 . 6711 1 977 . 1 1 99 99 ASP HB3 H 1 2.71 0.02 . 1 . . . . 99 ASP HB3 . 6711 1 978 . 1 1 99 99 ASP C C 13 174.75 0.02 . 1 . . . . 99 ASP C . 6711 1 979 . 1 1 99 99 ASP CA C 13 52.99 0.02 . 1 . . . . 99 ASP CA . 6711 1 980 . 1 1 99 99 ASP CB C 13 41.0 0.02 . 1 . . . . 99 ASP CB . 6711 1 981 . 1 1 99 99 ASP N N 15 121.5 0.02 . 1 . . . . 99 ASP N . 6711 1 982 . 1 1 100 100 PRO HA H 1 4.32 0.02 . 1 . . . . 100 PRO HA . 6711 1 983 . 1 1 100 100 PRO HB2 H 1 2.16 0.02 . 1 . . . . 100 PRO HB2 . 6711 1 984 . 1 1 100 100 PRO HB3 H 1 1.90 0.02 . 1 . . . . 100 PRO HB3 . 6711 1 985 . 1 1 100 100 PRO HD2 H 1 3.71 0.02 . 1 . . . . 100 PRO HD2 . 6711 1 986 . 1 1 100 100 PRO HD3 H 1 3.71 0.02 . 1 . . . . 100 PRO HD3 . 6711 1 987 . 1 1 100 100 PRO C C 13 177.04 0.02 . 1 . . . . 100 PRO C . 6711 1 988 . 1 1 100 100 PRO CA C 13 63.5 0.02 . 1 . . . . 100 PRO CA . 6711 1 989 . 1 1 100 100 PRO CB C 13 31.7 0.02 . 1 . . . . 100 PRO CB . 6711 1 990 . 1 1 100 100 PRO CG C 13 27.1 0.02 . 1 . . . . 100 PRO CG . 6711 1 991 . 1 1 100 100 PRO CD C 13 50.4 0.02 . 1 . . . . 100 PRO CD . 6711 1 992 . 1 1 101 101 MET H H 1 8.29 0.02 . 1 . . . . 101 MET H . 6711 1 993 . 1 1 101 101 MET HA H 1 4.35 0.02 . 1 . . . . 101 MET HA . 6711 1 994 . 1 1 101 101 MET HB2 H 1 1.84 0.02 . 1 . . . . 101 MET HB2 . 6711 1 995 . 1 1 101 101 MET HB3 H 1 1.84 0.02 . 1 . . . . 101 MET HB3 . 6711 1 996 . 1 1 101 101 MET HG2 H 1 2.4 0.02 . 1 . . . . 101 MET HG2 . 6711 1 997 . 1 1 101 101 MET HG3 H 1 2.4 0.02 . 1 . . . . 101 MET HG3 . 6711 1 998 . 1 1 101 101 MET C C 13 176.6 0.02 . 1 . . . . 101 MET C . 6711 1 999 . 1 1 101 101 MET CA C 13 55.14 0.02 . 1 . . . . 101 MET CA . 6711 1 1000 . 1 1 101 101 MET CB C 13 32.0 0.02 . 1 . . . . 101 MET CB . 6711 1 1001 . 1 1 101 101 MET CG C 13 32.2 0.02 . 1 . . . . 101 MET CG . 6711 1 1002 . 1 1 101 101 MET N N 15 118.47 0.02 . 1 . . . . 101 MET N . 6711 1 1003 . 1 1 102 102 GLY H H 1 8.16 0.02 . 1 . . . . 102 GLY H . 6711 1 1004 . 1 1 102 102 GLY HA2 H 1 3.81 0.02 . 1 . . . . 102 GLY HA2 . 6711 1 1005 . 1 1 102 102 GLY HA3 H 1 3.81 0.02 . 1 . . . . 102 GLY HA3 . 6711 1 1006 . 1 1 102 102 GLY C C 13 173.97 0.02 . 1 . . . . 102 GLY C . 6711 1 1007 . 1 1 102 102 GLY CA C 13 45.34 0.02 . 1 . . . . 102 GLY CA . 6711 1 1008 . 1 1 102 102 GLY N N 15 109.1 0.02 . 1 . . . . 102 GLY N . 6711 1 1009 . 1 1 103 103 TYR H H 1 7.67 0.02 . 1 . . . . 103 TYR H . 6711 1 1010 . 1 1 103 103 TYR HA H 1 4.51 0.02 . 1 . . . . 103 TYR HA . 6711 1 1011 . 1 1 103 103 TYR HB2 H 1 2.96 0.02 . 2 . . . . 103 TYR HB2 . 6711 1 1012 . 1 1 103 103 TYR HB3 H 1 2.81 0.02 . 2 . . . . 103 TYR HB3 . 6711 1 1013 . 1 1 103 103 TYR C C 13 175.88 0.02 . 1 . . . . 103 TYR C . 6711 1 1014 . 1 1 103 103 TYR CA C 13 57.61 0.02 . 1 . . . . 103 TYR CA . 6711 1 1015 . 1 1 103 103 TYR CB C 13 38.64 0.02 . 1 . . . . 103 TYR CB . 6711 1 1016 . 1 1 103 103 TYR N N 15 119.02 0.02 . 1 . . . . 103 TYR N . 6711 1 1017 . 1 1 104 104 GLU H H 1 8.63 0.02 . 1 . . . . 104 GLU H . 6711 1 1018 . 1 1 104 104 GLU HA H 1 4.24 0.02 . 1 . . . . 104 GLU HA . 6711 1 1019 . 1 1 104 104 GLU HB2 H 1 2.00 0.02 . 1 . . . . 104 GLU HB2 . 6711 1 1020 . 1 1 104 104 GLU HB3 H 1 2.00 0.02 . 1 . . . . 104 GLU HB3 . 6711 1 1021 . 1 1 104 104 GLU HG2 H 1 2.24 0.02 . 1 . . . . 104 GLU HG2 . 6711 1 1022 . 1 1 104 104 GLU HG3 H 1 2.24 0.02 . 1 . . . . 104 GLU HG3 . 6711 1 1023 . 1 1 104 104 GLU C C 13 177.03 0.02 . 1 . . . . 104 GLU C . 6711 1 1024 . 1 1 104 104 GLU CA C 13 56.8 0.02 . 1 . . . . 104 GLU CA . 6711 1 1025 . 1 1 104 104 GLU CB C 13 30.1 0.02 . 1 . . . . 104 GLU CB . 6711 1 1026 . 1 1 104 104 GLU CG C 13 36.4 0.02 . 1 . . . . 104 GLU CG . 6711 1 1027 . 1 1 104 104 GLU N N 15 122.52 0.02 . 1 . . . . 104 GLU N . 6711 1 1028 . 1 1 105 105 SER H H 1 8.40 0.02 . 1 . . . . 105 SER H . 6711 1 1029 . 1 1 105 105 SER HA H 1 4.32 0.02 . 1 . . . . 105 SER HA . 6711 1 1030 . 1 1 105 105 SER HB2 H 1 3.86 0.02 . 1 . . . . 105 SER HB2 . 6711 1 1031 . 1 1 105 105 SER HB3 H 1 3.86 0.02 . 1 . . . . 105 SER HB3 . 6711 1 1032 . 1 1 105 105 SER C C 13 174.93 0.02 . 1 . . . . 105 SER C . 6711 1 1033 . 1 1 105 105 SER CA C 13 56.7 0.02 . 1 . . . . 105 SER CA . 6711 1 1034 . 1 1 105 105 SER CB C 13 63.5 0.02 . 1 . . . . 105 SER CB . 6711 1 1035 . 1 1 105 105 SER N N 15 116.63 0.02 . 1 . . . . 105 SER N . 6711 1 1036 . 1 1 106 106 SER H H 1 8.22 0.02 . 1 . . . . 106 SER H . 6711 1 1037 . 1 1 106 106 SER HA H 1 4.41 0.02 . 1 . . . . 106 SER HA . 6711 1 1038 . 1 1 106 106 SER HB2 H 1 3.90 0.02 . 1 . . . . 106 SER HB2 . 6711 1 1039 . 1 1 106 106 SER HB3 H 1 3.90 0.02 . 1 . . . . 106 SER HB3 . 6711 1 1040 . 1 1 106 106 SER C C 13 174.26 0.02 . 1 . . . . 106 SER C . 6711 1 1041 . 1 1 106 106 SER CA C 13 58.17 0.02 . 1 . . . . 106 SER CA . 6711 1 1042 . 1 1 106 106 SER CB C 13 63.28 0.02 . 1 . . . . 106 SER CB . 6711 1 1043 . 1 1 106 106 SER N N 15 116.7 0.02 . 1 . . . . 106 SER N . 6711 1 1044 . 1 1 107 107 ALA H H 1 7.87 0.02 . 1 . . . . 107 ALA H . 6711 1 1045 . 1 1 107 107 ALA HA H 1 4.25 0.02 . 1 . . . . 107 ALA HA . 6711 1 1046 . 1 1 107 107 ALA HB1 H 1 1.40 0.02 . 1 . . . . 107 ALA HB . 6711 1 1047 . 1 1 107 107 ALA HB2 H 1 1.40 0.02 . 1 . . . . 107 ALA HB . 6711 1 1048 . 1 1 107 107 ALA HB3 H 1 1.40 0.02 . 1 . . . . 107 ALA HB . 6711 1 1049 . 1 1 107 107 ALA C C 13 177.42 0.02 . 1 . . . . 107 ALA C . 6711 1 1050 . 1 1 107 107 ALA CA C 13 52.41 0.02 . 1 . . . . 107 ALA CA . 6711 1 1051 . 1 1 107 107 ALA CB C 13 19.15 0.02 . 1 . . . . 107 ALA CB . 6711 1 1052 . 1 1 107 107 ALA N N 15 125.81 0.02 . 1 . . . . 107 ALA N . 6711 1 1053 . 1 1 108 108 GLU H H 1 8.35 0.02 . 1 . . . . 108 GLU H . 6711 1 1054 . 1 1 108 108 GLU HA H 1 4.08 0.02 . 1 . . . . 108 GLU HA . 6711 1 1055 . 1 1 108 108 GLU HB2 H 1 1.83 0.02 . 1 . . . . 108 GLU HB2 . 6711 1 1056 . 1 1 108 108 GLU HB3 H 1 1.83 0.02 . 1 . . . . 108 GLU HB3 . 6711 1 1057 . 1 1 108 108 GLU HG2 H 1 2.21 0.02 . 1 . . . . 108 GLU HG2 . 6711 1 1058 . 1 1 108 108 GLU HG3 H 1 2.21 0.02 . 1 . . . . 108 GLU HG3 . 6711 1 1059 . 1 1 108 108 GLU C C 13 175.88 0.02 . 1 . . . . 108 GLU C . 6711 1 1060 . 1 1 108 108 GLU CA C 13 56.76 0.02 . 1 . . . . 108 GLU CA . 6711 1 1061 . 1 1 108 108 GLU CB C 13 30.0 0.02 . 1 . . . . 108 GLU CB . 6711 1 1062 . 1 1 108 108 GLU CG C 13 36.1 0.02 . 1 . . . . 108 GLU CG . 6711 1 1063 . 1 1 108 108 GLU N N 15 120.91 0.02 . 1 . . . . 108 GLU N . 6711 1 1064 . 1 1 109 109 ARG H H 1 8.10 0.02 . 1 . . . . 109 ARG H . 6711 1 1065 . 1 1 109 109 ARG HA H 1 4.88 0.02 . 1 . . . . 109 ARG HA . 6711 1 1066 . 1 1 109 109 ARG HB2 H 1 2.08 0.02 . 1 . . . . 109 ARG HB2 . 6711 1 1067 . 1 1 109 109 ARG HB3 H 1 2.08 0.02 . 1 . . . . 109 ARG HB3 . 6711 1 1068 . 1 1 109 109 ARG HG2 H 1 1.67 0.02 . 1 . . . . 109 ARG HG2 . 6711 1 1069 . 1 1 109 109 ARG HG3 H 1 1.67 0.02 . 1 . . . . 109 ARG HG3 . 6711 1 1070 . 