data_6949 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6949 _Entry.Title ; domain 2 of receptor-associated protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-01-24 _Entry.Accession_date 2006-01-25 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _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.Entry_ID 1 Donghan Lee . . . 6949 2 Joseph Walsh D. . . 6949 3 Irina Mikhailenko . . . 6949 4 Molly Migliorini . . . 6949 5 Ping Yu . . . 6949 6 Yibing Wu . . . 6949 7 Stephen Locket . . . 6949 8 Dudley Strickland K. . . 6949 9 Yun-Xing Wang . . . 6949 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6949 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 488 6949 '15N chemical shifts' 110 6949 '1H chemical shifts' 754 6949 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 2 . . 2007-02-08 2006-01-24 update BMRB 'complete entry citation' 6949 1 . . 2006-08-07 2006-01-24 original author 'original release' 6949 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6949 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16865416 _Citation.Full_citation . _Citation.Title 'NMR assignment of domain 2 of the receptor-associated protein' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _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 54 _Citation.Page_last 54 _Citation.Year 2006 _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.Entry_ID _Citation_author.Citation_ID 1 Joseph Walsh D. . . 6949 1 2 Donghan Lee . . . 6949 1 3 Ping Yu . . . 6949 1 4 Molly Migliorini . . . 6949 1 5 Dudley Strickland K. . . 6949 1 6 Yun-Xing Wang . . . 6949 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6949 _Assembly.ID 1 _Assembly.Name 'd2 of RAP' _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 'not present' _Assembly.Molecular_mass . _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 'domain 2' 1 $receptor-associated_protein . . yes native yes no . . . 6949 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_receptor-associated_protein _Entity.Sf_category entity _Entity.Sf_framecode receptor-associated_protein _Entity.Entry_ID 6949 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'domain 2 of RAP' _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 ; SNSLSGTQEDGLDDPRLEKL WHKAKTSGKFSGEELDKLWR EFLHHKEKVHEYNVLLETLS RTEEIHENVISPSDLSDIKG SVLHSRHTELKEKLRSINQG LDRLRRVSHQGYSTEA ; _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 116 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16454 . RBD . . . . . 100.00 357 100.00 100.00 1.58e-72 . . . . 6949 1 2 no PDB 2P01 . "The Structure Of Receptor-Associated Protein(Rap)" . . . . . 100.00 323 100.00 100.00 2.32e-73 . . . . 6949 1 3 no PDB 2P03 . "The Structure Of Receptor-Associated Protein(Rap)" . . . . . 100.00 323 100.00 100.00 2.32e-73 . . . . 6949 1 4 no DBJ BAD96224 . "low density lipoprotein receptor-related protein associated protein 1 variant [Homo sapiens]" . . . . . 100.00 357 99.14 99.14 3.76e-72 . . . . 6949 1 5 no DBJ BAD96247 . "low density lipoprotein receptor-related protein associated protein 1 variant [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 9.64e-73 . . . . 6949 1 6 no DBJ BAF85010 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.05e-72 . . . . 6949 1 7 no DBJ BAG35576 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.15e-72 . . . . 6949 1 8 no DBJ BAG73353 . "low density lipoprotein receptor-related protein associated protein 1 [synthetic construct]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 9 no EMBL CAH90295 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 358 98.28 99.14 2.81e-71 . . . . 6949 1 10 no GB AAA51553 . "alpha-2-macroglobulin receptor-associated protein [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 11 no GB AAC67373 . "lipoprotein receptor associated protein [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 12 no GB AAI05075 . "Low density lipoprotein receptor-related protein associated protein 1 [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 13 no GB AAI12068 . "Low density lipoprotein receptor-related protein associated protein 1 [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 14 no GB AAY18903 . "lipoprotein receptor associated protein; alpha-2-macroglobulin receptor-associated protein [synthetic construct]" . . . . . 100.00 381 100.00 100.00 3.66e-72 . . . . 6949 1 15 no REF NP_001125136 . "alpha-2-macroglobulin receptor-associated protein precursor [Pongo abelii]" . . . . . 100.00 358 98.28 99.14 2.81e-71 . . . . 6949 1 16 no REF NP_001233320 . "alpha-2-macroglobulin receptor-associated protein precursor [Pan troglodytes]" . . . . . 100.00 357 98.28 99.14 1.82e-71 . . . . 6949 1 17 no REF NP_002328 . "alpha-2-macroglobulin receptor-associated protein precursor [Homo sapiens]" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 18 no REF XP_003279069 . "PREDICTED: alpha-2-macroglobulin receptor-associated protein [Nomascus leucogenys]" . . . . . 100.00 460 98.28 99.14 5.35e-70 . . . . 6949 1 19 no REF XP_003804417 . "PREDICTED: alpha-2-macroglobulin receptor-associated protein isoform X1 [Pan paniscus]" . . . . . 100.00 357 98.28 99.14 1.82e-71 . . . . 6949 1 20 no SP P30533 . "RecName: Full=Alpha-2-macroglobulin receptor-associated protein; Short=Alpha-2-MRAP; AltName: Full=Low density lipoprotein rece" . . . . . 100.00 357 100.00 100.00 1.20e-72 . . . . 6949 1 stop_ 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 1 101 SER . 6949 1 2 102 ASN . 6949 1 3 103 SER . 6949 1 4 104 LEU . 6949 1 5 105 SER . 6949 1 6 106 GLY . 6949 1 7 107 THR . 6949 1 8 108 GLN . 6949 1 9 109 GLU . 6949 1 10 110 ASP . 6949 1 11 111 GLY . 6949 1 12 112 LEU . 6949 1 13 113 ASP . 6949 1 14 114 ASP . 6949 1 15 115 PRO . 6949 1 16 116 ARG . 6949 1 17 117 LEU . 6949 1 18 118 GLU . 6949 1 19 119 LYS . 6949 1 20 120 LEU . 6949 1 21 121 TRP . 6949 1 22 122 HIS . 6949 1 23 123 LYS . 6949 1 24 124 ALA . 6949 1 25 125 LYS . 6949 1 26 126 THR . 6949 1 27 127 SER . 6949 1 28 128 GLY . 6949 1 29 129 LYS . 6949 1 30 130 PHE . 6949 1 31 131 SER . 6949 1 32 132 GLY . 6949 1 33 133 GLU . 6949 1 34 134 GLU . 6949 1 35 135 LEU . 6949 1 36 136 ASP . 6949 1 37 137 LYS . 6949 1 38 138 LEU . 6949 1 39 139 TRP . 6949 1 40 140 ARG . 6949 1 41 141 GLU . 6949 1 42 142 PHE . 6949 1 43 143 LEU . 6949 1 44 144 HIS . 6949 1 45 145 HIS . 6949 1 46 146 LYS . 6949 1 47 147 GLU . 6949 1 48 148 LYS . 6949 1 49 149 VAL . 6949 1 50 150 HIS . 6949 1 51 151 GLU . 6949 1 52 152 TYR . 6949 1 53 153 ASN . 6949 1 54 154 VAL . 6949 1 55 155 LEU . 6949 1 56 156 LEU . 6949 1 57 157 GLU . 6949 1 58 158 THR . 6949 1 59 159 LEU . 6949 1 60 160 SER . 6949 1 61 161 ARG . 6949 1 62 162 THR . 6949 1 63 163 GLU . 6949 1 64 164 GLU . 6949 1 65 165 ILE . 6949 1 66 166 HIS . 6949 1 67 167 GLU . 6949 1 68 168 ASN . 6949 1 69 169 VAL . 6949 1 70 170 ILE . 6949 1 71 171 SER . 6949 1 72 172 PRO . 6949 1 73 173 SER . 6949 1 74 174 ASP . 6949 1 75 175 LEU . 6949 1 76 176 SER . 6949 1 77 177 ASP . 6949 1 78 178 ILE . 6949 1 79 179 LYS . 6949 1 80 180 GLY . 6949 1 81 181 SER . 6949 1 82 182 VAL . 6949 1 83 183 LEU . 6949 1 84 184 HIS . 6949 1 85 185 SER . 6949 1 86 186 ARG . 6949 1 87 187 HIS . 6949 1 88 188 THR . 6949 1 89 189 GLU . 6949 1 90 190 LEU . 6949 1 91 191 LYS . 6949 1 92 192 GLU . 6949 1 93 193 LYS . 6949 1 94 194 LEU . 6949 1 95 195 ARG . 6949 1 96 196 SER . 6949 1 97 197 ILE . 6949 1 98 198 ASN . 6949 1 99 199 GLN . 6949 1 100 200 GLY . 6949 1 101 201 LEU . 6949 1 102 202 ASP . 6949 1 103 203 ARG . 6949 1 104 204 LEU . 6949 1 105 205 ARG . 6949 1 106 206 ARG . 6949 1 107 207 VAL . 6949 1 108 208 SER . 6949 1 109 209 HIS . 6949 1 110 210 GLN . 6949 1 111 211 GLY . 6949 1 112 212 TYR . 6949 1 113 213 SER . 6949 1 114 214 THR . 6949 1 115 215 GLU . 6949 1 116 216 ALA . 6949 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 . SER 1 1 6949 1 . ASN 2 2 6949 1 . SER 3 3 6949 1 . LEU 4 4 6949 1 . SER 5 5 6949 1 . GLY 6 6 6949 1 . THR 7 7 6949 1 . GLN 8 8 6949 1 . GLU 9 9 6949 1 . ASP 10 10 6949 1 . GLY 11 11 6949 1 . LEU 12 12 6949 1 . ASP 13 13 6949 1 . ASP 14 14 6949 1 . PRO 15 15 6949 1 . ARG 16 16 6949 1 . LEU 17 17 6949 1 . GLU 18 18 6949 1 . LYS 19 19 6949 1 . LEU 20 20 6949 1 . TRP 21 21 6949 1 . HIS 22 22 6949 1 . LYS 23 23 6949 1 . ALA 24 24 6949 1 . LYS 25 25 6949 1 . THR 26 26 6949 1 . SER 27 27 6949 1 . GLY 28 28 6949 1 . LYS 29 29 6949 1 . PHE 30 30 6949 1 . SER 31 31 6949 1 . GLY 32 32 6949 1 . GLU 33 33 6949 1 . GLU 34 34 6949 1 . LEU 35 35 6949 1 . ASP 36 36 6949 1 . LYS 37 37 6949 1 . LEU 38 38 6949 1 . TRP 39 39 6949 1 . ARG 40 40 6949 1 . GLU 41 41 6949 1 . PHE 42 42 6949 1 . LEU 43 43 6949 1 . HIS 44 44 6949 1 . HIS 45 45 6949 1 . LYS 46 46 6949 1 . GLU 47 47 6949 1 . LYS 48 48 6949 1 . VAL 49 49 6949 1 . HIS 50 50 6949 1 . GLU 51 51 6949 1 . TYR 52 52 6949 1 . ASN 53 53 6949 1 . VAL 54 54 6949 1 . LEU 55 55 6949 1 . LEU 56 56 6949 1 . GLU 57 57 6949 1 . THR 58 58 6949 1 . LEU 59 59 6949 1 . SER 60 60 6949 1 . ARG 61 61 6949 1 . THR 62 62 6949 1 . GLU 63 63 6949 1 . GLU 64 64 6949 1 . ILE 65 65 6949 1 . HIS 66 66 6949 1 . GLU 67 67 6949 1 . ASN 68 68 6949 1 . VAL 69 69 6949 1 . ILE 70 70 6949 1 . SER 71 71 6949 1 . PRO 72 72 6949 1 . SER 73 73 6949 1 . ASP 74 74 6949 1 . LEU 75 75 6949 1 . SER 76 76 6949 1 . ASP 77 77 6949 1 . ILE 78 78 6949 1 . LYS 79 79 6949 1 . GLY 80 80 6949 1 . SER 81 81 6949 1 . VAL 82 82 6949 1 . LEU 83 83 6949 1 . HIS 84 84 6949 1 . SER 85 85 6949 1 . ARG 86 86 6949 1 . HIS 87 87 6949 1 . THR 88 88 6949 1 . GLU 89 89 6949 1 . LEU 90 90 6949 1 . LYS 91 91 6949 1 . GLU 92 92 6949 1 . LYS 93 93 6949 1 . LEU 94 94 6949 1 . ARG 95 95 6949 1 . SER 96 96 6949 1 . ILE 97 97 6949 1 . ASN 98 98 6949 1 . GLN 99 99 6949 1 . GLY 100 100 6949 1 . LEU 101 101 6949 1 . ASP 102 102 6949 1 . ARG 103 103 6949 1 . LEU 104 104 6949 1 . ARG 105 105 6949 1 . ARG 106 106 6949 1 . VAL 107 107 6949 1 . SER 108 108 6949 1 . HIS 109 109 6949 1 . GLN 110 110 6949 1 . GLY 111 111 6949 1 . TYR 112 112 6949 1 . SER 113 113 6949 1 . THR 114 114 6949 1 . GLU 115 115 6949 1 . ALA 116 116 6949 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 6949 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $receptor-associated_protein . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 6949 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 6949 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $receptor-associated_protein . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6949 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6949 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 'domain 2 of RAP' '[U-13C; U-15N]' . . 1 $receptor-associated_protein . . 1 . . mM . . . . 6949 1 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 6949 _Sample_condition_list.ID 1 _Sample_condition_list.Details . 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 pH 7.25 . pH 6949 1 temperature 303 0.1 K 6949 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 6949 _NMR_spectrometer.ID 1 _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 6949 _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 15N-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 2 13C-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 5 '15N-resolved NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 6 '13C-resolved NOESYs for aliphatic and aromatic carbons' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6949 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 6949 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . 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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6949 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6949 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6949 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 6949 _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 $sample_1 isotropic 6949 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 2 2 ASN HA H 1 4.400 0.020 . 1 . . . . 102 ASN HA . 6949 1 2 . 1 1 2 2 ASN HB2 H 1 2.570 0.020 . 2 . . . . 102 ASN HB2 . 6949 1 3 . 1 1 2 2 ASN HB3 H 1 2.670 0.020 . 2 . . . . 102 ASN HB3 . 6949 1 4 . 1 1 2 2 ASN C C 13 175.980 0.400 . 1 . . . . 102 ASN C . 6949 1 5 . 1 1 2 2 ASN CA C 13 54.830 0.400 . 1 . . . . 102 ASN CA . 6949 1 6 . 1 1 2 2 ASN CB C 13 40.700 0.400 . 1 . . . . 102 ASN CB . 6949 1 7 . 1 1 3 3 SER H H 1 8.230 0.020 . 1 . . . . 103 SER H . 6949 1 8 . 1 1 3 3 SER HA H 1 4.280 0.020 . 1 . . . . 103 SER HA . 6949 1 9 . 1 1 3 3 SER HB2 H 1 3.710 0.020 . 1 . . . . 103 SER HB2 . 6949 1 10 . 1 1 3 3 SER HB3 H 1 3.710 0.020 . 1 . . . . 103 SER HB3 . 6949 1 11 . 1 1 3 3 SER C C 13 175.040 0.400 . 1 . . . . 103 SER C . 6949 1 12 . 1 1 3 3 SER CA C 13 58.420 0.400 . 1 . . . . 103 SER CA . 6949 1 13 . 1 1 3 3 SER CB C 13 63.650 0.400 . 1 . . . . 103 SER CB . 6949 1 14 . 1 1 3 3 SER N N 15 121.450 0.400 . 1 . . . . 103 SER N . 6949 1 15 . 1 1 4 4 LEU H H 1 8.330 0.020 . 1 . . . . 104 LEU H . 6949 1 16 . 1 1 4 4 LEU HA H 1 4.270 0.020 . 1 . . . . 104 LEU HA . 6949 1 17 . 1 1 4 4 LEU HB2 H 1 1.460 0.020 . 2 . . . . 104 LEU HB2 . 6949 1 18 . 1 1 4 4 LEU HB3 H 1 1.530 0.020 . 2 . . . . 104 LEU HB3 . 6949 1 19 . 1 1 4 4 LEU HG H 1 1.500 0.020 . 1 . . . . 104 LEU HG . 6949 1 20 . 1 1 4 4 LEU HD11 H 1 0.750 0.020 . 2 . . . . 104 LEU HD1 . 6949 1 21 . 1 1 4 4 LEU HD12 H 1 0.750 0.020 . 2 . . . . 104 LEU HD1 . 6949 1 22 . 1 1 4 4 LEU HD13 H 1 0.750 0.020 . 2 . . . . 104 LEU HD1 . 6949 1 23 . 1 1 4 4 LEU HD21 H 1 0.710 0.020 . 2 . . . . 104 LEU HD2 . 6949 1 24 . 1 1 4 4 LEU HD22 H 1 0.710 0.020 . 2 . . . . 104 LEU HD2 . 6949 1 25 . 1 1 4 4 LEU HD23 H 1 0.710 0.020 . 2 . . . . 104 LEU HD2 . 6949 1 26 . 1 1 4 4 LEU C C 13 177.600 0.400 . 1 . . . . 104 LEU C . 6949 1 27 . 1 1 4 4 LEU CA C 13 55.250 0.400 . 1 . . . . 104 LEU CA . 6949 1 28 . 1 1 4 4 LEU CB C 13 42.030 0.400 . 1 . . . . 104 LEU CB . 6949 1 29 . 