data_11590 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11590 _Entry.Title ; Solution Structure of the PhoP DNA-Binding Domain from Mycobacterium tuberculosis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-04-17 _Entry.Accession_date 2015-05-06 _Entry.Last_release_date 2015-08-10 _Entry.Original_release_date 2015-08-10 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1.1.61 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _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 Ramsay Macdonald . . . 11590 2 Dibyendu Sarkar . . . 11590 3 Brendan Amer . R. . 11590 4 Robert Clubb . T. . 11590 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 11590 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID MTB . 11590 NMR . 11590 PhoPC . 11590 'heteronuclear NOE' . 11590 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11590 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 453 11590 '15N chemical shifts' 98 11590 '1H chemical shifts' 673 11590 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2015-08-10 . original BMRB . 11590 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2RV8 'BMRB Entry Tracking System' 11590 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11590 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26209027 _Citation.Full_citation . _Citation.Title ; Solution structure of the PhoP DNA-binding domain from Mycobacterium tuberculosis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2015 _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 Ramsay Macdonald . . . 11590 1 2 Dibyendu Sarkar . . . 11590 1 3 Brendan Amer . R. . 11590 1 4 Robert Clubb . T. . 11590 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11590 _Assembly.ID 1 _Assembly.Name 'PhoP DNA-Binding Domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 'PhoP DNA-Binding Domain' 1 $PhoPC A . yes native no no . . . 11590 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PhoPC _Entity.Sf_category entity _Entity.Sf_framecode PhoPC _Entity.Entry_ID 11590 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PhoPC _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSSHHHHHHSSGLVPRGSH MKGNKEPRNVRLTFADIELD EETHEVWKAGQPVSLSPTEF TLLRYFVINAGTVLSKPKIL DHVWRYDFGGDVNVVESYVS YLRRKIDTGEKRLLHTLRGV GYVLREPR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 120-247 _Entity.Polymer_author_seq_details 'Residues 120-141 represent a histidine-tag' _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 128 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'PhoPC (PhoP C-terminal domain)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14723.858 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 PDB 2RV8 . "Solution Structure Of The Phop Dna-binding Domain From Mycobacterium Tuberculosis" . . . . . 100.00 128 100.00 100.00 4.30e-87 . . . . 11590 1 2 no PDB 3R0J . "Structure Of Phop From Mycobacterium Tuberculosis" . . . . . 83.59 250 100.00 100.00 7.50e-70 . . . . 11590 1 3 no DBJ BAH25072 . "putative two component system response transcriptional positive regulator [Mycobacterium bovis BCG str. Tokyo 172]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 4 no DBJ BAL64650 . "two component system response transcriptionalpositive regulator [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 83.59 247 100.00 100.00 2.84e-70 . . . . 11590 1 5 no DBJ BAQ04662 . "two component system response transcriptional positive regulator [Mycobacterium tuberculosis str. Kurono]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 6 no DBJ GAA44527 . "two component system response transcriptional positive regulator [Mycobacterium tuberculosis NCGM2209]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 7 no EMBL CAL70795 . "Possible two component system response transcriptional positive regulator phoP [Mycobacterium bovis BCG str. Pasteur 1173P2]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 8 no EMBL CCC25841 . "putative two component system response transcriptional positive regulator PHOP [Mycobacterium africanum GM041182]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 9 no EMBL CCC43101 . "putative two component system response transcriptional positive regulator PHOP [Mycobacterium canettii CIPT 140010059]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 10 no EMBL CCC63367 . "possible two component system response transcriptional positive regulator phoP [Mycobacterium bovis BCG str. Moreau RDJ]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 11 no EMBL CCE36300 . "phoP [Mycobacterium tuberculosis UT205]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 12 no GB AAK45023 . "DNA-binding response regulator [Mycobacterium tuberculosis CDC1551]" . . . . . 83.59 240 100.00 100.00 3.32e-70 . . . . 11590 1 13 no GB ABQ72495 . "putative two component system response transcriptional positive regulator PhoP [Mycobacterium tuberculosis H37Ra]" . . . . . 83.59 247 99.07 99.07 3.52e-69 . . . . 11590 1 14 no GB ABR05115 . "two component system response transcriptional positive regulator phoP [Mycobacterium tuberculosis F11]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 15 no GB ACT23809 . "two component system transcriptional regulator phoP [Mycobacterium tuberculosis KZN 1435]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 16 no GB AEB02905 . "two component system transcriptional regulator phoP [Mycobacterium tuberculosis KZN 4207]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 17 no REF NP_215271 . "two component system response transcriptional positive regulator PhoP [Mycobacterium tuberculosis H37Rv]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 18 no REF NP_854438 . "two component system response transcriptional positive regulator PHOP [Mycobacterium bovis AF2122/97]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 19 no REF WP_003403867 . "MULTISPECIES: DNA-binding response regulator [Mycobacterium]" . . . . . 83.59 247 100.00 100.00 3.13e-70 . . . . 11590 1 20 no REF WP_003915456 . "DNA-binding response regulator [Mycobacterium tuberculosis]" . . . . . 83.59 240 100.00 100.00 3.32e-70 . . . . 11590 1 21 no REF WP_012054162 . "DNA-binding response regulator [Mycobacterium tuberculosis]" . . . . . 83.59 247 99.07 99.07 3.52e-69 . . . . 11590 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 1 120 MET . 11590 1 2 121 GLY . 11590 1 3 122 SER . 11590 1 4 123 SER . 11590 1 5 124 HIS . 11590 1 6 125 HIS . 11590 1 7 126 HIS . 11590 1 8 127 HIS . 11590 1 9 128 HIS . 11590 1 10 129 HIS . 11590 1 11 130 SER . 11590 1 12 131 SER . 11590 1 13 132 GLY . 11590 1 14 133 LEU . 11590 1 15 134 VAL . 11590 1 16 135 PRO . 11590 1 17 136 ARG . 11590 1 18 137 GLY . 11590 1 19 138 SER . 11590 1 20 139 HIS . 11590 1 21 140 MET . 11590 1 22 141 LYS . 11590 1 23 142 GLY . 11590 1 24 143 ASN . 11590 1 25 144 LYS . 11590 1 26 145 GLU . 11590 1 27 146 PRO . 11590 1 28 147 ARG . 11590 1 29 148 ASN . 11590 1 30 149 VAL . 11590 1 31 150 ARG . 11590 1 32 151 LEU . 11590 1 33 152 THR . 11590 1 34 153 PHE . 11590 1 35 154 ALA . 11590 1 36 155 ASP . 11590 1 37 156 ILE . 11590 1 38 157 GLU . 11590 1 39 158 LEU . 11590 1 40 159 ASP . 11590 1 41 160 GLU . 11590 1 42 161 GLU . 11590 1 43 162 THR . 11590 1 44 163 HIS . 11590 1 45 164 GLU . 11590 1 46 165 VAL . 11590 1 47 166 TRP . 11590 1 48 167 LYS . 11590 1 49 168 ALA . 11590 1 50 169 GLY . 11590 1 51 170 GLN . 11590 1 52 171 PRO . 11590 1 53 172 VAL . 11590 1 54 173 SER . 11590 1 55 174 LEU . 11590 1 56 175 SER . 11590 1 57 176 PRO . 11590 1 58 177 THR . 11590 1 59 178 GLU . 11590 1 60 179 PHE . 11590 1 61 180 THR . 11590 1 62 181 LEU . 11590 1 63 182 LEU . 11590 1 64 183 ARG . 11590 1 65 184 TYR . 11590 1 66 185 PHE . 11590 1 67 186 VAL . 11590 1 68 187 ILE . 11590 1 69 188 ASN . 11590 1 70 189 ALA . 11590 1 71 190 GLY . 11590 1 72 191 THR . 11590 1 73 192 VAL . 11590 1 74 193 LEU . 11590 1 75 194 SER . 11590 1 76 195 LYS . 11590 1 77 196 PRO . 11590 1 78 197 LYS . 11590 1 79 198 ILE . 11590 1 80 199 LEU . 11590 1 81 200 ASP . 11590 1 82 201 HIS . 11590 1 83 202 VAL . 11590 1 84 203 TRP . 11590 1 85 204 ARG . 