1 1 109 109 ARG HD2 H 1 3.13 0.02 . 1 . . . . 109 ARG HD2 . 6711 1 1071 . 1 1 109 109 ARG HD3 H 1 3.13 0.02 . 1 . . . . 109 ARG HD3 . 6711 1 1072 . 1 1 109 109 ARG C C 13 175.80 0.02 . 1 . . . . 109 ARG C . 6711 1 1073 . 1 1 109 109 ARG CA C 13 53.3 0.02 . 1 . . . . 109 ARG CA . 6711 1 1074 . 1 1 109 109 ARG CB C 13 32.45 0.02 . 1 . . . . 109 ARG CB . 6711 1 1075 . 1 1 109 109 ARG CG C 13 27.3 0.02 . 1 . . . . 109 ARG CG . 6711 1 1076 . 1 1 109 109 ARG CD C 13 42.9 0.02 . 1 . . . . 109 ARG CD . 6711 1 1077 . 1 1 109 109 ARG N N 15 121.78 0.02 . 1 . . . . 109 ARG N . 6711 1 1078 . 1 1 110 110 TRP H H 1 8.72 0.02 . 1 . . . . 110 TRP H . 6711 1 1079 . 1 1 110 110 TRP HA H 1 4.21 0.02 . 1 . . . . 110 TRP HA . 6711 1 1080 . 1 1 110 110 TRP HB2 H 1 2.75 0.02 . 1 . . . . 110 TRP HB2 . 6711 1 1081 . 1 1 110 110 TRP HB3 H 1 2.75 0.02 . 1 . . . . 110 TRP HB3 . 6711 1 1082 . 1 1 110 110 TRP C C 13 176.56 0.02 . 1 . . . . 110 TRP C . 6711 1 1083 . 1 1 110 110 TRP CA C 13 59.9 0.02 . 1 . . . . 110 TRP CA . 6711 1 1084 . 1 1 110 110 TRP CB C 13 29.4 0.02 . 1 . . . . 110 TRP CB . 6711 1 1085 . 1 1 110 110 TRP N N 15 121.17 0.02 . 1 . . . . 110 TRP N . 6711 1 1086 . 1 1 111 111 SER H H 1 5.70 0.02 . 1 . . . . 111 SER H . 6711 1 1087 . 1 1 111 111 SER HA H 1 4.18 0.02 . 1 . . . . 111 SER HA . 6711 1 1088 . 1 1 111 111 SER HB2 H 1 1.98 0.02 . 1 . . . . 111 SER HB2 . 6711 1 1089 . 1 1 111 111 SER HB3 H 1 1.98 0.02 . 1 . . . . 111 SER HB3 . 6711 1 1090 . 1 1 111 111 SER CA C 13 56.77 0.02 . 1 . . . . 111 SER CA . 6711 1 1091 . 1 1 111 111 SER CB C 13 63.26 0.02 . 1 . . . . 111 SER CB . 6711 1 1092 . 1 1 111 111 SER N N 15 119.56 0.02 . 1 . . . . 111 SER N . 6711 1 1093 . 1 1 112 112 PRO HA H 1 4.27 0.02 . 1 . . . . 112 PRO HA . 6711 1 1094 . 1 1 112 112 PRO HB2 H 1 2.09 0.02 . 2 . . . . 112 PRO HB2 . 6711 1 1095 . 1 1 112 112 PRO HB3 H 1 1.84 0.02 . 2 . . . . 112 PRO HB3 . 6711 1 1096 . 1 1 112 112 PRO C C 13 175.86 0.02 . 1 . . . . 112 PRO C . 6711 1 1097 . 1 1 112 112 PRO CA C 13 64.37 0.02 . 1 . . . . 112 PRO CA . 6711 1 1098 . 1 1 112 112 PRO CB C 13 31.91 0.02 . 1 . . . . 112 PRO CB . 6711 1 1099 . 1 1 112 112 PRO CG C 13 27.72 0.02 . 1 . . . . 112 PRO CG . 6711 1 1100 . 1 1 112 112 PRO CD C 13 50.75 0.02 . 1 . . . . 112 PRO CD . 6711 1 1101 . 1 1 113 113 VAL H H 1 6.71 0.02 . 1 . . . . 113 VAL H . 6711 1 1102 . 1 1 113 113 VAL HA H 1 4.22 0.02 . 1 . . . . 113 VAL HA . 6711 1 1103 . 1 1 113 113 VAL HB H 1 2.12 0.02 . 1 . . . . 113 VAL HB . 6711 1 1104 . 1 1 113 113 VAL HG11 H 1 0.71 0.02 . 1 . . . . 113 VAL HG1 . 6711 1 1105 . 1 1 113 113 VAL HG12 H 1 0.71 0.02 . 1 . . . . 113 VAL HG1 . 6711 1 1106 . 1 1 113 113 VAL HG13 H 1 0.71 0.02 . 1 . . . . 113 VAL HG1 . 6711 1 1107 . 1 1 113 113 VAL HG21 H 1 0.71 0.02 . 1 . . . . 113 VAL HG2 . 6711 1 1108 . 1 1 113 113 VAL HG22 H 1 0.71 0.02 . 1 . . . . 113 VAL HG2 . 6711 1 1109 . 1 1 113 113 VAL HG23 H 1 0.71 0.02 . 1 . . . . 113 VAL HG2 . 6711 1 1110 . 1 1 113 113 VAL C C 13 177.56 0.02 . 1 . . . . 113 VAL C . 6711 1 1111 . 1 1 113 113 VAL CA C 13 61.55 0.02 . 1 . . . . 113 VAL CA . 6711 1 1112 . 1 1 113 113 VAL CB C 13 30.70 0.02 . 1 . . . . 113 VAL CB . 6711 1 1113 . 1 1 113 113 VAL CG1 C 13 20.88 0.02 . 2 . . . . 113 VAL CG1 . 6711 1 1114 . 1 1 113 113 VAL CG2 C 13 19.39 0.02 . 2 . . . . 113 VAL CG2 . 6711 1 1115 . 1 1 113 113 VAL N N 15 109.52 0.02 . 1 . . . . 113 VAL N . 6711 1 1116 . 1 1 114 114 GLN H H 1 7.05 0.02 . 1 . . . . 114 GLN H . 6711 1 1117 . 1 1 114 114 GLN HA H 1 4.49 0.02 . 1 . . . . 114 GLN HA . 6711 1 1118 . 1 1 114 114 GLN HB2 H 1 0.59 0.02 . 1 . . . . 114 GLN HB2 . 6711 1 1119 . 1 1 114 114 GLN HB3 H 1 0.59 0.02 . 1 . . . . 114 GLN HB3 . 6711 1 1120 . 1 1 114 114 GLN HG2 H 1 2.03 0.02 . 1 . . . . 114 GLN HG2 . 6711 1 1121 . 1 1 114 114 GLN HG3 H 1 2.03 0.02 . 1 . . . . 114 GLN HG3 . 6711 1 1122 . 1 1 114 114 GLN C C 13 172.57 0.02 . 1 . . . . 114 GLN C . 6711 1 1123 . 1 1 114 114 GLN CA C 13 54.28 0.02 . 1 . . . . 114 GLN CA . 6711 1 1124 . 1 1 114 114 GLN CB C 13 27.45 0.02 . 1 . . . . 114 GLN CB . 6711 1 1125 . 1 1 114 114 GLN CG C 13 31.08 0.02 . 1 . . . . 114 GLN CG . 6711 1 1126 . 1 1 114 114 GLN N N 15 119.2 0.02 . 1 . . . . 114 GLN N . 6711 1 1127 . 1 1 115 115 SER H H 1 6.72 0.02 . 1 . . . . 115 SER H . 6711 1 1128 . 1 1 115 115 SER HA H 1 4.94 0.02 . 1 . . . . 115 SER HA . 6711 1 1129 . 1 1 115 115 SER HB2 H 1 4.42 0.02 . 2 . . . . 115 SER HB2 . 6711 1 1130 . 1 1 115 115 SER HB3 H 1 3.86 0.02 . 2 . . . . 115 SER HB3 . 6711 1 1131 . 1 1 115 115 SER C C 13 174.36 0.02 . 1 . . . . 115 SER C . 6711 1 1132 . 1 1 115 115 SER CA C 13 56.13 0.02 . 1 . . . . 115 SER CA . 6711 1 1133 . 1 1 115 115 SER CB C 13 66.21 0.02 . 1 . . . . 115 SER CB . 6711 1 1134 . 1 1 115 115 SER N N 15 107.79 0.02 . 1 . . . . 115 SER N . 6711 1 1135 . 1 1 116 116 VAL H H 1 10.35 0.02 . 1 . . . . 116 VAL H . 6711 1 1136 . 1 1 116 116 VAL HA H 1 3.56 0.02 . 1 . . . . 116 VAL HA . 6711 1 1137 . 1 1 116 116 VAL HB H 1 2.14 0.02 . 1 . . . . 116 VAL HB . 6711 1 1138 . 1 1 116 116 VAL HG11 H 1 0.77 0.02 . 1 . . . . 116 VAL HG1 . 6711 1 1139 . 1 1 116 116 VAL HG12 H 1 0.77 0.02 . 1 . . . . 116 VAL HG1 . 6711 1 1140 . 1 1 116 116 VAL HG13 H 1 0.77 0.02 . 1 . . . . 116 VAL HG1 . 6711 1 1141 . 1 1 116 116 VAL HG21 H 1 0.77 0.02 . 1 . . . . 116 VAL HG2 . 6711 1 1142 . 1 1 116 116 VAL HG22 H 1 0.77 0.02 . 1 . . . . 116 VAL HG2 . 6711 1 1143 . 1 1 116 116 VAL HG23 H 1 0.77 0.02 . 1 . . . . 116 VAL HG2 . 6711 1 1144 . 1 1 116 116 VAL C C 13 177.84 0.02 . 1 . . . . 116 VAL C . 6711 1 1145 . 1 1 116 116 VAL CA C 13 67.43 0.02 . 1 . . . . 116 VAL CA . 6711 1 1146 . 1 1 116 116 VAL CB C 13 30.97 0.02 . 1 . . . . 116 VAL CB . 6711 1 1147 . 1 1 116 116 VAL CG1 C 13 23.75 0.02 . 1 . . . . 116 VAL CG1 . 6711 1 1148 . 1 1 116 116 VAL CG2 C 13 21.42 0.02 . 1 . . . . 116 VAL CG2 . 6711 1 1149 . 1 1 116 116 VAL N N 15 123.25 0.02 . 1 . . . . 116 VAL N . 6711 1 1150 . 1 1 117 117 GLU H H 1 9.34 0.02 . 1 . . . . 117 GLU H . 6711 1 1151 . 1 1 117 117 GLU HA H 1 3.68 0.02 . 1 . . . . 117 GLU HA . 6711 1 1152 . 1 1 117 117 GLU HB2 H 1 2.13 0.02 . 2 . . . . 117 GLU HB2 . 6711 1 1153 . 1 1 117 117 GLU HB3 H 1 2.03 0.02 . 2 . . . . 117 GLU HB3 . 6711 1 1154 . 1 1 117 117 GLU C C 13 177.23 0.02 . 1 . . . . 117 GLU C . 6711 1 1155 . 1 1 117 117 GLU CA C 13 60.77 0.02 . 1 . . . . 117 GLU CA . 6711 1 1156 . 1 1 117 117 GLU CB C 13 29.9 0.02 . 1 . . . . 117 GLU CB . 6711 1 1157 . 1 1 117 117 GLU CG C 13 36.28 0.02 . 1 . . . . 117 GLU CG . 6711 1 1158 . 1 1 117 117 GLU N N 15 120.69 0.02 . 1 . . . . 117 GLU N . 6711 1 1159 . 1 1 118 118 LYS H H 1 7.77 0.02 . 1 . . . . 118 LYS H . 6711 1 1160 . 1 1 118 118 LYS HA H 1 3.98 0.02 . 1 . . . . 118 LYS HA . 6711 1 1161 . 1 1 118 118 LYS HB2 H 1 1.94 0.02 . 1 . . . . 118 LYS HB2 . 6711 1 1162 . 