1 1 4 4 LEU CG C 13 26.880 0.400 . 1 . . . . 104 LEU CG . 6949 1 30 . 1 1 4 4 LEU CD1 C 13 24.890 0.400 . 1 . . . . 104 LEU CD1 . 6949 1 31 . 1 1 4 4 LEU CD2 C 13 23.200 0.400 . 1 . . . . 104 LEU CD2 . 6949 1 32 . 1 1 4 4 LEU N N 15 123.780 0.400 . 1 . . . . 104 LEU N . 6949 1 33 . 1 1 5 5 SER H H 1 8.130 0.020 . 1 . . . . 105 SER H . 6949 1 34 . 1 1 5 5 SER HA H 1 4.290 0.020 . 1 . . . . 105 SER HA . 6949 1 35 . 1 1 5 5 SER HB2 H 1 3.740 0.020 . 1 . . . . 105 SER HB2 . 6949 1 36 . 1 1 5 5 SER HB3 H 1 3.740 0.020 . 1 . . . . 105 SER HB3 . 6949 1 37 . 1 1 5 5 SER C C 13 175.080 0.400 . 1 . . . . 105 SER C . 6949 1 38 . 1 1 5 5 SER CA C 13 58.500 0.400 . 1 . . . . 105 SER CA . 6949 1 39 . 1 1 5 5 SER CB C 13 63.680 0.400 . 1 . . . . 105 SER CB . 6949 1 40 . 1 1 5 5 SER N N 15 115.990 0.400 . 1 . . . . 105 SER N . 6949 1 41 . 1 1 6 6 GLY H H 1 8.260 0.020 . 1 . . . . 106 GLY H . 6949 1 42 . 1 1 6 6 GLY HA2 H 1 3.900 0.020 . 1 . . . . 106 GLY HA2 . 6949 1 43 . 1 1 6 6 GLY HA3 H 1 3.900 0.020 . 1 . . . . 106 GLY HA3 . 6949 1 44 . 1 1 6 6 GLY C C 13 174.340 0.400 . 1 . . . . 106 GLY C . 6949 1 45 . 1 1 6 6 GLY CA C 13 45.320 0.400 . 1 . . . . 106 GLY CA . 6949 1 46 . 1 1 6 6 GLY N N 15 110.980 0.400 . 1 . . . . 106 GLY N . 6949 1 47 . 1 1 7 7 THR H H 1 7.960 0.020 . 1 . . . . 107 THR H . 6949 1 48 . 1 1 7 7 THR HA H 1 4.220 0.020 . 1 . . . . 107 THR HA . 6949 1 49 . 1 1 7 7 THR HB H 1 4.090 0.020 . 1 . . . . 107 THR HB . 6949 1 50 . 1 1 7 7 THR HG21 H 1 1.040 0.020 . 1 . . . . 107 THR HG2 . 6949 1 51 . 1 1 7 7 THR HG22 H 1 1.040 0.020 . 1 . . . . 107 THR HG2 . 6949 1 52 . 1 1 7 7 THR HG23 H 1 1.040 0.020 . 1 . . . . 107 THR HG2 . 6949 1 53 . 1 1 7 7 THR C C 13 174.710 0.400 . 1 . . . . 107 THR C . 6949 1 54 . 1 1 7 7 THR CA C 13 61.860 0.400 . 1 . . . . 107 THR CA . 6949 1 55 . 1 1 7 7 THR CB C 13 69.830 0.400 . 1 . . . . 107 THR CB . 6949 1 56 . 1 1 7 7 THR CG2 C 13 21.280 0.400 . 1 . . . . 107 THR CG2 . 6949 1 57 . 1 1 7 7 THR N N 15 113.260 0.400 . 1 . . . . 107 THR N . 6949 1 58 . 1 1 8 8 GLN H H 1 8.310 0.020 . 1 . . . . 108 GLN H . 6949 1 59 . 1 1 8 8 GLN HA H 1 4.040 0.020 . 1 . . . . 108 GLN HA . 6949 1 60 . 1 1 8 8 GLN HB2 H 1 1.770 0.020 . 2 . . . . 108 GLN HB2 . 6949 1 61 . 1 1 8 8 GLN HB3 H 1 1.840 0.020 . 2 . . . . 108 GLN HB3 . 6949 1 62 . 1 1 8 8 GLN HG2 H 1 2.020 0.020 . 2 . . . . 108 GLN HG2 . 6949 1 63 . 1 1 8 8 GLN HG3 H 1 1.970 0.020 . 2 . . . . 108 GLN HG3 . 6949 1 64 . 1 1 8 8 GLN C C 13 176.070 0.400 . 1 . . . . 108 GLN C . 6949 1 65 . 1 1 8 8 GLN CA C 13 56.060 0.400 . 1 . . . . 108 GLN CA . 6949 1 66 . 1 1 8 8 GLN CB C 13 28.890 0.400 . 1 . . . . 108 GLN CB . 6949 1 67 . 1 1 8 8 GLN CG C 13 33.510 0.400 . 1 . . . . 108 GLN CG . 6949 1 68 . 1 1 8 8 GLN N N 15 122.270 0.400 . 1 . . . . 108 GLN N . 6949 1 69 . 1 1 9 9 GLU H H 1 8.310 0.020 . 1 . . . . 109 GLU H . 6949 1 70 . 1 1 9 9 GLU HA H 1 4.110 0.020 . 1 . . . . 109 GLU HA . 6949 1 71 . 1 1 9 9 GLU HB2 H 1 1.890 0.020 . 2 . . . . 109 GLU HB2 . 6949 1 72 . 1 1 9 9 GLU HB3 H 1 1.800 0.020 . 2 . . . . 109 GLU HB3 . 6949 1 73 . 1 1 9 9 GLU HG3 H 1 2.050 0.020 . 2 . . . . 109 GLU HG3 . 6949 1 74 . 1 1 9 9 GLU C C 13 176.150 0.400 . 1 . . . . 109 GLU C . 6949 1 75 . 1 1 9 9 GLU CA C 13 56.730 0.400 . 1 . . . . 109 GLU CA . 6949 1 76 . 1 1 9 9 GLU CB C 13 30.040 0.400 . 1 . . . . 109 GLU CB . 6949 1 77 . 1 1 9 9 GLU CG C 13 36.200 0.400 . 1 . . . . 109 GLU CG . 6949 1 78 . 1 1 9 9 GLU N N 15 121.710 0.400 . 1 . . . . 109 GLU N . 6949 1 79 . 1 1 10 10 ASP H H 1 8.140 0.020 . 1 . . . . 110 ASP H . 6949 1 80 . 1 1 10 10 ASP HA H 1 4.500 0.020 . 1 . . . . 110 ASP HA . 6949 1 81 . 1 1 10 10 ASP HB2 H 1 2.580 0.020 . 1 . . . . 110 ASP HB2 . 6949 1 82 . 1 1 10 10 ASP HB3 H 1 2.580 0.020 . 1 . . . . 110 ASP HB3 . 6949 1 83 . 1 1 10 10 ASP C C 13 176.320 0.400 . 1 . . . . 110 ASP C . 6949 1 84 . 1 1 10 10 ASP CA C 13 54.460 0.400 . 1 . . . . 110 ASP CA . 6949 1 85 . 1 1 10 10 ASP CB C 13 41.240 0.400 . 1 . . . . 110 ASP CB . 6949 1 86 . 1 1 10 10 ASP N N 15 120.830 0.400 . 1 . . . . 110 ASP N . 6949 1 87 . 1 1 11 11 GLY H H 1 8.090 0.020 . 1 . . . . 111 GLY H . 6949 1 88 . 1 1 11 11 GLY HA2 H 1 4.050 0.020 . 2 . . . . 111 GLY HA2 . 6949 1 89 . 1 1 11 11 GLY HA3 H 1 3.870 0.020 . 2 . . . . 111 GLY HA3 . 6949 1 90 . 1 1 11 11 GLY C C 13 173.910 0.400 . 1 . . . . 111 GLY C . 6949 1 91 . 1 1 11 11 GLY CA C 13 45.080 0.400 . 1 . . . . 111 GLY CA . 6949 1 92 . 1 1 11 11 GLY N N 15 107.460 0.400 . 1 . . . . 111 GLY N . 6949 1 93 . 1 1 12 12 LEU H H 1 8.600 0.020 . 1 . . . . 112 LEU H . 6949 1 94 . 1 1 12 12 LEU HA H 1 4.040 0.020 . 1 . . . . 112 LEU HA . 6949 1 95 . 1 1 12 12 LEU HB2 H 1 1.570 0.020 . 2 . . . . 112 LEU HB2 . 6949 1 96 . 1 1 12 12 LEU HB3 H 1 1.290 0.020 . 2 . . . . 112 LEU HB3 . 6949 1 97 . 1 1 12 12 LEU HG H 1 1.400 0.020 . 1 . . . . 112 LEU HG . 6949 1 98 . 1 1 12 12 LEU HD11 H 1 0.430 0.020 . 2 . . . . 112 LEU HD1 . 6949 1 99 . 1 1 12 12 LEU HD12 H 1 0.430 0.020 . 2 . . . . 112 LEU HD1 . 6949 1 100 . 1 1 12 12 LEU HD13 H 1 0.430 0.020 . 2 . . . . 112 LEU HD1 . 6949 1 101 . 1 1 12 12 LEU HD21 H 1 0.160 0.020 . 2 . . . . 112 LEU HD2 . 6949 1 102 . 1 1 12 12 LEU HD22 H 1 0.160 0.020 . 2 . . . . 112 LEU HD2 . 6949 1 103 . 1 1 12 12 LEU HD23 H 1 0.160 0.020 . 2 . . . . 112 LEU HD2 . 6949 1 104 . 1 1 12 12 LEU CA C 13 55.350 0.400 . 1 . . . . 112 LEU CA . 6949 1 105 . 1 1 12 12 LEU CB C 13 42.720 0.400 . 1 . . . . 112 LEU CB . 6949 1 106 . 1 1 12 12 LEU CG C 13 26.410 0.400 . 1 . . . . 112 LEU CG . 6949 1 107 . 1 1 12 12 LEU CD1 C 13 25.940 0.400 . 1 . . . . 112 LEU CD1 . 6949 1 108 . 1 1 12 12 LEU CD2 C 13 22.880 0.400 . 1 . . . . 112 LEU CD2 . 6949 1 109 . 1 1 12 12 LEU N N 15 119.930 0.400 . 1 . . . . 112 LEU N . 6949 1 110 . 1 1 13 13 ASP HA H 1 4.160 0.020 . 1 . . . . 113 ASP HA . 6949 1 111 . 1 1 13 13 ASP HB2 H 1 2.720 0.020 . 2 . . . . 113 ASP HB2 . 6949 1 112 . 1 1 13 13 ASP HB3 H 1 2.470 0.020 . 2 . . . . 113 ASP HB3 . 6949 1 113 . 1 1 13 13 ASP C C 13 175.000 0.400 . 1 . . . . 113 ASP C . 6949 1 114 . 1 1 13 13 ASP CA C 13 55.200 0.400 . 1 . . . . 113 ASP CA . 6949 1 115 . 1 1 13 13 ASP CB C 13 39.960 0.400 . 1 . . . . 113 ASP CB . 6949 1 116 . 1 1 14 14 ASP H H 1 7.500 0.020 . 1 . . . . 114 ASP H . 6949 1 117 . 1 1 14 14 ASP HA H 1 4.840 0.020 . 1 . . . . 114 ASP HA . 6949 1 118 . 1 1 14 14 ASP HB2 H 1 2.510 0.020 . 2 . . . . 114 ASP HB2 . 6949 1 119 . 1 1 14 14 ASP HB3 H 1 2.720 0.020 . 2 . . . . 114 ASP HB3 . 6949 1 120 . 1 1 14 14 ASP CA C 13 51.800 0.400 . 1 . . . . 114 ASP CA . 6949 1 121 . 1 1 14 14 ASP CB C 13 42.790 0.400 . 1 . . . . 114 ASP CB . 6949 1 122 . 1 1 14 14 ASP N N 15 116.490 0.400 . 1 . . . . 114 ASP N . 6949 1 123 . 1 1 15 15 PRO HA H 1 4.320 0.020 . 1 . . . . 115 PRO HA . 6949 1 124 . 1 1 15 15 PRO HB2 H 1 2.330 0.020 . 2 . . . . 115 PRO HB2 . 6949 1 125 . 1 1 15 15 PRO HB3 H 1 1.910 0.020 . 2 . . . . 115 PRO HB3 . 6949 1 126 . 1 1 15 15 PRO HG2 H 1 1.990 0.020 . 1 . . . . 115 PRO HG2 . 6949 1 127 . 1 1 15 15 PRO HG3 H 1 1.990 0.020 . 1 . . . . 115 PRO HG3 . 6949 1 128 . 1 1 15 15 PRO HD2 H 1 3.810 0.020 . 2 . . . . 115 PRO HD2 . 6949 1 129 . 1 1 15 15 PRO HD3 H 1 3.850 0.020 . 2 . . . . 115 PRO HD3 . 6949 1 130 . 1 1 15 15 PRO C C 13 179.070 0.400 . 1 . . . . 115 PRO C . 6949 1 131 . 1 1 15 15 PRO CA C 13 64.890 0.400 . 1 . . . . 115 PRO CA . 6949 1 132 . 1 1 15 15 PRO CB C 13 32.420 0.400 . 1 . . . . 115 PRO CB . 6949 1 133 . 1 1 15 15 PRO CG C 13 27.200 0.400 . 1 . . . . 115 PRO CG . 6949 1 134 . 1 1 15 15 PRO CD C 13 51.260 0.400 . 1 . . . . 115 PRO CD . 6949 1 135 . 1 1 16 16 ARG H H 1 8.190 0.020 . 1 . . . . 116 ARG H . 6949 1 136 . 1 1 16 16 ARG HA H 1 4.010 0.020 . 1 . . . . 116 ARG HA . 6949 1 137 . 1 1 16 16 ARG HB2 H 1 1.850 0.020 . 1 . . . . 116 ARG HB2 . 6949 1 138 . 1 1 16 16 ARG HB3 H 1 1.850 0.020 . 1 . . . . 116 ARG HB3 . 6949 1 139 . 1 1 16 16 ARG HD2 H 1 3.210 0.020 . 1 . . . . 116 ARG HD2 . 6949 1 140 . 1 1 16 16 ARG HD3 H 1 3.210 0.020 . 1 . . . . 116 ARG HD3 . 6949 1 141 . 1 1 16 16 ARG C C 13 179.790 0.400 . 1 . . . . 116 ARG C . 6949 1 142 . 1 1 16 16 ARG CA C 13 59.230 0.400 . 1 . . . . 116 ARG CA . 6949 1 143 . 1 1 16 16 ARG CB C 13 29.470 0.400 . 1 . . . . 116 ARG CB . 6949 1 144 . 1 1 16 16 ARG N N 15 117.580 0.400 . 1 . . . . 116 ARG N . 6949 1 145 . 1 1 17 17 LEU H H 1 7.530 0.020 . 1 . . . . 117 LEU H . 6949 1 146 . 1 1 17 17 LEU HA H 1 4.100 0.020 . 1 . . . . 117 LEU HA . 6949 1 147 . 1 1 17 17 LEU HB2 H 1 1.830 0.020 . 2 . . . . 117 LEU HB2 . 6949 1 148 . 1 1 17 17 LEU HB3 H 1 1.540 0.020 . 2 . . . . 117 LEU HB3 . 6949 1 149 . 1 1 17 17 LEU HG H 1 1.800 0.020 . 1 . . . . 117 LEU HG . 6949 1 150 . 1 1 17 17 LEU HD11 H 1 0.710 0.020 . 2 . . . . 117 LEU HD1 . 6949 1 151 . 1 1 17 17 LEU HD12 H 1 0.710 0.020 . 2 . . . . 117 LEU HD1 . 6949 1 152 . 1 1 17 17 LEU HD13 H 1 0.710 0.020 . 2 . . . . 117 LEU HD1 . 6949 1 153 . 1 1 17 17 LEU HD21 H 1 0.960 0.020 . 2 . . . . 117 LEU HD2 . 6949 1 154 . 1 1 17 17 LEU HD22 H 1 0.960 0.020 . 2 . . . . 117 LEU HD2 . 6949 1 155 . 1 1 17 17 LEU HD23 H 1 0.960 0.020 . 2 . . . . 117 LEU HD2 . 6949 1 156 . 1 1 17 17 LEU C C 13 178.650 0.400 . 1 . . . . 117 LEU C . 6949 1 157 . 1 1 17 17 LEU CA C 13 56.840 0.400 . 1 . . . . 117 LEU CA . 6949 1 158 . 1 1 17 17 LEU CB C 13 42.190 0.400 . 1 . . . . 117 LEU CB . 6949 1 159 . 1 1 17 17 LEU CG C 13 26.810 0.400 . 1 . . . . 117 LEU CG . 6949 1 160 . 1 1 17 17 LEU CD1 C 13 22.430 0.400 . 1 . . . . 117 LEU CD1 . 6949 1 161 . 1 1 17 17 LEU CD2 C 13 25.650 0.400 . 1 . . . . 117 LEU CD2 . 6949 1 162 . 1 1 17 17 LEU N N 15 118.370 0.400 . 1 . . . . 117 LEU N . 6949 1 163 . 1 1 18 18 GLU H H 1 8.300 0.020 . 1 . . . . 118 GLU H . 6949 1 164 . 1 1 18 18 GLU HA H 1 3.900 0.020 . 1 . . . . 118 GLU HA . 6949 1 165 . 1 1 18 18 GLU HB2 H 1 2.040 0.020 . 1 . . . . 118 GLU HB2 . 6949 1 166 . 1 1 18 18 GLU HB3 H 1 2.040 0.020 . 1 . . . . 118 GLU HB3 . 6949 1 167 . 1 1 18 18 GLU HG3 H 1 2.270 0.020 . 2 . . . . 118 GLU HG3 . 6949 1 168 . 1 1 18 18 GLU C C 13 178.880 0.400 . 1 . . . . 118 GLU C . 6949 1 169 . 1 1 18 18 GLU CA C 13 59.830 0.400 . 1 . . . . 118 GLU CA . 6949 1 170 . 1 1 18 18 GLU CB C 13 29.290 0.400 . 1 . . . . 118 GLU CB . 6949 1 171 . 1 1 18 18 GLU CG C 13 36.930 0.400 . 1 . . . . 118 GLU CG . 6949 1 172 . 1 1 18 18 GLU N N 15 118.550 0.400 . 1 . . . . 118 GLU N . 6949 1 173 . 1 1 19 19 LYS H H 1 7.640 0.020 . 1 . . . . 119 LYS H . 6949 1 174 . 1 1 19 19 LYS HA H 1 4.060 0.020 . 1 . . . . 119 LYS HA . 6949 1 175 . 1 1 19 19 LYS HB2 H 1 1.850 0.020 . 1 . . . . 119 LYS HB2 . 6949 1 176 . 1 1 19 19 LYS HB3 H 1 1.850 0.020 . 1 . . . . 119 LYS HB3 . 6949 1 177 . 1 1 19 19 LYS HG2 H 1 1.560 0.020 . 2 . . . . 119 LYS HG2 . 6949 1 178 . 1 1 19 19 LYS HG3 H 1 1.390 0.020 . 2 . . . . 119 LYS HG3 . 6949 1 179 . 1 1 19 19 LYS HD2 H 1 1.610 0.020 . 1 . . . . 119 LYS HD2 . 6949 1 180 . 1 1 19 19 LYS HD3 H 1 1.610 0.020 . 1 . . . . 119 LYS HD3 . 6949 1 181 . 1 1 19 19 LYS HE2 H 1 2.850 0.020 . 1 . . . . 119 LYS HE2 . 6949 1 182 . 1 1 19 19 LYS HE3 H 1 2.850 0.020 . 1 . . . . 119 LYS HE3 . 6949 1 183 . 1 1 19 19 LYS C C 13 179.450 0.400 . 1 . . . . 119 LYS C . 6949 1 184 . 1 1 19 19 LYS CA C 13 59.580 0.400 . 1 . . . . 119 LYS CA . 6949 1 185 . 1 1 19 19 LYS CB C 13 32.490 0.400 . 1 . . . . 119 LYS CB . 6949 1 186 . 1 1 19 19 LYS CG C 13 25.190 0.400 . 1 . . . . 119 LYS CG . 6949 1 187 . 1 1 19 19 LYS CD C 13 29.220 0.400 . 1 . . . . 119 LYS CD . 6949 1 188 . 1 1 19 19 LYS CE C 13 41.820 0.400 . 1 . . . . 119 LYS CE . 6949 1 189 . 1 1 19 19 LYS N N 15 118.140 0.400 . 1 . . . . 119 LYS N . 6949 1 190 . 1 1 20 20 LEU H H 1 7.280 0.020 . 1 . . . . 120 LEU H . 6949 1 191 . 1 1 20 20 LEU HA H 1 4.060 0.020 . 1 . . . . 120 LEU HA . 6949 1 192 . 1 1 20 20 LEU HB2 H 1 1.860 0.020 . 2 . . . . 120 LEU HB2 . 6949 1 193 . 1 1 20 20 LEU HB3 H 1 2.120 0.020 . 2 . . . . 120 LEU HB3 . 6949 1 194 . 1 1 20 20 LEU HG H 1 2.010 0.020 . 1 . . . . 120 LEU HG . 6949 1 195 . 1 1 20 20 LEU HD11 H 1 0.800 0.020 . 2 . . . . 120 LEU HD1 . 6949 1 196 . 1 1 20 20 LEU HD12 H 1 0.800 0.020 . 2 . . . . 120 LEU HD1 . 6949 1 197 . 1 1 20 20 LEU HD13 H 1 0.800 0.020 . 2 . . . . 120 LEU HD1 . 6949 1 198 . 1 1 20 20 LEU HD21 H 1 0.880 0.020 . 2 . . . . 120 LEU HD2 . 6949 1 199 . 1 1 20 20 LEU HD22 H 1 0.880 0.020 . 2 . . . . 120 LEU HD2 . 6949 1 200 . 1 1 20 20 LEU HD23 H 1 0.880 0.020 . 2 . . . . 120 LEU HD2 . 6949 1 201 . 1 1 20 20 LEU C C 13 177.820 0.400 . 1 . . . . 120 LEU C . 6949 1 202 . 1 1 20 20 LEU CA C 13 57.710 0.400 . 1 . . . . 120 LEU CA . 6949 1 203 . 1 1 20 20 LEU CB C 13 41.890 0.400 . 1 . . . . 120 LEU CB . 6949 1 204 . 1 1 20 20 LEU CG C 13 26.260 0.400 . 1 . . . . 120 LEU CG . 6949 1 205 . 1 1 20 20 LEU CD1 C 13 25.340 0.400 . 1 . . . . 120 LEU CD1 . 6949 1 206 . 1 1 20 20 LEU CD2 C 13 23.510 0.400 . 1 . . . . 120 LEU CD2 . 6949 1 207 . 1 1 20 20 LEU N N 15 119.900 0.400 . 1 . . . . 120 LEU N . 6949 1 208 . 1 1 21 21 TRP H H 1 8.220 0.020 . 1 . . . . 121 TRP H . 6949 1 209 . 1 1 21 21 TRP HA H 1 4.200 0.020 . 1 . . . . 121 TRP HA . 6949 1 210 . 1 1 21 21 TRP HB2 H 1 2.910 0.020 . 2 . . . . 121 TRP HB2 . 6949 1 211 . 1 1 21 21 TRP HB3 H 1 2.400 0.020 . 2 . . . . 121 TRP HB3 . 6949 1 212 . 1 1 21 21 TRP HD1 H 1 6.950 0.020 . 1 . . . . 121 TRP HD1 . 6949 1 213 . 1 1 21 21 TRP HE1 H 1 9.670 0.020 . 1 . . . . 121 TRP HE1 . 6949 1 214 . 1 1 21 21 TRP C C 13 176.600 0.400 . 1 . . . . 121 TRP C . 6949 1 215 . 1 1 21 21 TRP CA C 13 59.040 0.400 . 1 . . . . 121 TRP CA . 6949 1 216 . 1 1 21 21 TRP CB C 13 29.550 0.400 . 1 . . . . 121 TRP CB . 6949 1 217 . 1 1 21 21 TRP CD1 C 13 126.300 0.400 . 1 . . . . 121 TRP CD1 . 6949 1 218 . 1 1 21 21 TRP N N 15 120.710 0.400 . 1 . . . . 121 TRP N . 6949 1 219 . 1 1 21 21 TRP NE1 N 15 127.490 0.400 . 1 . . . . 121 TRP NE1 . 6949 1 220 . 1 1 22 22 HIS H H 1 8.260 0.020 . 1 . . . . 122 HIS H . 6949 1 221 . 1 1 22 22 HIS HA H 1 3.650 0.020 . 1 . . . . 122 HIS HA . 