11590 1 86 205 TYR . 11590 1 87 206 ASP . 11590 1 88 207 PHE . 11590 1 89 208 GLY . 11590 1 90 209 GLY . 11590 1 91 210 ASP . 11590 1 92 211 VAL . 11590 1 93 212 ASN . 11590 1 94 213 VAL . 11590 1 95 214 VAL . 11590 1 96 215 GLU . 11590 1 97 216 SER . 11590 1 98 217 TYR . 11590 1 99 218 VAL . 11590 1 100 219 SER . 11590 1 101 220 TYR . 11590 1 102 221 LEU . 11590 1 103 222 ARG . 11590 1 104 223 ARG . 11590 1 105 224 LYS . 11590 1 106 225 ILE . 11590 1 107 226 ASP . 11590 1 108 227 THR . 11590 1 109 228 GLY . 11590 1 110 229 GLU . 11590 1 111 230 LYS . 11590 1 112 231 ARG . 11590 1 113 232 LEU . 11590 1 114 233 LEU . 11590 1 115 234 HIS . 11590 1 116 235 THR . 11590 1 117 236 LEU . 11590 1 118 237 ARG . 11590 1 119 238 GLY . 11590 1 120 239 VAL . 11590 1 121 240 GLY . 11590 1 122 241 TYR . 11590 1 123 242 VAL . 11590 1 124 243 LEU . 11590 1 125 244 ARG . 11590 1 126 245 GLU . 11590 1 127 246 PRO . 11590 1 128 247 ARG . 11590 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 11590 1 . GLY 2 2 11590 1 . SER 3 3 11590 1 . SER 4 4 11590 1 . HIS 5 5 11590 1 . HIS 6 6 11590 1 . HIS 7 7 11590 1 . HIS 8 8 11590 1 . HIS 9 9 11590 1 . HIS 10 10 11590 1 . SER 11 11 11590 1 . SER 12 12 11590 1 . GLY 13 13 11590 1 . LEU 14 14 11590 1 . VAL 15 15 11590 1 . PRO 16 16 11590 1 . ARG 17 17 11590 1 . GLY 18 18 11590 1 . SER 19 19 11590 1 . HIS 20 20 11590 1 . MET 21 21 11590 1 . LYS 22 22 11590 1 . GLY 23 23 11590 1 . ASN 24 24 11590 1 . LYS 25 25 11590 1 . GLU 26 26 11590 1 . PRO 27 27 11590 1 . ARG 28 28 11590 1 . ASN 29 29 11590 1 . VAL 30 30 11590 1 . ARG 31 31 11590 1 . LEU 32 32 11590 1 . THR 33 33 11590 1 . PHE 34 34 11590 1 . ALA 35 35 11590 1 . ASP 36 36 11590 1 . ILE 37 37 11590 1 . GLU 38 38 11590 1 . LEU 39 39 11590 1 . ASP 40 40 11590 1 . GLU 41 41 11590 1 . GLU 42 42 11590 1 . THR 43 43 11590 1 . HIS 44 44 11590 1 . GLU 45 45 11590 1 . VAL 46 46 11590 1 . TRP 47 47 11590 1 . LYS 48 48 11590 1 . ALA 49 49 11590 1 . GLY 50 50 11590 1 . GLN 51 51 11590 1 . PRO 52 52 11590 1 . VAL 53 53 11590 1 . SER 54 54 11590 1 . LEU 55 55 11590 1 . SER 56 56 11590 1 . PRO 57 57 11590 1 . THR 58 58 11590 1 . GLU 59 59 11590 1 . PHE 60 60 11590 1 . THR 61 61 11590 1 . LEU 62 62 11590 1 . LEU 63 63 11590 1 . ARG 64 64 11590 1 . TYR 65 65 11590 1 . PHE 66 66 11590 1 . VAL 67 67 11590 1 . ILE 68 68 11590 1 . ASN 69 69 11590 1 . ALA 70 70 11590 1 . GLY 71 71 11590 1 . THR 72 72 11590 1 . VAL 73 73 11590 1 . LEU 74 74 11590 1 . SER 75 75 11590 1 . LYS 76 76 11590 1 . PRO 77 77 11590 1 . LYS 78 78 11590 1 . ILE 79 79 11590 1 . LEU 80 80 11590 1 . ASP 81 81 11590 1 . HIS 82 82 11590 1 . VAL 83 83 11590 1 . TRP 84 84 11590 1 . ARG 85 85 11590 1 . TYR 86 86 11590 1 . ASP 87 87 11590 1 . PHE 88 88 11590 1 . GLY 89 89 11590 1 . GLY 90 90 11590 1 . ASP 91 91 11590 1 . VAL 92 92 11590 1 . ASN 93 93 11590 1 . VAL 94 94 11590 1 . VAL 95 95 11590 1 . GLU 96 96 11590 1 . SER 97 97 11590 1 . TYR 98 98 11590 1 . VAL 99 99 11590 1 . SER 100 100 11590 1 . TYR 101 101 11590 1 . LEU 102 102 11590 1 . ARG 103 103 11590 1 . ARG 104 104 11590 1 . LYS 105 105 11590 1 . ILE 106 106 11590 1 . ASP 107 107 11590 1 . THR 108 108 11590 1 . GLY 109 109 11590 1 . GLU 110 110 11590 1 . LYS 111 111 11590 1 . ARG 112 112 11590 1 . LEU 113 113 11590 1 . LEU 114 114 11590 1 . HIS 115 115 11590 1 . THR 116 116 11590 1 . LEU 117 117 11590 1 . ARG 118 118 11590 1 . GLY 119 119 11590 1 . VAL 120 120 11590 1 . GLY 121 121 11590 1 . TYR 122 122 11590 1 . VAL 123 123 11590 1 . LEU 124 124 11590 1 . ARG 125 125 11590 1 . GLU 126 126 11590 1 . PRO 127 127 11590 1 . ARG 128 128 11590 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 11590 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $PhoPC . 1773 organism . 'Mycobacterium tuberculosis' 'Mycobacterium tuberculosis' . . Bacteria . Mycobacterium tuberculosis . . . . . . . . . . . . . 11590 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 11590 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $PhoPC . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . pET-15b . . . 11590 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11590 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _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 'sodium phosphate' 'natural abundance' . . . . . buffer 50.0 . . mM . . . . 11590 1 2 'sodium chloride' 'natural abundance' . . . . . salt 300.0 . . mM . . . . 11590 1 3 'sodium azide' 'natural abundance' . . . . . . 0.01 . . % . . . . 11590 1 4 PhoPC '[U-100% 13C; U-100% 15N]' . . 1 $PhoPC . protein 1.0 . . mM 0.5 . . . 11590 1 5 H2O 'natural abundance' . . . . . solvent 93 . . % . . . . 11590 1 6 D2O [U-2H] . . . . . solvent 7 . . % . . . . 11590 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 11590 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _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 'sodium phosphate' 'natural abundance' . . . . . buffer 50.0 . . mM . . . . 11590 2 2 'sodium chloride' 'natural abundance' . . . . . salt 300.0 . . mM . . . . 11590 2 3 'sodium azide' 'natural abundance' . . . . . . 0.01 . . % . . . . 11590 2 4 PhoPC '[U-100% 13C; U-100% 15N]' . . 1 $PhoPC . protein 1.0 . . mM 0.5 . . . 11590 2 5 D2O [U-2H] . . . . . solvent 100 . . % . . . . 11590 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 11590 _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 'ionic strength' 350 . mM 11590 1 pH 6.5 . pH 11590 1 pressure 1 . atm 11590 1 temperature 298 . K 11590 1 stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 11590 _Software.ID 1 _Software.Name X-PLOR_NIH _Software.Version 2.25 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 11590 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11590 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11590 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 11590 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11590 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 11590 _Software.ID 3 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 11590 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11590 3 stop_ save_ save_PIPP _Software.Sf_category software _Software.Sf_framecode PIPP _Software.Entry_ID 11590 _Software.ID 4 _Software.Name PIPP _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Garrett . . 11590 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 11590 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 11590 _Software.ID 5 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 11590 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'dihedral angle calculation' 11590 5 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 11590 _Software.ID 6 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 11590 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID statistics 11590 6 stop_ save_ save_UNIO _Software.Sf_category software _Software.Sf_framecode UNIO _Software.Entry_ID 11590 _Software.ID 7 _Software.Name UNIO _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Herrmann . . 11590 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11590 7 'peak picking' 11590 7 'structure solution' 11590 7 stop_ save_ save_ATNOS-CANDID _Software.Sf_category software _Software.Sf_framecode ATNOS-CANDID _Software.Entry_ID 11590 _Software.ID 8 _Software.Name ATNOS-CANDID _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 11590 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11590 8 'peak picking' 11590 8 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 11590 _Software.ID 9 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 11590 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 11590 9 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 11590 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avence _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11590 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avence _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 11590 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avence _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11590 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 500 . . . 