1 1 118 118 LYS HB3 H 1 1.94 0.02 . 1 . . . . 118 LYS HB3 . 6711 1 1163 . 1 1 118 118 LYS HG2 H 1 1.51 0.02 . 1 . . . . 118 LYS HG2 . 6711 1 1164 . 1 1 118 118 LYS HG3 H 1 1.51 0.02 . 1 . . . . 118 LYS HG3 . 6711 1 1165 . 1 1 118 118 LYS HE2 H 1 2.15 0.02 . 1 . . . . 118 LYS HE2 . 6711 1 1166 . 1 1 118 118 LYS HE3 H 1 2.15 0.02 . 1 . . . . 118 LYS HE3 . 6711 1 1167 . 1 1 118 118 LYS C C 13 180.59 0.02 . 1 . . . . 118 LYS C . 6711 1 1168 . 1 1 118 118 LYS CA C 13 59.1 0.02 . 1 . . . . 118 LYS CA . 6711 1 1169 . 1 1 118 118 LYS CB C 13 32.2 0.02 . 1 . . . . 118 LYS CB . 6711 1 1170 . 1 1 118 118 LYS CG C 13 25.0 0.02 . 1 . . . . 118 LYS CG . 6711 1 1171 . 1 1 118 118 LYS CD C 13 28.5 0.02 . 1 . . . . 118 LYS CD . 6711 1 1172 . 1 1 118 118 LYS CE C 13 41.6 0.02 . 1 . . . . 118 LYS CE . 6711 1 1173 . 1 1 118 118 LYS N N 15 116.35 0.02 . 1 . . . . 118 LYS N . 6711 1 1174 . 1 1 119 119 ILE H H 1 8.32 0.02 . 1 . . . . 119 ILE H . 6711 1 1175 . 1 1 119 119 ILE HA H 1 3.51 0.02 . 1 . . . . 119 ILE HA . 6711 1 1176 . 1 1 119 119 ILE HB H 1 2.14 0.02 . 1 . . . . 119 ILE HB . 6711 1 1177 . 1 1 119 119 ILE HD11 H 1 0.68 0.02 . 4 . . . . 119 ILE HD1 . 6711 1 1178 . 1 1 119 119 ILE HD12 H 1 0.68 0.02 . 4 . . . . 119 ILE HD1 . 6711 1 1179 . 1 1 119 119 ILE HD13 H 1 0.68 0.02 . 4 . . . . 119 ILE HD1 . 6711 1 1180 . 1 1 119 119 ILE C C 13 177.35 0.02 . 1 . . . . 119 ILE C . 6711 1 1181 . 1 1 119 119 ILE CA C 13 65.95 0.02 . 1 . . . . 119 ILE CA . 6711 1 1182 . 1 1 119 119 ILE CB C 13 38.40 0.02 . 1 . . . . 119 ILE CB . 6711 1 1183 . 1 1 119 119 ILE CG1 C 13 27.5 0.02 . 1 . . . . 119 ILE CG1 . 6711 1 1184 . 1 1 119 119 ILE CG2 C 13 17.4 0.02 . 1 . . . . 119 ILE CG2 . 6711 1 1185 . 1 1 119 119 ILE CD1 C 13 14.39 0.02 . 1 . . . . 119 ILE CD1 . 6711 1 1186 . 1 1 119 119 ILE N N 15 121.3 0.02 . 1 . . . . 119 ILE N . 6711 1 1187 . 1 1 120 120 LEU H H 1 8.48 0.02 . 1 . . . . 120 LEU H . 6711 1 1188 . 1 1 120 120 LEU HA H 1 3.81 0.02 . 1 . . . . 120 LEU HA . 6711 1 1189 . 1 1 120 120 LEU HB2 H 1 1.98 0.02 . 1 . . . . 120 LEU HB2 . 6711 1 1190 . 1 1 120 120 LEU HB3 H 1 1.98 0.02 . 1 . . . . 120 LEU HB3 . 6711 1 1191 . 1 1 120 120 LEU HG H 1 1.33 0.02 . 1 . . . . 120 LEU HG . 6711 1 1192 . 1 1 120 120 LEU HD11 H 1 0.72 0.02 . 1 . . . . 120 LEU HD1 . 6711 1 1193 . 1 1 120 120 LEU HD12 H 1 0.72 0.02 . 1 . . . . 120 LEU HD1 . 6711 1 1194 . 1 1 120 120 LEU HD13 H 1 0.72 0.02 . 1 . . . . 120 LEU HD1 . 6711 1 1195 . 1 1 120 120 LEU HD21 H 1 0.72 0.02 . 1 . . . . 120 LEU HD2 . 6711 1 1196 . 1 1 120 120 LEU HD22 H 1 0.72 0.02 . 1 . . . . 120 LEU HD2 . 6711 1 1197 . 1 1 120 120 LEU HD23 H 1 0.72 0.02 . 1 . . . . 120 LEU HD2 . 6711 1 1198 . 1 1 120 120 LEU C C 13 178.98 0.02 . 1 . . . . 120 LEU C . 6711 1 1199 . 1 1 120 120 LEU CA C 13 58.12 0.02 . 1 . . . . 120 LEU CA . 6711 1 1200 . 1 1 120 120 LEU CB C 13 40.38 0.02 . 1 . . . . 120 LEU CB . 6711 1 1201 . 1 1 120 120 LEU CG C 13 26.9 0.02 . 1 . . . . 120 LEU CG . 6711 1 1202 . 1 1 120 120 LEU CD1 C 13 21.79 0.02 . 1 . . . . 120 LEU CD1 . 6711 1 1203 . 1 1 120 120 LEU CD2 C 13 21.79 0.02 . 1 . . . . 120 LEU CD2 . 6711 1 1204 . 1 1 120 120 LEU N N 15 117.84 0.02 . 1 . . . . 120 LEU N . 6711 1 1205 . 1 1 121 121 LEU H H 1 8.65 0.02 . 1 . . . . 121 LEU H . 6711 1 1206 . 1 1 121 121 LEU HA H 1 4.09 0.02 . 1 . . . . 121 LEU HA . 6711 1 1207 . 1 1 121 121 LEU HB2 H 1 1.82 0.02 . 1 . . . . 121 LEU HB2 . 6711 1 1208 . 1 1 121 121 LEU HB3 H 1 1.55 0.02 . 1 . . . . 121 LEU HB3 . 6711 1 1209 . 1 1 121 121 LEU HD11 H 1 0.89 0.02 . 1 . . . . 121 LEU HD1 . 6711 1 1210 . 1 1 121 121 LEU HD12 H 1 0.89 0.02 . 1 . . . . 121 LEU HD1 . 6711 1 1211 . 1 1 121 121 LEU HD13 H 1 0.89 0.02 . 1 . . . . 121 LEU HD1 . 6711 1 1212 . 1 1 121 121 LEU HD21 H 1 0.89 0.02 . 1 . . . . 121 LEU HD2 . 6711 1 1213 . 1 1 121 121 LEU HD22 H 1 0.89 0.02 . 1 . . . . 121 LEU HD2 . 6711 1 1214 . 1 1 121 121 LEU HD23 H 1 0.89 0.02 . 1 . . . . 121 LEU HD2 . 6711 1 1215 . 1 1 121 121 LEU C C 13 180.66 0.02 . 1 . . . . 121 LEU C . 6711 1 1216 . 1 1 121 121 LEU CA C 13 57.9 0.02 . 1 . . . . 121 LEU CA . 6711 1 1217 . 1 1 121 121 LEU CB C 13 41.19 0.02 . 1 . . . . 121 LEU CB . 6711 1 1218 . 1 1 121 121 LEU CG C 13 27.16 0.02 . 1 . . . . 121 LEU CG . 6711 1 1219 . 1 1 121 121 LEU CD1 C 13 25.31 0.02 . 1 . . . . 121 LEU CD1 . 6711 1 1220 . 1 1 121 121 LEU CD2 C 13 22.52 0.02 . 1 . . . . 121 LEU CD2 . 6711 1 1221 . 1 1 121 121 LEU N N 15 118.47 0.02 . 1 . . . . 121 LEU N . 6711 1 1222 . 1 1 122 122 SER H H 1 8.03 0.02 . 1 . . . . 122 SER H . 6711 1 1223 . 1 1 122 122 SER HA H 1 4.23 0.02 . 1 . . . . 122 SER HA . 6711 1 1224 . 1 1 122 122 SER HB2 H 1 3.87 0.02 . 1 . . . . 122 SER HB2 . 6711 1 1225 . 1 1 122 122 SER HB3 H 1 3.87 0.02 . 1 . . . . 122 SER HB3 . 6711 1 1226 . 1 1 122 122 SER C C 13 176.97 0.02 . 1 . . . . 122 SER C . 6711 1 1227 . 1 1 122 122 SER CA C 13 62.2 0.02 . 1 . . . . 122 SER CA . 6711 1 1228 . 1 1 122 122 SER CB C 13 63.77 0.02 . 1 . . . . 122 SER CB . 6711 1 1229 . 1 1 122 122 SER N N 15 117.15 0.02 . 1 . . . . 122 SER N . 6711 1 1230 . 1 1 123 123 VAL H H 1 8.22 0.02 . 1 . . . . 123 VAL H . 6711 1 1231 . 1 1 123 123 VAL HA H 1 3.65 0.02 . 1 . . . . 123 VAL HA . 6711 1 1232 . 1 1 123 123 VAL HB H 1 2.26 0.02 . 1 . . . . 123 VAL HB . 6711 1 1233 . 1 1 123 123 VAL HG11 H 1 0.93 0.02 . 1 . . . . 123 VAL HG1 . 6711 1 1234 . 1 1 123 123 VAL HG12 H 1 0.93 0.02 . 1 . . . . 123 VAL HG1 . 6711 1 1235 . 1 1 123 123 VAL HG13 H 1 0.93 0.02 . 1 . . . . 123 VAL HG1 . 6711 1 1236 . 1 1 123 123 VAL HG21 H 1 0.93 0.02 . 1 . . . . 123 VAL HG2 . 6711 1 1237 . 1 1 123 123 VAL HG22 H 1 0.93 0.02 . 1 . . . . 123 VAL HG2 . 6711 1 1238 . 1 1 123 123 VAL HG23 H 1 0.93 0.02 . 1 . . . . 123 VAL HG2 . 6711 1 1239 . 1 1 123 123 VAL C C 13 177.04 0.02 . 1 . . . . 123 VAL C . 6711 1 1240 . 1 1 123 123 VAL CA C 13 66.46 0.02 . 1 . . . . 123 VAL CA . 6711 1 1241 . 1 1 123 123 VAL CB C 13 30.84 0.02 . 1 . . . . 123 VAL CB . 6711 1 1242 . 1 1 123 123 VAL CG1 C 13 24.0 0.02 . 1 . . . . 123 VAL CG1 . 6711 1 1243 . 1 1 123 123 VAL CG2 C 13 21.9 0.02 . 1 . . . . 123 VAL CG2 . 6711 1 1244 . 1 1 123 123 VAL N N 15 124.16 0.02 . 1 . . . . 123 VAL N . 6711 1 1245 . 1 1 124 124 VAL H H 1 8.06 0.02 . 1 . . . . 124 VAL H . 6711 1 1246 . 1 1 124 124 VAL HA H 1 3.43 0.02 . 1 . . . . 124 VAL HA . 6711 1 1247 . 1 1 124 124 VAL HB H 1 2.19 0.02 . 1 . . . . 124 VAL HB . 6711 1 1248 . 1 1 124 124 VAL HG11 H 1 1.16 0.02 . 1 . . . . 124 VAL HG1 . 6711 1 1249 . 1 1 124 124 VAL HG12 H 1 1.16 0.02 . 1 . . . . 124 VAL HG1 . 6711 1 1250 . 1 1 124 124 VAL HG13 H 1 1.16 0.02 . 1 . . . . 124 VAL HG1 . 6711 1 1251 . 1 1 124 124 VAL HG21 H 1 1.16 0.02 . 1 . . . . 124 VAL HG2 . 6711 1 1252 . 1 1 124 124 VAL HG22 H 1 1.16 0.02 . 1 . . . . 124 VAL HG2 . 6711 1 1253 . 1 1 124 124 VAL HG23 H 1 1.16 0.02 . 1 . . . . 124 VAL HG2 . 