6949 1 222 . 1 1 22 22 HIS HB2 H 1 3.090 0.020 . 2 . . . . 122 HIS HB2 . 6949 1 223 . 1 1 22 22 HIS HB3 H 1 3.010 0.020 . 2 . . . . 122 HIS HB3 . 6949 1 224 . 1 1 22 22 HIS HD2 H 1 6.850 0.020 . 1 . . . . 122 HIS HD2 . 6949 1 225 . 1 1 22 22 HIS C C 13 178.710 0.400 . 1 . . . . 122 HIS C . 6949 1 226 . 1 1 22 22 HIS CA C 13 60.330 0.400 . 1 . . . . 122 HIS CA . 6949 1 227 . 1 1 22 22 HIS CB C 13 30.370 0.400 . 1 . . . . 122 HIS CB . 6949 1 228 . 1 1 22 22 HIS CD2 C 13 118.930 0.400 . 1 . . . . 122 HIS CD2 . 6949 1 229 . 1 1 22 22 HIS N N 15 116.560 0.400 . 1 . . . . 122 HIS N . 6949 1 230 . 1 1 23 23 LYS H H 1 7.740 0.020 . 1 . . . . 123 LYS H . 6949 1 231 . 1 1 23 23 LYS HA H 1 3.660 0.020 . 1 . . . . 123 LYS HA . 6949 1 232 . 1 1 23 23 LYS HB2 H 1 1.830 0.020 . 1 . . . . 123 LYS HB2 . 6949 1 233 . 1 1 23 23 LYS HB3 H 1 1.830 0.020 . 1 . . . . 123 LYS HB3 . 6949 1 234 . 1 1 23 23 LYS HG2 H 1 1.070 0.020 . 2 . . . . 123 LYS HG2 . 6949 1 235 . 1 1 23 23 LYS HG3 H 1 1.300 0.020 . 2 . . . . 123 LYS HG3 . 6949 1 236 . 1 1 23 23 LYS HD2 H 1 1.460 0.020 . 2 . . . . 123 LYS HD2 . 6949 1 237 . 1 1 23 23 LYS HD3 H 1 1.830 0.020 . 2 . . . . 123 LYS HD3 . 6949 1 238 . 1 1 23 23 LYS HE2 H 1 2.770 0.020 . 1 . . . . 123 LYS HE2 . 6949 1 239 . 1 1 23 23 LYS HE3 H 1 2.770 0.020 . 1 . . . . 123 LYS HE3 . 6949 1 240 . 1 1 23 23 LYS C C 13 178.210 0.400 . 1 . . . . 123 LYS C . 6949 1 241 . 1 1 23 23 LYS CA C 13 58.830 0.400 . 1 . . . . 123 LYS CA . 6949 1 242 . 1 1 23 23 LYS CB C 13 31.180 0.400 . 1 . . . . 123 LYS CB . 6949 1 243 . 1 1 23 23 LYS CG C 13 24.070 0.400 . 1 . . . . 123 LYS CG . 6949 1 244 . 1 1 23 23 LYS CD C 13 28.440 0.400 . 1 . . . . 123 LYS CD . 6949 1 245 . 1 1 23 23 LYS CE C 13 41.520 0.400 . 1 . . . . 123 LYS CE . 6949 1 246 . 1 1 23 23 LYS N N 15 120.330 0.400 . 1 . . . . 123 LYS N . 6949 1 247 . 1 1 24 24 ALA H H 1 8.010 0.020 . 1 . . . . 124 ALA H . 6949 1 248 . 1 1 24 24 ALA HA H 1 4.100 0.020 . 1 . . . . 124 ALA HA . 6949 1 249 . 1 1 24 24 ALA HB1 H 1 0.950 0.020 . 1 . . . . 124 ALA HB . 6949 1 250 . 1 1 24 24 ALA HB2 H 1 0.950 0.020 . 1 . . . . 124 ALA HB . 6949 1 251 . 1 1 24 24 ALA HB3 H 1 0.950 0.020 . 1 . . . . 124 ALA HB . 6949 1 252 . 1 1 24 24 ALA C C 13 181.300 0.400 . 1 . . . . 124 ALA C . 6949 1 253 . 1 1 24 24 ALA CA C 13 55.270 0.400 . 1 . . . . 124 ALA CA . 6949 1 254 . 1 1 24 24 ALA CB C 13 18.350 0.400 . 1 . . . . 124 ALA CB . 6949 1 255 . 1 1 24 24 ALA N N 15 122.110 0.400 . 1 . . . . 124 ALA N . 6949 1 256 . 1 1 25 25 LYS H H 1 8.190 0.020 . 1 . . . . 125 LYS H . 6949 1 257 . 1 1 25 25 LYS HA H 1 3.420 0.020 . 1 . . . . 125 LYS HA . 6949 1 258 . 1 1 25 25 LYS HB3 H 1 0.950 0.020 . 1 . . . . 125 LYS HB3 . 6949 1 259 . 1 1 25 25 LYS HG2 H 1 0.750 0.020 . 2 . . . . 125 LYS HG2 . 6949 1 260 . 1 1 25 25 LYS HG3 H 1 0.620 0.020 . 2 . . . . 125 LYS HG3 . 6949 1 261 . 1 1 25 25 LYS HD2 H 1 1.170 0.020 . 1 . . . . 125 LYS HD2 . 6949 1 262 . 1 1 25 25 LYS HD3 H 1 1.170 0.020 . 1 . . . . 125 LYS HD3 . 6949 1 263 . 1 1 25 25 LYS HE2 H 1 2.470 0.020 . 2 . . . . 125 LYS HE2 . 6949 1 264 . 1 1 25 25 LYS HE3 H 1 2.600 0.020 . 2 . . . . 125 LYS HE3 . 6949 1 265 . 1 1 25 25 LYS C C 13 178.100 0.400 . 1 . . . . 125 LYS C . 6949 1 266 . 1 1 25 25 LYS CA C 13 59.470 0.400 . 1 . . . . 125 LYS CA . 6949 1 267 . 1 1 25 25 LYS CB C 13 31.670 0.400 . 1 . . . . 125 LYS CB . 6949 1 268 . 1 1 25 25 LYS CG C 13 24.170 0.400 . 1 . . . . 125 LYS CG . 6949 1 269 . 1 1 25 25 LYS CD C 13 28.980 0.400 . 1 . . . . 125 LYS CD . 6949 1 270 . 1 1 25 25 LYS CE C 13 41.420 0.400 . 1 . . . . 125 LYS CE . 6949 1 271 . 1 1 25 25 LYS N N 15 117.400 0.400 . 1 . . . . 125 LYS N . 6949 1 272 . 1 1 26 26 THR H H 1 7.370 0.020 . 1 . . . . 126 THR H . 6949 1 273 . 1 1 26 26 THR HA H 1 4.190 0.020 . 1 . . . . 126 THR HA . 6949 1 274 . 1 1 26 26 THR HB H 1 4.160 0.020 . 1 . . . . 126 THR HB . 6949 1 275 . 1 1 26 26 THR HG21 H 1 0.840 0.020 . 1 . . . . 126 THR HG2 . 6949 1 276 . 1 1 26 26 THR HG22 H 1 0.840 0.020 . 1 . . . . 126 THR HG2 . 6949 1 277 . 1 1 26 26 THR HG23 H 1 0.840 0.020 . 1 . . . . 126 THR HG2 . 6949 1 278 . 1 1 26 26 THR C C 13 176.300 0.400 . 1 . . . . 126 THR C . 6949 1 279 . 1 1 26 26 THR CA C 13 62.050 0.400 . 1 . . . . 126 THR CA . 6949 1 280 . 1 1 26 26 THR CB C 13 70.250 0.400 . 1 . . . . 126 THR CB . 6949 1 281 . 1 1 26 26 THR CG2 C 13 20.990 0.400 . 1 . . . . 126 THR CG2 . 6949 1 282 . 1 1 26 26 THR N N 15 106.640 0.400 . 1 . . . . 126 THR N . 6949 1 283 . 1 1 27 27 SER H H 1 7.610 0.020 . 1 . . . . 127 SER H . 6949 1 284 . 1 1 27 27 SER HA H 1 4.450 0.020 . 1 . . . . 127 SER HA . 6949 1 285 . 1 1 27 27 SER HB2 H 1 3.740 0.020 . 1 . . . . 127 SER HB2 . 6949 1 286 . 1 1 27 27 SER HB3 H 1 3.740 0.020 . 1 . . . . 127 SER HB3 . 6949 1 287 . 1 1 27 27 SER C C 13 176.120 0.400 . 1 . . . . 127 SER C . 6949 1 288 . 1 1 27 27 SER CA C 13 60.900 0.400 . 1 . . . . 127 SER CA . 6949 1 289 . 1 1 27 27 SER CB C 13 64.500 0.400 . 1 . . . . 127 SER CB . 6949 1 290 . 1 1 27 27 SER N N 15 117.290 0.400 . 1 . . . . 127 SER N . 6949 1 291 . 1 1 28 28 GLY H H 1 8.010 0.020 . 1 . . . . 128 GLY H . 6949 1 292 . 1 1 28 28 GLY HA2 H 1 4.090 0.020 . 2 . . . . 128 GLY HA2 . 6949 1 293 . 1 1 28 28 GLY HA3 H 1 3.820 0.020 . 2 . . . . 128 GLY HA3 . 6949 1 294 . 1 1 28 28 GLY C C 13 175.280 0.400 . 1 . . . . 128 GLY C . 6949 1 295 . 1 1 28 28 GLY CA C 13 45.930 0.400 . 1 . . . . 128 GLY CA . 6949 1 296 . 1 1 28 28 GLY N N 15 111.030 0.400 . 1 . . . . 128 GLY N . 6949 1 297 . 1 1 29 29 LYS H H 1 8.050 0.020 . 1 . . . . 129 LYS H . 6949 1 298 . 1 1 29 29 LYS HA H 1 4.040 0.020 . 1 . . . . 129 LYS HA . 6949 1 299 . 1 1 29 29 LYS HB2 H 1 1.270 0.020 . 1 . . . . 129 LYS HB2 . 6949 1 300 . 1 1 29 29 LYS HB3 H 1 1.270 0.020 . 1 . . . . 129 LYS HB3 . 6949 1 301 . 1 1 29 29 LYS HG2 H 1 1.030 0.020 . 1 . . . . 129 LYS HG2 . 6949 1 302 . 1 1 29 29 LYS HG3 H 1 1.030 0.020 . 1 . . . . 129 LYS HG3 . 6949 1 303 . 1 1 29 29 LYS HD2 H 1 1.280 0.020 . 1 . . . . 129 LYS HD2 . 6949 1 304 . 1 1 29 29 LYS HD3 H 1 1.280 0.020 . 1 . . . . 129 LYS HD3 . 6949 1 305 . 1 1 29 29 LYS HE2 H 1 2.790 0.020 . 2 . . . . 129 LYS HE2 . 6949 1 306 . 1 1 29 29 LYS HE3 H 1 2.840 0.020 . 2 . . . . 129 LYS HE3 . 6949 1 307 . 1 1 29 29 LYS C C 13 175.080 0.400 . 1 . . . . 129 LYS C . 6949 1 308 . 1 1 29 29 LYS CA C 13 56.190 0.400 . 1 . . . . 129 LYS CA . 6949 1 309 . 1 1 29 29 LYS CB C 13 32.650 0.400 . 1 . . . . 129 LYS CB . 6949 1 310 . 1 1 29 29 LYS CG C 13 25.070 0.400 . 1 . . . . 129 LYS CG . 6949 1 311 . 1 1 29 29 LYS CD C 13 28.240 0.400 . 1 . . . . 129 LYS CD . 6949 1 312 . 1 1 29 29 LYS CE C 13 42.120 0.400 . 1 . . . . 129 LYS CE . 6949 1 313 . 1 1 29 29 LYS N N 15 117.600 0.400 . 1 . . . . 129 LYS N . 6949 1 314 . 1 1 30 30 PHE H H 1 7.780 0.020 . 1 . . . . 130 PHE H . 6949 1 315 . 1 1 30 30 PHE HA H 1 4.900 0.020 . 1 . . . . 130 PHE HA . 6949 1 316 . 1 1 30 30 PHE HB2 H 1 3.040 0.020 . 2 . . . . 130 PHE HB2 . 6949 1 317 . 1 1 30 30 PHE HB3 H 1 2.700 0.020 . 2 . . . . 130 PHE HB3 . 6949 1 318 . 1 1 30 30 PHE HD1 H 1 7.070 0.020 . 1 . . . . 130 PHE HD1 . 6949 1 319 . 1 1 30 30 PHE HE1 H 1 6.870 0.020 . 1 . . . . 130 PHE HE1 . 6949 1 320 . 1 1 30 30 PHE HZ H 1 7.370 0.020 . 1 . . . . 130 PHE HZ . 6949 1 321 . 1 1 30 30 PHE C C 13 176.200 0.400 . 1 . . . . 130 PHE C . 6949 1 322 . 1 1 30 30 PHE CA C 13 56.500 0.400 . 1 . . . . 130 PHE CA . 6949 1 323 . 1 1 30 30 PHE CB C 13 42.690 0.400 . 1 . . . . 130 PHE CB . 6949 1 324 . 1 1 30 30 PHE CD1 C 13 132.220 0.400 . 1 . . . . 130 PHE CD1 . 6949 1 325 . 1 1 30 30 PHE CE1 C 13 130.930 0.400 . 1 . . . . 130 PHE CE1 . 6949 1 326 . 1 1 30 30 PHE CZ C 13 131.220 0.400 . 1 . . . . 130 PHE CZ . 6949 1 327 . 1 1 30 30 PHE N N 15 116.630 0.400 . 1 . . . . 130 PHE N . 6949 1 328 . 1 1 31 31 SER H H 1 9.380 0.020 . 1 . . . . 131 SER H . 6949 1 329 . 1 1 31 31 SER HA H 1 4.570 0.020 . 1 . . . . 131 SER HA . 6949 1 330 . 1 1 31 31 SER HB2 H 1 3.280 0.020 . 2 . . . . 131 SER HB2 . 6949 1 331 . 1 1 31 31 SER HB3 H 1 3.940 0.020 . 2 . . . . 131 SER HB3 . 6949 1 332 . 1 1 31 31 SER C C 13 175.180 0.400 . 1 . . . . 131 SER C . 6949 1 333 . 1 1 31 31 SER CA C 13 56.880 0.400 . 1 . . . . 131 SER CA . 6949 1 334 . 1 1 31 31 SER CB C 13 65.290 0.400 . 1 . . . . 131 SER CB . 6949 1 335 . 1 1 31 31 SER N N 15 120.190 0.400 . 1 . . . . 131 SER N . 6949 1 336 . 1 1 32 32 GLY H H 1 8.960 0.020 . 1 . . . . 132 GLY H . 6949 1 337 . 1 1 32 32 GLY HA2 H 1 3.950 0.020 . 2 . . . . 132 GLY HA2 . 6949 1 338 . 1 1 32 32 GLY HA3 H 1 3.710 0.020 . 2 . . . . 132 GLY HA3 . 6949 1 339 . 1 1 32 32 GLY C C 13 176.850 0.400 . 1 . . . . 132 GLY C . 6949 1 340 . 1 1 32 32 GLY CA C 13 47.980 0.400 . 1 . . . . 132 GLY CA . 6949 1 341 . 1 1 32 32 GLY N N 15 109.100 0.400 . 1 . . . . 132 GLY N . 6949 1 342 . 1 1 33 33 GLU H H 1 8.580 0.020 . 1 . . . . 133 GLU H . 6949 1 343 . 1 1 33 33 GLU HA H 1 4.150 0.020 . 1 . . . . 133 GLU HA . 6949 1 344 . 1 1 33 33 GLU HB2 H 1 1.980 0.020 . 2 . . . . 133 GLU HB2 . 6949 1 345 . 1 1 33 33 GLU HB3 H 1 1.910 0.020 . 2 . . . . 133 GLU HB3 . 6949 1 346 . 1 1 33 33 GLU HG3 H 1 2.250 0.020 . 2 . . . . 133 GLU HG3 . 6949 1 347 . 1 1 33 33 GLU C C 13 176.480 0.400 . 1 . . . . 133 GLU C . 6949 1 348 . 1 1 33 33 GLU CA C 13 59.470 0.400 . 1 . . . . 133 GLU CA . 6949 1 349 . 1 1 33 33 GLU CB C 13 29.670 0.400 . 1 . . . . 133 GLU CB . 6949 1 350 . 1 1 33 33 GLU CG C 13 36.650 0.400 . 1 . . . . 133 GLU CG . 6949 1 351 . 1 1 33 33 GLU N N 15 121.360 0.400 . 1 . . . . 133 GLU N . 6949 1 352 . 1 1 34 34 GLU H H 1 7.850 0.020 . 1 . . . . 134 GLU H . 6949 1 353 . 1 1 34 34 GLU HA H 1 4.030 0.020 . 1 . . . . 134 GLU HA . 6949 1 354 . 1 1 34 34 GLU HB2 H 1 2.530 0.020 . 2 . . . . 134 GLU HB2 . 6949 1 355 . 1 1 34 34 GLU HB3 H 1 2.740 0.020 . 2 . . . . 134 GLU HB3 . 6949 1 356 . 1 1 34 34 GLU HG3 H 1 2.200 0.020 . 2 . . . . 134 GLU HG3 . 6949 1 357 . 1 1 34 34 GLU C C 13 178.880 0.400 . 1 . . . . 134 GLU C . 6949 1 358 . 1 1 34 34 GLU CA C 13 59.330 0.400 . 1 . . . . 134 GLU CA . 6949 1 359 . 1 1 34 34 GLU CB C 13 31.430 0.400 . 1 . . . . 134 GLU CB . 6949 1 360 . 1 1 34 34 GLU CG C 13 38.070 0.400 . 1 . . . . 134 GLU CG . 6949 1 361 . 1 1 34 34 GLU N N 15 120.490 0.400 . 1 . . . . 134 GLU N . 6949 1 362 . 1 1 35 35 LEU H H 1 8.600 0.020 . 1 . . . . 135 LEU H . 6949 1 363 . 1 1 35 35 LEU HA H 1 4.120 0.020 . 1 . . . . 135 LEU HA . 6949 1 364 . 1 1 35 35 LEU HB2 H 1 1.660 0.020 . 2 . . . . 135 LEU HB2 . 6949 1 365 . 1 1 35 35 LEU HB3 H 1 1.910 0.020 . 2 . . . . 135 LEU HB3 . 6949 1 366 . 1 1 35 35 LEU HG H 1 1.720 0.020 . 1 . . . . 135 LEU HG . 6949 1 367 . 1 1 35 35 LEU HD11 H 1 0.610 0.020 . 2 . . . . 135 LEU HD1 . 6949 1 368 . 1 1 35 35 LEU HD12 H 1 0.610 0.020 . 2 . . . . 135 LEU HD1 . 6949 1 369 . 1 1 35 35 LEU HD13 H 1 0.610 0.020 . 2 . . . . 135 LEU HD1 . 6949 1 370 . 1 1 35 35 LEU HD21 H 1 0.270 0.020 . 2 . . . . 135 LEU HD2 . 6949 1 371 . 1 1 35 35 LEU HD22 H 1 0.270 0.020 . 2 . . . . 135 LEU HD2 . 6949 1 372 . 1 1 35 35 LEU HD23 H 1 0.270 0.020 . 2 . . . . 135 LEU HD2 . 6949 1 373 . 1 1 35 35 LEU C C 13 179.130 0.400 . 1 . . . . 135 LEU C . 6949 1 374 . 1 1 35 35 LEU CA C 13 57.860 0.400 . 1 . . . . 135 LEU CA . 6949 1 375 . 1 1 35 35 LEU CB C 13 41.100 0.400 . 1 . . . . 135 LEU CB . 6949 1 376 . 1 1 35 35 LEU CG C 13 26.900 0.400 . 1 . . . . 135 LEU CG . 6949 1 377 . 1 1 35 35 LEU CD1 C 13 25.320 0.400 . 1 . . . . 135 LEU CD1 . 6949 1 378 . 1 1 35 35 LEU CD2 C 13 23.290 0.400 . 1 . . . . 135 LEU CD2 . 6949 1 379 . 1 1 35 35 LEU N N 15 120.740 0.400 . 1 . . . . 135 LEU N . 6949 1 380 . 1 1 36 36 ASP H H 1 7.660 0.020 . 1 . . . . 136 ASP H . 6949 1 381 . 1 1 36 36 ASP HA H 1 4.490 0.020 . 1 . . . . 136 ASP HA . 6949 1 382 . 1 1 36 36 ASP HB2 H 1 2.700 0.020 . 2 . . . . 136 ASP HB2 . 6949 1 383 . 1 1 36 36 ASP HB3 H 1 2.780 0.020 . 2 . . . . 136 ASP HB3 . 6949 1 384 . 1 1 36 36 ASP C C 13 178.670 0.400 . 1 . . . . 136 ASP C . 6949 1 385 . 1 1 36 36 ASP CA C 13 57.690 0.400 . 1 . . . . 136 ASP CA . 6949 1 386 . 1 1 36 36 ASP CB C 13 40.790 0.400 . 1 . . . . 136 ASP CB . 6949 1 387 . 1 1 36 36 ASP N N 15 119.530 0.400 . 1 . . . . 136 ASP N . 6949 1 388 . 1 1 37 37 LYS H H 1 7.520 0.020 . 1 . . . . 137 LYS H . 6949 1 389 . 1 1 37 37 LYS HA H 1 3.910 0.020 . 1 . . . . 137 LYS HA . 6949 1 390 . 1 1 37 37 LYS HB2 H 1 2.080 0.020 . 2 . . . . 137 LYS HB2 . 6949 1 391 . 1 1 37 37 LYS HB3 H 1 1.870 0.020 . 2 . . . . 137 LYS HB3 . 6949 1 392 . 1 1 37 37 LYS HG2 H 1 1.420 0.020 . 1 . . . . 137 LYS HG2 . 6949 1 393 . 1 1 37 37 LYS HG3 H 1 1.420 0.020 . 1 . . . . 137 LYS HG3 . 6949 1 394 . 1 1 37 37 LYS HD2 H 1 1.270 0.020 . 2 . . . . 137 LYS HD2 . 6949 1 395 . 1 1 37 37 LYS HD3 H 1 1.420 0.020 . 2 . . . . 137 LYS HD3 . 6949 1 396 . 1 1 37 37 LYS HE2 H 1 2.550 0.020 . 2 . . . . 137 LYS HE2 . 6949 1 397 . 1 1 37 37 LYS HE3 H 1 2.490 0.020 . 2 . . . . 137 LYS HE3 . 6949 1 398 . 1 1 37 37 LYS C C 13 178.980 0.400 . 1 . . . . 137 LYS C . 6949 1 399 . 1 1 37 37 LYS CA C 13 59.840 0.400 . 1 . . . . 137 LYS CA . 6949 1 400 . 1 1 37 37 LYS CB C 13 32.520 0.400 . 1 . . . . 137 LYS CB . 6949 1 401 . 1 1 37 37 LYS CG C 13 24.940 0.400 . 1 . . . . 137 LYS CG . 6949 1 402 . 1 1 37 37 LYS CD C 13 29.600 0.400 . 1 . . . . 137 LYS CD . 6949 1 403 . 1 1 37 37 LYS CE C 13 41.870 0.400 . 1 . . . . 137 LYS CE . 6949 1 404 . 1 1 37 37 LYS N N 15 120.860 0.400 . 1 . . . . 137 LYS N . 6949 1 405 . 1 1 38 38 LEU H H 1 8.860 0.020 . 1 . . . . 138 LEU H . 6949 1 406 . 1 1 38 38 LEU HA H 1 4.300 0.020 . 1 . . . . 138 LEU HA . 6949 1 407 . 1 1 38 38 LEU HB2 H 1 2.100 0.020 . 2 . . . . 138 LEU HB2 . 6949 1 408 . 1 1 38 38 LEU HB3 H 1 1.680 0.020 . 2 . . . . 138 LEU HB3 . 6949 1 409 . 1 1 38 38 LEU HG H 1 1.810 0.020 . 1 . . . . 138 LEU HG . 6949 1 410 . 1 1 38 38 LEU HD11 H 1 0.370 0.020 . 2 . . . . 138 LEU HD1 . 6949 1 411 . 1 1 38 38 LEU HD12 H 1 0.370 0.020 . 2 . . . . 138 LEU HD1 . 6949 1 412 . 1 1 38 38 LEU HD13 H 1 0.370 0.020 . 