11590 1 2 spectrometer_2 Bruker Avance . 600 . . . 11590 1 3 spectrometer_3 Bruker Avance . 800 . . . 11590 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 11590 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 8 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 10 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 11 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11590 1 12 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 13 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 14 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 15 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 16 '3D HCCH-COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11590 1 17 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 18 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 19 '3D HBHANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11590 1 20 '3D (H)CCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 11590 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 11590 _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 0.00 na indirect 0.251449530 . . . . . . . . . 11590 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 external direct 1.0 . . . . . . . . . 11590 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 11590 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_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 11590 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _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 '2D 1H-15N HSQC' 1 $sample_1 isotropic 11590 1 2 '2D 1H-13C HSQC aliphatic' 2 $sample_2 isotropic 11590 1 3 '2D 1H-13C HSQC aromatic' 2 $sample_2 isotropic 11590 1 4 '3D HNCO' 1 $sample_1 isotropic 11590 1 5 '3D HNCACB' 1 $sample_1 isotropic 11590 1 6 '3D CBCA(CO)NH' 1 $sample_1 isotropic 11590 1 7 '3D HBHA(CO)NH' 1 $sample_1 isotropic 11590 1 8 '3D HNHA' 1 $sample_1 isotropic 11590 1 9 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11590 1 10 '3D 1H-15N TOCSY' 1 $sample_1 isotropic 11590 1 11 '3D HNCA' 1 $sample_1 isotropic 11590 1 13 '3D 1H-13C NOESY aromatic' 2 $sample_2 isotropic 11590 1 14 '3D HCCH-TOCSY' 2 $sample_2 isotropic 11590 1 15 '3D C(CO)NH' 1 $sample_1 isotropic 11590 1 16 '3D HCCH-COSY' 2 $sample_2 isotropic 11590 1 17 '3D HN(CA)CO' 1 $sample_1 isotropic 11590 1 19 '3D HBHANH' 1 $sample_1 isotropic 11590 1 20 '3D (H)CCH-TOCSY' 2 $sample_2 isotropic 11590 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 23 23 GLY H H 1 8.433 . . 1 . . . A 142 GLY H . 11590 1 2 . 1 1 23 23 GLY HA2 H 1 3.898 . . 2 . . . A 142 GLY HA2 . 11590 1 3 . 1 1 23 23 GLY HA3 H 1 3.898 . . 2 . . . A 142 GLY HA3 . 11590 1 4 . 1 1 23 23 GLY C C 13 173.719 . . 1 . . . A 142 GLY C . 11590 1 5 . 1 1 23 23 GLY CA C 13 44.713 . . 1 . . . A 142 GLY CA . 11590 1 6 . 1 1 23 23 GLY N N 15 110.120 . . 1 . . . A 142 GLY N . 11590 1 7 . 1 1 24 24 ASN H H 1 8.297 . . 1 . . . A 143 ASN H . 11590 1 8 . 1 1 24 24 ASN HA H 1 4.669 . . 1 . . . A 143 ASN HA . 11590 1 9 . 1 1 24 24 ASN HB2 H 1 2.696 . . 2 . . . A 143 ASN HB2 . 11590 1 10 . 1 1 24 24 ASN HB3 H 1 2.736 . . 2 . . . A 143 ASN HB3 . 11590 1 11 . 1 1 24 24 ASN C C 13 175.049 . . 1 . . . A 143 ASN C . 11590 1 12 . 1 1 24 24 ASN CA C 13 52.709 . . 1 . . . A 143 ASN CA . 11590 1 13 . 1 1 24 24 ASN CB C 13 38.640 . . 1 . . . A 143 ASN CB . 11590 1 14 . 1 1 24 24 ASN N N 15 118.772 . . 1 . . . A 143 ASN N . 11590 1 15 . 1 1 25 25 LYS H H 1 8.304 . . 1 . . . A 144 LYS H . 11590 1 16 . 1 1 25 25 LYS HA H 1 4.245 . . 1 . . . A 144 LYS HA . 11590 1 17 . 1 1 25 25 LYS HB2 H 1 1.759 . . 2 . . . A 144 LYS HB2 . 11590 1 18 . 1 1 25 25 LYS HB3 H 1 1.759 . . 2 . . . A 144 LYS HB3 . 11590 1 19 . 1 1 25 25 LYS C C 13 176.112 . . 1 . . . A 144 LYS C . 11590 1 20 . 1 1 25 25 LYS CA C 13 55.918 . . 1 . . . A 144 LYS CA . 11590 1 21 . 1 1 25 25 LYS CB C 13 32.567 . . 1 . . . A 144 LYS CB . 11590 1 22 . 1 1 25 25 LYS CG C 13 24.357 . . 1 . . . A 144 LYS CG . 11590 1 23 . 1 1 25 25 LYS CD C 13 28.583 . . 1 . . . A 144 LYS CD . 11590 1 24 . 1 1 25 25 LYS CE C 13 41.623 . . 1 . . . A 144 LYS CE . 11590 1 25 . 1 1 25 25 LYS N N 15 121.303 . . 1 . . . A 144 LYS N . 11590 1 26 . 1 1 26 26 GLU H H 1 8.320 . . 1 . . . A 145 GLU H . 11590 1 27 . 1 1 26 26 GLU HA H 1 4.482 . . 1 . . . A 145 GLU HA . 11590 1 28 . 1 1 26 26 GLU HB3 H 1 1.861 . . 2 . . . A 145 GLU HB3 . 11590 1 29 . 1 1 26 26 GLU HG3 H 1 2.215 . . 2 . . . A 145 GLU HG3 . 11590 1 30 . 1 1 26 26 GLU CA C 13 54.071 . . 1 . . . A 145 GLU CA . 11590 1 31 . 1 1 26 26 GLU CB C 13 29.386 . . 1 . . . A 145 GLU CB . 11590 1 32 . 1 1 26 26 GLU CG C 13 35.652 . . 1 . . . A 145 GLU CG . 11590 1 33 . 1 1 26 26 GLU N N 15 123.253 . . 1 . . . A 145 GLU N . 11590 1 34 . 1 1 27 27 PRO HA H 1 4.337 . . 1 . . . A 146 PRO HA . 11590 1 35 . 1 1 27 27 PRO HB2 H 1 1.852 . . 2 . . . A 146 PRO HB2 . 11590 1 36 . 1 1 27 27 PRO HB3 H 1 2.204 . . 2 . . . A 146 PRO HB3 . 11590 1 37 . 1 1 27 27 PRO HG2 H 1 1.875 . . 2 . . . A 146 PRO HG2 . 11590 1 38 . 1 1 27 27 PRO HG3 H 1 1.969 . . 2 . . . A 146 PRO HG3 . 11590 1 39 . 1 1 27 27 PRO HD2 H 1 3.621 . . 2 . . . A 146 PRO HD2 . 11590 1 40 . 1 1 27 27 PRO HD3 H 1 3.727 . . 2 . . . A 146 PRO HD3 . 11590 1 41 . 1 1 27 27 PRO C C 13 176.628 . . 1 . . . A 146 PRO C . 11590 1 42 . 1 1 27 27 PRO CA C 13 62.840 . . 1 . . . A 146 PRO CA . 11590 1 43 . 1 1 27 27 PRO CB C 13 31.765 . . 1 . . . A 146 PRO CB . 11590 1 44 . 1 1 27 27 PRO CG C 13 27.098 . . 1 . . . A 146 PRO CG . 11590 1 45 . 1 1 27 27 PRO CD C 13 50.348 . . 1 . . . A 146 PRO CD . 11590 1 46 . 1 1 28 28 ARG H H 1 8.407 . . 1 . . . A 147 ARG H . 11590 1 47 . 1 1 28 28 ARG HA H 1 4.254 . . 1 . . . A 147 ARG HA . 11590 1 48 . 1 1 28 28 ARG HB3 H 1 1.719 . . 2 . . . A 147 ARG HB3 . 11590 1 49 . 1 1 28 28 ARG C C 13 175.780 . . 1 . . . A 147 ARG C . 11590 1 50 . 1 1 28 28 ARG CA C 13 55.588 . . 1 . . . A 147 ARG CA . 11590 1 51 . 1 1 28 28 ARG CB C 13 31.030 . . 1 . . . A 147 ARG CB . 11590 1 52 . 1 1 28 28 ARG CG C 13 27.120 . . 1 . . . A 147 ARG CG . 11590 1 53 . 1 1 28 28 ARG CD C 13 42.809 . . 1 . . . A 147 ARG CD . 11590 1 54 . 1 1 28 28 ARG N N 15 121.177 . . 1 . . . A 147 ARG N . 11590 1 55 . 1 1 29 29 ASN H H 1 8.499 . . 1 . . . A 148 ASN H . 11590 1 56 . 1 1 29 29 ASN HA H 1 4.718 . . 1 . . . A 148 ASN HA . 11590 1 57 . 1 1 29 29 ASN HB2 H 1 2.717 . . 2 . . . A 148 ASN HB2 . 11590 1 58 . 1 1 29 29 ASN HB3 H 1 2.826 . . 2 . . . A 148 ASN HB3 . 11590 1 59 . 1 1 29 29 ASN C C 13 174.919 . . 1 . . . A 148 ASN C . 11590 1 60 . 1 1 29 29 ASN CA C 13 52.772 . . 1 . . . A 148 ASN CA . 11590 1 61 . 1 1 29 29 ASN CB C 13 38.570 . . 1 . . . A 148 ASN CB . 11590 1 62 . 1 1 29 29 ASN N N 15 120.623 . . 1 . . . A 148 ASN N . 11590 1 63 . 1 1 30 30 VAL H H 1 8.336 . . 1 . . . A 149 VAL H . 11590 1 64 . 1 1 30 30 VAL HA H 1 4.176 . . 1 . . . A 149 VAL HA . 11590 1 65 . 1 1 30 30 VAL HB H 1 2.162 . . 1 . . . A 149 VAL HB . 11590 1 66 . 1 1 30 30 VAL HG11 H 1 0.913 . . 2 . . . A 149 VAL HG11 . 11590 1 67 . 1 1 30 30 VAL HG12 H 1 0.913 . . 2 . . . A 149 VAL HG12 . 11590 1 68 . 1 1 30 30 VAL HG13 H 1 0.913 . . 2 . . . A 149 VAL HG13 . 11590 1 69 . 1 1 30 30 VAL HG21 H 1 0.908 . . 2 . . . A 149 VAL HG21 . 11590 1 70 . 1 1 30 30 VAL HG22 H 1 0.908 . . 2 . . . A 149 VAL HG22 . 11590 1 71 . 1 1 30 30 VAL HG23 H 1 0.908 . . 2 . . . A 149 VAL HG23 . 11590 1 72 . 1 1 30 30 VAL C C 13 175.433 . . 1 . . . A 149 VAL C . 11590 1 73 . 1 1 30 30 VAL CA C 13 61.908 . . 1 . . . A 149 VAL CA . 11590 1 74 . 1 1 30 30 VAL CB C 13 32.309 . . 1 . . . A 149 VAL CB . 11590 1 75 . 1 1 30 30 VAL CG1 C 13 19.981 . . 2 . . . A 149 VAL CG1 . 11590 1 76 . 1 1 30 30 VAL CG2 C 13 21.128 . . 2 . . . A 149 VAL CG2 . 11590 1 77 . 1 1 30 30 VAL N N 15 120.120 . . 1 . . . A 149 VAL N . 11590 1 78 . 1 1 31 31 ARG H H 1 8.185 . . 1 . . . A 150 ARG H . 11590 1 79 . 1 1 31 31 ARG HA H 1 5.102 . . 1 . . . A 150 ARG HA . 11590 1 80 . 1 1 31 31 ARG HB2 H 1 1.683 . . 2 . . . A 150 ARG HB2 . 11590 1 81 . 1 1 31 31 ARG HB3 H 1 1.683 . . 2 . . . A 150 ARG HB3 . 11590 1 82 . 