6711 1 1254 . 1 1 124 124 VAL C C 13 178.17 0.02 . 1 . . . . 124 VAL C . 6711 1 1255 . 1 1 124 124 VAL CA C 13 68.1 0.02 . 1 . . . . 124 VAL CA . 6711 1 1256 . 1 1 124 124 VAL CB C 13 31.3 0.02 . 1 . . . . 124 VAL CB . 6711 1 1257 . 1 1 124 124 VAL CG1 C 13 22.98 0.02 . 1 . . . . 124 VAL CG1 . 6711 1 1258 . 1 1 124 124 VAL CG2 C 13 20.96 0.02 . 1 . . . . 124 VAL CG2 . 6711 1 1259 . 1 1 124 124 VAL N N 15 120.71 0.02 . 1 . . . . 124 VAL N . 6711 1 1260 . 1 1 125 125 SER H H 1 7.82 0.02 . 1 . . . . 125 SER H . 6711 1 1261 . 1 1 125 125 SER HA H 1 4.28 0.02 . 1 . . . . 125 SER HA . 6711 1 1262 . 1 1 125 125 SER HB2 H 1 3.99 0.02 . 1 . . . . 125 SER HB2 . 6711 1 1263 . 1 1 125 125 SER HB3 H 1 3.99 0.02 . 1 . . . . 125 SER HB3 . 6711 1 1264 . 1 1 125 125 SER C C 13 176.30 0.02 . 1 . . . . 125 SER C . 6711 1 1265 . 1 1 125 125 SER CA C 13 61.4 0.02 . 1 . . . . 125 SER CA . 6711 1 1266 . 1 1 125 125 SER CB C 13 63.0 0.02 . 1 . . . . 125 SER CB . 6711 1 1267 . 1 1 125 125 SER N N 15 113.37 0.02 . 1 . . . . 125 SER N . 6711 1 1268 . 1 1 126 126 MET H H 1 7.88 0.02 . 1 . . . . 126 MET H . 6711 1 1269 . 1 1 126 126 MET HA H 1 4.17 0.02 . 1 . . . . 126 MET HA . 6711 1 1270 . 1 1 126 126 MET HB2 H 1 2.15 0.02 . 1 . . . . 126 MET HB2 . 6711 1 1271 . 1 1 126 126 MET HB3 H 1 2.15 0.02 . 1 . . . . 126 MET HB3 . 6711 1 1272 . 1 1 126 126 MET HG2 H 1 2.56 0.02 . 1 . . . . 126 MET HG2 . 6711 1 1273 . 1 1 126 126 MET HG3 H 1 2.56 0.02 . 1 . . . . 126 MET HG3 . 6711 1 1274 . 1 1 126 126 MET C C 13 178.47 0.02 . 1 . . . . 126 MET C . 6711 1 1275 . 1 1 126 126 MET CA C 13 57.1 0.02 . 1 . . . . 126 MET CA . 6711 1 1276 . 1 1 126 126 MET CB C 13 31.7 0.02 . 1 . . . . 126 MET CB . 6711 1 1277 . 1 1 126 126 MET CG C 13 31.7 0.02 . 1 . . . . 126 MET CG . 6711 1 1278 . 1 1 126 126 MET N N 15 121.41 0.02 . . . . . . 126 MET N . 6711 1 1279 . 1 1 127 127 LEU H H 1 7.82 0.02 . 1 . . . . 127 LEU H . 6711 1 1280 . 1 1 127 127 LEU HA H 1 3.69 0.02 . 1 . . . . 127 LEU HA . 6711 1 1281 . 1 1 127 127 LEU HB2 H 1 2.01 0.02 . 2 . . . . 127 LEU HB2 . 6711 1 1282 . 1 1 127 127 LEU HB3 H 1 1.0 0.02 . 2 . . . . 127 LEU HB3 . 6711 1 1283 . 1 1 127 127 LEU HG H 1 1.58 0.02 . 1 . . . . 127 LEU HG . 6711 1 1284 . 1 1 127 127 LEU HD11 H 1 0.43 0.02 . 1 . . . . 127 LEU HD1 . 6711 1 1285 . 1 1 127 127 LEU HD12 H 1 0.43 0.02 . 1 . . . . 127 LEU HD1 . 6711 1 1286 . 1 1 127 127 LEU HD13 H 1 0.43 0.02 . 1 . . . . 127 LEU HD1 . 6711 1 1287 . 1 1 127 127 LEU HD21 H 1 0.43 0.02 . 1 . . . . 127 LEU HD2 . 6711 1 1288 . 1 1 127 127 LEU HD22 H 1 0.43 0.02 . 1 . . . . 127 LEU HD2 . 6711 1 1289 . 1 1 127 127 LEU HD23 H 1 0.43 0.02 . 1 . . . . 127 LEU HD2 . 6711 1 1290 . 1 1 127 127 LEU C C 13 176.67 0.02 . 1 . . . . 127 LEU C . 6711 1 1291 . 1 1 127 127 LEU CA C 13 57.7 0.02 . 1 . . . . 127 LEU CA . 6711 1 1292 . 1 1 127 127 LEU CB C 13 40.9 0.02 . 1 . . . . 127 LEU CB . 6711 1 1293 . 1 1 127 127 LEU CG C 13 25.96 0.02 . 1 . . . . 127 LEU CG . 6711 1 1294 . 1 1 127 127 LEU CD1 C 13 24.5 0.02 . 2 . . . . 127 LEU CD1 . 6711 1 1295 . 1 1 127 127 LEU CD2 C 13 20.95 0.02 . 2 . . . . 127 LEU CD2 . 6711 1 1296 . 1 1 127 127 LEU N N 15 120.62 0.02 . 1 . . . . 127 LEU N . 6711 1 1297 . 1 1 128 128 ALA H H 1 7.52 0.02 . 1 . . . . 128 ALA H . 6711 1 1298 . 1 1 128 128 ALA HA H 1 4.36 0.02 . 1 . . . . 128 ALA HA . 6711 1 1299 . 1 1 128 128 ALA HB1 H 1 1.59 0.02 . 1 . . . . 128 ALA HB . 6711 1 1300 . 1 1 128 128 ALA HB2 H 1 1.59 0.02 . 1 . . . . 128 ALA HB . 6711 1 1301 . 1 1 128 128 ALA HB3 H 1 1.59 0.02 . 1 . . . . 128 ALA HB . 6711 1 1302 . 1 1 128 128 ALA C C 13 178.09 0.02 . 1 . . . . 128 ALA C . 6711 1 1303 . 1 1 128 128 ALA CA C 13 53.9 0.02 . 1 . . . . 128 ALA CA . 6711 1 1304 . 1 1 128 128 ALA CB C 13 19.53 0.02 . 1 . . . . 128 ALA CB . 6711 1 1305 . 1 1 128 128 ALA N N 15 117.62 0.02 . 1 . . . . 128 ALA N . 6711 1 1306 . 1 1 129 129 GLU H H 1 8.04 0.02 . 1 . . . . 129 GLU H . 6711 1 1307 . 1 1 129 129 GLU HA H 1 4.20 0.02 . 1 . . . . 129 GLU HA . 6711 1 1308 . 1 1 129 129 GLU HB2 H 1 1.94 0.02 . 1 . . . . 129 GLU HB2 . 6711 1 1309 . 1 1 129 129 GLU HB3 H 1 1.94 0.02 . 1 . . . . 129 GLU HB3 . 6711 1 1310 . 1 1 129 129 GLU HG2 H 1 2.2 0.02 . 1 . . . . 129 GLU HG2 . 6711 1 1311 . 1 1 129 129 GLU HG3 H 1 2.2 0.02 . 1 . . . . 129 GLU HG3 . 6711 1 1312 . 1 1 129 129 GLU C C 13 181.20 0.02 . 1 . . . . 129 GLU C . 6711 1 1313 . 1 1 129 129 GLU CA C 13 53.1 0.02 . 1 . . . . 129 GLU CA . 6711 1 1314 . 1 1 129 129 GLU CB C 13 30.7 0.02 . 1 . . . . 129 GLU CB . 6711 1 1315 . 1 1 129 129 GLU N N 15 117.76 0.02 . 1 . . . . 129 GLU N . 6711 1 1316 . 1 1 130 130 PRO HA H 1 4.28 0.02 . 1 . . . . 130 PRO HA . 6711 1 1317 . 1 1 130 130 PRO HB2 H 1 1.92 0.02 . 2 . . . . 130 PRO HB2 . 6711 1 1318 . 1 1 130 130 PRO HB3 H 1 0.87 0.02 . 2 . . . . 130 PRO HB3 . 6711 1 1319 . 1 1 130 130 PRO C C 13 178.86 0.02 . 1 . . . . 130 PRO C . 6711 1 1320 . 1 1 130 130 PRO CA C 13 62.6 0.02 . 1 . . . . 130 PRO CA . 6711 1 1321 . 1 1 130 130 PRO CB C 13 31.1 0.02 . 1 . . . . 130 PRO CB . 6711 1 1322 . 1 1 130 130 PRO CG C 13 25.2 0.02 . 1 . . . . 130 PRO CG . 6711 1 1323 . 1 1 130 130 PRO CD C 13 49.77 0.02 . 1 . . . . 130 PRO CD . 6711 1 1324 . 1 1 131 131 ASN H H 1 8.495 0.02 . 1 . . . . 131 ASN H . 6711 1 1325 . 1 1 131 131 ASN HA H 1 4.62 0.02 . 1 . . . . 131 ASN HA . 6711 1 1326 . 1 1 131 131 ASN HB2 H 1 2.79 0.02 . 1 . . . . 131 ASN HB2 . 6711 1 1327 . 1 1 131 131 ASN HB3 H 1 2.79 0.02 . 1 . . . . 131 ASN HB3 . 6711 1 1328 . 1 1 131 131 ASN C C 13 174.78 0.02 . 1 . . . . 131 ASN C . 6711 1 1329 . 1 1 131 131 ASN CA C 13 52.18 0.02 . 1 . . . . 131 ASN CA . 6711 1 1330 . 1 1 131 131 ASN CB C 13 39.5 0.02 . 1 . . . . 131 ASN CB . 6711 1 1331 . 1 1 131 131 ASN N N 15 118.7 0.02 . 1 . . . . 131 ASN N . 6711 1 1332 . 1 1 132 132 ASP H H 1 8.51 0.02 . 1 . . . . 132 ASP H . 6711 1 1333 . 1 1 132 132 ASP HA H 1 4.40 0.02 . 1 . . . . 132 ASP HA . 6711 1 1334 . 1 1 132 132 ASP HB2 H 1 2.75 0.02 . 2 . . . . 132 ASP HB2 . 6711 1 1335 . 1 1 132 132 ASP HB3 H 1 2.47 0.02 . 2 . . . . 132 ASP HB3 . 6711 1 1336 . 1 1 132 132 ASP C C 13 176.65 0.02 . 1 . . . . 132 ASP C . 6711 1 1337 . 1 1 132 132 ASP CA C 13 54.4 0.02 . 1 . . . . 132 ASP CA . 6711 1 1338 . 1 1 132 132 ASP CB C 13 40.7 0.02 . 1 . . . . 132 ASP CB . 6711 1 1339 . 1 1 132 132 ASP N N 15 120.84 0.02 . 1 . . . . 132 ASP N . 6711 1 1340 . 1 1 133 133 GLU H H 1 8.37 0.02 . 1 . . . . 133 GLU H . 6711 1 1341 . 1 1 133 133 GLU HA H 1 4.13 0.02 . 1 . . . . 133 GLU HA . 6711 1 1342 . 1 1 133 133 GLU HB2 H 1 1.95 0.02 . 1 . . . . 133 GLU HB2 . 6711 1 1343 . 1 1 133 133 GLU HB3 H 1 1.95 0.02 . 1 . . . . 133 GLU HB3 . 6711 1 1344 . 1 1 133 133 GLU HG2 H 1 2.18 0.02 . 1 . . . . 133 GLU HG2 . 6711 1 1345 . 1 1 133 133 GLU HG3 H 1 2.18 0.02 . 1 . . . . 133 GLU HG3 . 6711 1 1346 . 1 1 133 133 GLU C C 13 176.64 0.02 . 