2 . . . . 138 LEU HD1 . 6949 1 413 . 1 1 38 38 LEU HD21 H 1 0.740 0.020 . 2 . . . . 138 LEU HD2 . 6949 1 414 . 1 1 38 38 LEU HD22 H 1 0.740 0.020 . 2 . . . . 138 LEU HD2 . 6949 1 415 . 1 1 38 38 LEU HD23 H 1 0.740 0.020 . 2 . . . . 138 LEU HD2 . 6949 1 416 . 1 1 38 38 LEU C C 13 179.270 0.400 . 1 . . . . 138 LEU C . 6949 1 417 . 1 1 38 38 LEU CA C 13 58.040 0.400 . 1 . . . . 138 LEU CA . 6949 1 418 . 1 1 38 38 LEU CB C 13 41.620 0.400 . 1 . . . . 138 LEU CB . 6949 1 419 . 1 1 38 38 LEU CG C 13 26.860 0.400 . 1 . . . . 138 LEU CG . 6949 1 420 . 1 1 38 38 LEU CD1 C 13 26.550 0.400 . 1 . . . . 138 LEU CD1 . 6949 1 421 . 1 1 38 38 LEU CD2 C 13 22.680 0.400 . 1 . . . . 138 LEU CD2 . 6949 1 422 . 1 1 38 38 LEU N N 15 123.540 0.400 . 1 . . . . 138 LEU N . 6949 1 423 . 1 1 39 39 TRP H H 1 9.040 0.020 . 1 . . . . 139 TRP H . 6949 1 424 . 1 1 39 39 TRP HA H 1 3.980 0.020 . 1 . . . . 139 TRP HA . 6949 1 425 . 1 1 39 39 TRP HB2 H 1 3.200 0.020 . 2 . . . . 139 TRP HB2 . 6949 1 426 . 1 1 39 39 TRP HB3 H 1 3.260 0.020 . 2 . . . . 139 TRP HB3 . 6949 1 427 . 1 1 39 39 TRP HD1 H 1 6.870 0.020 . 1 . . . . 139 TRP HD1 . 6949 1 428 . 1 1 39 39 TRP HE1 H 1 9.750 0.020 . 1 . . . . 139 TRP HE1 . 6949 1 429 . 1 1 39 39 TRP C C 13 177.820 0.400 . 1 . . . . 139 TRP C . 6949 1 430 . 1 1 39 39 TRP CA C 13 59.880 0.400 . 1 . . . . 139 TRP CA . 6949 1 431 . 1 1 39 39 TRP CB C 13 29.300 0.400 . 1 . . . . 139 TRP CB . 6949 1 432 . 1 1 39 39 TRP CD1 C 13 125.770 0.400 . 1 . . . . 139 TRP CD1 . 6949 1 433 . 1 1 39 39 TRP N N 15 121.380 0.400 . 1 . . . . 139 TRP N . 6949 1 434 . 1 1 39 39 TRP NE1 N 15 128.070 0.400 . 1 . . . . 139 TRP NE1 . 6949 1 435 . 1 1 40 40 ARG H H 1 7.470 0.020 . 1 . . . . 140 ARG H . 6949 1 436 . 1 1 40 40 ARG HA H 1 3.620 0.020 . 1 . . . . 140 ARG HA . 6949 1 437 . 1 1 40 40 ARG HB2 H 1 1.780 0.020 . 2 . . . . 140 ARG HB2 . 6949 1 438 . 1 1 40 40 ARG HB3 H 1 1.980 0.020 . 2 . . . . 140 ARG HB3 . 6949 1 439 . 1 1 40 40 ARG HG2 H 1 1.590 0.020 . 2 . . . . 140 ARG HG2 . 6949 1 440 . 1 1 40 40 ARG HG3 H 1 1.920 0.020 . 2 . . . . 140 ARG HG3 . 6949 1 441 . 1 1 40 40 ARG HD2 H 1 3.070 0.020 . 2 . . . . 140 ARG HD2 . 6949 1 442 . 1 1 40 40 ARG HD3 H 1 3.190 0.020 . 2 . . . . 140 ARG HD3 . 6949 1 443 . 1 1 40 40 ARG C C 13 179.720 0.400 . 1 . . . . 140 ARG C . 6949 1 444 . 1 1 40 40 ARG CA C 13 59.730 0.400 . 1 . . . . 140 ARG CA . 6949 1 445 . 1 1 40 40 ARG CB C 13 29.400 0.400 . 1 . . . . 140 ARG CB . 6949 1 446 . 1 1 40 40 ARG CG C 13 28.380 0.400 . 1 . . . . 140 ARG CG . 6949 1 447 . 1 1 40 40 ARG CD C 13 43.270 0.400 . 1 . . . . 140 ARG CD . 6949 1 448 . 1 1 40 40 ARG N N 15 114.730 0.400 . 1 . . . . 140 ARG N . 6949 1 449 . 1 1 41 41 GLU H H 1 7.980 0.020 . 1 . . . . 141 GLU H . 6949 1 450 . 1 1 41 41 GLU HA H 1 4.110 0.020 . 1 . . . . 141 GLU HA . 6949 1 451 . 1 1 41 41 GLU HB2 H 1 2.400 0.020 . 1 . . . . 141 GLU HB2 . 6949 1 452 . 1 1 41 41 GLU HB3 H 1 2.400 0.020 . 1 . . . . 141 GLU HB3 . 6949 1 453 . 1 1 41 41 GLU HG3 H 1 2.050 0.020 . 2 . . . . 141 GLU HG3 . 6949 1 454 . 1 1 41 41 GLU C C 13 180.720 0.400 . 1 . . . . 141 GLU C . 6949 1 455 . 1 1 41 41 GLU CA C 13 60.850 0.400 . 1 . . . . 141 GLU CA . 6949 1 456 . 1 1 41 41 GLU CB C 13 29.220 0.400 . 1 . . . . 141 GLU CB . 6949 1 457 . 1 1 41 41 GLU CG C 13 37.490 0.400 . 1 . . . . 141 GLU CG . 6949 1 458 . 1 1 41 41 GLU N N 15 120.960 0.400 . 1 . . . . 141 GLU N . 6949 1 459 . 1 1 42 42 PHE H H 1 8.570 0.020 . 1 . . . . 142 PHE H . 6949 1 460 . 1 1 42 42 PHE HA H 1 3.870 0.020 . 1 . . . . 142 PHE HA . 6949 1 461 . 1 1 42 42 PHE HB2 H 1 2.310 0.020 . 2 . . . . 142 PHE HB2 . 6949 1 462 . 1 1 42 42 PHE HB3 H 1 2.920 0.020 . 2 . . . . 142 PHE HB3 . 6949 1 463 . 1 1 42 42 PHE HD1 H 1 7.190 0.020 . 1 . . . . 142 PHE HD1 . 6949 1 464 . 1 1 42 42 PHE HE1 H 1 7.270 0.020 . 1 . . . . 142 PHE HE1 . 6949 1 465 . 1 1 42 42 PHE HZ H 1 7.110 0.020 . 1 . . . . 142 PHE HZ . 6949 1 466 . 1 1 42 42 PHE C C 13 178.260 0.400 . 1 . . . . 142 PHE C . 6949 1 467 . 1 1 42 42 PHE CA C 13 62.850 0.400 . 1 . . . . 142 PHE CA . 6949 1 468 . 1 1 42 42 PHE CB C 13 38.800 0.400 . 1 . . . . 142 PHE CB . 6949 1 469 . 1 1 42 42 PHE CD1 C 13 131.900 0.400 . 1 . . . . 142 PHE CD1 . 6949 1 470 . 1 1 42 42 PHE CE1 C 13 131.270 0.400 . 1 . . . . 142 PHE CE1 . 6949 1 471 . 1 1 42 42 PHE CZ C 13 129.200 0.400 . 1 . . . . 142 PHE CZ . 6949 1 472 . 1 1 42 42 PHE N N 15 123.400 0.400 . 1 . . . . 142 PHE N . 6949 1 473 . 1 1 43 43 LEU H H 1 8.010 0.020 . 1 . . . . 143 LEU H . 6949 1 474 . 1 1 43 43 LEU HA H 1 3.560 0.020 . 1 . . . . 143 LEU HA . 6949 1 475 . 1 1 43 43 LEU HB2 H 1 1.460 0.020 . 2 . . . . 143 LEU HB2 . 6949 1 476 . 1 1 43 43 LEU HB3 H 1 1.130 0.020 . 2 . . . . 143 LEU HB3 . 6949 1 477 . 1 1 43 43 LEU HD11 H 1 0.480 0.020 . 2 . . . . 143 LEU HD1 . 6949 1 478 . 1 1 43 43 LEU HD12 H 1 0.480 0.020 . 2 . . . . 143 LEU HD1 . 6949 1 479 . 1 1 43 43 LEU HD13 H 1 0.480 0.020 . 2 . . . . 143 LEU HD1 . 6949 1 480 . 1 1 43 43 LEU HD21 H 1 0.220 0.020 . 2 . . . . 143 LEU HD2 . 6949 1 481 . 1 1 43 43 LEU HD22 H 1 0.220 0.020 . 2 . . . . 143 LEU HD2 . 6949 1 482 . 1 1 43 43 LEU HD23 H 1 0.220 0.020 . 2 . . . . 143 LEU HD2 . 6949 1 483 . 1 1 43 43 LEU C C 13 180.110 0.400 . 1 . . . . 143 LEU C . 6949 1 484 . 1 1 43 43 LEU CA C 13 57.740 0.400 . 1 . . . . 143 LEU CA . 6949 1 485 . 1 1 43 43 LEU CB C 13 40.820 0.400 . 1 . . . . 143 LEU CB . 6949 1 486 . 1 1 43 43 LEU CD1 C 13 25.160 0.400 . 1 . . . . 143 LEU CD1 . 6949 1 487 . 1 1 43 43 LEU CD2 C 13 21.700 0.400 . 1 . . . . 143 LEU CD2 . 6949 1 488 . 1 1 43 43 LEU N N 15 118.690 0.400 . 1 . . . . 143 LEU N . 6949 1 489 . 1 1 44 44 HIS H H 1 8.170 0.020 . 1 . . . . 144 HIS H . 6949 1 490 . 1 1 44 44 HIS HA H 1 4.270 0.020 . 1 . . . . 144 HIS HA . 6949 1 491 . 1 1 44 44 HIS HB2 H 1 3.130 0.020 . 2 . . . . 144 HIS HB2 . 6949 1 492 . 1 1 44 44 HIS HB3 H 1 3.150 0.020 . 2 . . . . 144 HIS HB3 . 6949 1 493 . 1 1 44 44 HIS HD2 H 1 6.980 0.020 . 1 . . . . 144 HIS HD2 . 6949 1 494 . 1 1 44 44 HIS C C 13 177.210 0.400 . 1 . . . . 144 HIS C . 6949 1 495 . 1 1 44 44 HIS CA C 13 58.670 0.400 . 1 . . . . 144 HIS CA . 6949 1 496 . 1 1 44 44 HIS CB C 13 29.480 0.400 . 1 . . . . 144 HIS CB . 6949 1 497 . 1 1 44 44 HIS CD2 C 13 121.000 0.400 . 1 . . . . 144 HIS CD2 . 6949 1 498 . 1 1 44 44 HIS N N 15 119.720 0.400 . 1 . . . . 144 HIS N . 6949 1 499 . 1 1 45 45 HIS H H 1 7.840 0.020 . 1 . . . . 145 HIS H . 6949 1 500 . 1 1 45 45 HIS HA H 1 3.910 0.020 . 1 . . . . 145 HIS HA . 6949 1 501 . 1 1 45 45 HIS HB2 H 1 2.860 0.020 . 2 . . . . 145 HIS HB2 . 6949 1 502 . 1 1 45 45 HIS HB3 H 1 3.160 0.020 . 2 . . . . 145 HIS HB3 . 6949 1 503 . 1 1 45 45 HIS HD2 H 1 6.560 0.020 . 1 . . . . 145 HIS HD2 . 6949 1 504 . 1 1 45 45 HIS C C 13 176.820 0.400 . 1 . . . . 145 HIS C . 6949 1 505 . 1 1 45 45 HIS CA C 13 60.810 0.400 . 1 . . . . 145 HIS CA . 6949 1 506 . 1 1 45 45 HIS CB C 13 31.060 0.400 . 1 . . . . 145 HIS CB . 6949 1 507 . 1 1 45 45 HIS CD2 C 13 117.150 0.400 . 1 . . . . 145 HIS CD2 . 6949 1 508 . 1 1 45 45 HIS N N 15 120.200 0.400 . 1 . . . . 145 HIS N . 6949 1 509 . 1 1 46 46 LYS H H 1 8.060 0.020 . 1 . . . . 146 LYS H . 6949 1 510 . 1 1 46 46 LYS HA H 1 3.710 0.020 . 1 . . . . 146 LYS HA . 6949 1 511 . 1 1 46 46 LYS HB2 H 1 1.870 0.020 . 2 . . . . 146 LYS HB2 . 6949 1 512 . 1 1 46 46 LYS HB3 H 1 1.730 0.020 . 2 . . . . 146 LYS HB3 . 6949 1 513 . 1 1 46 46 LYS HG2 H 1 1.240 0.020 . 2 . . . . 146 LYS HG2 . 6949 1 514 . 1 1 46 46 LYS HG3 H 1 1.530 0.020 . 2 . . . . 146 LYS HG3 . 6949 1 515 . 1 1 46 46 LYS HD2 H 1 1.440 0.020 . 2 . . . . 146 LYS HD2 . 6949 1 516 . 1 1 46 46 LYS HD3 H 1 1.580 0.020 . 2 . . . . 146 LYS HD3 . 6949 1 517 . 1 1 46 46 LYS HE2 H 1 2.810 0.020 . 1 . . . . 146 LYS HE2 . 6949 1 518 . 1 1 46 46 LYS HE3 H 1 2.810 0.020 . 1 . . . . 146 LYS HE3 . 6949 1 519 . 1 1 46 46 LYS C C 13 179.290 0.400 . 1 . . . . 146 LYS C . 6949 1 520 . 1 1 46 46 LYS CA C 13 59.510 0.400 . 1 . . . . 146 LYS CA . 6949 1 521 . 1 1 46 46 LYS CB C 13 31.650 0.400 . 1 . . . . 146 LYS CB . 6949 1 522 . 1 1 46 46 LYS CG C 13 24.360 0.400 . 1 . . . . 146 LYS CG . 6949 1 523 . 1 1 46 46 LYS CD C 13 29.220 0.400 . 1 . . . . 146 LYS CD . 6949 1 524 . 1 1 46 46 LYS CE C 13 41.650 0.400 . 1 . . . . 146 LYS CE . 6949 1 525 . 1 1 46 46 LYS N N 15 117.640 0.400 . 1 . . . . 146 LYS N . 6949 1 526 . 1 1 47 47 GLU H H 1 7.780 0.020 . 1 . . . . 147 GLU H . 6949 1 527 . 1 1 47 47 GLU HA H 1 4.000 0.020 . 1 . . . . 147 GLU HA . 6949 1 528 . 1 1 47 47 GLU HB2 H 1 2.090 0.020 . 2 . . . . 147 GLU HB2 . 6949 1 529 . 1 1 47 47 GLU HB3 H 1 1.990 0.020 . 2 . . . . 147 GLU HB3 . 6949 1 530 . 1 1 47 47 GLU HG3 H 1 2.130 0.020 . 2 . . . . 147 GLU HG3 . 6949 1 531 . 1 1 47 47 GLU C C 13 179.000 0.400 . 1 . . . . 147 GLU C . 6949 1 532 . 1 1 47 47 GLU CA C 13 59.270 0.400 . 1 . . . . 147 GLU CA . 6949 1 533 . 1 1 47 47 GLU CB C 13 29.220 0.400 . 1 . . . . 147 GLU CB . 6949 1 534 . 1 1 47 47 GLU CG C 13 36.120 0.400 . 1 . . . . 147 GLU CG . 6949 1 535 . 1 1 47 47 GLU N N 15 120.020 0.400 . 1 . . . . 147 GLU N . 6949 1 536 . 1 1 48 48 LYS H H 1 7.760 0.020 . 1 . . . . 148 LYS H . 6949 1 537 . 1 1 48 48 LYS HA H 1 3.870 0.020 . 1 . . . . 148 LYS HA . 6949 1 538 . 1 1 48 48 LYS HB2 H 1 1.710 0.020 . 2 . . . . 148 LYS HB2 . 6949 1 539 . 1 1 48 48 LYS HB3 H 1 1.500 0.020 . 2 . . . . 148 LYS HB3 . 6949 1 540 . 1 1 48 48 LYS HG2 H 1 1.290 0.020 . 2 . . . . 148 LYS HG2 . 6949 1 541 . 1 1 48 48 LYS HG3 H 1 1.140 0.020 . 2 . . . . 148 LYS HG3 . 6949 1 542 . 1 1 48 48 LYS HD2 H 1 1.380 0.020 . 1 . . . . 148 LYS HD2 . 6949 1 543 . 1 1 48 48 LYS HD3 H 1 1.380 0.020 . 1 . . . . 148 LYS HD3 . 6949 1 544 . 1 1 48 48 LYS HE2 H 1 2.640 0.020 . 2 . . . . 148 LYS HE2 . 6949 1 545 . 1 1 48 48 LYS HE3 H 1 2.560 0.020 . 2 . . . . 148 LYS HE3 . 6949 1 546 . 1 1 48 48 LYS C C 13 180.240 0.400 . 1 . . . . 148 LYS C . 6949 1 547 . 1 1 48 48 LYS CA C 13 58.900 0.400 . 1 . . . . 148 LYS CA . 6949 1 548 . 1 1 48 48 LYS CB C 13 31.820 0.400 . 1 . . . . 148 LYS CB . 6949 1 549 . 1 1 48 48 LYS CG C 13 24.110 0.400 . 1 . . . . 148 LYS CG . 6949 1 550 . 1 1 48 48 LYS CD C 13 28.740 0.400 . 1 . . . . 148 LYS CD . 6949 1 551 . 1 1 48 48 LYS N N 15 121.070 0.400 . 1 . . . . 148 LYS N . 6949 1 552 . 1 1 49 49 VAL H H 1 8.150 0.020 . 1 . . . . 149 VAL H . 6949 1 553 . 1 1 49 49 VAL HA H 1 3.380 0.020 . 1 . . . . 149 VAL HA . 6949 1 554 . 1 1 49 49 VAL HB H 1 1.940 0.020 . 1 . . . . 149 VAL HB . 6949 1 555 . 1 1 49 49 VAL HG11 H 1 0.870 0.020 . 2 . . . . 149 VAL HG1 . 6949 1 556 . 1 1 49 49 VAL HG12 H 1 0.870 0.020 . 2 . . . . 149 VAL HG1 . 6949 1 557 . 1 1 49 49 VAL HG13 H 1 0.870 0.020 . 2 . . . . 149 VAL HG1 . 6949 1 558 . 1 1 49 49 VAL HG21 H 1 0.560 0.020 . 2 . . . . 149 VAL HG2 . 6949 1 559 . 1 1 49 49 VAL HG22 H 1 0.560 0.020 . 2 . . . . 149 VAL HG2 . 6949 1 560 . 1 1 49 49 VAL HG23 H 1 0.560 0.020 . 2 . . . . 149 VAL HG2 . 6949 1 561 . 1 1 49 49 VAL C C 13 177.610 0.400 . 1 . . . . 149 VAL C . 6949 1 562 . 1 1 49 49 VAL CA C 13 66.960 0.400 . 1 . . . . 149 VAL CA . 6949 1 563 . 1 1 49 49 VAL CB C 13 31.580 0.400 . 1 . . . . 149 VAL CB . 6949 1 564 . 1 1 49 49 VAL CG1 C 13 21.280 0.400 . 1 . . . . 149 VAL CG1 . 6949 1 565 . 1 1 49 49 VAL CG2 C 13 23.030 0.400 . 1 . . . . 149 VAL CG2 . 6949 1 566 . 1 1 49 49 VAL N N 15 122.150 0.400 . 1 . . . . 149 VAL N . 6949 1 567 . 1 1 50 50 HIS H H 1 8.090 0.020 . 1 . . . . 150 HIS H . 6949 1 568 . 1 1 50 50 HIS HA H 1 4.290 0.020 . 1 . . . . 150 HIS HA . 6949 1 569 . 1 1 50 50 HIS HB2 H 1 3.090 0.020 . 2 . . . . 150 HIS HB2 . 6949 1 570 . 1 1 50 50 HIS HB3 H 1 3.230 0.020 . 2 . . . . 150 HIS HB3 . 6949 1 571 . 1 1 50 50 HIS HD2 H 1 7.000 0.020 . 1 . . . . 150 HIS HD2 . 6949 1 572 . 1 1 50 50 HIS C C 13 176.990 0.400 . 1 . . . . 150 HIS C . 6949 1 573 . 1 1 50 50 HIS CA C 13 60.010 0.400 . 1 . . . . 150 HIS CA . 6949 1 574 . 1 1 50 50 HIS CB C 13 29.460 0.400 . 1 . . . . 150 HIS CB . 6949 1 575 . 1 1 50 50 HIS CD2 C 13 119.650 0.400 . 1 . . . . 150 HIS CD2 . 6949 1 576 . 1 1 50 50 HIS N N 15 119.720 0.400 . 1 . . . . 150 HIS N . 6949 1 577 . 1 1 51 51 GLU H H 1 8.120 0.020 . 1 . . . . 151 GLU H . 6949 1 578 . 1 1 51 51 GLU HA H 1 3.680 0.020 . 1 . . . . 151 GLU HA . 6949 1 579 . 1 1 51 51 GLU HB2 H 1 1.940 0.020 . 2 . . . . 151 GLU HB2 . 6949 1 580 . 1 1 51 51 GLU HB3 H 1 2.090 0.020 . 2 . . . . 151 GLU HB3 . 6949 1 581 . 1 1 51 51 GLU HG3 H 1 2.040 0.020 . 2 . . . . 151 GLU HG3 . 6949 1 582 . 1 1 51 51 GLU C C 13 179.160 0.400 . 1 . . . . 151 GLU C . 6949 1 583 . 1 1 51 51 GLU CA C 13 59.390 0.400 . 1 . . . . 151 GLU CA . 6949 1 584 . 1 1 51 51 GLU CB C 13 29.690 0.400 . 1 . . . . 151 GLU CB . 6949 1 585 . 1 1 51 51 GLU CG C 13 36.520 0.400 . 1 . . . . 151 GLU CG . 6949 1 586 . 1 1 51 51 GLU N N 15 117.430 0.400 . 1 . . . . 151 GLU N . 6949 1 587 . 1 1 52 52 TYR H H 1 7.910 0.020 . 1 . . . . 152 TYR H . 6949 1 588 . 1 1 52 52 TYR HA H 1 3.770 0.020 . 1 . . . . 152 TYR HA . 6949 1 589 . 1 1 52 52 TYR HB2 H 1 2.860 0.020 . 2 . . . . 152 TYR HB2 . 6949 1 590 . 1 1 52 52 TYR HB3 H 1 3.080 0.020 . 2 . . . . 152 TYR HB3 . 6949 1 591 . 1 1 52 52 TYR HD1 H 1 6.820 0.020 . 1 . . . . 152 TYR HD1 . 6949 1 592 . 1 1 52 52 TYR HE1 H 1 6.720 0.020 . 1 . . . . 152 TYR HE1 . 6949 1 593 . 1 1 52 52 TYR C C 13 175.430 0.400 . 1 . . . . 152 TYR C . 6949 1 594 . 1 1 52 52 TYR CA C 13 61.820 0.400 . 1 . . . . 152 TYR CA . 6949 1 595 . 1 1 52 52 TYR CB C 13 38.960 0.400 . 1 . . . . 152 TYR CB . 6949 1 596 . 1 1 52 52 TYR CD1 C 13 132.630 0.400 . 1 . . . . 152 TYR CD1 . 6949 1 597 . 1 1 52 52 TYR CE1 C 13 118.490 0.400 . 1 . . . . 152 TYR CE1 . 6949 1 598 . 1 1 52 52 TYR N N 15 120.930 0.400 . 1 . . . . 152 TYR N . 6949 1 599 . 1 1 53 53 ASN H H 1 8.390 0.020 . 1 . . . . 153 ASN H . 6949 1 600 . 1 1 53 53 ASN HA H 1 4.100 0.020 . 1 . . . . 153 ASN HA . 6949 1 601 . 1 1 53 53 ASN HB2 H 1 2.580 0.020 . 2 . . . . 153 ASN HB2 . 6949 1 602 . 1 1 53 53 ASN HB3 H 1 2.860 0.020 . 2 . . . . 