1 1 31 31 ARG HG2 H 1 1.454 . . 2 . . . A 150 ARG HG2 . 11590 1 83 . 1 1 31 31 ARG HG3 H 1 1.677 . . 2 . . . A 150 ARG HG3 . 11590 1 84 . 1 1 31 31 ARG HD2 H 1 2.983 . . 2 . . . A 150 ARG HD2 . 11590 1 85 . 1 1 31 31 ARG HD3 H 1 2.983 . . 2 . . . A 150 ARG HD3 . 11590 1 86 . 1 1 31 31 ARG C C 13 176.292 . . 1 . . . A 150 ARG C . 11590 1 87 . 1 1 31 31 ARG CA C 13 54.507 . . 1 . . . A 150 ARG CA . 11590 1 88 . 1 1 31 31 ARG CB C 13 31.253 . . 1 . . . A 150 ARG CB . 11590 1 89 . 1 1 31 31 ARG CG C 13 27.319 . . 1 . . . A 150 ARG CG . 11590 1 90 . 1 1 31 31 ARG CD C 13 43.105 . . 1 . . . A 150 ARG CD . 11590 1 91 . 1 1 31 31 ARG N N 15 123.263 . . 1 . . . A 150 ARG N . 11590 1 92 . 1 1 32 32 LEU H H 1 8.923 . . 1 . . . A 151 LEU H . 11590 1 93 . 1 1 32 32 LEU HA H 1 4.683 . . 1 . . . A 151 LEU HA . 11590 1 94 . 1 1 32 32 LEU HB2 H 1 1.463 . . 2 . . . A 151 LEU HB2 . 11590 1 95 . 1 1 32 32 LEU HB3 H 1 1.667 . . 2 . . . A 151 LEU HB3 . 11590 1 96 . 1 1 32 32 LEU HG H 1 1.631 . . 1 . . . A 151 LEU HG . 11590 1 97 . 1 1 32 32 LEU HD11 H 1 0.840 . . 2 . . . A 151 LEU HD11 . 11590 1 98 . 1 1 32 32 LEU HD12 H 1 0.840 . . 2 . . . A 151 LEU HD12 . 11590 1 99 . 1 1 32 32 LEU HD13 H 1 0.840 . . 2 . . . A 151 LEU HD13 . 11590 1 100 . 1 1 32 32 LEU HD21 H 1 0.837 . . 2 . . . A 151 LEU HD21 . 11590 1 101 . 1 1 32 32 LEU HD22 H 1 0.837 . . 2 . . . A 151 LEU HD22 . 11590 1 102 . 1 1 32 32 LEU HD23 H 1 0.837 . . 2 . . . A 151 LEU HD23 . 11590 1 103 . 1 1 32 32 LEU C C 13 176.281 . . 1 . . . A 151 LEU C . 11590 1 104 . 1 1 32 32 LEU CA C 13 53.640 . . 1 . . . A 151 LEU CA . 11590 1 105 . 1 1 32 32 LEU CB C 13 43.664 . . 1 . . . A 151 LEU CB . 11590 1 106 . 1 1 32 32 LEU CG C 13 26.869 . . 1 . . . A 151 LEU CG . 11590 1 107 . 1 1 32 32 LEU CD1 C 13 25.204 . . 2 . . . A 151 LEU CD1 . 11590 1 108 . 1 1 32 32 LEU CD2 C 13 23.381 . . 2 . . . A 151 LEU CD2 . 11590 1 109 . 1 1 32 32 LEU N N 15 124.609 . . 1 . . . A 151 LEU N . 11590 1 110 . 1 1 33 33 THR H H 1 8.455 . . 1 . . . A 152 THR H . 11590 1 111 . 1 1 33 33 THR HA H 1 5.335 . . 1 . . . A 152 THR HA . 11590 1 112 . 1 1 33 33 THR HB H 1 4.006 . . 1 . . . A 152 THR HB . 11590 1 113 . 1 1 33 33 THR HG21 H 1 1.040 . . 1 . . . A 152 THR HG21 . 11590 1 114 . 1 1 33 33 THR HG22 H 1 1.040 . . 1 . . . A 152 THR HG22 . 11590 1 115 . 1 1 33 33 THR HG23 H 1 1.040 . . 1 . . . A 152 THR HG23 . 11590 1 116 . 1 1 33 33 THR C C 13 173.885 . . 1 . . . A 152 THR C . 11590 1 117 . 1 1 33 33 THR CA C 13 59.653 . . 1 . . . A 152 THR CA . 11590 1 118 . 1 1 33 33 THR CB C 13 71.793 . . 1 . . . A 152 THR CB . 11590 1 119 . 1 1 33 33 THR CG2 C 13 20.994 . . 1 . . . A 152 THR CG2 . 11590 1 120 . 1 1 33 33 THR N N 15 114.287 . . 1 . . . A 152 THR N . 11590 1 121 . 1 1 34 34 PHE H H 1 8.600 . . 1 . . . A 153 PHE H . 11590 1 122 . 1 1 34 34 PHE HA H 1 4.270 . . 1 . . . A 153 PHE HA . 11590 1 123 . 1 1 34 34 PHE HB2 H 1 2.492 . . 2 . . . A 153 PHE HB2 . 11590 1 124 . 1 1 34 34 PHE HB3 H 1 3.198 . . 2 . . . A 153 PHE HB3 . 11590 1 125 . 1 1 34 34 PHE C C 13 173.355 . . 1 . . . A 153 PHE C . 11590 1 126 . 1 1 34 34 PHE CA C 13 58.738 . . 1 . . . A 153 PHE CA . 11590 1 127 . 1 1 34 34 PHE CB C 13 42.804 . . 1 . . . A 153 PHE CB . 11590 1 128 . 1 1 34 34 PHE N N 15 122.820 . . 1 . . . A 153 PHE N . 11590 1 129 . 1 1 35 35 ALA H H 1 8.587 . . 1 . . . A 154 ALA H . 11590 1 130 . 1 1 35 35 ALA HA H 1 3.491 . . 1 . . . A 154 ALA HA . 11590 1 131 . 1 1 35 35 ALA HB1 H 1 1.051 . . 1 . . . A 154 ALA HB1 . 11590 1 132 . 1 1 35 35 ALA HB2 H 1 1.051 . . 1 . . . A 154 ALA HB2 . 11590 1 133 . 1 1 35 35 ALA HB3 H 1 1.051 . . 1 . . . A 154 ALA HB3 . 11590 1 134 . 1 1 35 35 ALA C C 13 175.777 . . 1 . . . A 154 ALA C . 11590 1 135 . 1 1 35 35 ALA CA C 13 53.424 . . 1 . . . A 154 ALA CA . 11590 1 136 . 1 1 35 35 ALA CB C 13 16.150 . . 1 . . . A 154 ALA CB . 11590 1 137 . 1 1 35 35 ALA N N 15 130.322 . . 1 . . . A 154 ALA N . 11590 1 138 . 1 1 36 36 ASP H H 1 8.077 . . 1 . . . A 155 ASP H . 11590 1 139 . 1 1 36 36 ASP HA H 1 4.684 . . 1 . . . A 155 ASP HA . 11590 1 140 . 1 1 36 36 ASP HB2 H 1 2.508 . . 2 . . . A 155 ASP HB2 . 11590 1 141 . 1 1 36 36 ASP HB3 H 1 2.943 . . 2 . . . A 155 ASP HB3 . 11590 1 142 . 1 1 36 36 ASP C C 13 175.604 . . 1 . . . A 155 ASP C . 11590 1 143 . 1 1 36 36 ASP CA C 13 52.350 . . 1 . . . A 155 ASP CA . 11590 1 144 . 1 1 36 36 ASP CB C 13 39.320 . . 1 . . . A 155 ASP CB . 11590 1 145 . 1 1 36 36 ASP N N 15 121.683 . . 1 . . . A 155 ASP N . 11590 1 146 . 1 1 37 37 ILE H H 1 9.125 . . 1 . . . A 156 ILE H . 11590 1 147 . 1 1 37 37 ILE HA H 1 4.988 . . 1 . . . A 156 ILE HA . 11590 1 148 . 1 1 37 37 ILE HB H 1 2.246 . . 1 . . . A 156 ILE HB . 11590 1 149 . 1 1 37 37 ILE HG12 H 1 2.028 . . 2 . . . A 156 ILE HG12 . 11590 1 150 . 1 1 37 37 ILE HG13 H 1 2.028 . . 2 . . . A 156 ILE HG13 . 11590 1 151 . 1 1 37 37 ILE HG21 H 1 0.860 . . 1 . . . A 156 ILE HG21 . 11590 1 152 . 1 1 37 37 ILE HG22 H 1 0.860 . . 1 . . . A 156 ILE HG22 . 11590 1 153 . 1 1 37 37 ILE HG23 H 1 0.860 . . 1 . . . A 156 ILE HG23 . 11590 1 154 . 1 1 37 37 ILE HD11 H 1 0.963 . . 1 . . . A 156 ILE HD11 . 11590 1 155 . 1 1 37 37 ILE HD12 H 1 0.963 . . 1 . . . A 156 ILE HD12 . 11590 1 156 . 1 1 37 37 ILE HD13 H 1 0.963 . . 1 . . . A 156 ILE HD13 . 11590 1 157 . 1 1 37 37 ILE C C 13 175.093 . . 1 . . . A 156 ILE C . 11590 1 158 . 1 1 37 37 ILE CA C 13 60.780 . . 1 . . . A 156 ILE CA . 11590 1 159 . 1 1 37 37 ILE CB C 13 39.641 . . 1 . . . A 156 ILE CB . 11590 1 160 . 1 1 37 37 ILE CG1 C 13 28.131 . . 1 . . . A 156 ILE CG1 . 11590 1 161 . 1 1 37 37 ILE CG2 C 13 17.909 . . 1 . . . A 156 ILE CG2 . 11590 1 162 . 1 1 37 37 ILE CD1 C 13 14.441 . . 1 . . . A 156 ILE CD1 . 11590 1 163 . 1 1 37 37 ILE N N 15 123.621 . . 1 . . . A 156 ILE N . 11590 1 164 . 1 1 38 38 GLU H H 1 9.120 . . 1 . . . A 157 GLU H . 11590 1 165 . 1 1 38 38 GLU HA H 1 5.401 . . 1 . . . A 157 GLU HA . 11590 1 166 . 1 1 38 38 GLU HB2 H 1 1.979 . . 2 . . . A 157 GLU HB2 . 11590 1 167 . 1 1 38 38 GLU HB3 H 1 2.023 . . 2 . . . A 157 GLU HB3 . 11590 1 168 . 1 1 38 38 GLU HG2 H 1 2.111 . . 2 . . . A 157 GLU HG2 . 11590 1 169 . 1 1 38 38 GLU HG3 H 1 2.111 . . 2 . . . A 157 GLU HG3 . 11590 1 170 . 1 1 38 38 GLU C C 13 174.402 . . 1 . . . A 157 GLU C . 11590 1 171 . 1 1 38 38 GLU CA C 13 54.238 . . 1 . . . A 157 GLU CA . 11590 1 172 . 1 1 38 38 GLU CB C 13 34.695 . . 1 . . . A 157 GLU CB . 11590 1 173 . 1 1 38 38 GLU CG C 13 36.547 . . 1 . . . A 157 GLU CG . 11590 1 174 . 1 1 38 38 GLU N N 15 126.991 . . 1 . . . A 157 GLU N . 11590 1 175 . 1 1 39 39 LEU H H 1 9.407 . . 1 . . . A 158 LEU H . 11590 1 176 . 1 1 39 39 LEU HA H 1 5.560 . . 1 . . . A 158 LEU HA . 11590 1 177 . 1 1 39 39 LEU HB2 H 1 1.686 . . 2 . . . A 158 LEU HB2 . 11590 1 178 . 1 1 39 39 LEU HB3 H 1 1.686 . . 2 . . . A 158 LEU HB3 . 11590 1 179 . 1 1 39 39 LEU HG H 1 1.752 . . 1 . . . A 158 LEU HG . 11590 1 180 . 1 1 39 39 LEU HD11 H 1 0.632 . . 2 . . . A 158 LEU HD11 . 11590 1 181 . 1 1 39 39 LEU HD12 H 1 0.632 . . 2 . . . A 158 LEU HD12 . 11590 1 182 . 1 1 39 39 LEU HD13 H 1 0.632 . . 2 . . . A 158 LEU HD13 . 11590 1 183 . 1 1 39 39 LEU HD21 H 1 0.397 . . 2 . . . A 158 LEU HD21 . 11590 1 184 . 1 1 39 39 LEU HD22 H 1 0.397 . . 2 . . . A 158 LEU HD22 . 11590 1 185 . 1 1 39 39 LEU HD23 H 1 0.397 . . 2 . . . A 158 LEU HD23 . 11590 1 186 . 1 1 39 39 LEU C C 13 174.402 . . 1 . . . A 158 LEU C . 11590 1 187 . 1 1 39 39 LEU CA C 13 54.397 . . 1 . . . A 158 LEU CA . 11590 1 188 . 1 1 39 39 LEU CB C 13 45.172 . . 1 . . . A 158 LEU CB . 11590 1 189 . 1 1 39 39 LEU CG C 13 27.334 . . 1 . . . A 158 LEU CG . 11590 1 190 . 1 1 39 39 LEU CD1 C 13 25.638 . . 2 . . . A 158 LEU CD1 . 11590 1 191 . 1 1 39 39 LEU CD2 C 13 26.329 . . 2 . . . A 158 LEU CD2 . 11590 1 192 . 1 1 39 39 LEU N N 15 121.944 . . 1 . . . A 158 LEU N . 11590 1 193 . 1 1 40 40 ASP H H 1 9.154 . . 1 . . . A 159 ASP H . 11590 1 194 . 1 1 40 40 ASP HA H 1 5.285 . . 1 . . . A 159 ASP HA . 11590 1 195 . 1 1 40 40 ASP HB2 H 1 2.453 . . 2 . . . A 159 ASP HB2 . 11590 1 196 . 1 1 40 40 ASP HB3 H 1 3.483 . . 2 . . . A 159 ASP HB3 . 11590 1 197 . 1 1 40 40 ASP C C 13 177.157 . . 