1 . . . . 133 GLU C . 6711 1 1347 . 1 1 133 133 GLU CA C 13 57.5 0.02 . 1 . . . . 133 GLU CA . 6711 1 1348 . 1 1 133 133 GLU CB C 13 29.69 0.02 . 1 . . . . 133 GLU CB . 6711 1 1349 . 1 1 133 133 GLU CG C 13 36.3 0.02 . 1 . . . . 133 GLU CG . 6711 1 1350 . 1 1 133 133 GLU N N 15 120.05 0.02 . 1 . . . . 133 GLU N . 6711 1 1351 . 1 1 134 134 SER H H 1 7.63 0.02 . 1 . . . . 134 SER H . 6711 1 1352 . 1 1 134 134 SER HA H 1 4.27 0.02 . 1 . . . . 134 SER HA . 6711 1 1353 . 1 1 134 134 SER HB2 H 1 3.68 0.02 . 1 . . . . 134 SER HB2 . 6711 1 1354 . 1 1 134 134 SER HB3 H 1 3.68 0.02 . 1 . . . . 134 SER HB3 . 6711 1 1355 . 1 1 134 134 SER C C 13 174.93 0.02 . 1 . . . . 134 SER C . 6711 1 1356 . 1 1 134 134 SER CA C 13 57.78 0.02 . 1 . . . . 134 SER CA . 6711 1 1357 . 1 1 134 134 SER CB C 13 64.04 0.02 . 1 . . . . 134 SER CB . 6711 1 1358 . 1 1 134 134 SER N N 15 113.67 0.02 . 1 . . . . 134 SER N . 6711 1 1359 . 1 1 135 135 GLY H H 1 8.20 0.02 . 1 . . . . 135 GLY H . 6711 1 1360 . 1 1 135 135 GLY HA2 H 1 3.80 0.02 . 1 . . . . 135 GLY HA2 . 6711 1 1361 . 1 1 135 135 GLY HA3 H 1 3.55 0.02 . 1 . . . . 135 GLY HA3 . 6711 1 1362 . 1 1 135 135 GLY C C 13 173.6 0.02 . 1 . . . . 135 GLY C . 6711 1 1363 . 1 1 135 135 GLY CA C 13 45.79 0.02 . 1 . . . . 135 GLY CA . 6711 1 1364 . 1 1 135 135 GLY N N 15 111.18 0.02 . 1 . . . . 135 GLY N . 6711 1 1365 . 1 1 136 136 ALA H H 1 7.81 0.02 . 1 . . . . 136 ALA H . 6711 1 1366 . 1 1 136 136 ALA HA H 1 3.63 0.02 . 1 . . . . 136 ALA HA . 6711 1 1367 . 1 1 136 136 ALA HB1 H 1 0.35 0.02 . 1 . . . . 136 ALA HB . 6711 1 1368 . 1 1 136 136 ALA HB2 H 1 0.35 0.02 . 1 . . . . 136 ALA HB . 6711 1 1369 . 1 1 136 136 ALA HB3 H 1 0.35 0.02 . 1 . . . . 136 ALA HB . 6711 1 1370 . 1 1 136 136 ALA C C 13 177.13 0.02 . 1 . . . . 136 ALA C . 6711 1 1371 . 1 1 136 136 ALA CA C 13 54.35 0.02 . 1 . . . . 136 ALA CA . 6711 1 1372 . 1 1 136 136 ALA CB C 13 17.3 0.02 . 1 . . . . 136 ALA CB . 6711 1 1373 . 1 1 136 136 ALA N N 15 125.7 0.02 . 1 . . . . 136 ALA N . 6711 1 1374 . 1 1 137 137 ASN H H 1 7.43 0.02 . 1 . . . . 137 ASN H . 6711 1 1375 . 1 1 137 137 ASN HA H 1 4.80 0.02 . 1 . . . . 137 ASN HA . 6711 1 1376 . 1 1 137 137 ASN HB2 H 1 3.04 0.02 . 1 . . . . 137 ASN HB2 . 6711 1 1377 . 1 1 137 137 ASN HB3 H 1 3.04 0.02 . 1 . . . . 137 ASN HB3 . 6711 1 1378 . 1 1 137 137 ASN C C 13 176.75 0.02 . 1 . . . . 137 ASN C . 6711 1 1379 . 1 1 137 137 ASN CA C 13 51.2 0.02 . 1 . . . . 137 ASN CA . 6711 1 1380 . 1 1 137 137 ASN CB C 13 37.84 0.02 . 1 . . . . 137 ASN CB . 6711 1 1381 . 1 1 137 137 ASN N N 15 112.77 0.02 . 1 . . . . 137 ASN N . 6711 1 1382 . 1 1 138 138 VAL H H 1 8.85 0.02 . 1 . . . . 138 VAL H . 6711 1 1383 . 1 1 138 138 VAL HA H 1 3.71 0.02 . 1 . . . . 138 VAL HA . 6711 1 1384 . 1 1 138 138 VAL HB H 1 2.12 0.02 . 1 . . . . 138 VAL HB . 6711 1 1385 . 1 1 138 138 VAL HG11 H 1 1.01 0.02 . 1 . . . . 138 VAL HG1 . 6711 1 1386 . 1 1 138 138 VAL HG12 H 1 1.01 0.02 . 1 . . . . 138 VAL HG1 . 6711 1 1387 . 1 1 138 138 VAL HG13 H 1 1.01 0.02 . 1 . . . . 138 VAL HG1 . 6711 1 1388 . 1 1 138 138 VAL HG21 H 1 1.01 0.02 . 1 . . . . 138 VAL HG2 . 6711 1 1389 . 1 1 138 138 VAL HG22 H 1 1.01 0.02 . 1 . . . . 138 VAL HG2 . 6711 1 1390 . 1 1 138 138 VAL HG23 H 1 1.01 0.02 . 1 . . . . 138 VAL HG2 . 6711 1 1391 . 1 1 138 138 VAL C C 13 177.76 0.02 . 1 . . . . 138 VAL C . 6711 1 1392 . 1 1 138 138 VAL CA C 13 65.68 0.02 . 1 . . . . 138 VAL CA . 6711 1 1393 . 1 1 138 138 VAL CB C 13 31.74 0.02 . 1 . . . . 138 VAL CB . 6711 1 1394 . 1 1 138 138 VAL CG1 C 13 21.1 0.02 . 1 . . . . 138 VAL CG1 . 6711 1 1395 . 1 1 138 138 VAL CG2 C 13 21.1 0.02 . 1 . . . . 138 VAL CG2 . 6711 1 1396 . 1 1 138 138 VAL N N 15 126.0 0.02 . 1 . . . . 138 VAL N . 6711 1 1397 . 1 1 139 139 ASP H H 1 7.88 0.02 . 1 . . . . 139 ASP H . 6711 1 1398 . 1 1 139 139 ASP HA H 1 4.56 0.02 . 1 . . . . 139 ASP HA . 6711 1 1399 . 1 1 139 139 ASP HB2 H 1 2.85 0.02 . 1 . . . . 139 ASP HB2 . 6711 1 1400 . 1 1 139 139 ASP HB3 H 1 2.85 0.02 . 1 . . . . 139 ASP HB3 . 6711 1 1401 . 1 1 139 139 ASP C C 13 179.27 0.02 . 1 . . . . 139 ASP C . 6711 1 1402 . 1 1 139 139 ASP CA C 13 57.5 0.02 . 1 . . . . 139 ASP CA . 6711 1 1403 . 1 1 139 139 ASP CB C 13 40.2 0.02 . 1 . . . . 139 ASP CB . 6711 1 1404 . 1 1 139 139 ASP N N 15 120.73 0.02 . 1 . . . . 139 ASP N . 6711 1 1405 . 1 1 140 140 ALA H H 1 7.39 0.02 . 1 . . . . 140 ALA H . 6711 1 1406 . 1 1 140 140 ALA HA H 1 3.87 0.02 . 1 . . . . 140 ALA HA . 6711 1 1407 . 1 1 140 140 ALA HB1 H 1 0.12 0.02 . 1 . . . . 140 ALA HB . 6711 1 1408 . 1 1 140 140 ALA HB2 H 1 0.12 0.02 . 1 . . . . 140 ALA HB . 6711 1 1409 . 1 1 140 140 ALA HB3 H 1 0.12 0.02 . 1 . . . . 140 ALA HB . 6711 1 1410 . 1 1 140 140 ALA C C 13 178.87 0.02 . 1 . . . . 140 ALA C . 6711 1 1411 . 1 1 140 140 ALA CA C 13 54.5 0.02 . 1 . . . . 140 ALA CA . 6711 1 1412 . 1 1 140 140 ALA CB C 13 16.38 0.02 . 1 . . . . 140 ALA CB . 6711 1 1413 . 1 1 140 140 ALA N N 15 121.8 0.02 . 1 . . . . 140 ALA N . 6711 1 1414 . 1 1 141 141 SER H H 1 8.30 0.02 . 1 . . . . 141 SER H . 6711 1 1415 . 1 1 141 141 SER HA H 1 3.92 0.02 . 1 . . . . 141 SER HA . 6711 1 1416 . 1 1 141 141 SER C C 13 177.77 0.02 . 1 . . . . 141 SER C . 6711 1 1417 . 1 1 141 141 SER CA C 13 62.76 0.02 . 1 . . . . 141 SER CA . 6711 1 1418 . 1 1 141 141 SER CB C 13 63.7 0.02 . 1 . . . . 141 SER CB . 6711 1 1419 . 1 1 141 141 SER N N 15 114.97 0.02 . 1 . . . . 141 SER N . 6711 1 1420 . 1 1 142 142 LYS H H 1 8.10 0.02 . 1 . . . . 142 LYS H . 6711 1 1421 . 1 1 142 142 LYS HA H 1 3.96 0.02 . 1 . . . . 142 LYS HA . 6711 1 1422 . 1 1 142 142 LYS HB2 H 1 1.95 0.02 . 1 . . . . 142 LYS HB2 . 6711 1 1423 . 1 1 142 142 LYS HB3 H 1 1.95 0.02 . 1 . . . . 142 LYS HB3 . 6711 1 1424 . 1 1 142 142 LYS HG2 H 1 1.43 0.02 . 1 . . . . 142 LYS HG2 . 6711 1 1425 . 1 1 142 142 LYS HG3 H 1 1.43 0.02 . 1 . . . . 142 LYS HG3 . 6711 1 1426 . 1 1 142 142 LYS HD2 H 1 1.65 0.02 . 1 . . . . 142 LYS HD2 . 6711 1 1427 . 1 1 142 142 LYS HD3 H 1 1.65 0.02 . 1 . . . . 142 LYS HD3 . 6711 1 1428 . 1 1 142 142 LYS HE2 H 1 2.98 0.02 . 1 . . . . 142 LYS HE2 . 6711 1 1429 . 1 1 142 142 LYS HE3 H 1 2.98 0.02 . 1 . . . . 142 LYS HE3 . 6711 1 1430 . 1 1 142 142 LYS C C 13 177.76 0.02 . 1 . . . . 142 LYS C . 6711 1 1431 . 1 1 142 142 LYS CA C 13 59.4 0.02 . 1 . . . . 142 LYS CA . 6711 1 1432 . 1 1 142 142 LYS CB C 13 32.2 0.02 . 1 . . . . 142 LYS CB . 6711 1 1433 . 1 1 142 142 LYS CG C 13 25.0 0.02 . 1 . . . . 142 LYS CG . 6711 1 1434 . 1 1 142 142 LYS CD C 13 29.2 0.02 . 1 . . . . 142 LYS CD . 6711 1 1435 . 1 1 142 142 LYS CE C 13 42.1 0.02 . 1 . . . . 142 LYS CE . 6711 1 1436 . 1 1 142 142 LYS N N 15 120.67 0.02 . 1 . . . . 142 LYS N . 6711 1 1437 . 1 1 143 143 MET H H 1 7.81 0.02 . 1 . . . . 143 MET H . 6711 1 1438 . 1 1 143 143 MET HA H 1 4.1 0.02 . 1 . . . . 143 MET HA . 6711 1 1439 . 