153 ASN HB3 . 6949 1 603 . 1 1 53 53 ASN C C 13 178.840 0.400 . 1 . . . . 153 ASN C . 6949 1 604 . 1 1 53 53 ASN CA C 13 56.120 0.400 . 1 . . . . 153 ASN CA . 6949 1 605 . 1 1 53 53 ASN CB C 13 37.660 0.400 . 1 . . . . 153 ASN CB . 6949 1 606 . 1 1 53 53 ASN N N 15 118.530 0.400 . 1 . . . . 153 ASN N . 6949 1 607 . 1 1 54 54 VAL H H 1 8.120 0.020 . 1 . . . . 154 VAL H . 6949 1 608 . 1 1 54 54 VAL HA H 1 3.500 0.020 . 1 . . . . 154 VAL HA . 6949 1 609 . 1 1 54 54 VAL HB H 1 1.810 0.020 . 1 . . . . 154 VAL HB . 6949 1 610 . 1 1 54 54 VAL HG11 H 1 0.700 0.020 . 2 . . . . 154 VAL HG1 . 6949 1 611 . 1 1 54 54 VAL HG12 H 1 0.700 0.020 . 2 . . . . 154 VAL HG1 . 6949 1 612 . 1 1 54 54 VAL HG13 H 1 0.700 0.020 . 2 . . . . 154 VAL HG1 . 6949 1 613 . 1 1 54 54 VAL HG21 H 1 0.590 0.020 . 2 . . . . 154 VAL HG2 . 6949 1 614 . 1 1 54 54 VAL HG22 H 1 0.590 0.020 . 2 . . . . 154 VAL HG2 . 6949 1 615 . 1 1 54 54 VAL HG23 H 1 0.590 0.020 . 2 . . . . 154 VAL HG2 . 6949 1 616 . 1 1 54 54 VAL C C 13 178.910 0.400 . 1 . . . . 154 VAL C . 6949 1 617 . 1 1 54 54 VAL CA C 13 66.390 0.400 . 1 . . . . 154 VAL CA . 6949 1 618 . 1 1 54 54 VAL CB C 13 31.710 0.400 . 1 . . . . 154 VAL CB . 6949 1 619 . 1 1 54 54 VAL CG1 C 13 21.070 0.400 . 1 . . . . 154 VAL CG1 . 6949 1 620 . 1 1 54 54 VAL CG2 C 13 22.410 0.400 . 1 . . . . 154 VAL CG2 . 6949 1 621 . 1 1 54 54 VAL N N 15 121.120 0.400 . 1 . . . . 154 VAL N . 6949 1 622 . 1 1 55 55 LEU H H 1 7.650 0.020 . 1 . . . . 155 LEU H . 6949 1 623 . 1 1 55 55 LEU HA H 1 3.910 0.020 . 1 . . . . 155 LEU HA . 6949 1 624 . 1 1 55 55 LEU HB2 H 1 1.500 0.020 . 1 . . . . 155 LEU HB2 . 6949 1 625 . 1 1 55 55 LEU HB3 H 1 1.500 0.020 . 1 . . . . 155 LEU HB3 . 6949 1 626 . 1 1 55 55 LEU HG H 1 1.480 0.020 . 1 . . . . 155 LEU HG . 6949 1 627 . 1 1 55 55 LEU HD11 H 1 0.720 0.020 . 2 . . . . 155 LEU HD1 . 6949 1 628 . 1 1 55 55 LEU HD12 H 1 0.720 0.020 . 2 . . . . 155 LEU HD1 . 6949 1 629 . 1 1 55 55 LEU HD13 H 1 0.720 0.020 . 2 . . . . 155 LEU HD1 . 6949 1 630 . 1 1 55 55 LEU HD21 H 1 0.670 0.020 . 2 . . . . 155 LEU HD2 . 6949 1 631 . 1 1 55 55 LEU HD22 H 1 0.670 0.020 . 2 . . . . 155 LEU HD2 . 6949 1 632 . 1 1 55 55 LEU HD23 H 1 0.670 0.020 . 2 . . . . 155 LEU HD2 . 6949 1 633 . 1 1 55 55 LEU C C 13 178.810 0.400 . 1 . . . . 155 LEU C . 6949 1 634 . 1 1 55 55 LEU CA C 13 57.820 0.400 . 1 . . . . 155 LEU CA . 6949 1 635 . 1 1 55 55 LEU CB C 13 41.370 0.400 . 1 . . . . 155 LEU CB . 6949 1 636 . 1 1 55 55 LEU CG C 13 26.690 0.400 . 1 . . . . 155 LEU CG . 6949 1 637 . 1 1 55 55 LEU CD1 C 13 23.510 0.400 . 1 . . . . 155 LEU CD1 . 6949 1 638 . 1 1 55 55 LEU CD2 C 13 24.540 0.400 . 1 . . . . 155 LEU CD2 . 6949 1 639 . 1 1 55 55 LEU N N 15 123.420 0.400 . 1 . . . . 155 LEU N . 6949 1 640 . 1 1 56 56 LEU H H 1 8.350 0.020 . 1 . . . . 156 LEU H . 6949 1 641 . 1 1 56 56 LEU HA H 1 3.600 0.020 . 1 . . . . 156 LEU HA . 6949 1 642 . 1 1 56 56 LEU HB2 H 1 1.400 0.020 . 2 . . . . 156 LEU HB2 . 6949 1 643 . 1 1 56 56 LEU HB3 H 1 1.120 0.020 . 2 . . . . 156 LEU HB3 . 6949 1 644 . 1 1 56 56 LEU HG H 1 1.210 0.020 . 1 . . . . 156 LEU HG . 6949 1 645 . 1 1 56 56 LEU HD11 H 1 0.640 0.020 . 2 . . . . 156 LEU HD1 . 6949 1 646 . 1 1 56 56 LEU HD12 H 1 0.640 0.020 . 2 . . . . 156 LEU HD1 . 6949 1 647 . 1 1 56 56 LEU HD13 H 1 0.640 0.020 . 2 . . . . 156 LEU HD1 . 6949 1 648 . 1 1 56 56 LEU HD21 H 1 0.680 0.020 . 2 . . . . 156 LEU HD2 . 6949 1 649 . 1 1 56 56 LEU HD22 H 1 0.680 0.020 . 2 . . . . 156 LEU HD2 . 6949 1 650 . 1 1 56 56 LEU HD23 H 1 0.680 0.020 . 2 . . . . 156 LEU HD2 . 6949 1 651 . 1 1 56 56 LEU C C 13 179.750 0.400 . 1 . . . . 156 LEU C . 6949 1 652 . 1 1 56 56 LEU CA C 13 58.100 0.400 . 1 . . . . 156 LEU CA . 6949 1 653 . 1 1 56 56 LEU CB C 13 41.620 0.400 . 1 . . . . 156 LEU CB . 6949 1 654 . 1 1 56 56 LEU CG C 13 26.730 0.400 . 1 . . . . 156 LEU CG . 6949 1 655 . 1 1 56 56 LEU CD1 C 13 24.300 0.400 . 1 . . . . 156 LEU CD1 . 6949 1 656 . 1 1 56 56 LEU CD2 C 13 24.300 0.400 . 1 . . . . 156 LEU CD2 . 6949 1 657 . 1 1 56 56 LEU N N 15 120.180 0.400 . 1 . . . . 156 LEU N . 6949 1 658 . 1 1 57 57 GLU H H 1 7.780 0.020 . 1 . . . . 157 GLU H . 6949 1 659 . 1 1 57 57 GLU HA H 1 3.830 0.020 . 1 . . . . 157 GLU HA . 6949 1 660 . 1 1 57 57 GLU HB2 H 1 1.980 0.020 . 1 . . . . 157 GLU HB2 . 6949 1 661 . 1 1 57 57 GLU HB3 H 1 1.980 0.020 . 1 . . . . 157 GLU HB3 . 6949 1 662 . 1 1 57 57 GLU HG3 H 1 2.100 0.020 . 2 . . . . 157 GLU HG3 . 6949 1 663 . 1 1 57 57 GLU C C 13 179.080 0.400 . 1 . . . . 157 GLU C . 6949 1 664 . 1 1 57 57 GLU CA C 13 59.260 0.400 . 1 . . . . 157 GLU CA . 6949 1 665 . 1 1 57 57 GLU CB C 13 29.140 0.400 . 1 . . . . 157 GLU CB . 6949 1 666 . 1 1 57 57 GLU CG C 13 36.180 0.400 . 1 . . . . 157 GLU CG . 6949 1 667 . 1 1 57 57 GLU N N 15 119.300 0.400 . 1 . . . . 157 GLU N . 6949 1 668 . 1 1 58 58 THR H H 1 7.990 0.020 . 1 . . . . 158 THR H . 6949 1 669 . 1 1 58 58 THR HA H 1 3.810 0.020 . 1 . . . . 158 THR HA . 6949 1 670 . 1 1 58 58 THR HB H 1 4.190 0.020 . 1 . . . . 158 THR HB . 6949 1 671 . 1 1 58 58 THR HG21 H 1 1.090 0.020 . 1 . . . . 158 THR HG2 . 6949 1 672 . 1 1 58 58 THR HG22 H 1 1.090 0.020 . 1 . . . . 158 THR HG2 . 6949 1 673 . 1 1 58 58 THR HG23 H 1 1.090 0.020 . 1 . . . . 158 THR HG2 . 6949 1 674 . 1 1 58 58 THR C C 13 176.780 0.400 . 1 . . . . 158 THR C . 6949 1 675 . 1 1 58 58 THR CA C 13 65.970 0.400 . 1 . . . . 158 THR CA . 6949 1 676 . 1 1 58 58 THR CB C 13 69.300 0.400 . 1 . . . . 158 THR CB . 6949 1 677 . 1 1 58 58 THR CG2 C 13 21.250 0.400 . 1 . . . . 158 THR CG2 . 6949 1 678 . 1 1 58 58 THR N N 15 114.730 0.400 . 1 . . . . 158 THR N . 6949 1 679 . 1 1 59 59 LEU H H 1 8.040 0.020 . 1 . . . . 159 LEU H . 6949 1 680 . 1 1 59 59 LEU HA H 1 4.000 0.020 . 1 . . . . 159 LEU HA . 6949 1 681 . 1 1 59 59 LEU HB2 H 1 1.540 0.020 . 2 . . . . 159 LEU HB2 . 6949 1 682 . 1 1 59 59 LEU HB3 H 1 1.260 0.020 . 2 . . . . 159 LEU HB3 . 6949 1 683 . 1 1 59 59 LEU HG H 1 1.540 0.020 . 1 . . . . 159 LEU HG . 6949 1 684 . 1 1 59 59 LEU HD11 H 1 0.490 0.020 . 2 . . . . 159 LEU HD1 . 6949 1 685 . 1 1 59 59 LEU HD12 H 1 0.490 0.020 . 2 . . . . 159 LEU HD1 . 6949 1 686 . 1 1 59 59 LEU HD13 H 1 0.490 0.020 . 2 . . . . 159 LEU HD1 . 6949 1 687 . 1 1 59 59 LEU HD21 H 1 0.470 0.020 . 2 . . . . 159 LEU HD2 . 6949 1 688 . 1 1 59 59 LEU HD22 H 1 0.470 0.020 . 2 . . . . 159 LEU HD2 . 6949 1 689 . 1 1 59 59 LEU HD23 H 1 0.470 0.020 . 2 . . . . 159 LEU HD2 . 6949 1 690 . 1 1 59 59 LEU C C 13 178.400 0.400 . 1 . . . . 159 LEU C . 6949 1 691 . 1 1 59 59 LEU CA C 13 56.820 0.400 . 1 . . . . 159 LEU CA . 6949 1 692 . 1 1 59 59 LEU CB C 13 41.670 0.400 . 1 . . . . 159 LEU CB . 6949 1 693 . 1 1 59 59 LEU CD1 C 13 22.900 0.400 . 1 . . . . 159 LEU CD1 . 6949 1 694 . 1 1 59 59 LEU CD2 C 13 25.240 0.400 . 1 . . . . 159 LEU CD2 . 6949 1 695 . 1 1 59 59 LEU N N 15 121.750 0.400 . 1 . . . . 159 LEU N . 6949 1 696 . 1 1 60 60 SER H H 1 7.850 0.020 . 1 . . . . 160 SER H . 6949 1 697 . 1 1 60 60 SER HA H 1 4.200 0.020 . 1 . . . . 160 SER HA . 6949 1 698 . 1 1 60 60 SER HB2 H 1 3.850 0.020 . 2 . . . . 160 SER HB2 . 6949 1 699 . 1 1 60 60 SER HB3 H 1 3.800 0.020 . 2 . . . . 160 SER HB3 . 6949 1 700 . 1 1 60 60 SER C C 13 174.980 0.400 . 1 . . . . 160 SER C . 6949 1 701 . 1 1 60 60 SER CA C 13 60.090 0.400 . 1 . . . . 160 SER CA . 6949 1 702 . 1 1 60 60 SER CB C 13 63.450 0.400 . 1 . . . . 160 SER CB . 6949 1 703 . 1 1 60 60 SER N N 15 114.180 0.400 . 1 . . . . 160 SER N . 6949 1 704 . 1 1 61 61 ARG H H 1 7.560 0.020 . 1 . . . . 161 ARG H . 6949 1 705 . 1 1 61 61 ARG HA H 1 4.250 0.020 . 1 . . . . 161 ARG HA . 6949 1 706 . 1 1 61 61 ARG HB2 H 1 1.750 0.020 . 2 . . . . 161 ARG HB2 . 6949 1 707 . 1 1 61 61 ARG HB3 H 1 1.840 0.020 . 2 . . . . 161 ARG HB3 . 6949 1 708 . 1 1 61 61 ARG HG2 H 1 1.540 0.020 . 2 . . . . 161 ARG HG2 . 6949 1 709 . 1 1 61 61 ARG HG3 H 1 1.650 0.020 . 2 . . . . 161 ARG HG3 . 6949 1 710 . 1 1 61 61 ARG HD2 H 1 3.080 0.020 . 1 . . . . 161 ARG HD2 . 6949 1 711 . 1 1 61 61 ARG HD3 H 1 3.080 0.020 . 1 . . . . 161 ARG HD3 . 6949 1 712 . 1 1 61 61 ARG C C 13 177.060 0.400 . 1 . . . . 161 ARG C . 6949 1 713 . 1 1 61 61 ARG CA C 13 56.950 0.400 . 1 . . . . 161 ARG CA . 6949 1 714 . 1 1 61 61 ARG CB C 13 30.450 0.400 . 1 . . . . 161 ARG CB . 6949 1 715 . 1 1 61 61 ARG CG C 13 27.200 0.400 . 1 . . . . 161 ARG CG . 6949 1 716 . 1 1 61 61 ARG CD C 13 43.210 0.400 . 1 . . . . 161 ARG CD . 6949 1 717 . 1 1 61 61 ARG N N 15 120.490 0.400 . 1 . . . . 161 ARG N . 6949 1 718 . 1 1 62 62 THR H H 1 7.810 0.020 . 1 . . . . 162 THR H . 6949 1 719 . 1 1 62 62 THR HA H 1 4.180 0.020 . 1 . . . . 162 THR HA . 6949 1 720 . 1 1 62 62 THR HB H 1 4.160 0.020 . 1 . . . . 162 THR HB . 6949 1 721 . 1 1 62 62 THR HG21 H 1 1.120 0.020 . 1 . . . . 162 THR HG2 . 6949 1 722 . 1 1 62 62 THR HG22 H 1 1.120 0.020 . 1 . . . . 162 THR HG2 . 6949 1 723 . 1 1 62 62 THR HG23 H 1 1.120 0.020 . 1 . . . . 162 THR HG2 . 6949 1 724 . 1 1 62 62 THR C C 13 174.670 0.400 . 1 . . . . 162 THR C . 6949 1 725 . 1 1 62 62 THR CA C 13 62.640 0.400 . 1 . . . . 162 THR CA . 6949 1 726 . 1 1 62 62 THR CB C 13 69.620 0.400 . 1 . . . . 162 THR CB . 6949 1 727 . 1 1 62 62 THR CG2 C 13 21.230 0.400 . 1 . . . . 162 THR CG2 . 6949 1 728 . 1 1 62 62 THR N N 15 113.140 0.400 . 1 . . . . 162 THR N . 6949 1 729 . 1 1 63 63 GLU H H 1 8.170 0.020 . 1 . . . . 163 GLU H . 6949 1 730 . 1 1 63 63 GLU HA H 1 4.200 0.020 . 1 . . . . 163 GLU HA . 6949 1 731 . 1 1 63 63 GLU HB2 H 1 1.980 0.020 . 2 . . . . 163 GLU HB2 . 6949 1 732 . 1 1 63 63 GLU HB3 H 1 1.820 0.020 . 2 . . . . 163 GLU HB3 . 6949 1 733 . 1 1 63 63 GLU HG3 H 1 2.140 0.020 . 2 . . . . 163 GLU HG3 . 6949 1 734 . 1 1 63 63 GLU C C 13 176.200 0.400 . 1 . . . . 163 GLU C . 6949 1 735 . 1 1 63 63 GLU CA C 13 56.650 0.400 . 1 . . . . 163 GLU CA . 6949 1 736 . 1 1 63 63 GLU CB C 13 30.290 0.400 . 1 . . . . 163 GLU CB . 6949 1 737 . 1 1 63 63 GLU CG C 13 36.270 0.400 . 1 . . . . 163 GLU CG . 6949 1 738 . 1 1 63 63 GLU N N 15 122.140 0.400 . 1 . . . . 163 GLU N . 6949 1 739 . 1 1 64 64 GLU H H 1 8.140 0.020 . 1 . . . . 164 GLU H . 6949 1 740 . 1 1 64 64 GLU HA H 1 4.100 0.020 . 1 . . . . 164 GLU HA . 6949 1 741 . 1 1 64 64 GLU HB2 H 1 1.840 0.020 . 1 . . . . 164 GLU HB2 . 6949 1 742 . 1 1 64 64 GLU HB3 H 1 1.840 0.020 . 1 . . . . 164 GLU HB3 . 6949 1 743 . 1 1 64 64 GLU HG3 H 1 2.070 0.020 . 2 . . . . 164 GLU HG3 . 6949 1 744 . 1 1 64 64 GLU C C 13 176.260 0.400 . 1 . . . . 164 GLU C . 6949 1 745 . 1 1 64 64 GLU CA C 13 56.650 0.400 . 1 . . . . 164 GLU CA . 6949 1 746 . 1 1 64 64 GLU CB C 13 30.100 0.400 . 1 . . . . 164 GLU CB . 6949 1 747 . 1 1 64 64 GLU CG C 13 36.240 0.400 . 1 . . . . 164 GLU CG . 6949 1 748 . 1 1 64 64 GLU N N 15 120.960 0.400 . 1 . . . . 164 GLU N . 6949 1 749 . 1 1 65 65 ILE H H 1 7.890 0.020 . 1 . . . . 165 ILE H . 6949 1 750 . 1 1 65 65 ILE HA H 1 4.000 0.020 . 1 . . . . 165 ILE HA . 6949 1 751 . 1 1 65 65 ILE HB H 1 1.690 0.020 . 1 . . . . 165 ILE HB . 6949 1 752 . 1 1 65 65 ILE HG12 H 1 1.250 0.020 . 2 . . . . 165 ILE HG12 . 6949 1 753 . 1 1 65 65 ILE HG13 H 1 0.990 0.020 . 2 . . . . 165 ILE HG13 . 6949 1 754 . 1 1 65 65 ILE HG21 H 1 0.690 0.020 . 1 . . . . 165 ILE HG2 . 6949 1 755 . 1 1 65 65 ILE HG22 H 1 0.690 0.020 . 1 . . . . 165 ILE HG2 . 6949 1 756 . 1 1 65 65 ILE HG23 H 1 0.690 0.020 . 1 . . . . 165 ILE HG2 . 6949 1 757 . 1 1 65 65 ILE HD11 H 1 0.670 0.020 . 1 . . . . 165 ILE HD1 . 6949 1 758 . 1 1 65 65 ILE HD12 H 1 0.670 0.020 . 1 . . . . 165 ILE HD1 . 6949 1 759 . 1 1 65 65 ILE HD13 H 1 0.670 0.020 . 1 . . . . 165 ILE HD1 . 6949 1 760 . 1 1 65 65 ILE C C 13 175.860 0.400 . 1 . . . . 165 ILE C . 6949 1 761 . 1 1 65 65 ILE CA C 13 60.990 0.400 . 1 . . . . 165 ILE CA . 6949 1 762 . 1 1 65 65 ILE CB C 13 38.550 0.400 . 1 . . . . 165 ILE CB . 6949 1 763 . 1 1 65 65 ILE CG1 C 13 27.160 0.400 . 1 . . . . 165 ILE CG1 . 6949 1 764 . 1 1 65 65 ILE CG2 C 13 17.270 0.400 . 1 . . . . 165 ILE CG2 . 6949 1 765 . 1 1 65 65 ILE CD1 C 13 12.810 0.400 . 1 . . . . 165 ILE CD1 . 6949 1 766 . 1 1 65 65 ILE N N 15 120.820 0.400 . 1 . . . . 165 ILE N . 6949 1 767 . 1 1 66 66 HIS H H 1 8.180 0.020 . 1 . . . . 166 HIS H . 6949 1 768 . 1 1 66 66 HIS HA H 1 4.520 0.020 . 1 . . . . 166 HIS HA . 6949 1 769 . 1 1 66 66 HIS HB2 H 1 2.940 0.020 . 2 . . . . 166 HIS HB2 . 6949 1 770 . 1 1 66 66 HIS HB3 H 1 3.030 0.020 . 2 . . . . 166 HIS HB3 . 6949 1 771 . 1 1 66 66 HIS HD2 H 1 6.940 0.020 . 1 . . . . 166 HIS HD2 . 6949 1 772 . 1 1 66 66 HIS C C 13 175.210 0.400 . 1 . . . . 166 HIS C . 6949 1 773 . 1 1 66 66 HIS CA C 13 55.960 0.400 . 1 . . . . 166 HIS CA . 6949 1 774 . 1 1 66 66 HIS CB C 13 30.630 0.400 . 1 . . . . 166 HIS CB . 6949 1 775 . 1 1 66 66 HIS CD2 C 13 119.780 0.400 . 1 . . . . 166 HIS CD2 . 6949 1 776 . 1 1 66 66 HIS N N 15 123.270 0.400 . 1 . . . . 166 HIS N . 6949 1 777 . 1 1 67 67 GLU H H 1 8.250 0.020 . 1 . . . . 167 GLU H . 6949 1 778 . 1 1 67 67 GLU HA H 1 4.110 0.020 . 1 . . . . 167 GLU HA . 6949 1 779 . 1 1 67 67 GLU HB2 H 1 1.910 0.020 . 2 . . . . 167 GLU HB2 . 6949 1 780 . 1 1 67 67 GLU HB3 H 1 1.800 0.020 . 2 . . . . 167 GLU HB3 . 6949 1 781 . 1 1 67 67 GLU HG3 H 1 2.070 0.020 . 2 . . . . 167 GLU HG3 . 6949 1 782 . 1 1 67 67 GLU C C 13 175.980 0.400 . 1 . . . . 167 GLU C . 6949 1 783 . 1 1 67 67 GLU CA C 13 56.810 0.400 . 1 . . . . 167 GLU CA . 6949 1 784 . 1 1 67 67 GLU CB C 13 30.120 0.400 . 1 . . . . 167 GLU CB . 6949 1 785 . 1 1 67 67 GLU CG C 13 36.020 0.400 . 1 . . . . 167 GLU CG . 6949 1 786 . 1 1 67 67 GLU N N 15 121.440 0.400 . 1 . . . . 167 GLU N . 6949 1 787 . 1 1 68 68 ASN H H 1 8.460 0.020 . 1 . . . . 168 ASN H . 6949 1 788 . 1 1 68 68 ASN HA H 1 4.030 0.020 . 1 . . . . 168 ASN HA . 6949 1 789 . 1 1 68 68 ASN HB2 H 1 2.630 0.020 . 2 . . . . 168 ASN HB2 . 6949 1 790 . 1 1 68 68 ASN HB3 H 1 2.720 0.020 . 2 . . . . 168 ASN HB3 . 6949 1 791 . 1 1 68 68 ASN C C 13 174.840 0.400 . 1 . . . . 168 ASN C . 6949 1 792 . 1 1 68 68 ASN CA C 13 53.150 0.400 . 1 . . . . 