1 . . . A 159 ASP C . 11590 1 198 . 1 1 40 40 ASP CA C 13 52.713 . . 1 . . . A 159 ASP CA . 11590 1 199 . 1 1 40 40 ASP CB C 13 44.565 . . 1 . . . A 159 ASP CB . 11590 1 200 . 1 1 40 40 ASP N N 15 123.141 . . 1 . . . A 159 ASP N . 11590 1 201 . 1 1 41 41 GLU H H 1 9.350 . . 1 . . . A 160 GLU H . 11590 1 202 . 1 1 41 41 GLU HA H 1 4.182 . . 1 . . . A 160 GLU HA . 11590 1 203 . 1 1 41 41 GLU HB2 H 1 2.157 . . 2 . . . A 160 GLU HB2 . 11590 1 204 . 1 1 41 41 GLU HB3 H 1 2.157 . . 2 . . . A 160 GLU HB3 . 11590 1 205 . 1 1 41 41 GLU HG2 H 1 2.062 . . 2 . . . A 160 GLU HG2 . 11590 1 206 . 1 1 41 41 GLU HG3 H 1 2.416 . . 2 . . . A 160 GLU HG3 . 11590 1 207 . 1 1 41 41 GLU C C 13 176.978 . . 1 . . . A 160 GLU C . 11590 1 208 . 1 1 41 41 GLU CA C 13 59.353 . . 1 . . . A 160 GLU CA . 11590 1 209 . 1 1 41 41 GLU CB C 13 31.079 . . 1 . . . A 160 GLU CB . 11590 1 210 . 1 1 41 41 GLU CG C 13 38.218 . . 1 . . . A 160 GLU CG . 11590 1 211 . 1 1 41 41 GLU N N 15 124.369 . . 1 . . . A 160 GLU N . 11590 1 212 . 1 1 42 42 GLU H H 1 8.981 . . 1 . . . A 161 GLU H . 11590 1 213 . 1 1 42 42 GLU HA H 1 4.270 . . 1 . . . A 161 GLU HA . 11590 1 214 . 1 1 42 42 GLU HB2 H 1 2.132 . . 2 . . . A 161 GLU HB2 . 11590 1 215 . 1 1 42 42 GLU HB3 H 1 2.132 . . 2 . . . A 161 GLU HB3 . 11590 1 216 . 1 1 42 42 GLU HG2 H 1 2.127 . . 2 . . . A 161 GLU HG2 . 11590 1 217 . 1 1 42 42 GLU HG3 H 1 2.127 . . 2 . . . A 161 GLU HG3 . 11590 1 218 . 1 1 42 42 GLU C C 13 178.355 . . 1 . . . A 161 GLU C . 11590 1 219 . 1 1 42 42 GLU CA C 13 57.721 . . 1 . . . A 161 GLU CA . 11590 1 220 . 1 1 42 42 GLU CB C 13 30.072 . . 1 . . . A 161 GLU CB . 11590 1 221 . 1 1 42 42 GLU CG C 13 36.032 . . 1 . . . A 161 GLU CG . 11590 1 222 . 1 1 42 42 GLU N N 15 118.235 . . 1 . . . A 161 GLU N . 11590 1 223 . 1 1 43 43 THR H H 1 8.462 . . 1 . . . A 162 THR H . 11590 1 224 . 1 1 43 43 THR HA H 1 4.072 . . 1 . . . A 162 THR HA . 11590 1 225 . 1 1 43 43 THR HB H 1 4.182 . . 1 . . . A 162 THR HB . 11590 1 226 . 1 1 43 43 THR HG21 H 1 1.090 . . 1 . . . A 162 THR HG21 . 11590 1 227 . 1 1 43 43 THR HG22 H 1 1.090 . . 1 . . . A 162 THR HG22 . 11590 1 228 . 1 1 43 43 THR HG23 H 1 1.090 . . 1 . . . A 162 THR HG23 . 11590 1 229 . 1 1 43 43 THR C C 13 176.463 . . 1 . . . A 162 THR C . 11590 1 230 . 1 1 43 43 THR CA C 13 61.538 . . 1 . . . A 162 THR CA . 11590 1 231 . 1 1 43 43 THR CB C 13 69.387 . . 1 . . . A 162 THR CB . 11590 1 232 . 1 1 43 43 THR CG2 C 13 21.587 . . 1 . . . A 162 THR CG2 . 11590 1 233 . 1 1 43 43 THR N N 15 109.183 . . 1 . . . A 162 THR N . 11590 1 234 . 1 1 44 44 HIS H H 1 8.140 . . 1 . . . A 163 HIS H . 11590 1 235 . 1 1 44 44 HIS HA H 1 3.696 . . 1 . . . A 163 HIS HA . 11590 1 236 . 1 1 44 44 HIS HB2 H 1 2.286 . . 2 . . . A 163 HIS HB2 . 11590 1 237 . 1 1 44 44 HIS HB3 H 1 3.068 . . 2 . . . A 163 HIS HB3 . 11590 1 238 . 1 1 44 44 HIS C C 13 173.010 . . 1 . . . A 163 HIS C . 11590 1 239 . 1 1 44 44 HIS CA C 13 56.035 . . 1 . . . A 163 HIS CA . 11590 1 240 . 1 1 44 44 HIS CB C 13 24.299 . . 1 . . . A 163 HIS CB . 11590 1 241 . 1 1 44 44 HIS N N 15 114.140 . . 1 . . . A 163 HIS N . 11590 1 242 . 1 1 45 45 GLU H H 1 7.517 . . 1 . . . A 164 GLU H . 11590 1 243 . 1 1 45 45 GLU HA H 1 3.872 . . 1 . . . A 164 GLU HA . 11590 1 244 . 1 1 45 45 GLU HB2 H 1 0.923 . . 2 . . . A 164 GLU HB2 . 11590 1 245 . 1 1 45 45 GLU HB3 H 1 1.345 . . 2 . . . A 164 GLU HB3 . 11590 1 246 . 1 1 45 45 GLU HG2 H 1 1.755 . . 2 . . . A 164 GLU HG2 . 11590 1 247 . 1 1 45 45 GLU HG3 H 1 1.956 . . 2 . . . A 164 GLU HG3 . 11590 1 248 . 1 1 45 45 GLU C C 13 174.401 . . 1 . . . A 164 GLU C . 11590 1 249 . 1 1 45 45 GLU CA C 13 56.441 . . 1 . . . A 164 GLU CA . 11590 1 250 . 1 1 45 45 GLU CB C 13 33.257 . . 1 . . . A 164 GLU CB . 11590 1 251 . 1 1 45 45 GLU CG C 13 37.488 . . 1 . . . A 164 GLU CG . 11590 1 252 . 1 1 45 45 GLU N N 15 118.187 . . 1 . . . A 164 GLU N . 11590 1 253 . 1 1 46 46 VAL H H 1 7.434 . . 1 . . . A 165 VAL H . 11590 1 254 . 1 1 46 46 VAL HA H 1 4.865 . . 1 . . . A 165 VAL HA . 11590 1 255 . 1 1 46 46 VAL HB H 1 1.890 . . 1 . . . A 165 VAL HB . 11590 1 256 . 1 1 46 46 VAL HG11 H 1 1.066 . . 2 . . . A 165 VAL HG11 . 11590 1 257 . 1 1 46 46 VAL HG12 H 1 1.066 . . 2 . . . A 165 VAL HG12 . 11590 1 258 . 1 1 46 46 VAL HG13 H 1 1.066 . . 2 . . . A 165 VAL HG13 . 11590 1 259 . 1 1 46 46 VAL HG21 H 1 0.733 . . 2 . . . A 165 VAL HG21 . 11590 1 260 . 1 1 46 46 VAL HG22 H 1 0.733 . . 2 . . . A 165 VAL HG22 . 11590 1 261 . 1 1 46 46 VAL HG23 H 1 0.733 . . 2 . . . A 165 VAL HG23 . 11590 1 262 . 1 1 46 46 VAL C C 13 173.886 . . 1 . . . A 165 VAL C . 11590 1 263 . 1 1 46 46 VAL CA C 13 60.216 . . 1 . . . A 165 VAL CA . 11590 1 264 . 1 1 46 46 VAL CB C 13 35.249 . . 1 . . . A 165 VAL CB . 11590 1 265 . 1 1 46 46 VAL CG1 C 13 22.932 . . 2 . . . A 165 VAL CG1 . 11590 1 266 . 1 1 46 46 VAL CG2 C 13 21.177 . . 2 . . . A 165 VAL CG2 . 11590 1 267 . 1 1 46 46 VAL N N 15 118.815 . . 1 . . . A 165 VAL N . 11590 1 268 . 1 1 47 47 TRP H H 1 9.568 . . 1 . . . A 166 TRP H . 11590 1 269 . 1 1 47 47 TRP HA H 1 5.281 . . 1 . . . A 166 TRP HA . 11590 1 270 . 1 1 47 47 TRP HB2 H 1 2.532 . . 2 . . . A 166 TRP HB2 . 11590 1 271 . 1 1 47 47 TRP HB3 H 1 3.085 . . 2 . . . A 166 TRP HB3 . 11590 1 272 . 1 1 47 47 TRP HD1 H 1 6.528 . . 1 . . . A 166 TRP HD1 . 11590 1 273 . 1 1 47 47 TRP HE1 H 1 10.203 . . 1 . . . A 166 TRP HE1 . 11590 1 274 . 1 1 47 47 TRP HZ2 H 1 7.211 . . 1 . . . A 166 TRP HZ2 . 11590 1 275 . 1 1 47 47 TRP HH2 H 1 6.977 . . 1 . . . A 166 TRP HH2 . 11590 1 276 . 1 1 47 47 TRP C C 13 174.267 . . 1 . . . A 166 TRP C . 11590 1 277 . 1 1 47 47 TRP CA C 13 57.002 . . 1 . . . A 166 TRP CA . 11590 1 278 . 1 1 47 47 TRP CB C 13 34.056 . . 1 . . . A 166 TRP CB . 11590 1 279 . 1 1 47 47 TRP CD1 C 13 124.350 . . 1 . . . A 166 TRP CD1 . 11590 1 280 . 1 1 47 47 TRP N N 15 126.263 . . 1 . . . A 166 TRP N . 11590 1 281 . 1 1 47 47 TRP NE1 N 15 129.027 . . 1 . . . A 166 TRP NE1 . 11590 1 282 . 1 1 48 48 LYS H H 1 9.054 . . 1 . . . A 167 LYS H . 11590 1 283 . 1 1 48 48 LYS HA H 1 5.166 . . 1 . . . A 167 LYS HA . 11590 1 284 . 1 1 48 48 LYS HB2 H 1 1.431 . . 2 . . . A 167 LYS HB2 . 11590 1 285 . 1 1 48 48 LYS HB3 H 1 1.981 . . 2 . . . A 167 LYS HB3 . 11590 1 286 . 1 1 48 48 LYS HG3 H 1 1.099 . . 2 . . . A 167 LYS HG3 . 11590 1 287 . 1 1 48 48 LYS HE2 H 1 2.813 . . 2 . . . A 167 LYS HE2 . 11590 1 288 . 1 1 48 48 LYS HE3 H 1 3.088 . . 2 . . . A 167 LYS HE3 . 11590 1 289 . 1 1 48 48 LYS C C 13 176.294 . . 1 . . . A 167 LYS C . 11590 1 290 . 1 1 48 48 LYS CA C 13 52.990 . . 1 . . . A 167 LYS CA . 11590 1 291 . 1 1 48 48 LYS CB C 13 34.827 . . 1 . . . A 167 LYS CB . 11590 1 292 . 1 1 48 48 LYS CG C 13 25.145 . . 1 . . . A 167 LYS CG . 11590 1 293 . 1 1 48 48 LYS CD C 13 29.159 . . 1 . . . A 167 LYS CD . 11590 1 294 . 1 1 48 48 LYS CE C 13 42.132 . . 1 . . . A 167 LYS CE . 11590 1 295 . 1 1 48 48 LYS N N 15 121.684 . . 1 . . . A 167 LYS N . 11590 1 296 . 1 1 49 49 ALA H H 1 10.061 . . 1 . . . A 168 ALA H . 11590 1 297 . 1 1 49 49 ALA HA H 1 4.138 . . 1 . . . A 168 ALA HA . 11590 1 298 . 1 1 49 49 ALA HB1 H 1 1.481 . . 1 . . . A 168 ALA HB1 . 11590 1 299 . 1 1 49 49 ALA HB2 H 1 1.481 . . 1 . . . A 168 ALA HB2 . 11590 1 300 . 1 1 49 49 ALA HB3 H 1 1.481 . . 1 . . . A 168 ALA HB3 . 11590 1 301 . 1 1 49 49 ALA C C 13 177.494 . . 1 . . . A 168 ALA C . 11590 1 302 . 1 1 49 49 ALA CA C 13 52.949 . . 1 . . . A 168 ALA CA . 11590 1 303 . 1 1 49 49 ALA CB C 13 16.833 . . 1 . . . A 168 ALA CB . 11590 1 304 . 1 1 49 49 ALA N N 15 134.417 . . 1 . . . A 168 ALA N . 11590 1 305 . 1 1 50 50 GLY H H 1 9.262 . . 1 . . . A 169 GLY H . 11590 1 306 . 1 1 50 50 GLY HA2 H 1 3.509 . . 2 . . . A 169 GLY HA2 . 11590 1 307 . 1 1 50 50 GLY HA3 H 1 4.158 . . 2 . . . A 169 GLY HA3 . 11590 1 308 . 1 1 50 50 GLY C C 13 173.713 . . 1 . . . A 169 GLY C . 11590 1 309 . 1 1 50 50 GLY CA C 13 44.941 . . 1 . . . A 169 GLY CA . 11590 1 310 . 1 1 50 50 GLY N N 15 103.491 . . 1 . . . A 169 GLY N . 11590 1 311 . 1 1 51 51 GLN H H 1 8.100 . . 1 . . . A 170 GLN H . 11590 1 312 . 1 1 51 51 GLN HA H 1 5.050 . . 1 . . . A 170 GLN HA . 11590 1 313 . 