1 1 143 143 MET HB2 H 1 2.68 0.02 . 1 . . . . 143 MET HB2 . 6711 1 1440 . 1 1 143 143 MET HB3 H 1 2.68 0.02 . 1 . . . . 143 MET HB3 . 6711 1 1441 . 1 1 143 143 MET HG2 H 1 2.90 0.02 . 1 . . . . 143 MET HG2 . 6711 1 1442 . 1 1 143 143 MET HG3 H 1 2.90 0.02 . 1 . . . . 143 MET HG3 . 6711 1 1443 . 1 1 143 143 MET HE1 H 1 2.2 0.02 . 1 . . . . 143 MET HE . 6711 1 1444 . 1 1 143 143 MET HE2 H 1 2.2 0.02 . 1 . . . . 143 MET HE . 6711 1 1445 . 1 1 143 143 MET HE3 H 1 2.2 0.02 . 1 . . . . 143 MET HE . 6711 1 1446 . 1 1 143 143 MET C C 13 177.9 0.02 . 1 . . . . 143 MET C . 6711 1 1447 . 1 1 143 143 MET CA C 13 58.9 0.02 . 1 . . . . 143 MET CA . 6711 1 1448 . 1 1 143 143 MET CB C 13 34.2 0.02 . 1 . . . . 143 MET CB . 6711 1 1449 . 1 1 143 143 MET CG C 13 32.1 0.02 . 1 . . . . 143 MET CG . 6711 1 1450 . 1 1 143 143 MET N N 15 118.47 0.02 . 1 . . . . 143 MET N . 6711 1 1451 . 1 1 144 144 TRP H H 1 8.58 0.02 . 1 . . . . 144 TRP H . 6711 1 1452 . 1 1 144 144 TRP HA H 1 3.54 0.02 . 1 . . . . 144 TRP HA . 6711 1 1453 . 1 1 144 144 TRP HB2 H 1 3.00 0.02 . 2 . . . . 144 TRP HB2 . 6711 1 1454 . 1 1 144 144 TRP HB3 H 1 2.64 0.02 . 2 . . . . 144 TRP HB3 . 6711 1 1455 . 1 1 144 144 TRP C C 13 176.55 0.02 . 1 . . . . 144 TRP C . 6711 1 1456 . 1 1 144 144 TRP CA C 13 60.4 0.02 . 1 . . . . 144 TRP CA . 6711 1 1457 . 1 1 144 144 TRP CB C 13 28.9 0.02 . 1 . . . . 144 TRP CB . 6711 1 1458 . 1 1 144 144 TRP N N 15 117.76 0.02 . 1 . . . . 144 TRP N . 6711 1 1459 . 1 1 145 145 ARG H H 1 7.41 0.02 . 1 . . . . 145 ARG H . 6711 1 1460 . 1 1 145 145 ARG HA H 1 3.87 0.02 . 1 . . . . 145 ARG HA . 6711 1 1461 . 1 1 145 145 ARG HB2 H 1 1.86 0.02 . 1 . . . . 145 ARG HB2 . 6711 1 1462 . 1 1 145 145 ARG HB3 H 1 1.86 0.02 . 1 . . . . 145 ARG HB3 . 6711 1 1463 . 1 1 145 145 ARG HG2 H 1 1.61 0.02 . 1 . . . . 145 ARG HG2 . 6711 1 1464 . 1 1 145 145 ARG HG3 H 1 1.61 0.02 . 1 . . . . 145 ARG HG3 . 6711 1 1465 . 1 1 145 145 ARG HD2 H 1 3.21 0.02 . 1 . . . . 145 ARG HD2 . 6711 1 1466 . 1 1 145 145 ARG HD3 H 1 3.21 0.02 . 1 . . . . 145 ARG HD3 . 6711 1 1467 . 1 1 145 145 ARG C C 13 178.58 0.02 . 1 . . . . 145 ARG C . 6711 1 1468 . 1 1 145 145 ARG CA C 13 58.47 0.02 . 1 . . . . 145 ARG CA . 6711 1 1469 . 1 1 145 145 ARG CB C 13 31.29 0.02 . 1 . . . . 145 ARG CB . 6711 1 1470 . 1 1 145 145 ARG CG C 13 27.05 0.02 . 1 . . . . 145 ARG CG . 6711 1 1471 . 1 1 145 145 ARG CD C 13 43.4 0.02 . 1 . . . . 145 ARG CD . 6711 1 1472 . 1 1 145 145 ARG N N 15 114.3 0.02 . 1 . . . . 145 ARG N . 6711 1 1473 . 1 1 146 146 ASP H H 1 8.55 0.02 . 1 . . . . 146 ASP H . 6711 1 1474 . 1 1 146 146 ASP HA H 1 4.68 0.02 . 1 . . . . 146 ASP HA . 6711 1 1475 . 1 1 146 146 ASP HB2 H 1 2.65 0.02 . 1 . . . . 146 ASP HB2 . 6711 1 1476 . 1 1 146 146 ASP HB3 H 1 2.65 0.02 . 1 . . . . 146 ASP HB3 . 6711 1 1477 . 1 1 146 146 ASP C C 13 176.72 0.02 . 1 . . . . 146 ASP C . 6711 1 1478 . 1 1 146 146 ASP CA C 13 55.66 0.02 . 1 . . . . 146 ASP CA . 6711 1 1479 . 1 1 146 146 ASP CB C 13 41.8 0.02 . 1 . . . . 146 ASP CB . 6711 1 1480 . 1 1 146 146 ASP N N 15 116.3 0.02 . 1 . . . . 146 ASP N . 6711 1 1481 . 1 1 147 147 ASP H H 1 8.85 0.02 . 1 . . . . 147 ASP H . 6711 1 1482 . 1 1 147 147 ASP HA H 1 2.95 0.02 . 1 . . . . 147 ASP HA . 6711 1 1483 . 1 1 147 147 ASP HB2 H 1 2.37 0.02 . 1 . . . . 147 ASP HB2 . 6711 1 1484 . 1 1 147 147 ASP HB3 H 1 2.37 0.02 . 1 . . . . 147 ASP HB3 . 6711 1 1485 . 1 1 147 147 ASP C C 13 174.87 0.02 . 1 . . . . 147 ASP C . 6711 1 1486 . 1 1 147 147 ASP CA C 13 52.28 0.02 . 1 . . . . 147 ASP CA . 6711 1 1487 . 1 1 147 147 ASP CB C 13 39.97 0.02 . 1 . . . . 147 ASP CB . 6711 1 1488 . 1 1 147 147 ASP N N 15 123.5 0.02 . 1 . . . . 147 ASP N . 6711 1 1489 . 1 1 148 148 ARG H H 1 8.41 0.02 . 1 . . . . 148 ARG H . 6711 1 1490 . 1 1 148 148 ARG HA H 1 3.5 0.02 . 1 . . . . 148 ARG HA . 6711 1 1491 . 1 1 148 148 ARG HB2 H 1 1.53 0.02 . 1 . . . . 148 ARG HB2 . 6711 1 1492 . 1 1 148 148 ARG HB3 H 1 1.53 0.02 . 1 . . . . 148 ARG HB3 . 6711 1 1493 . 1 1 148 148 ARG HG2 H 1 1.23 0.02 . 1 . . . . 148 ARG HG2 . 6711 1 1494 . 1 1 148 148 ARG HG3 H 1 1.23 0.02 . 1 . . . . 148 ARG HG3 . 6711 1 1495 . 1 1 148 148 ARG HD2 H 1 2.16 0.02 . 1 . . . . 148 ARG HD2 . 6711 1 1496 . 1 1 148 148 ARG HD3 H 1 2.16 0.02 . 1 . . . . 148 ARG HD3 . 6711 1 1497 . 1 1 148 148 ARG C C 13 177.58 0.02 . 1 . . . . 148 ARG C . 6711 1 1498 . 1 1 148 148 ARG CA C 13 58.47 0.02 . 1 . . . . 148 ARG CA . 6711 1 1499 . 1 1 148 148 ARG CB C 13 28.8 0.02 . 1 . . . . 148 ARG CB . 6711 1 1500 . 1 1 148 148 ARG CG C 13 25.9 0.02 . 1 . . . . 148 ARG CG . 6711 1 1501 . 1 1 148 148 ARG CD C 13 41.2 0.02 . 1 . . . . 148 ARG CD . 6711 1 1502 . 1 1 148 148 ARG N N 15 124.85 0.02 . 1 . . . . 148 ARG N . 6711 1 1503 . 1 1 149 149 GLU H H 1 8.40 0.02 . 1 . . . . 149 GLU H . 6711 1 1504 . 1 1 149 149 GLU HA H 1 3.96 0.02 . 1 . . . . 149 GLU HA . 6711 1 1505 . 1 1 149 149 GLU HB2 H 1 2.04 0.02 . 1 . . . . 149 GLU HB2 . 6711 1 1506 . 1 1 149 149 GLU HB3 H 1 2.04 0.02 . 1 . . . . 149 GLU HB3 . 6711 1 1507 . 1 1 149 149 GLU HG2 H 1 2.29 0.02 . 1 . . . . 149 GLU HG2 . 6711 1 1508 . 1 1 149 149 GLU HG3 H 1 2.29 0.02 . 1 . . . . 149 GLU HG3 . 6711 1 1509 . 1 1 149 149 GLU C C 13 179.76 0.02 . 1 . . . . 149 GLU C . 6711 1 1510 . 1 1 149 149 GLU CA C 13 59.5 0.02 . 1 . . . . 149 GLU CA . 6711 1 1511 . 1 1 149 149 GLU CB C 13 29.0 0.02 . 1 . . . . 149 GLU CB . 6711 1 1512 . 1 1 149 149 GLU CG C 13 36.4 0.02 . 1 . . . . 149 GLU CG . 6711 1 1513 . 1 1 149 149 GLU N N 15 114.78 0.02 . 1 . . . . 149 GLU N . 6711 1 1514 . 1 1 150 150 GLN H H 1 7.48 0.02 . 1 . . . . 150 GLN H . 6711 1 1515 . 1 1 150 150 GLN HA H 1 4.08 0.02 . 1 . . . . 150 GLN HA . 6711 1 1516 . 1 1 150 150 GLN HB2 H 1 2.14 0.02 . 1 . . . . 150 GLN HB2 . 6711 1 1517 . 1 1 150 150 GLN HB3 H 1 2.14 0.02 . 1 . . . . 150 GLN HB3 . 6711 1 1518 . 1 1 150 150 GLN HG2 H 1 2.49 0.02 . 1 . . . . 150 GLN HG2 . 6711 1 1519 . 1 1 150 150 GLN HG3 H 1 2.49 0.02 . 1 . . . . 150 GLN HG3 . 6711 1 1520 . 1 1 150 150 GLN C C 13 177.78 0.02 . 1 . . . . 150 GLN C . 6711 1 1521 . 1 1 150 150 GLN CA C 13 58.1 0.02 . 1 . . . . 150 GLN CA . 6711 1 1522 . 1 1 150 150 GLN CB C 13 27.6 0.02 . 1 . . . . 150 GLN CB . 6711 1 1523 . 1 1 150 150 GLN CG C 13 33.9 0.02 . 1 . . . . 150 GLN CG . 6711 1 1524 . 1 1 150 150 GLN N N 15 120.8 0.02 . 1 . . . . 150 GLN N . 6711 1 1525 . 1 1 151 151 PHE H H 1 8.10 0.02 . 1 . . . . 151 PHE H . 6711 1 1526 . 1 1 151 151 PHE HA H 1 4.06 0.02 . 1 . . . . 151 PHE HA . 6711 1 1527 . 1 1 151 151 PHE HB2 H 1 3.59 0.02 . 2 . . . . 151 PHE HB2 . 6711 1 1528 . 1 1 151 151 PHE HB3 H 1 2.68 0.02 . 2 . . . . 151 PHE HB3 . 6711 1 1529 . 1 1 151 151 PHE C C 13 177.32 0.02 . 1 . . . . 151 PHE C . 6711 1 1530 . 1 1 151 151 PHE CA C 13 62.7 0.02 . 1 . . . . 151 PHE CA . 6711 1 1531 . 1 1 151 151 PHE CB C 13 38.84 0.02 . 1 . . . . 