168 ASN CA . 6949 1 793 . 1 1 68 68 ASN CB C 13 38.780 0.400 . 1 . . . . 168 ASN CB . 6949 1 794 . 1 1 68 68 ASN N N 15 118.890 0.400 . 1 . . . . 168 ASN N . 6949 1 795 . 1 1 69 69 VAL H H 1 7.890 0.020 . 1 . . . . 169 VAL H . 6949 1 796 . 1 1 69 69 VAL HA H 1 3.990 0.020 . 1 . . . . 169 VAL HA . 6949 1 797 . 1 1 69 69 VAL HB H 1 1.960 0.020 . 1 . . . . 169 VAL HB . 6949 1 798 . 1 1 69 69 VAL HG11 H 1 0.760 0.020 . 2 . . . . 169 VAL HG1 . 6949 1 799 . 1 1 69 69 VAL HG12 H 1 0.760 0.020 . 2 . . . . 169 VAL HG1 . 6949 1 800 . 1 1 69 69 VAL HG13 H 1 0.760 0.020 . 2 . . . . 169 VAL HG1 . 6949 1 801 . 1 1 69 69 VAL HG21 H 1 0.770 0.020 . 2 . . . . 169 VAL HG2 . 6949 1 802 . 1 1 69 69 VAL HG22 H 1 0.770 0.020 . 2 . . . . 169 VAL HG2 . 6949 1 803 . 1 1 69 69 VAL HG23 H 1 0.770 0.020 . 2 . . . . 169 VAL HG2 . 6949 1 804 . 1 1 69 69 VAL C C 13 175.830 0.400 . 1 . . . . 169 VAL C . 6949 1 805 . 1 1 69 69 VAL CA C 13 62.290 0.400 . 1 . . . . 169 VAL CA . 6949 1 806 . 1 1 69 69 VAL CB C 13 32.650 0.400 . 1 . . . . 169 VAL CB . 6949 1 807 . 1 1 69 69 VAL CG1 C 13 21.130 0.400 . 1 . . . . 169 VAL CG1 . 6949 1 808 . 1 1 69 69 VAL CG2 C 13 20.440 0.400 . 1 . . . . 169 VAL CG2 . 6949 1 809 . 1 1 69 69 VAL N N 15 119.640 0.400 . 1 . . . . 169 VAL N . 6949 1 810 . 1 1 70 70 ILE H H 1 8.070 0.020 . 1 . . . . 170 ILE H . 6949 1 811 . 1 1 70 70 ILE HA H 1 4.080 0.020 . 1 . . . . 170 ILE HA . 6949 1 812 . 1 1 70 70 ILE HB H 1 1.720 0.020 . 1 . . . . 170 ILE HB . 6949 1 813 . 1 1 70 70 ILE HG12 H 1 1.330 0.020 . 2 . . . . 170 ILE HG12 . 6949 1 814 . 1 1 70 70 ILE HG13 H 1 1.040 0.020 . 2 . . . . 170 ILE HG13 . 6949 1 815 . 1 1 70 70 ILE HG21 H 1 0.750 0.020 . 1 . . . . 170 ILE HG2 . 6949 1 816 . 1 1 70 70 ILE HG22 H 1 0.750 0.020 . 1 . . . . 170 ILE HG2 . 6949 1 817 . 1 1 70 70 ILE HG23 H 1 0.750 0.020 . 1 . . . . 170 ILE HG2 . 6949 1 818 . 1 1 70 70 ILE HD11 H 1 0.690 0.020 . 1 . . . . 170 ILE HD1 . 6949 1 819 . 1 1 70 70 ILE HD12 H 1 0.690 0.020 . 1 . . . . 170 ILE HD1 . 6949 1 820 . 1 1 70 70 ILE HD13 H 1 0.690 0.020 . 1 . . . . 170 ILE HD1 . 6949 1 821 . 1 1 70 70 ILE C C 13 175.890 0.400 . 1 . . . . 170 ILE C . 6949 1 822 . 1 1 70 70 ILE CA C 13 60.800 0.400 . 1 . . . . 170 ILE CA . 6949 1 823 . 1 1 70 70 ILE CB C 13 38.590 0.400 . 1 . . . . 170 ILE CB . 6949 1 824 . 1 1 70 70 ILE CG1 C 13 27.280 0.400 . 1 . . . . 170 ILE CG1 . 6949 1 825 . 1 1 70 70 ILE CG2 C 13 17.490 0.400 . 1 . . . . 170 ILE CG2 . 6949 1 826 . 1 1 70 70 ILE CD1 C 13 12.710 0.400 . 1 . . . . 170 ILE CD1 . 6949 1 827 . 1 1 70 70 ILE N N 15 124.040 0.400 . 1 . . . . 170 ILE N . 6949 1 828 . 1 1 71 71 SER H H 1 8.320 0.020 . 1 . . . . 171 SER H . 6949 1 829 . 1 1 71 71 SER HA H 1 4.660 0.020 . 1 . . . . 171 SER HA . 6949 1 830 . 1 1 71 71 SER CA C 13 55.850 0.400 . 1 . . . . 171 SER CA . 6949 1 831 . 1 1 71 71 SER CB C 13 63.430 0.400 . 1 . . . . 171 SER CB . 6949 1 832 . 1 1 71 71 SER N N 15 120.820 0.400 . 1 . . . . 171 SER N . 6949 1 833 . 1 1 72 72 PRO HA H 1 4.290 0.020 . 1 . . . . 172 PRO HA . 6949 1 834 . 1 1 72 72 PRO HB2 H 1 1.850 0.020 . 2 . . . . 172 PRO HB2 . 6949 1 835 . 1 1 72 72 PRO HB3 H 1 2.180 0.020 . 2 . . . . 172 PRO HB3 . 6949 1 836 . 1 1 72 72 PRO HG2 H 1 1.890 0.020 . 1 . . . . 172 PRO HG2 . 6949 1 837 . 1 1 72 72 PRO HG3 H 1 1.890 0.020 . 1 . . . . 172 PRO HG3 . 6949 1 838 . 1 1 72 72 PRO HD2 H 1 3.670 0.020 . 1 . . . . 172 PRO HD2 . 6949 1 839 . 1 1 72 72 PRO HD3 H 1 3.670 0.020 . 1 . . . . 172 PRO HD3 . 6949 1 840 . 1 1 72 72 PRO C C 13 177.330 0.400 . 1 . . . . 172 PRO C . 6949 1 841 . 1 1 72 72 PRO CA C 13 63.810 0.400 . 1 . . . . 172 PRO CA . 6949 1 842 . 1 1 72 72 PRO CB C 13 31.940 0.400 . 1 . . . . 172 PRO CB . 6949 1 843 . 1 1 72 72 PRO CG C 13 27.370 0.400 . 1 . . . . 172 PRO CG . 6949 1 844 . 1 1 72 72 PRO CD C 13 50.720 0.400 . 1 . . . . 172 PRO CD . 6949 1 845 . 1 1 73 73 SER H H 1 8.140 0.020 . 1 . . . . 173 SER H . 6949 1 846 . 1 1 73 73 SER HA H 1 4.200 0.020 . 1 . . . . 173 SER HA . 6949 1 847 . 1 1 73 73 SER HB2 H 1 3.770 0.020 . 2 . . . . 173 SER HB2 . 6949 1 848 . 1 1 73 73 SER HB3 H 1 3.720 0.020 . 2 . . . . 173 SER HB3 . 6949 1 849 . 1 1 73 73 SER C C 13 174.460 0.400 . 1 . . . . 173 SER C . 6949 1 850 . 1 1 73 73 SER CA C 13 59.170 0.400 . 1 . . . . 173 SER CA . 6949 1 851 . 1 1 73 73 SER CB C 13 63.560 0.400 . 1 . . . . 173 SER CB . 6949 1 852 . 1 1 73 73 SER N N 15 114.410 0.400 . 1 . . . . 173 SER N . 6949 1 853 . 1 1 74 74 ASP H H 1 8.040 0.020 . 1 . . . . 174 ASP H . 6949 1 854 . 1 1 74 74 ASP HA H 1 4.490 0.020 . 1 . . . . 174 ASP HA . 6949 1 855 . 1 1 74 74 ASP HB2 H 1 2.540 0.020 . 2 . . . . 174 ASP HB2 . 6949 1 856 . 1 1 74 74 ASP HB3 H 1 2.640 0.020 . 2 . . . . 174 ASP HB3 . 6949 1 857 . 1 1 74 74 ASP C C 13 176.420 0.400 . 1 . . . . 174 ASP C . 6949 1 858 . 1 1 74 74 ASP CA C 13 54.490 0.400 . 1 . . . . 174 ASP CA . 6949 1 859 . 1 1 74 74 ASP CB C 13 41.150 0.400 . 1 . . . . 174 ASP CB . 6949 1 860 . 1 1 74 74 ASP N N 15 121.670 0.400 . 1 . . . . 174 ASP N . 6949 1 861 . 1 1 75 75 LEU H H 1 7.970 0.020 . 1 . . . . 175 LEU H . 6949 1 862 . 1 1 75 75 LEU HA H 1 4.180 0.020 . 1 . . . . 175 LEU HA . 6949 1 863 . 1 1 75 75 LEU HB2 H 1 1.530 0.020 . 1 . . . . 175 LEU HB2 . 6949 1 864 . 1 1 75 75 LEU HB3 H 1 1.530 0.020 . 1 . . . . 175 LEU HB3 . 6949 1 865 . 1 1 75 75 LEU HG H 1 1.500 0.020 . 1 . . . . 175 LEU HG . 6949 1 866 . 1 1 75 75 LEU HD11 H 1 0.770 0.020 . 2 . . . . 175 LEU HD1 . 6949 1 867 . 1 1 75 75 LEU HD12 H 1 0.770 0.020 . 2 . . . . 175 LEU HD1 . 6949 1 868 . 1 1 75 75 LEU HD13 H 1 0.770 0.020 . 2 . . . . 175 LEU HD1 . 6949 1 869 . 1 1 75 75 LEU HD21 H 1 0.710 0.020 . 2 . . . . 175 LEU HD2 . 6949 1 870 . 1 1 75 75 LEU HD22 H 1 0.710 0.020 . 2 . . . . 175 LEU HD2 . 6949 1 871 . 1 1 75 75 LEU HD23 H 1 0.710 0.020 . 2 . . . . 175 LEU HD2 . 6949 1 872 . 1 1 75 75 LEU C C 13 177.580 0.400 . 1 . . . . 175 LEU C . 6949 1 873 . 1 1 75 75 LEU CA C 13 55.490 0.400 . 1 . . . . 175 LEU CA . 6949 1 874 . 1 1 75 75 LEU CB C 13 41.840 0.400 . 1 . . . . 175 LEU CB . 6949 1 875 . 1 1 75 75 LEU CG C 13 26.880 0.400 . 1 . . . . 175 LEU CG . 6949 1 876 . 1 1 75 75 LEU CD1 C 13 25.000 0.400 . 1 . . . . 175 LEU CD1 . 6949 1 877 . 1 1 75 75 LEU CD2 C 13 23.350 0.400 . 1 . . . . 175 LEU CD2 . 6949 1 878 . 1 1 75 75 LEU N N 15 121.640 0.400 . 1 . . . . 175 LEU N . 6949 1 879 . 1 1 76 76 SER H H 1 8.090 0.020 . 1 . . . . 176 SER H . 6949 1 880 . 1 1 76 76 SER HA H 1 4.200 0.020 . 1 . . . . 176 SER HA . 6949 1 881 . 1 1 76 76 SER HB2 H 1 3.740 0.020 . 1 . . . . 176 SER HB2 . 6949 1 882 . 1 1 76 76 SER HB3 H 1 3.740 0.020 . 1 . . . . 176 SER HB3 . 6949 1 883 . 1 1 76 76 SER C C 13 174.490 0.400 . 1 . . . . 176 SER C . 6949 1 884 . 1 1 76 76 SER CA C 13 59.180 0.400 . 1 . . . . 176 SER CA . 6949 1 885 . 1 1 76 76 SER CB C 13 63.560 0.400 . 1 . . . . 176 SER CB . 6949 1 886 . 1 1 76 76 SER N N 15 115.310 0.400 . 1 . . . . 176 SER N . 6949 1 887 . 1 1 77 77 ASP H H 1 8.080 0.020 . 1 . . . . 177 ASP H . 6949 1 888 . 1 1 77 77 ASP HA H 1 4.500 0.020 . 1 . . . . 177 ASP HA . 6949 1 889 . 1 1 77 77 ASP HB2 H 1 2.530 0.020 . 2 . . . . 177 ASP HB2 . 6949 1 890 . 1 1 77 77 ASP HB3 H 1 2.600 0.020 . 2 . . . . 177 ASP HB3 . 6949 1 891 . 1 1 77 77 ASP C C 13 176.480 0.400 . 1 . . . . 177 ASP C . 6949 1 892 . 1 1 77 77 ASP CA C 13 54.370 0.400 . 1 . . . . 177 ASP CA . 6949 1 893 . 1 1 77 77 ASP CB C 13 41.060 0.400 . 1 . . . . 177 ASP CB . 6949 1 894 . 1 1 77 77 ASP N N 15 121.690 0.400 . 1 . . . . 177 ASP N . 6949 1 895 . 1 1 78 78 ILE H H 1 7.850 0.020 . 1 . . . . 178 ILE H . 6949 1 896 . 1 1 78 78 ILE HA H 1 3.990 0.020 . 1 . . . . 178 ILE HA . 6949 1 897 . 1 1 78 78 ILE HB H 1 1.780 0.020 . 1 . . . . 178 ILE HB . 6949 1 898 . 1 1 78 78 ILE HG12 H 1 1.310 0.020 . 2 . . . . 178 ILE HG12 . 6949 1 899 . 1 1 78 78 ILE HG13 H 1 1.060 0.020 . 2 . . . . 178 ILE HG13 . 6949 1 900 . 1 1 78 78 ILE HG21 H 1 0.740 0.020 . 1 . . . . 178 ILE HG2 . 6949 1 901 . 1 1 78 78 ILE HG22 H 1 0.740 0.020 . 1 . . . . 178 ILE HG2 . 6949 1 902 . 1 1 78 78 ILE HG23 H 1 0.740 0.020 . 1 . . . . 178 ILE HG2 . 6949 1 903 . 1 1 78 78 ILE HD11 H 1 0.700 0.020 . 1 . . . . 178 ILE HD1 . 6949 1 904 . 1 1 78 78 ILE HD12 H 1 0.700 0.020 . 1 . . . . 178 ILE HD1 . 6949 1 905 . 1 1 78 78 ILE HD13 H 1 0.700 0.020 . 1 . . . . 178 ILE HD1 . 6949 1 906 . 1 1 78 78 ILE C C 13 176.650 0.400 . 1 . . . . 178 ILE C . 6949 1 907 . 1 1 78 78 ILE CA C 13 61.630 0.400 . 1 . . . . 178 ILE CA . 6949 1 908 . 1 1 78 78 ILE CB C 13 38.310 0.400 . 1 . . . . 178 ILE CB . 6949 1 909 . 1 1 78 78 ILE CG1 C 13 27.430 0.400 . 1 . . . . 178 ILE CG1 . 6949 1 910 . 1 1 78 78 ILE CG2 C 13 17.570 0.400 . 1 . . . . 178 ILE CG2 . 6949 1 911 . 1 1 78 78 ILE CD1 C 13 12.990 0.400 . 1 . . . . 178 ILE CD1 . 6949 1 912 . 1 1 78 78 ILE N N 15 120.580 0.400 . 1 . . . . 178 ILE N . 6949 1 913 . 1 1 79 79 LYS H H 1 8.170 0.020 . 1 . . . . 179 LYS H . 6949 1 914 . 1 1 79 79 LYS HA H 1 4.060 0.020 . 1 . . . . 179 LYS HA . 6949 1 915 . 1 1 79 79 LYS HB2 H 1 1.690 0.020 . 1 . . . . 179 LYS HB2 . 6949 1 916 . 1 1 79 79 LYS HB3 H 1 1.690 0.020 . 1 . . . . 179 LYS HB3 . 6949 1 917 . 1 1 79 79 LYS HG2 H 1 1.260 0.020 . 2 . . . . 179 LYS HG2 . 6949 1 918 . 1 1 79 79 LYS HG3 H 1 1.330 0.020 . 2 . . . . 179 LYS HG3 . 6949 1 919 . 1 1 79 79 LYS HD2 H 1 1.540 0.020 . 1 . . . . 179 LYS HD2 . 6949 1 920 . 1 1 79 79 LYS HD3 H 1 1.540 0.020 . 1 . . . . 179 LYS HD3 . 6949 1 921 . 1 1 79 79 LYS HE2 H 1 2.850 0.020 . 1 . . . . 179 LYS HE2 . 6949 1 922 . 1 1 79 79 LYS HE3 H 1 2.850 0.020 . 1 . . . . 179 LYS HE3 . 6949 1 923 . 1 1 79 79 LYS C C 13 177.400 0.400 . 1 . . . . 179 LYS C . 6949 1 924 . 1 1 79 79 LYS CA C 13 56.920 0.400 . 1 . . . . 179 LYS CA . 6949 1 925 . 1 1 79 79 LYS CB C 13 32.470 0.400 . 1 . . . . 179 LYS CB . 6949 1 926 . 1 1 79 79 LYS CG C 13 24.810 0.400 . 1 . . . . 179 LYS CG . 6949 1 927 . 1 1 79 79 LYS CD C 13 28.760 0.400 . 1 . . . . 179 LYS CD . 6949 1 928 . 1 1 79 79 LYS CE C 13 41.820 0.400 . 1 . . . . 179 LYS CE . 6949 1 929 . 1 1 79 79 LYS N N 15 123.730 0.400 . 1 . . . . 179 LYS N . 6949 1 930 . 1 1 80 80 GLY H H 1 8.220 0.020 . 1 . . . . 180 GLY H . 6949 1 931 . 1 1 80 80 GLY HA2 H 1 3.830 0.020 . 1 . . . . 180 GLY HA2 . 6949 1 932 . 1 1 80 80 GLY HA3 H 1 3.830 0.020 . 1 . . . . 180 GLY HA3 . 6949 1 933 . 1 1 80 80 GLY C C 13 174.510 0.400 . 1 . . . . 180 GLY C . 6949 1 934 . 1 1 80 80 GLY CA C 13 45.400 0.400 . 1 . . . . 180 GLY CA . 6949 1 935 . 1 1 80 80 GLY N N 15 109.280 0.400 . 1 . . . . 180 GLY N . 6949 1 936 . 1 1 81 81 SER H H 1 8.050 0.020 . 1 . . . . 181 SER H . 6949 1 937 . 1 1 81 81 SER HA H 1 3.860 0.020 . 1 . . . . 181 SER HA . 6949 1 938 . 1 1 81 81 SER HB2 H 1 3.780 0.020 . 1 . . . . 181 SER HB2 . 6949 1 939 . 1 1 81 81 SER HB3 H 1 3.780 0.020 . 1 . . . . 181 SER HB3 . 6949 1 940 . 1 1 81 81 SER C C 13 175.550 0.400 . 1 . . . . 181 SER C . 6949 1 941 . 1 1 81 81 SER CA C 13 58.760 0.400 . 1 . . . . 181 SER CA . 6949 1 942 . 1 1 81 81 SER CB C 13 63.700 0.400 . 1 . . . . 181 SER CB . 6949 1 943 . 1 1 81 81 SER N N 15 115.950 0.400 . 1 . . . . 181 SER N . 6949 1 944 . 1 1 82 82 VAL H H 1 8.190 0.020 . 1 . . . . 182 VAL H . 6949 1 945 . 1 1 82 82 VAL HA H 1 3.910 0.020 . 1 . . . . 182 VAL HA . 6949 1 946 . 1 1 82 82 VAL HB H 1 2.000 0.020 . 1 . . . . 182 VAL HB . 6949 1 947 . 1 1 82 82 VAL HG11 H 1 0.850 0.020 . 2 . . . . 182 VAL HG1 . 6949 1 948 . 1 1 82 82 VAL HG12 H 1 0.850 0.020 . 2 . . . . 182 VAL HG1 . 6949 1 949 . 1 1 82 82 VAL HG13 H 1 0.850 0.020 . 2 . . . . 182 VAL HG1 . 6949 1 950 . 1 1 82 82 VAL HG21 H 1 0.780 0.020 . 2 . . . . 182 VAL HG2 . 6949 1 951 . 1 1 82 82 VAL HG22 H 1 0.780 0.020 . 2 . . . . 182 VAL HG2 . 6949 1 952 . 1 1 82 82 VAL HG23 H 1 0.780 0.020 . 2 . . . . 182 VAL HG2 . 6949 1 953 . 1 1 82 82 VAL C C 13 177.080 0.400 . 1 . . . . 182 VAL C . 6949 1 954 . 1 1 82 82 VAL CA C 13 63.740 0.400 . 1 . . . . 182 VAL CA . 6949 1 955 . 1 1 82 82 VAL CB C 13 32.190 0.400 . 1 . . . . 182 VAL CB . 6949 1 956 . 1 1 82 82 VAL CG1 C 13 21.000 0.400 . 1 . . . . 182 VAL CG1 . 6949 1 957 . 1 1 82 82 VAL CG2 C 13 21.000 0.400 . 1 . . . . 182 VAL CG2 . 6949 1 958 . 1 1 82 82 VAL N N 15 122.760 0.400 . 1 . . . . 182 VAL N . 6949 1 959 . 1 1 83 83 LEU H H 1 8.090 0.020 . 1 . . . . 183 LEU H . 6949 1 960 . 1 1 83 83 LEU HA H 1 4.040 0.020 . 1 . . . . 183 LEU HA . 6949 1 961 . 1 1 83 83 LEU HB2 H 1 1.350 0.020 . 2 . . . . 183 LEU HB2 . 6949 1 962 . 1 1 83 83 LEU HB3 H 1 1.490 0.020 . 2 . . . . 183 LEU HB3 . 6949 1 963 . 1 1 83 83 LEU HG H 1 1.410 0.020 . 1 . . . . 183 LEU HG . 6949 1 964 . 1 1 83 83 LEU HD11 H 1 0.740 0.020 . 2 . . . . 183 LEU HD1 . 6949 1 965 . 1 1 83 83 LEU HD12 H 1 0.740 0.020 . 2 . . . . 183 LEU HD1 . 6949 1 966 . 1 1 83 83 LEU HD13 H 1 0.740 0.020 . 2 . . . . 183 LEU HD1 . 6949 1 967 . 1 1 83 83 LEU HD21 H 1 0.680 0.020 . 2 . . . . 183 LEU HD2 . 6949 1 968 . 1 1 83 83 LEU HD22 H 1 0.680 0.020 . 2 . . . . 183 LEU HD2 . 6949 1 969 . 1 1 83 83 LEU HD23 H 1 0.680 0.020 . 2 . . . . 183 LEU HD2 . 6949 1 970 . 1 1 83 83 LEU C C 13 177.820 0.400 . 1 . . . . 183 LEU C . 6949 1 971 . 1 1 83 83 LEU CA C 13 56.500 0.400 . 1 . . . . 183 LEU CA . 6949 1 972 . 1 1 83 83 LEU CB C 13 41.960 0.400 . 1 . . . . 183 LEU CB . 6949 1 973 . 1 1 83 83 LEU CG C 13 26.880 0.400 . 1 . . . . 183 LEU CG . 6949 1 974 . 1 1 83 83 LEU CD1 C 13 24.740 0.400 . 1 . . . . 183 LEU CD1 . 6949 1 975 . 1 1 83 83 LEU CD2 C 13 23.870 0.400 . 1 . . . . 183 LEU CD2 . 6949 1 976 . 1 1 83 83 LEU N N 15 122.920 0.400 . 1 . . . . 183 LEU N . 6949 1 977 . 1 1 84 84 HIS H H 1 8.020 0.020 . 1 . . . . 184 HIS H . 6949 1 978 . 1 1 84 84 HIS HB2 H 1 3.010 0.020 . 1 . . . . 184 HIS HB2 . 6949 1 979 . 1 1 84 84 HIS HB3 H 1 3.010 0.020 . 1 . . . . 184 HIS HB3 . 6949 1 980 . 1 1 84 84 HIS HD2 H 1 6.880 0.020 . 1 . . . . 184 HIS HD2 . 6949 1 981 . 1 1 84 84 HIS CA C 13 58.290 0.400 . 1 . . . . 184 HIS CA . 6949 1 982 . 1 1 84 84 HIS CB C 13 30.670 0.400 . 1 . . . . 