1 1 51 51 GLN HB2 H 1 2.088 . . 2 . . . A 170 GLN HB2 . 11590 1 314 . 1 1 51 51 GLN HB3 H 1 2.219 . . 2 . . . A 170 GLN HB3 . 11590 1 315 . 1 1 51 51 GLN HG2 H 1 2.370 . . 2 . . . A 170 GLN HG2 . 11590 1 316 . 1 1 51 51 GLN HG3 H 1 2.448 . . 2 . . . A 170 GLN HG3 . 11590 1 317 . 1 1 51 51 GLN C C 13 173.541 . . 1 . . . A 170 GLN C . 11590 1 318 . 1 1 51 51 GLN CA C 13 51.676 . . 1 . . . A 170 GLN CA . 11590 1 319 . 1 1 51 51 GLN CB C 13 29.292 . . 1 . . . A 170 GLN CB . 11590 1 320 . 1 1 51 51 GLN CG C 13 32.842 . . 1 . . . A 170 GLN CG . 11590 1 321 . 1 1 51 51 GLN N N 15 121.186 . . 1 . . . A 170 GLN N . 11590 1 322 . 1 1 52 52 PRO HA H 1 4.474 . . 1 . . . A 171 PRO HA . 11590 1 323 . 1 1 52 52 PRO HB2 H 1 1.730 . . 2 . . . A 171 PRO HB2 . 11590 1 324 . 1 1 52 52 PRO HB3 H 1 2.028 . . 2 . . . A 171 PRO HB3 . 11590 1 325 . 1 1 52 52 PRO HG2 H 1 2.013 . . 2 . . . A 171 PRO HG2 . 11590 1 326 . 1 1 52 52 PRO HG3 H 1 2.143 . . 2 . . . A 171 PRO HG3 . 11590 1 327 . 1 1 52 52 PRO HD2 H 1 3.817 . . 2 . . . A 171 PRO HD2 . 11590 1 328 . 1 1 52 52 PRO HD3 H 1 4.064 . . 2 . . . A 171 PRO HD3 . 11590 1 329 . 1 1 52 52 PRO CA C 13 62.928 . . 1 . . . A 171 PRO CA . 11590 1 330 . 1 1 52 52 PRO CB C 13 32.178 . . 1 . . . A 171 PRO CB . 11590 1 331 . 1 1 52 52 PRO CG C 13 27.388 . . 1 . . . A 171 PRO CG . 11590 1 332 . 1 1 52 52 PRO CD C 13 50.721 . . 1 . . . A 171 PRO CD . 11590 1 333 . 1 1 53 53 VAL HA H 1 4.155 . . 1 . . . A 172 VAL HA . 11590 1 334 . 1 1 53 53 VAL HB H 1 1.523 . . 1 . . . A 172 VAL HB . 11590 1 335 . 1 1 53 53 VAL HG11 H 1 0.837 . . 2 . . . A 172 VAL HG11 . 11590 1 336 . 1 1 53 53 VAL HG12 H 1 0.837 . . 2 . . . A 172 VAL HG12 . 11590 1 337 . 1 1 53 53 VAL HG13 H 1 0.837 . . 2 . . . A 172 VAL HG13 . 11590 1 338 . 1 1 53 53 VAL HG21 H 1 0.713 . . 2 . . . A 172 VAL HG21 . 11590 1 339 . 1 1 53 53 VAL HG22 H 1 0.713 . . 2 . . . A 172 VAL HG22 . 11590 1 340 . 1 1 53 53 VAL HG23 H 1 0.713 . . 2 . . . A 172 VAL HG23 . 11590 1 341 . 1 1 53 53 VAL C C 13 174.898 . . 1 . . . A 172 VAL C . 11590 1 342 . 1 1 53 53 VAL CA C 13 60.410 . . 1 . . . A 172 VAL CA . 11590 1 343 . 1 1 53 53 VAL CB C 13 34.857 . . 1 . . . A 172 VAL CB . 11590 1 344 . 1 1 53 53 VAL CG1 C 13 20.956 . . 2 . . . A 172 VAL CG1 . 11590 1 345 . 1 1 53 53 VAL CG2 C 13 21.390 . . 2 . . . A 172 VAL CG2 . 11590 1 346 . 1 1 54 54 SER H H 1 8.672 . . 1 . . . A 173 SER H . 11590 1 347 . 1 1 54 54 SER HA H 1 4.477 . . 1 . . . A 173 SER HA . 11590 1 348 . 1 1 54 54 SER HB3 H 1 3.648 . . 2 . . . A 173 SER HB3 . 11590 1 349 . 1 1 54 54 SER C C 13 173.180 . . 1 . . . A 173 SER C . 11590 1 350 . 1 1 54 54 SER CA C 13 57.006 . . 1 . . . A 173 SER CA . 11590 1 351 . 1 1 54 54 SER CB C 13 62.561 . . 1 . . . A 173 SER CB . 11590 1 352 . 1 1 54 54 SER N N 15 122.486 . . 1 . . . A 173 SER N . 11590 1 353 . 1 1 55 55 LEU H H 1 8.490 . . 1 . . . A 174 LEU H . 11590 1 354 . 1 1 55 55 LEU HA H 1 4.763 . . 1 . . . A 174 LEU HA . 11590 1 355 . 1 1 55 55 LEU HB2 H 1 1.773 . . 2 . . . A 174 LEU HB2 . 11590 1 356 . 1 1 55 55 LEU HB3 H 1 1.773 . . 2 . . . A 174 LEU HB3 . 11590 1 357 . 1 1 55 55 LEU HG H 1 1.542 . . 1 . . . A 174 LEU HG . 11590 1 358 . 1 1 55 55 LEU HD11 H 1 0.754 . . 2 . . . A 174 LEU HD11 . 11590 1 359 . 1 1 55 55 LEU HD12 H 1 0.754 . . 2 . . . A 174 LEU HD12 . 11590 1 360 . 1 1 55 55 LEU HD13 H 1 0.754 . . 2 . . . A 174 LEU HD13 . 11590 1 361 . 1 1 55 55 LEU HD21 H 1 0.736 . . 2 . . . A 174 LEU HD21 . 11590 1 362 . 1 1 55 55 LEU HD22 H 1 0.736 . . 2 . . . A 174 LEU HD22 . 11590 1 363 . 1 1 55 55 LEU HD23 H 1 0.736 . . 2 . . . A 174 LEU HD23 . 11590 1 364 . 1 1 55 55 LEU C C 13 176.980 . . 1 . . . A 174 LEU C . 11590 1 365 . 1 1 55 55 LEU CA C 13 52.899 . . 1 . . . A 174 LEU CA . 11590 1 366 . 1 1 55 55 LEU CB C 13 43.429 . . 1 . . . A 174 LEU CB . 11590 1 367 . 1 1 55 55 LEU CG C 13 26.875 . . 1 . . . A 174 LEU CG . 11590 1 368 . 1 1 55 55 LEU CD1 C 13 27.356 . . 2 . . . A 174 LEU CD1 . 11590 1 369 . 1 1 55 55 LEU CD2 C 13 24.233 . . 2 . . . A 174 LEU CD2 . 11590 1 370 . 1 1 55 55 LEU N N 15 127.005 . . 1 . . . A 174 LEU N . 11590 1 371 . 1 1 56 56 SER H H 1 9.371 . . 1 . . . A 175 SER H . 11590 1 372 . 1 1 56 56 SER HA H 1 4.708 . . 1 . . . A 175 SER HA . 11590 1 373 . 1 1 56 56 SER HB2 H 1 3.915 . . 2 . . . A 175 SER HB2 . 11590 1 374 . 1 1 56 56 SER HB3 H 1 4.410 . . 2 . . . A 175 SER HB3 . 11590 1 375 . 1 1 56 56 SER CA C 13 56.571 . . 1 . . . A 175 SER CA . 11590 1 376 . 1 1 56 56 SER CB C 13 62.403 . . 1 . . . A 175 SER CB . 11590 1 377 . 1 1 56 56 SER N N 15 121.232 . . 1 . . . A 175 SER N . 11590 1 378 . 1 1 57 57 PRO HA H 1 4.391 . . 1 . . . A 176 PRO HA . 11590 1 379 . 1 1 57 57 PRO HB2 H 1 1.910 . . 2 . . . A 176 PRO HB2 . 11590 1 380 . 1 1 57 57 PRO HB3 H 1 2.345 . . 2 . . . A 176 PRO HB3 . 11590 1 381 . 1 1 57 57 PRO HG2 H 1 1.932 . . 2 . . . A 176 PRO HG2 . 11590 1 382 . 1 1 57 57 PRO HG3 H 1 2.132 . . 2 . . . A 176 PRO HG3 . 11590 1 383 . 1 1 57 57 PRO HD2 H 1 3.880 . . 2 . . . A 176 PRO HD2 . 11590 1 384 . 1 1 57 57 PRO HD3 H 1 3.880 . . 2 . . . A 176 PRO HD3 . 11590 1 385 . 1 1 57 57 PRO CA C 13 66.229 . . 1 . . . A 176 PRO CA . 11590 1 386 . 1 1 57 57 PRO CB C 13 31.492 . . 1 . . . A 176 PRO CB . 11590 1 387 . 1 1 57 57 PRO CG C 13 27.807 . . 1 . . . A 176 PRO CG . 11590 1 388 . 1 1 57 57 PRO CD C 13 49.673 . . 1 . . . A 176 PRO CD . 11590 1 389 . 1 1 58 58 THR HA H 1 3.622 . . 1 . . . A 177 THR HA . 11590 1 390 . 1 1 58 58 THR HB H 1 3.761 . . 1 . . . A 177 THR HB . 11590 1 391 . 1 1 58 58 THR HG21 H 1 0.359 . . 1 . . . A 177 THR HG21 . 11590 1 392 . 1 1 58 58 THR HG22 H 1 0.359 . . 1 . . . A 177 THR HG22 . 11590 1 393 . 1 1 58 58 THR HG23 H 1 0.359 . . 1 . . . A 177 THR HG23 . 11590 1 394 . 1 1 58 58 THR C C 13 175.939 . . 1 . . . A 177 THR C . 11590 1 395 . 1 1 58 58 THR CA C 13 66.396 . . 1 . . . A 177 THR CA . 11590 1 396 . 1 1 58 58 THR CB C 13 68.145 . . 1 . . . A 177 THR CB . 11590 1 397 . 1 1 58 58 THR CG2 C 13 21.707 . . 1 . . . A 177 THR CG2 . 11590 1 398 . 1 1 59 59 GLU H H 1 7.575 . . 1 . . . A 178 GLU H . 11590 1 399 . 1 1 59 59 GLU HA H 1 3.725 . . 1 . . . A 178 GLU HA . 11590 1 400 . 1 1 59 59 GLU HB2 H 1 1.875 . . 2 . . . A 178 GLU HB2 . 11590 1 401 . 1 1 59 59 GLU HB3 H 1 2.568 . . 2 . . . A 178 GLU HB3 . 11590 1 402 . 1 1 59 59 GLU HG2 H 1 2.248 . . 2 . . . A 178 GLU HG2 . 11590 1 403 . 1 1 59 59 GLU HG3 H 1 2.505 . . 2 . . . A 178 GLU HG3 . 11590 1 404 . 1 1 59 59 GLU C C 13 177.667 . . 1 . . . A 178 GLU C . 11590 1 405 . 1 1 59 59 GLU CA C 13 59.844 . . 1 . . . A 178 GLU CA . 11590 1 406 . 1 1 59 59 GLU CB C 13 30.828 . . 1 . . . A 178 GLU CB . 11590 1 407 . 1 1 59 59 GLU CG C 13 37.594 . . 1 . . . A 178 GLU CG . 11590 1 408 . 1 1 59 59 GLU N N 15 120.381 . . 1 . . . A 178 GLU N . 11590 1 409 . 1 1 60 60 PHE H H 1 9.077 . . 1 . . . A 179 PHE H . 11590 1 410 . 1 1 60 60 PHE HA H 1 3.623 . . 1 . . . A 179 PHE HA . 11590 1 411 . 1 1 60 60 PHE HB2 H 1 3.005 . . 2 . . . A 179 PHE HB2 . 11590 1 412 . 1 1 60 60 PHE HB3 H 1 3.140 . . 2 . . . A 179 PHE HB3 . 11590 1 413 . 1 1 60 60 PHE C C 13 175.957 . . 1 . . . A 179 PHE C . 11590 1 414 . 1 1 60 60 PHE CA C 13 62.466 . . 1 . . . A 179 PHE CA . 11590 1 415 . 1 1 60 60 PHE CB C 13 38.522 . . 1 . . . A 179 PHE CB . 11590 1 416 . 1 1 60 60 PHE N N 15 119.535 . . 1 . . . A 179 PHE N . 11590 1 417 . 1 1 61 61 THR H H 1 8.326 . . 1 . . . A 180 THR H . 11590 1 418 . 1 1 61 61 THR HA H 1 3.559 . . 1 . . . A 180 THR HA . 11590 1 419 . 1 1 61 61 THR HB H 1 4.037 . . 1 . . . A 180 THR HB . 11590 1 420 . 1 1 61 61 THR HG21 H 1 1.125 . . 1 . . . A 180 THR HG21 . 11590 1 421 . 1 1 61 61 THR HG22 H 1 1.125 . . 1 . . . A 180 THR HG22 . 11590 1 422 . 1 1 61 61 THR HG23 H 1 1.125 . . 1 . . . A 180 THR HG23 . 11590 1 423 . 1 1 61 61 THR CA C 13 66.527 . . 1 . . . A 180 THR CA . 11590 1 424 . 1 1 61 61 THR CB C 13 67.971 . . 1 . . . A 180 THR CB . 11590 1 425 . 1 1 61 61 THR CG2 C 13 22.233 . . 1 . . . A 180 THR CG2 . 11590 1 426 . 1 1 61 61 THR N N 15 116.935 . . 1 . . . A 180 THR N . 11590 1 427 . 1 1 62 62 LEU HA H 1 3.802 . . 1 . . . A 181 LEU HA . 11590 1 428 . 