151 PHE CB . 6711 1 1532 . 1 1 151 151 PHE N N 15 121.0 0.02 . 1 . . . . 151 PHE N . 6711 1 1533 . 1 1 152 152 TYR H H 1 8.66 0.02 . 1 . . . . 152 TYR H . 6711 1 1534 . 1 1 152 152 TYR HA H 1 4.45 0.02 . 1 . . . . 152 TYR HA . 6711 1 1535 . 1 1 152 152 TYR HB2 H 1 3.23 0.02 . 1 . . . . 152 TYR HB2 . 6711 1 1536 . 1 1 152 152 TYR HB3 H 1 3.23 0.02 . 1 . . . . 152 TYR HB3 . 6711 1 1537 . 1 1 152 152 TYR C C 13 178.6 0.02 . 1 . . . . 152 TYR C . 6711 1 1538 . 1 1 152 152 TYR CA C 13 58.9 0.02 . 1 . . . . 152 TYR CA . 6711 1 1539 . 1 1 152 152 TYR CB C 13 36.84 0.02 . 1 . . . . 152 TYR CB . 6711 1 1540 . 1 1 152 152 TYR N N 15 117.4 0.02 . 1 . . . . 152 TYR N . 6711 1 1541 . 1 1 153 153 LYS H H 1 7.63 0.02 . 1 . . . . 153 LYS H . 6711 1 1542 . 1 1 153 153 LYS HA H 1 4.03 0.02 . 1 . . . . 153 LYS HA . 6711 1 1543 . 1 1 153 153 LYS HB2 H 1 2.00 0.02 . 1 . . . . 153 LYS HB2 . 6711 1 1544 . 1 1 153 153 LYS HB3 H 1 2.00 0.02 . 1 . . . . 153 LYS HB3 . 6711 1 1545 . 1 1 153 153 LYS HG2 H 1 1.36 0.02 . 1 . . . . 153 LYS HG2 . 6711 1 1546 . 1 1 153 153 LYS HG3 H 1 1.36 0.02 . 1 . . . . 153 LYS HG3 . 6711 1 1547 . 1 1 153 153 LYS HD2 H 1 1.67 0.02 . 1 . . . . 153 LYS HD2 . 6711 1 1548 . 1 1 153 153 LYS HD3 H 1 1.67 0.02 . 1 . . . . 153 LYS HD3 . 6711 1 1549 . 1 1 153 153 LYS HE2 H 1 2.89 0.02 . 1 . . . . 153 LYS HE2 . 6711 1 1550 . 1 1 153 153 LYS HE3 H 1 2.89 0.02 . 1 . . . . 153 LYS HE3 . 6711 1 1551 . 1 1 153 153 LYS C C 13 179.7 0.02 . 1 . . . . 153 LYS C . 6711 1 1552 . 1 1 153 153 LYS CA C 13 59.98 0.02 . 1 . . . . 153 LYS CA . 6711 1 1553 . 1 1 153 153 LYS CB C 13 32.3 0.02 . 1 . . . . 153 LYS CB . 6711 1 1554 . 1 1 153 153 LYS CG C 13 25.2 0.02 . 1 . . . . 153 LYS CG . 6711 1 1555 . 1 1 153 153 LYS CD C 13 29.5 0.02 . 1 . . . . 153 LYS CD . 6711 1 1556 . 1 1 153 153 LYS CE C 13 42.0 0.02 . 1 . . . . 153 LYS CE . 6711 1 1557 . 1 1 153 153 LYS N N 15 119.98 0.02 . 1 . . . . 153 LYS N . 6711 1 1558 . 1 1 154 154 ILE H H 1 8.08 0.02 . 1 . . . . 154 ILE H . 6711 1 1559 . 1 1 154 154 ILE HA H 1 3.55 0.02 . 1 . . . . 154 ILE HA . 6711 1 1560 . 1 1 154 154 ILE HB H 1 1.57 0.02 . 1 . . . . 154 ILE HB . 6711 1 1561 . 1 1 154 154 ILE HG21 H 1 0.425 0.02 . 4 . . . . 154 ILE HG2 . 6711 1 1562 . 1 1 154 154 ILE HG22 H 1 0.425 0.02 . 4 . . . . 154 ILE HG2 . 6711 1 1563 . 1 1 154 154 ILE HG23 H 1 0.425 0.02 . 4 . . . . 154 ILE HG2 . 6711 1 1564 . 1 1 154 154 ILE HD11 H 1 0.195 0.02 . 4 . . . . 154 ILE HD1 . 6711 1 1565 . 1 1 154 154 ILE HD12 H 1 0.195 0.02 . 4 . . . . 154 ILE HD1 . 6711 1 1566 . 1 1 154 154 ILE HD13 H 1 0.195 0.02 . 4 . . . . 154 ILE HD1 . 6711 1 1567 . 1 1 154 154 ILE C C 13 178.4 0.02 . 1 . . . . 154 ILE C . 6711 1 1568 . 1 1 154 154 ILE CA C 13 64.17 0.02 . 1 . . . . 154 ILE CA . 6711 1 1569 . 1 1 154 154 ILE CB C 13 36.97 0.02 . 1 . . . . 154 ILE CB . 6711 1 1570 . 1 1 154 154 ILE CG1 C 13 28.2 0.02 . 1 . . . . 154 ILE CG1 . 6711 1 1571 . 1 1 154 154 ILE CG2 C 13 16.9 0.02 . 1 . . . . 154 ILE CG2 . 6711 1 1572 . 1 1 154 154 ILE CD1 C 13 12.76 0.02 . 1 . . . . 154 ILE CD1 . 6711 1 1573 . 1 1 154 154 ILE N N 15 122.3 0.02 . 1 . . . . 154 ILE N . 6711 1 1574 . 1 1 155 155 ALA H H 1 8.8 0.02 . 1 . . . . 155 ALA H . 6711 1 1575 . 1 1 155 155 ALA HA H 1 3.88 0.02 . 1 . . . . 155 ALA HA . 6711 1 1576 . 1 1 155 155 ALA HB1 H 1 0.95 0.02 . 1 . . . . 155 ALA HB . 6711 1 1577 . 1 1 155 155 ALA HB2 H 1 0.95 0.02 . 1 . . . . 155 ALA HB . 6711 1 1578 . 1 1 155 155 ALA HB3 H 1 0.95 0.02 . 1 . . . . 155 ALA HB . 6711 1 1579 . 1 1 155 155 ALA C C 13 179.36 0.02 . 1 . . . . 155 ALA C . 6711 1 1580 . 1 1 155 155 ALA CA C 13 55.6 0.02 . 1 . . . . 155 ALA CA . 6711 1 1581 . 1 1 155 155 ALA CB C 13 18.7 0.02 . 1 . . . . 155 ALA CB . 6711 1 1582 . 1 1 155 155 ALA N N 15 123.55 0.02 . 1 . . . . 155 ALA N . 6711 1 1583 . 1 1 156 156 LYS H H 1 7.86 0.02 . 1 . . . . 156 LYS H . 6711 1 1584 . 1 1 156 156 LYS HA H 1 4.09 0.02 . 1 . . . . 156 LYS HA . 6711 1 1585 . 1 1 156 156 LYS HB2 H 1 1.98 0.02 . 1 . . . . 156 LYS HB2 . 6711 1 1586 . 1 1 156 156 LYS HB3 H 1 1.98 0.02 . 1 . . . . 156 LYS HB3 . 6711 1 1587 . 1 1 156 156 LYS HG2 H 1 1.52 0.02 . 1 . . . . 156 LYS HG2 . 6711 1 1588 . 1 1 156 156 LYS HG3 H 1 1.52 0.02 . 1 . . . . 156 LYS HG3 . 6711 1 1589 . 1 1 156 156 LYS HD2 H 1 1.66 0.02 . 1 . . . . 156 LYS HD2 . 6711 1 1590 . 1 1 156 156 LYS HD3 H 1 1.66 0.02 . 1 . . . . 156 LYS HD3 . 6711 1 1591 . 1 1 156 156 LYS HE2 H 1 2.96 0.02 . 1 . . . . 156 LYS HE2 . 6711 1 1592 . 1 1 156 156 LYS HE3 H 1 2.96 0.02 . 1 . . . . 156 LYS HE3 . 6711 1 1593 . 1 1 156 156 LYS C C 13 179.7 0.02 . 1 . . . . 156 LYS C . 6711 1 1594 . 1 1 156 156 LYS CA C 13 59.4 0.02 . 1 . . . . 156 LYS CA . 6711 1 1595 . 1 1 156 156 LYS CB C 13 31.9 0.02 . 1 . . . . 156 LYS CB . 6711 1 1596 . 1 1 156 156 LYS CG C 13 25.5 0.02 . 1 . . . . 156 LYS CG . 6711 1 1597 . 1 1 156 156 LYS CD C 13 29.1 0.02 . 1 . . . . 156 LYS CD . 6711 1 1598 . 1 1 156 156 LYS CE C 13 42.1 0.02 . 1 . . . . 156 LYS CE . 6711 1 1599 . 1 1 156 156 LYS N N 15 115.84 0.02 . 1 . . . . 156 LYS N . 6711 1 1600 . 1 1 157 157 GLN H H 1 7.57 0.02 . 1 . . . . 157 GLN H . 6711 1 1601 . 1 1 157 157 GLN HA H 1 4.15 0.02 . 1 . . . . 157 GLN HA . 6711 1 1602 . 1 1 157 157 GLN HB2 H 1 2.12 0.02 . 1 . . . . 157 GLN HB2 . 6711 1 1603 . 1 1 157 157 GLN HB3 H 1 2.12 0.02 . 1 . . . . 157 GLN HB3 . 6711 1 1604 . 1 1 157 157 GLN HG2 H 1 2.56 0.02 . 2 . . . . 157 GLN HG2 . 6711 1 1605 . 1 1 157 157 GLN HG3 H 1 2.35 0.02 . 2 . . . . 157 GLN HG3 . 6711 1 1606 . 1 1 157 157 GLN C C 13 178.8 0.02 . 1 . . . . 157 GLN C . 6711 1 1607 . 1 1 157 157 GLN CA C 13 58.7 0.02 . 1 . . . . 157 GLN CA . 6711 1 1608 . 1 1 157 157 GLN CB C 13 28.0 0.02 . 1 . . . . 157 GLN CB . 6711 1 1609 . 1 1 157 157 GLN CG C 13 33.8 0.02 . 1 . . . . 157 GLN CG . 6711 1 1610 . 1 1 157 157 GLN N N 15 120.1 0.02 . 1 . . . . 157 GLN N . 6711 1 1611 . 1 1 158 158 ILE H H 1 8.47 0.02 . 1 . . . . 158 ILE H . 6711 1 1612 . 1 1 158 158 ILE HA H 1 3.82 0.02 . 1 . . . . 158 ILE HA . 6711 1 1613 . 1 1 158 158 ILE HB H 1 2.73 0.02 . 1 . . . . 158 ILE HB . 6711 1 1614 . 1 1 158 158 ILE HG12 H 1 1.17 0.02 . 2 . . . . 158 ILE HG12 . 6711 1 1615 . 1 1 158 158 ILE HG13 H 1 1.25 0.02 . 2 . . . . 158 ILE HG13 . 6711 1 1616 . 1 1 158 158 ILE HG21 H 1 0.66 0.02 . 4 . . . . 158 ILE HG2 . 6711 1 1617 . 1 1 158 158 ILE HG22 H 1 0.66 0.02 . 4 . . . . 158 ILE HG2 . 6711 1 1618 . 1 1 158 158 ILE HG23 H 1 0.66 0.02 . 4 . . . . 158 ILE HG2 . 6711 1 1619 . 1 1 158 158 ILE HD11 H 1 0.66 0.02 . 4 . . . . 158 ILE HD1 . 6711 1 1620 . 1 1 158 158 ILE HD12 H 1 0.66 0.02 . 4 . . . . 158 ILE HD1 . 6711 1 1621 . 1 1 158 158 ILE HD13 H 1 0.66 0.02 . 4 . . . . 158 ILE HD1 . 6711 1 1622 . 1 1 158 158 ILE C C 13 180.23 0.02 . 1 . . . . 158 ILE C . 6711 1 1623 . 1 1 158 158 ILE CA C 13 62.7 0.02 . 1 . . . . 158 ILE CA . 