184 HIS CB . 6949 1 983 . 1 1 84 84 HIS CD2 C 13 119.560 0.400 . 1 . . . . 184 HIS CD2 . 6949 1 984 . 1 1 84 84 HIS N N 15 118.700 0.400 . 1 . . . . 184 HIS N . 6949 1 985 . 1 1 86 86 ARG HA H 1 4.220 0.020 . 1 . . . . 186 ARG HA . 6949 1 986 . 1 1 86 86 ARG HB2 H 1 1.690 0.020 . 1 . . . . 186 ARG HB2 . 6949 1 987 . 1 1 86 86 ARG HB3 H 1 1.690 0.020 . 1 . . . . 186 ARG HB3 . 6949 1 988 . 1 1 86 86 ARG HG2 H 1 1.550 0.020 . 2 . . . . 186 ARG HG2 . 6949 1 989 . 1 1 86 86 ARG HG3 H 1 1.490 0.020 . 2 . . . . 186 ARG HG3 . 6949 1 990 . 1 1 86 86 ARG HD2 H 1 2.980 0.020 . 1 . . . . 186 ARG HD2 . 6949 1 991 . 1 1 86 86 ARG HD3 H 1 2.980 0.020 . 1 . . . . 186 ARG HD3 . 6949 1 992 . 1 1 86 86 ARG C C 13 177.340 0.400 . 1 . . . . 186 ARG C . 6949 1 993 . 1 1 86 86 ARG CA C 13 57.570 0.400 . 1 . . . . 186 ARG CA . 6949 1 994 . 1 1 86 86 ARG CB C 13 30.350 0.400 . 1 . . . . 186 ARG CB . 6949 1 995 . 1 1 86 86 ARG CG C 13 27.040 0.400 . 1 . . . . 186 ARG CG . 6949 1 996 . 1 1 86 86 ARG CD C 13 43.080 0.400 . 1 . . . . 186 ARG CD . 6949 1 997 . 1 1 87 87 HIS H H 1 7.990 0.020 . 1 . . . . 187 HIS H . 6949 1 998 . 1 1 87 87 HIS HD2 H 1 6.870 0.020 . 1 . . . . 187 HIS HD2 . 6949 1 999 . 1 1 87 87 HIS CA C 13 58.690 0.400 . 1 . . . . 187 HIS CA . 6949 1 1000 . 1 1 87 87 HIS CB C 13 30.450 0.400 . 1 . . . . 187 HIS CB . 6949 1 1001 . 1 1 87 87 HIS CD2 C 13 119.260 0.400 . 1 . . . . 187 HIS CD2 . 6949 1 1002 . 1 1 87 87 HIS N N 15 119.050 0.400 . 1 . . . . 187 HIS N . 6949 1 1003 . 1 1 88 88 THR HA H 1 3.810 0.020 . 1 . . . . 188 THR HA . 6949 1 1004 . 1 1 88 88 THR HB H 1 4.140 0.020 . 1 . . . . 188 THR HB . 6949 1 1005 . 1 1 88 88 THR HG21 H 1 1.140 0.020 . 1 . . . . 188 THR HG2 . 6949 1 1006 . 1 1 88 88 THR HG22 H 1 1.140 0.020 . 1 . . . . 188 THR HG2 . 6949 1 1007 . 1 1 88 88 THR HG23 H 1 1.140 0.020 . 1 . . . . 188 THR HG2 . 6949 1 1008 . 1 1 88 88 THR C C 13 176.080 0.400 . 1 . . . . 188 THR C . 6949 1 1009 . 1 1 88 88 THR CA C 13 66.230 0.400 . 1 . . . . 188 THR CA . 6949 1 1010 . 1 1 88 88 THR CB C 13 68.300 0.400 . 1 . . . . 188 THR CB . 6949 1 1011 . 1 1 88 88 THR CG2 C 13 21.770 0.400 . 1 . . . . 188 THR CG2 . 6949 1 1012 . 1 1 89 89 GLU H H 1 8.320 0.020 . 1 . . . . 189 GLU H . 6949 1 1013 . 1 1 89 89 GLU HA H 1 4.030 0.020 . 1 . . . . 189 GLU HA . 6949 1 1014 . 1 1 89 89 GLU HB2 H 1 2.000 0.020 . 1 . . . . 189 GLU HB2 . 6949 1 1015 . 1 1 89 89 GLU HB3 H 1 2.000 0.020 . 1 . . . . 189 GLU HB3 . 6949 1 1016 . 1 1 89 89 GLU HG3 H 1 2.280 0.020 . 2 . . . . 189 GLU HG3 . 6949 1 1017 . 1 1 89 89 GLU C C 13 178.900 0.400 . 1 . . . . 189 GLU C . 6949 1 1018 . 1 1 89 89 GLU CA C 13 59.190 0.400 . 1 . . . . 189 GLU CA . 6949 1 1019 . 1 1 89 89 GLU CB C 13 29.200 0.400 . 1 . . . . 189 GLU CB . 6949 1 1020 . 1 1 89 89 GLU CG C 13 36.200 0.400 . 1 . . . . 189 GLU CG . 6949 1 1021 . 1 1 89 89 GLU N N 15 122.610 0.400 . 1 . . . . 189 GLU N . 6949 1 1022 . 1 1 90 90 LEU H H 1 7.840 0.020 . 1 . . . . 190 LEU H . 6949 1 1023 . 1 1 90 90 LEU HA H 1 3.920 0.020 . 1 . . . . 190 LEU HA . 6949 1 1024 . 1 1 90 90 LEU HB2 H 1 1.670 0.020 . 1 . . . . 190 LEU HB2 . 6949 1 1025 . 1 1 90 90 LEU HB3 H 1 1.670 0.020 . 1 . . . . 190 LEU HB3 . 6949 1 1026 . 1 1 90 90 LEU HG H 1 1.550 0.020 . 1 . . . . 190 LEU HG . 6949 1 1027 . 1 1 90 90 LEU HD11 H 1 0.560 0.020 . 2 . . . . 190 LEU HD1 . 6949 1 1028 . 1 1 90 90 LEU HD12 H 1 0.560 0.020 . 2 . . . . 190 LEU HD1 . 6949 1 1029 . 1 1 90 90 LEU HD13 H 1 0.560 0.020 . 2 . . . . 190 LEU HD1 . 6949 1 1030 . 1 1 90 90 LEU HD21 H 1 0.550 0.020 . 2 . . . . 190 LEU HD2 . 6949 1 1031 . 1 1 90 90 LEU HD22 H 1 0.550 0.020 . 2 . . . . 190 LEU HD2 . 6949 1 1032 . 1 1 90 90 LEU HD23 H 1 0.550 0.020 . 2 . . . . 190 LEU HD2 . 6949 1 1033 . 1 1 90 90 LEU C C 13 178.550 0.400 . 1 . . . . 190 LEU C . 6949 1 1034 . 1 1 90 90 LEU CA C 13 58.240 0.400 . 1 . . . . 190 LEU CA . 6949 1 1035 . 1 1 90 90 LEU CB C 13 41.940 0.400 . 1 . . . . 190 LEU CB . 6949 1 1036 . 1 1 90 90 LEU CG C 13 26.860 0.400 . 1 . . . . 190 LEU CG . 6949 1 1037 . 1 1 90 90 LEU CD1 C 13 25.720 0.400 . 1 . . . . 190 LEU CD1 . 6949 1 1038 . 1 1 90 90 LEU CD2 C 13 24.580 0.400 . 1 . . . . 190 LEU CD2 . 6949 1 1039 . 1 1 90 90 LEU N N 15 119.670 0.400 . 1 . . . . 190 LEU N . 6949 1 1040 . 1 1 91 91 LYS H H 1 7.730 0.020 . 1 . . . . 191 LYS H . 6949 1 1041 . 1 1 91 91 LYS HA H 1 3.940 0.020 . 1 . . . . 191 LYS HA . 6949 1 1042 . 1 1 91 91 LYS HB2 H 1 1.850 0.020 . 2 . . . . 191 LYS HB2 . 6949 1 1043 . 1 1 91 91 LYS HB3 H 1 1.920 0.020 . 2 . . . . 191 LYS HB3 . 6949 1 1044 . 1 1 91 91 LYS HG2 H 1 1.480 0.020 . 1 . . . . 191 LYS HG2 . 6949 1 1045 . 1 1 91 91 LYS HG3 H 1 1.480 0.020 . 1 . . . . 191 LYS HG3 . 6949 1 1046 . 1 1 91 91 LYS HD2 H 1 1.590 0.020 . 1 . . . . 191 LYS HD2 . 6949 1 1047 . 1 1 91 91 LYS HD3 H 1 1.590 0.020 . 1 . . . . 191 LYS HD3 . 6949 1 1048 . 1 1 91 91 LYS HE2 H 1 2.850 0.020 . 1 . . . . 191 LYS HE2 . 6949 1 1049 . 1 1 91 91 LYS HE3 H 1 2.850 0.020 . 1 . . . . 191 LYS HE3 . 6949 1 1050 . 1 1 91 91 LYS C C 13 179.730 0.400 . 1 . . . . 191 LYS C . 6949 1 1051 . 1 1 91 91 LYS CA C 13 59.810 0.400 . 1 . . . . 191 LYS CA . 6949 1 1052 . 1 1 91 91 LYS CB C 13 32.160 0.400 . 1 . . . . 191 LYS CB . 6949 1 1053 . 1 1 91 91 LYS CG C 13 24.990 0.400 . 1 . . . . 191 LYS CG . 6949 1 1054 . 1 1 91 91 LYS CD C 13 29.140 0.400 . 1 . . . . 191 LYS CD . 6949 1 1055 . 1 1 91 91 LYS CE C 13 41.690 0.400 . 1 . . . . 191 LYS CE . 6949 1 1056 . 1 1 91 91 LYS N N 15 118.510 0.400 . 1 . . . . 191 LYS N . 6949 1 1057 . 1 1 92 92 GLU H H 1 8.080 0.020 . 1 . . . . 192 GLU H . 6949 1 1058 . 1 1 92 92 GLU HA H 1 4.030 0.020 . 1 . . . . 192 GLU HA . 6949 1 1059 . 1 1 92 92 GLU HB2 H 1 2.000 0.020 . 1 . . . . 192 GLU HB2 . 6949 1 1060 . 1 1 92 92 GLU HB3 H 1 2.000 0.020 . 1 . . . . 192 GLU HB3 . 6949 1 1061 . 1 1 92 92 GLU HG3 H 1 2.220 0.020 . 2 . . . . 192 GLU HG3 . 6949 1 1062 . 1 1 92 92 GLU C C 13 179.590 0.400 . 1 . . . . 192 GLU C . 6949 1 1063 . 1 1 92 92 GLU CA C 13 58.760 0.400 . 1 . . . . 192 GLU CA . 6949 1 1064 . 1 1 92 92 GLU CB C 13 29.200 0.400 . 1 . . . . 192 GLU CB . 6949 1 1065 . 1 1 92 92 GLU CG C 13 36.170 0.400 . 1 . . . . 192 GLU CG . 6949 1 1066 . 1 1 92 92 GLU N N 15 119.800 0.400 . 1 . . . . 192 GLU N . 6949 1 1067 . 1 1 93 93 LYS H H 1 8.250 0.020 . 1 . . . . 193 LYS H . 6949 1 1068 . 1 1 93 93 LYS HA H 1 4.060 0.020 . 1 . . . . 193 LYS HA . 6949 1 1069 . 1 1 93 93 LYS HB2 H 1 2.090 0.020 . 2 . . . . 193 LYS HB2 . 6949 1 1070 . 1 1 93 93 LYS HB3 H 1 1.920 0.020 . 2 . . . . 193 LYS HB3 . 6949 1 1071 . 1 1 93 93 LYS HG2 H 1 1.480 0.020 . 2 . . . . 193 LYS HG2 . 6949 1 1072 . 1 1 93 93 LYS HG3 H 1 1.660 0.020 . 2 . . . . 193 LYS HG3 . 6949 1 1073 . 1 1 93 93 LYS HD2 H 1 1.650 0.020 . 2 . . . . 193 LYS HD2 . 6949 1 1074 . 1 1 93 93 LYS HD3 H 1 1.500 0.020 . 2 . . . . 193 LYS HD3 . 6949 1 1075 . 1 1 93 93 LYS HE2 H 1 2.840 0.020 . 1 . . . . 193 LYS HE2 . 6949 1 1076 . 1 1 93 93 LYS HE3 H 1 2.840 0.020 . 1 . . . . 193 LYS HE3 . 6949 1 1077 . 1 1 93 93 LYS C C 13 175.980 0.400 . 1 . . . . 193 LYS C . 6949 1 1078 . 1 1 93 93 LYS CA C 13 59.470 0.400 . 1 . . . . 193 LYS CA . 6949 1 1079 . 1 1 93 93 LYS CB C 13 32.760 0.400 . 1 . . . . 193 LYS CB . 6949 1 1080 . 1 1 93 93 LYS CG C 13 26.450 0.400 . 1 . . . . 193 LYS CG . 6949 1 1081 . 1 1 93 93 LYS CD C 13 29.020 0.400 . 1 . . . . 193 LYS CD . 6949 1 1082 . 1 1 93 93 LYS CE C 13 42.120 0.400 . 1 . . . . 193 LYS CE . 6949 1 1083 . 1 1 93 93 LYS N N 15 120.860 0.400 . 1 . . . . 193 LYS N . 6949 1 1084 . 1 1 94 94 LEU H H 1 8.240 0.020 . 1 . . . . 194 LEU H . 6949 1 1085 . 1 1 94 94 LEU HA H 1 3.610 0.020 . 1 . . . . 194 LEU HA . 6949 1 1086 . 1 1 94 94 LEU HB2 H 1 1.750 0.020 . 2 . . . . 194 LEU HB2 . 6949 1 1087 . 1 1 94 94 LEU HB3 H 1 1.500 0.020 . 2 . . . . 194 LEU HB3 . 6949 1 1088 . 1 1 94 94 LEU HG H 1 1.340 0.020 . 1 . . . . 194 LEU HG . 6949 1 1089 . 1 1 94 94 LEU HD11 H 1 0.720 0.020 . 2 . . . . 194 LEU HD1 . 6949 1 1090 . 1 1 94 94 LEU HD12 H 1 0.720 0.020 . 2 . . . . 194 LEU HD1 . 6949 1 1091 . 1 1 94 94 LEU HD13 H 1 0.720 0.020 . 2 . . . . 194 LEU HD1 . 6949 1 1092 . 1 1 94 94 LEU HD21 H 1 0.460 0.020 . 2 . . . . 194 LEU HD2 . 6949 1 1093 . 1 1 94 94 LEU HD22 H 1 0.460 0.020 . 2 . . . . 194 LEU HD2 . 6949 1 1094 . 1 1 94 94 LEU HD23 H 1 0.460 0.020 . 2 . . . . 194 LEU HD2 . 6949 1 1095 . 1 1 94 94 LEU C C 13 174.840 0.400 . 1 . . . . 194 LEU C . 6949 1 1096 . 1 1 94 94 LEU CA C 13 57.460 0.400 . 1 . . . . 194 LEU CA . 6949 1 1097 . 1 1 94 94 LEU CB C 13 41.110 0.400 . 1 . . . . 194 LEU CB . 6949 1 1098 . 1 1 94 94 LEU CG C 13 26.540 0.400 . 1 . . . . 194 LEU CG . 6949 1 1099 . 1 1 94 94 LEU CD1 C 13 24.890 0.400 . 1 . . . . 194 LEU CD1 . 6949 1 1100 . 1 1 94 94 LEU CD2 C 13 25.010 0.400 . 1 . . . . 194 LEU CD2 . 6949 1 1101 . 1 1 94 94 LEU N N 15 121.480 0.400 . 1 . . . . 194 LEU N . 6949 1 1102 . 1 1 95 95 ARG H H 1 7.890 0.020 . 1 . . . . 195 ARG H . 6949 1 1103 . 1 1 95 95 ARG HA H 1 3.950 0.020 . 1 . . . . 195 ARG HA . 6949 1 1104 . 1 1 95 95 ARG HB2 H 1 1.840 0.020 . 1 . . . . 195 ARG HB2 . 6949 1 1105 . 1 1 95 95 ARG HB3 H 1 1.840 0.020 . 1 . . . . 195 ARG HB3 . 6949 1 1106 . 1 1 95 95 ARG HG2 H 1 1.440 0.020 . 2 . . . . 195 ARG HG2 . 6949 1 1107 . 1 1 95 95 ARG HG3 H 1 1.660 0.020 . 2 . . . . 195 ARG HG3 . 6949 1 1108 . 1 1 95 95 ARG HD2 H 1 3.100 0.020 . 1 . . . . 195 ARG HD2 . 6949 1 1109 . 1 1 95 95 ARG HD3 H 1 3.100 0.020 . 1 . . . . 195 ARG HD3 . 6949 1 1110 . 1 1 95 95 ARG C C 13 178.990 0.400 . 1 . . . . 195 ARG C . 6949 1 1111 . 1 1 95 95 ARG CA C 13 59.820 0.400 . 1 . . . . 195 ARG CA . 6949 1 1112 . 1 1 95 95 ARG CB C 13 29.450 0.400 . 1 . . . . 195 ARG CB . 6949 1 1113 . 1 1 95 95 ARG CG C 13 27.010 0.400 . 1 . . . . 195 ARG CG . 6949 1 1114 . 1 1 95 95 ARG CD C 13 43.220 0.400 . 1 . . . . 195 ARG CD . 6949 1 1115 . 1 1 95 95 ARG N N 15 119.680 0.400 . 1 . . . . 195 ARG N . 6949 1 1116 . 1 1 96 96 SER H H 1 7.720 0.020 . 1 . . . . 196 SER H . 6949 1 1117 . 1 1 96 96 SER HA H 1 4.160 0.020 . 1 . . . . 196 SER HA . 6949 1 1118 . 1 1 96 96 SER HB2 H 1 3.890 0.020 . 2 . . . . 196 SER HB2 . 6949 1 1119 . 1 1 96 96 SER HB3 H 1 3.930 0.020 . 2 . . . . 196 SER HB3 . 6949 1 1120 . 1 1 96 96 SER C C 13 179.080 0.400 . 1 . . . . 196 SER C . 6949 1 1121 . 1 1 96 96 SER CA C 13 61.110 0.400 . 1 . . . . 196 SER CA . 6949 1 1122 . 1 1 96 96 SER CB C 13 62.960 0.400 . 1 . . . . 196 SER CB . 6949 1 1123 . 1 1 96 96 SER N N 15 113.000 0.400 . 1 . . . . 196 SER N . 6949 1 1124 . 1 1 97 97 ILE H H 1 7.950 0.020 . 1 . . . . 197 ILE H . 6949 1 1125 . 1 1 97 97 ILE HA H 1 3.580 0.020 . 1 . . . . 197 ILE HA . 6949 1 1126 . 1 1 97 97 ILE HB H 1 1.790 0.020 . 1 . . . . 197 ILE HB . 6949 1 1127 . 1 1 97 97 ILE HG12 H 1 1.510 0.020 . 1 . . . . 197 ILE HG12 . 6949 1 1128 . 1 1 97 97 ILE HG13 H 1 1.510 0.020 . 1 . . . . 197 ILE HG13 . 6949 1 1129 . 1 1 97 97 ILE HG21 H 1 0.690 0.020 . 1 . . . . 197 ILE HG2 . 6949 1 1130 . 1 1 97 97 ILE HG22 H 1 0.690 0.020 . 1 . . . . 197 ILE HG2 . 6949 1 1131 . 1 1 97 97 ILE HG23 H 1 0.690 0.020 . 1 . . . . 197 ILE HG2 . 6949 1 1132 . 1 1 97 97 ILE HD11 H 1 0.380 0.020 . 1 . . . . 197 ILE HD1 . 6949 1 1133 . 1 1 97 97 ILE HD12 H 1 0.380 0.020 . 1 . . . . 197 ILE HD1 . 6949 1 1134 . 1 1 97 97 ILE HD13 H 1 0.380 0.020 . 1 . . . . 197 ILE HD1 . 6949 1 1135 . 1 1 97 97 ILE C C 13 177.630 0.400 . 1 . . . . 197 ILE C . 6949 1 1136 . 1 1 97 97 ILE CA C 13 65.760 0.400 . 1 . . . . 197 ILE CA . 6949 1 1137 . 1 1 97 97 ILE CB C 13 38.070 0.400 . 1 . . . . 197 ILE CB . 6949 1 1138 . 1 1 97 97 ILE CG1 C 13 30.370 0.400 . 1 . . . . 197 ILE CG1 . 6949 1 1139 . 1 1 97 97 ILE CG2 C 13 17.040 0.400 . 1 . . . . 197 ILE CG2 . 6949 1 1140 . 1 1 97 97 ILE CD1 C 13 14.210 0.400 . 1 . . . . 197 ILE CD1 . 6949 1 1141 . 1 1 97 97 ILE N N 15 124.290 0.400 . 1 . . . . 197 ILE N . 6949 1 1142 . 1 1 98 98 ASN H H 1 8.470 0.020 . 1 . . . . 198 ASN H . 6949 1 1143 . 1 1 98 98 ASN HA H 1 4.390 0.020 . 1 . . . . 198 ASN HA . 6949 1 1144 . 1 1 98 98 ASN HB2 H 1 2.750 0.020 . 1 . . . . 198 ASN HB2 . 6949 1 1145 . 1 1 98 98 ASN HB3 H 1 2.750 0.020 . 1 . . . . 198 ASN HB3 . 6949 1 1146 . 1 1 98 98 ASN C C 13 178.580 0.400 . 1 . . . . 198 ASN C . 6949 1 1147 . 1 1 98 98 ASN CA C 13 56.310 0.400 . 1 . . . . 198 ASN CA . 6949 1 1148 . 1 1 98 98 ASN CB C 13 37.480 0.400 . 1 . . . . 198 ASN CB . 6949 1 1149 . 1 1 98 98 ASN N N 15 120.700 0.400 . 1 . . . . 198 ASN N . 6949 1 1150 . 1 1 99 99 GLN H H 1 8.520 0.020 . 1 . . . . 199 GLN H . 6949 1 1151 . 1 1 99 99 GLN HA H 1 4.070 0.020 . 1 . . . . 199 GLN HA . 6949 1 1152 . 1 1 99 99 GLN HB2 H 1 1.990 0.020 . 2 . . . . 199 GLN HB2 . 6949 1 1153 . 1 1 99 99 GLN HB3 H 1 2.100 0.020 . 2 . . . . 199 GLN HB3 . 6949 1 1154 . 1 1 99 99 GLN HG2 H 1 2.310 0.020 . 2 . . . . 199 GLN HG2 . 6949 1 1155 . 1 1 99 99 GLN HG3 H 1 2.500 0.020 . 2 . . . . 199 GLN HG3 . 6949 1 1156 . 1 1 99 99 GLN C C 13 179.480 0.400 . 1 . . . . 199 GLN C . 6949 1 1157 . 1 1 99 99 GLN CA C 13 58.760 0.400 . 1 . . . . 199 GLN CA . 6949 1 1158 . 1 1 99 99 GLN CB C 13 28.290 0.400 . 1 . . . . 199 GLN CB . 6949 1 1159 . 1 1 99 99 GLN CG C 13 34.160 0.400 . 1 . . . . 199 GLN CG . 6949 1 1160 . 1 1 99 99 GLN N N 15 120.210 0.400 . 1 . . . . 199 GLN N . 6949 1 1161 . 1 1 100 100 GLY H H 1 8.250 0.020 . 1 . . . . 200 GLY H . 6949 1 1162 . 1 1 100 100 GLY HA2 H 1 3.810 0.020 . 2 . . . . 200 GLY HA2 . 6949 1 1163 . 1 1 100 100 GLY HA3 H 1 4.200 0.020 . 2 . . . . 200 GLY HA3 . 6949 1 1164 . 1 1 100 100 GLY C C 13 176.110 0.400 . 1 . . . . 200 GLY C . 6949 1 1165 . 1 1 100 100 GLY CA C 13 47.050 0.400 . 1 . . . . 200 GLY CA . 6949 1 1166 . 1 1 100 100 GLY N N 15 110.330 0.400 . 1 . . . . 200 GLY N . 6949 1 1167 . 1 1 101 101 LEU H H 1 8.390 0.020 . 1 . . . . 201 LEU H . 6949 1 1168 . 1 1 101 101 LEU HA H 1 3.570 0.020 . 1 . . . . 201 LEU HA . 6949 1 1169 . 1 1 101 101 LEU HB2 H 1 1.430 0.020 . 2 . . . . 201 LEU HB2 . 6949 1 1170 . 1 1 101 101 LEU HB3 H 1 1.750 0.020 . 