1 1 62 62 LEU HB2 H 1 1.194 . . 2 . . . A 181 LEU HB2 . 11590 1 429 . 1 1 62 62 LEU HB3 H 1 1.993 . . 2 . . . A 181 LEU HB3 . 11590 1 430 . 1 1 62 62 LEU HG H 1 1.477 . . 1 . . . A 181 LEU HG . 11590 1 431 . 1 1 62 62 LEU HD11 H 1 0.923 . . 2 . . . A 181 LEU HD11 . 11590 1 432 . 1 1 62 62 LEU HD12 H 1 0.923 . . 2 . . . A 181 LEU HD12 . 11590 1 433 . 1 1 62 62 LEU HD13 H 1 0.923 . . 2 . . . A 181 LEU HD13 . 11590 1 434 . 1 1 62 62 LEU HD21 H 1 0.737 . . 2 . . . A 181 LEU HD21 . 11590 1 435 . 1 1 62 62 LEU HD22 H 1 0.737 . . 2 . . . A 181 LEU HD22 . 11590 1 436 . 1 1 62 62 LEU HD23 H 1 0.737 . . 2 . . . A 181 LEU HD23 . 11590 1 437 . 1 1 62 62 LEU C C 13 176.455 . . 1 . . . A 181 LEU C . 11590 1 438 . 1 1 62 62 LEU CA C 13 57.445 . . 1 . . . A 181 LEU CA . 11590 1 439 . 1 1 62 62 LEU CB C 13 41.639 . . 1 . . . A 181 LEU CB . 11590 1 440 . 1 1 62 62 LEU CG C 13 26.640 . . 1 . . . A 181 LEU CG . 11590 1 441 . 1 1 62 62 LEU CD1 C 13 27.121 . . 2 . . . A 181 LEU CD1 . 11590 1 442 . 1 1 62 62 LEU CD2 C 13 24.525 . . 2 . . . A 181 LEU CD2 . 11590 1 443 . 1 1 63 63 LEU H H 1 8.632 . . 1 . . . A 182 LEU H . 11590 1 444 . 1 1 63 63 LEU HA H 1 3.995 . . 1 . . . A 182 LEU HA . 11590 1 445 . 1 1 63 63 LEU HB2 H 1 1.450 . . 2 . . . A 182 LEU HB2 . 11590 1 446 . 1 1 63 63 LEU HB3 H 1 1.653 . . 2 . . . A 182 LEU HB3 . 11590 1 447 . 1 1 63 63 LEU HD11 H 1 0.843 . . 2 . . . A 182 LEU HD11 . 11590 1 448 . 1 1 63 63 LEU HD12 H 1 0.843 . . 2 . . . A 182 LEU HD12 . 11590 1 449 . 1 1 63 63 LEU HD13 H 1 0.843 . . 2 . . . A 182 LEU HD13 . 11590 1 450 . 1 1 63 63 LEU HD21 H 1 0.757 . . 2 . . . A 182 LEU HD21 . 11590 1 451 . 1 1 63 63 LEU HD22 H 1 0.757 . . 2 . . . A 182 LEU HD22 . 11590 1 452 . 1 1 63 63 LEU HD23 H 1 0.757 . . 2 . . . A 182 LEU HD23 . 11590 1 453 . 1 1 63 63 LEU C C 13 177.669 . . 1 . . . A 182 LEU C . 11590 1 454 . 1 1 63 63 LEU CA C 13 57.757 . . 1 . . . A 182 LEU CA . 11590 1 455 . 1 1 63 63 LEU CB C 13 40.195 . . 1 . . . A 182 LEU CB . 11590 1 456 . 1 1 63 63 LEU CG C 13 26.683 . . 1 . . . A 182 LEU CG . 11590 1 457 . 1 1 63 63 LEU CD1 C 13 21.783 . . 2 . . . A 182 LEU CD1 . 11590 1 458 . 1 1 63 63 LEU CD2 C 13 27.811 . . 2 . . . A 182 LEU CD2 . 11590 1 459 . 1 1 63 63 LEU N N 15 119.112 . . 1 . . . A 182 LEU N . 11590 1 460 . 1 1 64 64 ARG H H 1 8.654 . . 1 . . . A 183 ARG H . 11590 1 461 . 1 1 64 64 ARG HA H 1 3.278 . . 1 . . . A 183 ARG HA . 11590 1 462 . 1 1 64 64 ARG HB2 H 1 0.934 . . 2 . . . A 183 ARG HB2 . 11590 1 463 . 1 1 64 64 ARG HB3 H 1 1.525 . . 2 . . . A 183 ARG HB3 . 11590 1 464 . 1 1 64 64 ARG HG2 H 1 1.182 . . 2 . . . A 183 ARG HG2 . 11590 1 465 . 1 1 64 64 ARG HG3 H 1 1.182 . . 2 . . . A 183 ARG HG3 . 11590 1 466 . 1 1 64 64 ARG HD2 H 1 2.956 . . 2 . . . A 183 ARG HD2 . 11590 1 467 . 1 1 64 64 ARG HD3 H 1 3.127 . . 2 . . . A 183 ARG HD3 . 11590 1 468 . 1 1 64 64 ARG C C 13 176.119 . . 1 . . . A 183 ARG C . 11590 1 469 . 1 1 64 64 ARG CA C 13 59.786 . . 1 . . . A 183 ARG CA . 11590 1 470 . 1 1 64 64 ARG CB C 13 28.557 . . 1 . . . A 183 ARG CB . 11590 1 471 . 1 1 64 64 ARG CD C 13 43.067 . . 1 . . . A 183 ARG CD . 11590 1 472 . 1 1 64 64 ARG N N 15 117.698 . . 1 . . . A 183 ARG N . 11590 1 473 . 1 1 65 65 TYR H H 1 7.621 . . 1 . . . A 184 TYR H . 11590 1 474 . 1 1 65 65 TYR HA H 1 3.933 . . 1 . . . A 184 TYR HA . 11590 1 475 . 1 1 65 65 TYR HB2 H 1 2.687 . . 2 . . . A 184 TYR HB2 . 11590 1 476 . 1 1 65 65 TYR HB3 H 1 2.832 . . 2 . . . A 184 TYR HB3 . 11590 1 477 . 1 1 65 65 TYR HD1 H 1 6.236 . . 3 . . . A 184 TYR HD1 . 11590 1 478 . 1 1 65 65 TYR HD2 H 1 6.236 . . 3 . . . A 184 TYR HD2 . 11590 1 479 . 1 1 65 65 TYR HE1 H 1 6.173 . . 3 . . . A 184 TYR HE1 . 11590 1 480 . 1 1 65 65 TYR HE2 H 1 6.173 . . 3 . . . A 184 TYR HE2 . 11590 1 481 . 1 1 65 65 TYR C C 13 178.185 . . 1 . . . A 184 TYR C . 11590 1 482 . 1 1 65 65 TYR CA C 13 60.675 . . 1 . . . A 184 TYR CA . 11590 1 483 . 1 1 65 65 TYR CB C 13 38.045 . . 1 . . . A 184 TYR CB . 11590 1 484 . 1 1 65 65 TYR CD1 C 13 130.735 . . 3 . . . A 184 TYR CD1 . 11590 1 485 . 1 1 65 65 TYR CD2 C 13 130.735 . . 3 . . . A 184 TYR CD2 . 11590 1 486 . 1 1 65 65 TYR CE1 C 13 117.906 . . 3 . . . A 184 TYR CE1 . 11590 1 487 . 1 1 65 65 TYR CE2 C 13 117.906 . . 3 . . . A 184 TYR CE2 . 11590 1 488 . 1 1 65 65 TYR N N 15 119.036 . . 1 . . . A 184 TYR N . 11590 1 489 . 1 1 66 66 PHE H H 1 7.909 . . 1 . . . A 185 PHE H . 11590 1 490 . 1 1 66 66 PHE HA H 1 3.809 . . 1 . . . A 185 PHE HA . 11590 1 491 . 1 1 66 66 PHE HB2 H 1 2.813 . . 2 . . . A 185 PHE HB2 . 11590 1 492 . 1 1 66 66 PHE HB3 H 1 3.011 . . 2 . . . A 185 PHE HB3 . 11590 1 493 . 1 1 66 66 PHE C C 13 177.149 . . 1 . . . A 185 PHE C . 11590 1 494 . 1 1 66 66 PHE CA C 13 62.609 . . 1 . . . A 185 PHE CA . 11590 1 495 . 1 1 66 66 PHE CB C 13 38.722 . . 1 . . . A 185 PHE CB . 11590 1 496 . 1 1 66 66 PHE N N 15 116.975 . . 1 . . . A 185 PHE N . 11590 1 497 . 1 1 67 67 VAL H H 1 8.310 . . 1 . . . A 186 VAL H . 11590 1 498 . 1 1 67 67 VAL HA H 1 3.138 . . 1 . . . A 186 VAL HA . 11590 1 499 . 1 1 67 67 VAL HB H 1 1.900 . . 1 . . . A 186 VAL HB . 11590 1 500 . 1 1 67 67 VAL HG11 H 1 0.732 . . 2 . . . A 186 VAL HG11 . 11590 1 501 . 1 1 67 67 VAL HG12 H 1 0.732 . . 2 . . . A 186 VAL HG12 . 11590 1 502 . 1 1 67 67 VAL HG13 H 1 0.732 . . 2 . . . A 186 VAL HG13 . 11590 1 503 . 1 1 67 67 VAL HG21 H 1 0.706 . . 2 . . . A 186 VAL HG21 . 11590 1 504 . 1 1 67 67 VAL HG22 H 1 0.706 . . 2 . . . A 186 VAL HG22 . 11590 1 505 . 1 1 67 67 VAL HG23 H 1 0.706 . . 2 . . . A 186 VAL HG23 . 11590 1 506 . 1 1 67 67 VAL C C 13 179.734 . . 1 . . . A 186 VAL C . 11590 1 507 . 1 1 67 67 VAL CA C 13 66.623 . . 1 . . . A 186 VAL CA . 11590 1 508 . 1 1 67 67 VAL CB C 13 31.212 . . 1 . . . A 186 VAL CB . 11590 1 509 . 1 1 67 67 VAL CG1 C 13 22.946 . . 2 . . . A 186 VAL CG1 . 11590 1 510 . 1 1 67 67 VAL CG2 C 13 21.642 . . 2 . . . A 186 VAL CG2 . 11590 1 511 . 1 1 67 67 VAL N N 15 117.353 . . 1 . . . A 186 VAL N . 11590 1 512 . 1 1 68 68 ILE H H 1 8.723 . . 1 . . . A 187 ILE H . 11590 1 513 . 1 1 68 68 ILE HA H 1 3.886 . . 1 . . . A 187 ILE HA . 11590 1 514 . 1 1 68 68 ILE HB H 1 1.797 . . 1 . . . A 187 ILE HB . 11590 1 515 . 1 1 68 68 ILE HG12 H 1 1.313 . . 2 . . . A 187 ILE HG12 . 11590 1 516 . 1 1 68 68 ILE HG13 H 1 1.356 . . 2 . . . A 187 ILE HG13 . 11590 1 517 . 1 1 68 68 ILE HG21 H 1 0.825 . . 1 . . . A 187 ILE HG21 . 11590 1 518 . 1 1 68 68 ILE HG22 H 1 0.825 . . 1 . . . A 187 ILE HG22 . 11590 1 519 . 1 1 68 68 ILE HG23 H 1 0.825 . . 1 . . . A 187 ILE HG23 . 11590 1 520 . 1 1 68 68 ILE HD11 H 1 0.761 . . 1 . . . A 187 ILE HD11 . 11590 1 521 . 1 1 68 68 ILE HD12 H 1 0.761 . . 1 . . . A 187 ILE HD12 . 11590 1 522 . 1 1 68 68 ILE HD13 H 1 0.761 . . 1 . . . A 187 ILE HD13 . 11590 1 523 . 1 1 68 68 ILE C C 13 176.467 . . 1 . . . A 187 ILE C . 11590 1 524 . 1 1 68 68 ILE CA C 13 64.006 . . 1 . . . A 187 ILE CA . 11590 1 525 . 1 1 68 68 ILE CB C 13 37.146 . . 1 . . . A 187 ILE CB . 11590 1 526 . 1 1 68 68 ILE CG1 C 13 27.400 . . 1 . . . A 187 ILE CG1 . 11590 1 527 . 1 1 68 68 ILE CG2 C 13 17.051 . . 1 . . . A 187 ILE CG2 . 11590 1 528 . 1 1 68 68 ILE CD1 C 13 13.091 . . 1 . . . A 187 ILE CD1 . 11590 1 529 . 1 1 68 68 ILE N N 15 118.528 . . 1 . . . A 187 ILE N . 11590 1 530 . 1 1 69 69 ASN H H 1 6.876 . . 1 . . . A 188 ASN H . 11590 1 531 . 1 1 69 69 ASN HA H 1 4.781 . . 1 . . . A 188 ASN HA . 11590 1 532 . 1 1 69 69 ASN HB2 H 1 2.236 . . 2 . . . A 188 ASN HB2 . 11590 1 533 . 1 1 69 69 ASN HB3 H 1 2.547 . . 2 . . . A 188 ASN HB3 . 11590 1 534 . 1 1 69 69 ASN C C 13 174.554 . . 1 . . . A 188 ASN C . 11590 1 535 . 1 1 69 69 ASN CA C 13 52.259 . . 1 . . . A 188 ASN CA . 11590 1 536 . 1 1 69 69 ASN CB C 13 39.438 . . 1 . . . A 188 ASN CB . 11590 1 537 . 1 1 69 69 ASN N N 15 116.956 . . 1 . . . A 188 ASN N . 11590 1 538 . 1 1 70 70 ALA H H 1 6.978 . . 1 . . . A 189 ALA H . 11590 1 539 . 1 1 70 70 ALA HA H 1 3.877 . . 1 . . . A 189 ALA HA . 11590 1 540 . 1 1 70 70 ALA HB1 H 1 1.047 . . 1 . . . A 189 ALA HB1 . 11590 1 541 . 1 1 70 70 ALA HB2 H 1 1.047 . . 1 . . . A 189 ALA HB2 . 11590 1 542 . 1 1 70 70 ALA HB3 H 1 1.047 . . 1 . . . A 189 ALA HB3 . 