6711 1 1624 . 1 1 158 158 ILE CB C 13 36.0 0.02 . 1 . . . . 158 ILE CB . 6711 1 1625 . 1 1 158 158 ILE CG1 C 13 27.8 0.02 . 1 . . . . 158 ILE CG1 . 6711 1 1626 . 1 1 158 158 ILE CG2 C 13 17.8 0.02 . 1 . . . . 158 ILE CG2 . 6711 1 1627 . 1 1 158 158 ILE CD1 C 13 10.15 0.02 . 1 . . . . 158 ILE CD1 . 6711 1 1628 . 1 1 158 158 ILE N N 15 122.8 0.02 . 1 . . . . 158 ILE N . 6711 1 1629 . 1 1 159 159 VAL H H 1 8.79 0.02 . 1 . . . . 159 VAL H . 6711 1 1630 . 1 1 159 159 VAL HA H 1 3.72 0.02 . 1 . . . . 159 VAL HA . 6711 1 1631 . 1 1 159 159 VAL HB H 1 2.49 0.02 . 1 . . . . 159 VAL HB . 6711 1 1632 . 1 1 159 159 VAL HG11 H 1 1.4 0.02 . 2 . . . . 159 VAL HG1 . 6711 1 1633 . 1 1 159 159 VAL HG12 H 1 1.4 0.02 . 2 . . . . 159 VAL HG1 . 6711 1 1634 . 1 1 159 159 VAL HG13 H 1 1.4 0.02 . 2 . . . . 159 VAL HG1 . 6711 1 1635 . 1 1 159 159 VAL HG21 H 1 0.97 0.02 . 2 . . . . 159 VAL HG2 . 6711 1 1636 . 1 1 159 159 VAL HG22 H 1 0.97 0.02 . 2 . . . . 159 VAL HG2 . 6711 1 1637 . 1 1 159 159 VAL HG23 H 1 0.97 0.02 . 2 . . . . 159 VAL HG2 . 6711 1 1638 . 1 1 159 159 VAL C C 13 179.3 0.02 . 1 . . . . 159 VAL C . 6711 1 1639 . 1 1 159 159 VAL CA C 13 67.6 0.02 . 1 . . . . 159 VAL CA . 6711 1 1640 . 1 1 159 159 VAL CB C 13 31.3 0.02 . 1 . . . . 159 VAL CB . 6711 1 1641 . 1 1 159 159 VAL CG1 C 13 23.2 0.02 . 2 . . . . 159 VAL CG1 . 6711 1 1642 . 1 1 159 159 VAL CG2 C 13 19.66 0.02 . 2 . . . . 159 VAL CG2 . 6711 1 1643 . 1 1 159 159 VAL N N 15 123.06 0.02 . 1 . . . . 159 VAL N . 6711 1 1644 . 1 1 160 160 GLN H H 1 8.36 0.02 . 1 . . . . 160 GLN H . 6711 1 1645 . 1 1 160 160 GLN HA H 1 3.94 0.02 . 1 . . . . 160 GLN HA . 6711 1 1646 . 1 1 160 160 GLN HB2 H 1 2.2 0.02 . 1 . . . . 160 GLN HB2 . 6711 1 1647 . 1 1 160 160 GLN HB3 H 1 2.2 0.02 . 1 . . . . 160 GLN HB3 . 6711 1 1648 . 1 1 160 160 GLN HG2 H 1 2.47 0.02 . 1 . . . . 160 GLN HG2 . 6711 1 1649 . 1 1 160 160 GLN HG3 H 1 2.47 0.02 . 1 . . . . 160 GLN HG3 . 6711 1 1650 . 1 1 160 160 GLN C C 13 178.87 0.02 . 1 . . . . 160 GLN C . 6711 1 1651 . 1 1 160 160 GLN CA C 13 59.5 0.02 . 1 . . . . 160 GLN CA . 6711 1 1652 . 1 1 160 160 GLN CB C 13 32.4 0.02 . 1 . . . . 160 GLN CB . 6711 1 1653 . 1 1 160 160 GLN CG C 13 33.7 0.02 . 1 . . . . 160 GLN CG . 6711 1 1654 . 1 1 160 160 GLN N N 15 119.9 0.02 . 1 . . . . 160 GLN N . 6711 1 1655 . 1 1 161 161 LYS H H 1 8.55 0.02 . 1 . . . . 161 LYS H . 6711 1 1656 . 1 1 161 161 LYS HA H 1 4.23 0.02 . 1 . . . . 161 LYS HA . 6711 1 1657 . 1 1 161 161 LYS HB2 H 1 1.98 0.02 . 1 . . . . 161 LYS HB2 . 6711 1 1658 . 1 1 161 161 LYS HB3 H 1 1.98 0.02 . 1 . . . . 161 LYS HB3 . 6711 1 1659 . 1 1 161 161 LYS HD2 H 1 1.625 0.02 . 1 . . . . 161 LYS HD2 . 6711 1 1660 . 1 1 161 161 LYS HD3 H 1 1.625 0.02 . 1 . . . . 161 LYS HD3 . 6711 1 1661 . 1 1 161 161 LYS HE2 H 1 2.90 0.02 . 1 . . . . 161 LYS HE2 . 6711 1 1662 . 1 1 161 161 LYS HE3 H 1 2.90 0.02 . 1 . . . . 161 LYS HE3 . 6711 1 1663 . 1 1 161 161 LYS C C 13 180.58 0.02 . 1 . . . . 161 LYS C . 6711 1 1664 . 1 1 161 161 LYS CA C 13 59.2 0.02 . 1 . . . . 161 LYS CA . 6711 1 1665 . 1 1 161 161 LYS CB C 13 32.4 0.02 . 1 . . . . 161 LYS CB . 6711 1 1666 . 1 1 161 161 LYS CG C 13 25.4 0.02 . 1 . . . . 161 LYS CG . 6711 1 1667 . 1 1 161 161 LYS CD C 13 29.3 0.02 . 1 . . . . 161 LYS CD . 6711 1 1668 . 1 1 161 161 LYS CE C 13 41.9 0.02 . 1 . . . . 161 LYS CE . 6711 1 1669 . 1 1 161 161 LYS N N 15 118.7 0.02 . 1 . . . . 161 LYS N . 6711 1 1670 . 1 1 162 162 SER H H 1 8.255 0.02 . 1 . . . . 162 SER H . 6711 1 1671 . 1 1 162 162 SER HA H 1 4.42 0.02 . 1 . . . . 162 SER HA . 6711 1 1672 . 1 1 162 162 SER HB2 H 1 2.85 0.02 . 1 . . . . 162 SER HB2 . 6711 1 1673 . 1 1 162 162 SER HB3 H 1 2.85 0.02 . 1 . . . . 162 SER HB3 . 6711 1 1674 . 1 1 162 162 SER HG H 1 5.88 0.02 . 1 . . . . 162 SER HG . 6711 1 1675 . 1 1 162 162 SER C C 13 175.02 0.02 . 1 . . . . 162 SER C . 6711 1 1676 . 1 1 162 162 SER CA C 13 61.6 0.02 . 1 . . . . 162 SER CA . 6711 1 1677 . 1 1 162 162 SER CB C 13 61.8 0.02 . 1 . . . . 162 SER CB . 6711 1 1678 . 1 1 162 162 SER N N 15 119.25 0.02 . 1 . . . . 162 SER N . 6711 1 1679 . 1 1 163 163 LEU H H 1 7.35 0.02 . 1 . . . . 163 LEU H . 6711 1 1680 . 1 1 163 163 LEU HA H 1 4.45 0.02 . 1 . . . . 163 LEU HA . 6711 1 1681 . 1 1 163 163 LEU HB2 H 1 1.83 0.02 . 2 . . . . 163 LEU HB2 . 6711 1 1682 . 1 1 163 163 LEU HB3 H 1 1.60 0.02 . 2 . . . . 163 LEU HB3 . 6711 1 1683 . 1 1 163 163 LEU HD11 H 1 0.85 0.02 . 1 . . . . 163 LEU HD1 . 6711 1 1684 . 1 1 163 163 LEU HD12 H 1 0.85 0.02 . 1 . . . . 163 LEU HD1 . 6711 1 1685 . 1 1 163 163 LEU HD13 H 1 0.85 0.02 . 1 . . . . 163 LEU HD1 . 6711 1 1686 . 1 1 163 163 LEU HD21 H 1 0.85 0.02 . 1 . . . . 163 LEU HD2 . 6711 1 1687 . 1 1 163 163 LEU HD22 H 1 0.85 0.02 . 1 . . . . 163 LEU HD2 . 6711 1 1688 . 1 1 163 163 LEU HD23 H 1 0.85 0.02 . 1 . . . . 163 LEU HD2 . 6711 1 1689 . 1 1 163 163 LEU C C 13 177.63 0.02 . 1 . . . . 163 LEU C . 6711 1 1690 . 1 1 163 163 LEU CA C 13 54.70 0.02 . 1 . . . . 163 LEU CA . 6711 1 1691 . 1 1 163 163 LEU CB C 13 42.52 0.02 . 1 . . . . 163 LEU CB . 6711 1 1692 . 1 1 163 163 LEU CG C 13 26.2 0.02 . 1 . . . . 163 LEU CG . 6711 1 1693 . 1 1 163 163 LEU CD1 C 13 25.0 0.02 . 2 . . . . 163 LEU CD1 . 6711 1 1694 . 1 1 163 163 LEU CD2 C 13 21.6 0.02 . 2 . . . . 163 LEU CD2 . 6711 1 1695 . 1 1 163 163 LEU N N 15 121.9 0.02 . 1 . . . . 163 LEU N . 6711 1 1696 . 1 1 164 164 GLY H H 1 7.95 0.02 . 1 . . . . 164 GLY H . 6711 1 1697 . 1 1 164 164 GLY HA2 H 1 4.04 0.02 . 2 . . . . 164 GLY HA2 . 6711 1 1698 . 1 1 164 164 GLY HA3 H 1 3.93 0.02 . 2 . . . . 164 GLY HA3 . 6711 1 1699 . 1 1 164 164 GLY C C 13 173.8 0.02 . 1 . . . . 164 GLY C . 6711 1 1700 . 1 1 164 164 GLY CA C 13 45.78 0.02 . 1 . . . . 164 GLY CA . 6711 1 1701 . 1 1 164 164 GLY N N 15 108.29 0.02 . 1 . . . . 164 GLY N . 6711 1 1702 . 1 1 165 165 LEU H H 1 7.66 0.02 . 1 . . . . 165 LEU H . 6711 1 1703 . 1 1 165 165 LEU HA H 1 4.23 0.02 . 1 . . . . 165 LEU HA . 6711 1 1704 . 1 1 165 165 LEU HB2 H 1 1.55 0.02 . 1 . . . . 165 LEU HB2 . 6711 1 1705 . 1 1 165 165 LEU HB3 H 1 1.55 0.02 . 1 . . . . 165 LEU HB3 . 6711 1 1706 . 1 1 165 165 LEU HD11 H 1 0.87 0.02 . 1 . . . . 165 LEU HD1 . 6711 1 1707 . 1 1 165 165 LEU HD12 H 1 0.87 0.02 . 1 . . . . 165 LEU HD1 . 6711 1 1708 . 1 1 165 165 LEU HD13 H 1 0.87 0.02 . 1 . . . . 165 LEU HD1 . 6711 1 1709 . 1 1 165 165 LEU HD21 H 1 0.87 0.02 . 1 . . . . 165 LEU HD2 . 6711 1 1710 . 1 1 165 165 LEU HD22 H 1 0.87 0.02 . 1 . . . . 165 LEU HD2 . 6711 1 1711 . 1 1 165 165 LEU HD23 H 1 0.87 0.02 . 1 . . . . 165 LEU HD2 . 6711 1 1712 . 1 1 165 165 LEU C C 13 172.04 0.02 . 1 . . . . 165 LEU C . 6711 1 1713 . 1 1 165 165 LEU CA C 13 55.6 0.02 . 1 . . . . 165 LEU CA . 6711 1 1714 . 1 1 165 165 LEU CB C 13 43.6 0.02 . 1 . . . . 165 LEU CB . 6711 1 1715 . 1 1 165 165 LEU N N 15 126.6 0.02 . 1 . . . . 165 LEU N . 6711 1 stop_ save_