2 . . . . 201 LEU HB3 . 6949 1 1171 . 1 1 101 101 LEU HG H 1 1.400 0.020 . 1 . . . . 201 LEU HG . 6949 1 1172 . 1 1 101 101 LEU HD11 H 1 0.730 0.020 . 2 . . . . 201 LEU HD1 . 6949 1 1173 . 1 1 101 101 LEU HD12 H 1 0.730 0.020 . 2 . . . . 201 LEU HD1 . 6949 1 1174 . 1 1 101 101 LEU HD13 H 1 0.730 0.020 . 2 . . . . 201 LEU HD1 . 6949 1 1175 . 1 1 101 101 LEU HD21 H 1 0.580 0.020 . 2 . . . . 201 LEU HD2 . 6949 1 1176 . 1 1 101 101 LEU HD22 H 1 0.580 0.020 . 2 . . . . 201 LEU HD2 . 6949 1 1177 . 1 1 101 101 LEU HD23 H 1 0.580 0.020 . 2 . . . . 201 LEU HD2 . 6949 1 1178 . 1 1 101 101 LEU C C 13 178.250 0.400 . 1 . . . . 201 LEU C . 6949 1 1179 . 1 1 101 101 LEU CA C 13 57.600 0.400 . 1 . . . . 201 LEU CA . 6949 1 1180 . 1 1 101 101 LEU CB C 13 41.180 0.400 . 1 . . . . 201 LEU CB . 6949 1 1181 . 1 1 101 101 LEU CG C 13 27.150 0.400 . 1 . . . . 201 LEU CG . 6949 1 1182 . 1 1 101 101 LEU CD1 C 13 24.890 0.400 . 1 . . . . 201 LEU CD1 . 6949 1 1183 . 1 1 101 101 LEU CD2 C 13 22.960 0.400 . 1 . . . . 201 LEU CD2 . 6949 1 1184 . 1 1 101 101 LEU N N 15 123.780 0.400 . 1 . . . . 201 LEU N . 6949 1 1185 . 1 1 102 102 ASP H H 1 7.670 0.020 . 1 . . . . 202 ASP H . 6949 1 1186 . 1 1 102 102 ASP HA H 1 4.190 0.020 . 1 . . . . 202 ASP HA . 6949 1 1187 . 1 1 102 102 ASP HB2 H 1 2.550 0.020 . 2 . . . . 202 ASP HB2 . 6949 1 1188 . 1 1 102 102 ASP HB3 H 1 2.670 0.020 . 2 . . . . 202 ASP HB3 . 6949 1 1189 . 1 1 102 102 ASP C C 13 178.800 0.400 . 1 . . . . 202 ASP C . 6949 1 1190 . 1 1 102 102 ASP CA C 13 57.680 0.400 . 1 . . . . 202 ASP CA . 6949 1 1191 . 1 1 102 102 ASP CB C 13 40.670 0.400 . 1 . . . . 202 ASP CB . 6949 1 1192 . 1 1 102 102 ASP N N 15 119.030 0.400 . 1 . . . . 202 ASP N . 6949 1 1193 . 1 1 103 103 ARG H H 1 7.670 0.020 . 1 . . . . 203 ARG H . 6949 1 1194 . 1 1 103 103 ARG HA H 1 3.950 0.020 . 1 . . . . 203 ARG HA . 6949 1 1195 . 1 1 103 103 ARG HB2 H 1 1.590 0.020 . 1 . . . . 203 ARG HB2 . 6949 1 1196 . 1 1 103 103 ARG HB3 H 1 1.590 0.020 . 1 . . . . 203 ARG HB3 . 6949 1 1197 . 1 1 103 103 ARG HG2 H 1 1.230 0.020 . 2 . . . . 203 ARG HG2 . 6949 1 1198 . 1 1 103 103 ARG HG3 H 1 1.610 0.020 . 2 . . . . 203 ARG HG3 . 6949 1 1199 . 1 1 103 103 ARG HD2 H 1 3.060 0.020 . 2 . . . . 203 ARG HD2 . 6949 1 1200 . 1 1 103 103 ARG HD3 H 1 3.160 0.020 . 2 . . . . 203 ARG HD3 . 6949 1 1201 . 1 1 103 103 ARG C C 13 177.620 0.400 . 1 . . . . 203 ARG C . 6949 1 1202 . 1 1 103 103 ARG CA C 13 59.620 0.400 . 1 . . . . 203 ARG CA . 6949 1 1203 . 1 1 103 103 ARG CB C 13 29.140 0.400 . 1 . . . . 203 ARG CB . 6949 1 1204 . 1 1 103 103 ARG CG C 13 28.100 0.400 . 1 . . . . 203 ARG CG . 6949 1 1205 . 1 1 103 103 ARG CD C 13 42.870 0.400 . 1 . . . . 203 ARG CD . 6949 1 1206 . 1 1 103 103 ARG N N 15 119.640 0.400 . 1 . . . . 203 ARG N . 6949 1 1207 . 1 1 104 104 LEU H H 1 8.060 0.020 . 1 . . . . 204 LEU H . 6949 1 1208 . 1 1 104 104 LEU HA H 1 3.660 0.020 . 1 . . . . 204 LEU HA . 6949 1 1209 . 1 1 104 104 LEU HB2 H 1 1.490 0.020 . 2 . . . . 204 LEU HB2 . 6949 1 1210 . 1 1 104 104 LEU HB3 H 1 0.750 0.020 . 2 . . . . 204 LEU HB3 . 6949 1 1211 . 1 1 104 104 LEU HG H 1 1.390 0.020 . 1 . . . . 204 LEU HG . 6949 1 1212 . 1 1 104 104 LEU HD11 H 1 -0.100 0.020 . 2 . . . . 204 LEU HD1 . 6949 1 1213 . 1 1 104 104 LEU HD12 H 1 -0.100 0.020 . 2 . . . . 204 LEU HD1 . 6949 1 1214 . 1 1 104 104 LEU HD13 H 1 -0.100 0.020 . 2 . . . . 204 LEU HD1 . 6949 1 1215 . 1 1 104 104 LEU HD21 H 1 -0.020 0.020 . 2 . . . . 204 LEU HD2 . 6949 1 1216 . 1 1 104 104 LEU HD22 H 1 -0.020 0.020 . 2 . . . . 204 LEU HD2 . 6949 1 1217 . 1 1 104 104 LEU HD23 H 1 -0.020 0.020 . 2 . . . . 204 LEU HD2 . 6949 1 1218 . 1 1 104 104 LEU C C 13 180.420 0.400 . 1 . . . . 204 LEU C . 6949 1 1219 . 1 1 104 104 LEU CA C 13 58.010 0.400 . 1 . . . . 204 LEU CA . 6949 1 1220 . 1 1 104 104 LEU CB C 13 41.100 0.400 . 1 . . . . 204 LEU CB . 6949 1 1221 . 1 1 104 104 LEU CG C 13 25.830 0.400 . 1 . . . . 204 LEU CG . 6949 1 1222 . 1 1 104 104 LEU CD1 C 13 24.340 0.400 . 1 . . . . 204 LEU CD1 . 6949 1 1223 . 1 1 104 104 LEU CD2 C 13 21.300 0.400 . 1 . . . . 204 LEU CD2 . 6949 1 1224 . 1 1 104 104 LEU N N 15 118.950 0.400 . 1 . . . . 204 LEU N . 6949 1 1225 . 1 1 105 105 ARG H H 1 8.650 0.020 . 1 . . . . 205 ARG H . 6949 1 1226 . 1 1 105 105 ARG HA H 1 3.870 0.020 . 1 . . . . 205 ARG HA . 6949 1 1227 . 1 1 105 105 ARG HB2 H 1 1.830 0.020 . 1 . . . . 205 ARG HB2 . 6949 1 1228 . 1 1 105 105 ARG HB3 H 1 1.830 0.020 . 1 . . . . 205 ARG HB3 . 6949 1 1229 . 1 1 105 105 ARG HG2 H 1 1.450 0.020 . 2 . . . . 205 ARG HG2 . 6949 1 1230 . 1 1 105 105 ARG HG3 H 1 1.620 0.020 . 2 . . . . 205 ARG HG3 . 6949 1 1231 . 1 1 105 105 ARG HD2 H 1 3.080 0.020 . 1 . . . . 205 ARG HD2 . 6949 1 1232 . 1 1 105 105 ARG HD3 H 1 3.080 0.020 . 1 . . . . 205 ARG HD3 . 6949 1 1233 . 1 1 105 105 ARG C C 13 178.070 0.400 . 1 . . . . 205 ARG C . 6949 1 1234 . 1 1 105 105 ARG CA C 13 60.270 0.400 . 1 . . . . 205 ARG CA . 6949 1 1235 . 1 1 105 105 ARG CB C 13 29.990 0.400 . 1 . . . . 205 ARG CB . 6949 1 1236 . 1 1 105 105 ARG CG C 13 28.120 0.400 . 1 . . . . 205 ARG CG . 6949 1 1237 . 1 1 105 105 ARG CD C 13 43.290 0.400 . 1 . . . . 205 ARG CD . 6949 1 1238 . 1 1 105 105 ARG N N 15 120.610 0.400 . 1 . . . . 205 ARG N . 6949 1 1239 . 1 1 106 106 ARG H H 1 7.680 0.020 . 1 . . . . 206 ARG H . 6949 1 1240 . 1 1 106 106 ARG HA H 1 4.000 0.020 . 1 . . . . 206 ARG HA . 6949 1 1241 . 1 1 106 106 ARG HB2 H 1 1.840 0.020 . 1 . . . . 206 ARG HB2 . 6949 1 1242 . 1 1 106 106 ARG HB3 H 1 1.840 0.020 . 1 . . . . 206 ARG HB3 . 6949 1 1243 . 1 1 106 106 ARG HG2 H 1 1.400 0.020 . 2 . . . . 206 ARG HG2 . 6949 1 1244 . 1 1 106 106 ARG HG3 H 1 1.600 0.020 . 2 . . . . 206 ARG HG3 . 6949 1 1245 . 1 1 106 106 ARG HD2 H 1 3.110 0.020 . 1 . . . . 206 ARG HD2 . 6949 1 1246 . 1 1 106 106 ARG HD3 H 1 3.110 0.020 . 1 . . . . 206 ARG HD3 . 6949 1 1247 . 1 1 106 106 ARG C C 13 178.910 0.400 . 1 . . . . 206 ARG C . 6949 1 1248 . 1 1 106 106 ARG CA C 13 59.840 0.400 . 1 . . . . 206 ARG CA . 6949 1 1249 . 1 1 106 106 ARG CB C 13 30.060 0.400 . 1 . . . . 206 ARG CB . 6949 1 1250 . 1 1 106 106 ARG CG C 13 27.620 0.400 . 1 . . . . 206 ARG CG . 6949 1 1251 . 1 1 106 106 ARG CD C 13 43.240 0.400 . 1 . . . . 206 ARG CD . 6949 1 1252 . 1 1 106 106 ARG N N 15 120.080 0.400 . 1 . . . . 206 ARG N . 6949 1 1253 . 1 1 107 107 VAL H H 1 8.860 0.020 . 1 . . . . 207 VAL H . 6949 1 1254 . 1 1 107 107 VAL HA H 1 3.570 0.020 . 1 . . . . 207 VAL HA . 6949 1 1255 . 1 1 107 107 VAL HB H 1 1.740 0.020 . 1 . . . . 207 VAL HB . 6949 1 1256 . 1 1 107 107 VAL HG11 H 1 0.830 0.020 . 2 . . . . 207 VAL HG1 . 6949 1 1257 . 1 1 107 107 VAL HG12 H 1 0.830 0.020 . 2 . . . . 207 VAL HG1 . 6949 1 1258 . 1 1 107 107 VAL HG13 H 1 0.830 0.020 . 2 . . . . 207 VAL HG1 . 6949 1 1259 . 1 1 107 107 VAL HG21 H 1 0.460 0.020 . 2 . . . . 207 VAL HG2 . 6949 1 1260 . 1 1 107 107 VAL HG22 H 1 0.460 0.020 . 2 . . . . 207 VAL HG2 . 6949 1 1261 . 1 1 107 107 VAL HG23 H 1 0.460 0.020 . 2 . . . . 207 VAL HG2 . 6949 1 1262 . 1 1 107 107 VAL C C 13 178.780 0.400 . 1 . . . . 207 VAL C . 6949 1 1263 . 1 1 107 107 VAL CA C 13 65.560 0.400 . 1 . . . . 207 VAL CA . 6949 1 1264 . 1 1 107 107 VAL CB C 13 31.840 0.400 . 1 . . . . 207 VAL CB . 6949 1 1265 . 1 1 107 107 VAL CG1 C 13 22.280 0.400 . 1 . . . . 207 VAL CG1 . 6949 1 1266 . 1 1 107 107 VAL CG2 C 13 21.660 0.400 . 1 . . . . 207 VAL CG2 . 6949 1 1267 . 1 1 107 107 VAL N N 15 118.520 0.400 . 1 . . . . 207 VAL N . 6949 1 1268 . 1 1 108 108 SER H H 1 8.090 0.020 . 1 . . . . 208 SER H . 6949 1 1269 . 1 1 108 108 SER HA H 1 3.960 0.020 . 1 . . . . 208 SER HA . 6949 1 1270 . 1 1 108 108 SER HB2 H 1 3.820 0.020 . 1 . . . . 208 SER HB2 . 6949 1 1271 . 1 1 108 108 SER HB3 H 1 3.820 0.020 . 1 . . . . 208 SER HB3 . 6949 1 1272 . 1 1 108 108 SER C C 13 173.310 0.400 . 1 . . . . 208 SER C . 6949 1 1273 . 1 1 108 108 SER CA C 13 63.250 0.400 . 1 . . . . 208 SER CA . 6949 1 1274 . 1 1 108 108 SER CB C 13 63.370 0.400 . 1 . . . . 208 SER CB . 6949 1 1275 . 1 1 108 108 SER N N 15 113.720 0.400 . 1 . . . . 208 SER N . 6949 1 1276 . 1 1 109 109 HIS H H 1 7.110 0.020 . 1 . . . . 209 HIS H . 6949 1 1277 . 1 1 109 109 HIS HA H 1 4.410 0.020 . 1 . . . . 209 HIS HA . 6949 1 1278 . 1 1 109 109 HIS HB2 H 1 3.100 0.020 . 2 . . . . 209 HIS HB2 . 6949 1 1279 . 1 1 109 109 HIS HB3 H 1 3.040 0.020 . 2 . . . . 209 HIS HB3 . 6949 1 1280 . 1 1 109 109 HIS HD2 H 1 6.980 0.020 . 1 . . . . 209 HIS HD2 . 6949 1 1281 . 1 1 109 109 HIS C C 13 176.580 0.400 . 1 . . . . 209 HIS C . 6949 1 1282 . 1 1 109 109 HIS CA C 13 58.240 0.400 . 1 . . . . 209 HIS CA . 6949 1 1283 . 1 1 109 109 HIS CB C 13 31.660 0.400 . 1 . . . . 209 HIS CB . 6949 1 1284 . 1 1 109 109 HIS CD2 C 13 122.320 0.400 . 1 . . . . 209 HIS CD2 . 6949 1 1285 . 1 1 109 109 HIS N N 15 113.410 0.400 . 1 . . . . 209 HIS N . 6949 1 1286 . 1 1 110 110 GLN H H 1 8.240 0.020 . 1 . . . . 210 GLN H . 6949 1 1287 . 1 1 110 110 GLN HA H 1 4.290 0.020 . 1 . . . . 210 GLN HA . 6949 1 1288 . 1 1 110 110 GLN HB2 H 1 1.930 0.020 . 2 . . . . 210 GLN HB2 . 6949 1 1289 . 1 1 110 110 GLN HB3 H 1 2.010 0.020 . 2 . . . . 210 GLN HB3 . 6949 1 1290 . 1 1 110 110 GLN HG2 H 1 2.280 0.020 . 2 . . . . 210 GLN HG2 . 6949 1 1291 . 1 1 110 110 GLN HG3 H 1 2.330 0.020 . 2 . . . . 210 GLN HG3 . 6949 1 1292 . 1 1 110 110 GLN C C 13 177.520 0.400 . 1 . . . . 210 GLN C . 6949 1 1293 . 1 1 110 110 GLN CA C 13 56.420 0.400 . 1 . . . . 210 GLN CA . 6949 1 1294 . 1 1 110 110 GLN CB C 13 30.890 0.400 . 1 . . . . 210 GLN CB . 6949 1 1295 . 1 1 110 110 GLN CG C 13 33.870 0.400 . 1 . . . . 210 GLN CG . 6949 1 1296 . 1 1 110 110 GLN N N 15 115.690 0.400 . 1 . . . . 210 GLN N . 6949 1 1297 . 1 1 111 111 GLY H H 1 8.680 0.020 . 1 . . . . 211 GLY H . 6949 1 1298 . 1 1 111 111 GLY HA2 H 1 3.780 0.020 . 2 . . . . 211 GLY HA2 . 6949 1 1299 . 1 1 111 111 GLY HA3 H 1 3.000 0.020 . 2 . . . . 211 GLY HA3 . 6949 1 1300 . 1 1 111 111 GLY C C 13 172.830 0.400 . 1 . . . . 211 GLY C . 6949 1 1301 . 1 1 111 111 GLY CA C 13 43.520 0.400 . 1 . . . . 211 GLY CA . 6949 1 1302 . 1 1 111 111 GLY N N 15 109.570 0.400 . 1 . . . . 211 GLY N . 6949 1 1303 . 1 1 112 112 TYR H H 1 8.290 0.020 . 1 . . . . 212 TYR H . 6949 1 1304 . 1 1 112 112 TYR HA H 1 4.370 0.020 . 1 . . . . 212 TYR HA . 6949 1 1305 . 1 1 112 112 TYR HB2 H 1 2.610 0.020 . 2 . . . . 212 TYR HB2 . 6949 1 1306 . 1 1 112 112 TYR HB3 H 1 3.070 0.020 . 2 . . . . 212 TYR HB3 . 6949 1 1307 . 1 1 112 112 TYR HD1 H 1 7.160 0.020 . 1 . . . . 212 TYR HD1 . 6949 1 1308 . 1 1 112 112 TYR HE1 H 1 6.930 0.020 . 1 . . . . 212 TYR HE1 . 6949 1 1309 . 1 1 112 112 TYR C C 13 177.480 0.400 . 1 . . . . 212 TYR C . 6949 1 1310 . 1 1 112 112 TYR CA C 13 60.080 0.400 . 1 . . . . 212 TYR CA . 6949 1 1311 . 1 1 112 112 TYR CB C 13 39.080 0.400 . 1 . . . . 212 TYR CB . 6949 1 1312 . 1 1 112 112 TYR CD1 C 13 132.620 0.400 . 1 . . . . 212 TYR CD1 . 6949 1 1313 . 1 1 112 112 TYR CE1 C 13 118.080 0.400 . 1 . . . . 212 TYR CE1 . 6949 1 1314 . 1 1 112 112 TYR N N 15 116.830 0.400 . 1 . . . . 212 TYR N . 6949 1 1315 . 1 1 113 113 SER H H 1 8.260 0.020 . 1 . . . . 213 SER H . 6949 1 1316 . 1 1 113 113 SER HA H 1 4.410 0.020 . 1 . . . . 213 SER HA . 6949 1 1317 . 1 1 113 113 SER HB2 H 1 3.810 0.020 . 1 . . . . 213 SER HB2 . 6949 1 1318 . 1 1 113 113 SER HB3 H 1 3.810 0.020 . 1 . . . . 213 SER HB3 . 6949 1 1319 . 1 1 113 113 SER C C 13 174.980 0.400 . 1 . . . . 213 SER C . 6949 1 1320 . 1 1 113 113 SER CA C 13 58.450 0.400 . 1 . . . . 213 SER CA . 6949 1 1321 . 1 1 113 113 SER CB C 13 63.580 0.400 . 1 . . . . 213 SER CB . 6949 1 1322 . 1 1 113 113 SER N N 15 115.880 0.400 . 1 . . . . 213 SER N . 6949 1 1323 . 1 1 114 114 THR H H 1 8.060 0.020 . 1 . . . . 214 THR H . 6949 1 1324 . 1 1 114 114 THR HA H 1 4.300 0.020 . 1 . . . . 214 THR HA . 6949 1 1325 . 1 1 114 114 THR HB H 1 4.160 0.020 . 1 . . . . 214 THR HB . 6949 1 1326 . 1 1 114 114 THR HG21 H 1 1.080 0.020 . 1 . . . . 214 THR HG2 . 6949 1 1327 . 1 1 114 114 THR HG22 H 1 1.080 0.020 . 1 . . . . 214 THR HG2 . 6949 1 1328 . 1 1 114 114 THR HG23 H 1 1.080 0.020 . 1 . . . . 214 THR HG2 . 6949 1 1329 . 1 1 114 114 THR C C 13 174.510 0.400 . 1 . . . . 214 THR C . 6949 1 1330 . 1 1 114 114 THR CA C 13 61.780 0.400 . 1 . . . . 214 THR CA . 6949 1 1331 . 1 1 114 114 THR CB C 13 70.160 0.400 . 1 . . . . 214 THR CB . 6949 1 1332 . 1 1 114 114 THR CG2 C 13 21.230 0.400 . 1 . . . . 214 THR CG2 . 6949 1 1333 . 1 1 114 114 THR N N 15 115.040 0.400 . 1 . . . . 214 THR N . 6949 1 1334 . 1 1 115 115 GLU H H 1 8.160 0.020 . 1 . . . . 215 GLU H . 6949 1 1335 . 1 1 115 115 GLU HA H 1 4.200 0.020 . 1 . . . . 215 GLU HA . 6949 1 1336 . 1 1 115 115 GLU HB2 H 1 1.990 0.020 . 2 . . . . 215 GLU HB2 . 6949 1 1337 . 1 1 115 115 GLU HB3 H 1 1.830 0.020 . 2 . . . . 215 GLU HB3 . 6949 1 1338 . 1 1 115 115 GLU HG3 H 1 2.120 0.020 . 2 . . . . 215 GLU HG3 . 6949 1 1339 . 1 1 115 115 GLU C C 13 175.050 0.400 . 1 . . . . 215 GLU C . 6949 1 1340 . 1 1 115 115 GLU CA C 13 56.330 0.400 . 1 . . . . 215 GLU CA . 6949 1 1341 . 1 1 115 115 GLU CB C 13 30.290 0.400 . 1 . . . . 215 GLU CB . 6949 1 1342 . 1 1 115 115 GLU CG C 13 36.270 0.400 . 1 . . . . 215 GLU CG . 6949 1 1343 . 1 1 115 115 GLU N N 15 123.180 0.400 . 1 . . . . 215 GLU N . 6949 1 1344 . 1 1 116 116 ALA H H 1 7.800 0.020 . 1 . . . . 216 ALA H . 6949 1 1345 . 1 1 116 116 ALA HA H 1 3.970 0.020 . 1 . . . . 216 ALA HA . 6949 1 1346 . 1 1 116 116 ALA HB1 H 1 1.190 0.020 . 1 . . . . 216 ALA HB . 6949 1 1347 . 1 1 116 116 ALA HB2 H 1 1.190 0.020 . 1 . . . . 216 ALA HB . 6949 1 1348 . 1 1 116 116 ALA HB3 H 1 1.190 0.020 . 1 . . . . 216 ALA HB . 6949 1 1349 . 1 1 116 116 ALA C C 13 182.460 0.400 . 1 . . . . 216 ALA C . 6949 1 1350 . 1 1 116 116 ALA CA C 13 53.810 0.400 . 1 . . . . 216 ALA CA . 6949 1 1351 . 1 1 116 116 ALA CB C 13 20.080 0.400 . 1 . . . . 216 ALA CB . 6949 1 1352 . 1 1 116 116 ALA N N 15 130.710 0.400 . 1 . . . . 216 ALA N . 6949 1 stop_ save_