11590 1 543 . 1 1 70 70 ALA C C 13 178.877 . . 1 . . . A 189 ALA C . 11590 1 544 . 1 1 70 70 ALA CA C 13 54.983 . . 1 . . . A 189 ALA CA . 11590 1 545 . 1 1 70 70 ALA CB C 13 17.940 . . 1 . . . A 189 ALA CB . 11590 1 546 . 1 1 70 70 ALA N N 15 124.887 . . 1 . . . A 189 ALA N . 11590 1 547 . 1 1 71 71 GLY H H 1 8.895 . . 1 . . . A 190 GLY H . 11590 1 548 . 1 1 71 71 GLY HA2 H 1 3.351 . . 2 . . . A 190 GLY HA2 . 11590 1 549 . 1 1 71 71 GLY HA3 H 1 4.326 . . 2 . . . A 190 GLY HA3 . 11590 1 550 . 1 1 71 71 GLY C C 13 173.544 . . 1 . . . A 190 GLY C . 11590 1 551 . 1 1 71 71 GLY CA C 13 45.514 . . 1 . . . A 190 GLY CA . 11590 1 552 . 1 1 71 71 GLY N N 15 110.639 . . 1 . . . A 190 GLY N . 11590 1 553 . 1 1 72 72 THR H H 1 8.303 . . 1 . . . A 191 THR H . 11590 1 554 . 1 1 72 72 THR HA H 1 4.318 . . 1 . . . A 191 THR HA . 11590 1 555 . 1 1 72 72 THR HB H 1 4.056 . . 1 . . . A 191 THR HB . 11590 1 556 . 1 1 72 72 THR HG21 H 1 1.042 . . 1 . . . A 191 THR HG21 . 11590 1 557 . 1 1 72 72 THR HG22 H 1 1.042 . . 1 . . . A 191 THR HG22 . 11590 1 558 . 1 1 72 72 THR HG23 H 1 1.042 . . 1 . . . A 191 THR HG23 . 11590 1 559 . 1 1 72 72 THR C C 13 172.340 . . 1 . . . A 191 THR C . 11590 1 560 . 1 1 72 72 THR CA C 13 61.278 . . 1 . . . A 191 THR CA . 11590 1 561 . 1 1 72 72 THR CB C 13 69.678 . . 1 . . . A 191 THR CB . 11590 1 562 . 1 1 72 72 THR CG2 C 13 21.218 . . 1 . . . A 191 THR CG2 . 11590 1 563 . 1 1 72 72 THR N N 15 118.974 . . 1 . . . A 191 THR N . 11590 1 564 . 1 1 73 73 VAL H H 1 8.573 . . 1 . . . A 192 VAL H . 11590 1 565 . 1 1 73 73 VAL HA H 1 3.788 . . 1 . . . A 192 VAL HA . 11590 1 566 . 1 1 73 73 VAL HB H 1 1.848 . . 1 . . . A 192 VAL HB . 11590 1 567 . 1 1 73 73 VAL HG11 H 1 0.758 . . 2 . . . A 192 VAL HG11 . 11590 1 568 . 1 1 73 73 VAL HG12 H 1 0.758 . . 2 . . . A 192 VAL HG12 . 11590 1 569 . 1 1 73 73 VAL HG13 H 1 0.758 . . 2 . . . A 192 VAL HG13 . 11590 1 570 . 1 1 73 73 VAL HG21 H 1 0.593 . . 2 . . . A 192 VAL HG21 . 11590 1 571 . 1 1 73 73 VAL HG22 H 1 0.593 . . 2 . . . A 192 VAL HG22 . 11590 1 572 . 1 1 73 73 VAL HG23 H 1 0.593 . . 2 . . . A 192 VAL HG23 . 11590 1 573 . 1 1 73 73 VAL C C 13 175.252 . . 1 . . . A 192 VAL C . 11590 1 574 . 1 1 73 73 VAL CA C 13 63.050 . . 1 . . . A 192 VAL CA . 11590 1 575 . 1 1 73 73 VAL CB C 13 30.705 . . 1 . . . A 192 VAL CB . 11590 1 576 . 1 1 73 73 VAL CG1 C 13 21.013 . . 2 . . . A 192 VAL CG1 . 11590 1 577 . 1 1 73 73 VAL CG2 C 13 21.042 . . 2 . . . A 192 VAL CG2 . 11590 1 578 . 1 1 73 73 VAL N N 15 126.861 . . 1 . . . A 192 VAL N . 11590 1 579 . 1 1 74 74 LEU H H 1 9.330 . . 1 . . . A 193 LEU H . 11590 1 580 . 1 1 74 74 LEU HA H 1 4.559 . . 1 . . . A 193 LEU HA . 11590 1 581 . 1 1 74 74 LEU HB2 H 1 1.066 . . 2 . . . A 193 LEU HB2 . 11590 1 582 . 1 1 74 74 LEU HB3 H 1 1.834 . . 2 . . . A 193 LEU HB3 . 11590 1 583 . 1 1 74 74 LEU HG H 1 1.719 . . 1 . . . A 193 LEU HG . 11590 1 584 . 1 1 74 74 LEU HD11 H 1 0.431 . . 2 . . . A 193 LEU HD11 . 11590 1 585 . 1 1 74 74 LEU HD12 H 1 0.431 . . 2 . . . A 193 LEU HD12 . 11590 1 586 . 1 1 74 74 LEU HD13 H 1 0.431 . . 2 . . . A 193 LEU HD13 . 11590 1 587 . 1 1 74 74 LEU HD21 H 1 0.188 . . 2 . . . A 193 LEU HD21 . 11590 1 588 . 1 1 74 74 LEU HD22 H 1 0.188 . . 2 . . . A 193 LEU HD22 . 11590 1 589 . 1 1 74 74 LEU HD23 H 1 0.188 . . 2 . . . A 193 LEU HD23 . 11590 1 590 . 1 1 74 74 LEU C C 13 175.261 . . 1 . . . A 193 LEU C . 11590 1 591 . 1 1 74 74 LEU CA C 13 52.900 . . 1 . . . A 193 LEU CA . 11590 1 592 . 1 1 74 74 LEU CB C 13 43.615 . . 1 . . . A 193 LEU CB . 11590 1 593 . 1 1 74 74 LEU CG C 13 24.792 . . 1 . . . A 193 LEU CG . 11590 1 594 . 1 1 74 74 LEU CD1 C 13 22.249 . . 2 . . . A 193 LEU CD1 . 11590 1 595 . 1 1 74 74 LEU CD2 C 13 25.369 . . 2 . . . A 193 LEU CD2 . 11590 1 596 . 1 1 74 74 LEU N N 15 131.617 . . 1 . . . A 193 LEU N . 11590 1 597 . 1 1 75 75 SER H H 1 8.039 . . 1 . . . A 194 SER H . 11590 1 598 . 1 1 75 75 SER HA H 1 4.799 . . 1 . . . A 194 SER HA . 11590 1 599 . 1 1 75 75 SER HB2 H 1 4.074 . . 2 . . . A 194 SER HB2 . 11590 1 600 . 1 1 75 75 SER HB3 H 1 4.259 . . 2 . . . A 194 SER HB3 . 11590 1 601 . 1 1 75 75 SER C C 13 174.222 . . 1 . . . A 194 SER C . 11590 1 602 . 1 1 75 75 SER CA C 13 56.247 . . 1 . . . A 194 SER CA . 11590 1 603 . 1 1 75 75 SER CB C 13 64.616 . . 1 . . . A 194 SER CB . 11590 1 604 . 1 1 75 75 SER N N 15 119.047 . . 1 . . . A 194 SER N . 11590 1 605 . 1 1 76 76 LYS H H 1 9.196 . . 1 . . . A 195 LYS H . 11590 1 606 . 1 1 76 76 LYS HA H 1 4.243 . . 1 . . . A 195 LYS HA . 11590 1 607 . 1 1 76 76 LYS C C 13 175.433 . . 1 . . . A 195 LYS C . 11590 1 608 . 1 1 76 76 LYS CA C 13 62.399 . . 1 . . . A 195 LYS CA . 11590 1 609 . 1 1 76 76 LYS CB C 13 29.949 . . 1 . . . A 195 LYS CB . 11590 1 610 . 1 1 76 76 LYS N N 15 118.721 . . 1 . . . A 195 LYS N . 11590 1 611 . 1 1 77 77 PRO HA H 1 4.168 . . 1 . . . A 196 PRO HA . 11590 1 612 . 1 1 77 77 PRO HB2 H 1 1.767 . . 2 . . . A 196 PRO HB2 . 11590 1 613 . 1 1 77 77 PRO HB3 H 1 2.326 . . 2 . . . A 196 PRO HB3 . 11590 1 614 . 1 1 77 77 PRO HG2 H 1 1.894 . . 2 . . . A 196 PRO HG2 . 11590 1 615 . 1 1 77 77 PRO HG3 H 1 2.117 . . 2 . . . A 196 PRO HG3 . 11590 1 616 . 1 1 77 77 PRO HD2 H 1 3.791 . . 2 . . . A 196 PRO HD2 . 11590 1 617 . 1 1 77 77 PRO HD3 H 1 3.836 . . 2 . . . A 196 PRO HD3 . 11590 1 618 . 1 1 77 77 PRO C C 13 178.696 . . 1 . . . A 196 PRO C . 11590 1 619 . 1 1 77 77 PRO CA C 13 65.876 . . 1 . . . A 196 PRO CA . 11590 1 620 . 1 1 77 77 PRO CB C 13 30.965 . . 1 . . . A 196 PRO CB . 11590 1 621 . 1 1 77 77 PRO CG C 13 28.184 . . 1 . . . A 196 PRO CG . 11590 1 622 . 1 1 77 77 PRO CD C 13 49.820 . . 1 . . . A 196 PRO CD . 11590 1 623 . 1 1 78 78 LYS H H 1 7.312 . . 1 . . . A 197 LYS H . 11590 1 624 . 1 1 78 78 LYS HA H 1 4.106 . . 1 . . . A 197 LYS HA . 11590 1 625 . 1 1 78 78 LYS HB2 H 1 1.966 . . 2 . . . A 197 LYS HB2 . 11590 1 626 . 1 1 78 78 LYS HB3 H 1 2.097 . . 2 . . . A 197 LYS HB3 . 11590 1 627 . 1 1 78 78 LYS C C 13 179.735 . . 1 . . . A 197 LYS C . 11590 1 628 . 1 1 78 78 LYS CA C 13 59.287 . . 1 . . . A 197 LYS CA . 11590 1 629 . 1 1 78 78 LYS CB C 13 31.858 . . 1 . . . A 197 LYS CB . 11590 1 630 . 1 1 78 78 LYS CG C 13 25.372 . . 1 . . . A 197 LYS CG . 11590 1 631 . 1 1 78 78 LYS CD C 13 29.154 . . 1 . . . A 197 LYS CD . 11590 1 632 . 1 1 78 78 LYS CE C 13 41.471 . . 1 . . . A 197 LYS CE . 11590 1 633 . 1 1 78 78 LYS N N 15 117.972 . . 1 . . . A 197 LYS N . 11590 1 634 . 1 1 79 79 ILE H H 1 8.173 . . 1 . . . A 198 ILE H . 11590 1 635 . 1 1 79 79 ILE HA H 1 3.461 . . 1 . . . A 198 ILE HA . 11590 1 636 . 1 1 79 79 ILE HB H 1 1.932 . . 1 . . . A 198 ILE HB . 11590 1 637 . 1 1 79 79 ILE HG12 H 1 0.599 . . 2 . . . A 198 ILE HG12 . 11590 1 638 . 1 1 79 79 ILE HG13 H 1 1.995 . . 2 . . . A 198 ILE HG13 . 11590 1 639 . 1 1 79 79 ILE HG21 H 1 0.855 . . 1 . . . A 198 ILE HG21 . 11590 1 640 . 1 1 79 79 ILE HG22 H 1 0.855 . . 1 . . . A 198 ILE HG22 . 11590 1 641 . 1 1 79 79 ILE HG23 H 1 0.855 . . 1 . . . A 198 ILE HG23 . 11590 1 642 . 1 1 79 79 ILE HD11 H 1 0.802 . . 1 . . . A 198 ILE HD11 . 11590 1 643 . 1 1 79 79 ILE HD12 H 1 0.802 . . 1 . . . A 198 ILE HD12 . 11590 1 644 . 1 1 79 79 ILE HD13 H 1 0.802 . . 1 . . . A 198 ILE HD13 . 11590 1 645 . 1 1 79 79 ILE C C 13 177.842 . . 1 . . . A 198 ILE C . 11590 1 646 . 1 1 79 79 ILE CA C 13 65.580 . . 1 . . . A 198 ILE CA . 11590 1 647 . 1 1 79 79 ILE CB C 13 38.085 . . 1 . . . A 198 ILE CB . 11590 1 648 . 1 1 79 79 ILE CG1 C 13 29.840 . . 1 . . . A 198 ILE CG1 . 11590 1 649 . 1 1 79 79 ILE CG2 C 13 19.427 . . 1 . . . A 198 ILE CG2 . 11590 1 650 . 1 1 79 79 ILE CD1 C 13 14.887 . . 1 . . . A 198 ILE CD1 . 11590 1 651 . 1 1 79 79 ILE N N 15 119.985 . . 1 . . . A 198 ILE N . 11590 1 652 . 1 1 80 80 LEU H H 1 8.658 . . 1 . . . A 199 LEU H . 11590 1 653 . 1 1 80 80 LEU HA H 1 4.129 . . 1 . . . A 199 LEU HA . 11590 1 654 . 1 1 80 80 LEU HB2 H 1 1.576 . . 2 . . . A 199 LEU HB2 . 11590 1 655 . 1 1 80 80 LEU HB3 H 1 1.576 . . 2 . . . A 199 LEU HB3 . 11590 1 656 . 1 1 80 80 LEU HG H 1 1.488 . . 1 . . . A 199 LEU HG . 11590 1 657 . 1 1 80 80 LEU HD11 H 1 0.550 . . 2 . . . A 199 LEU HD11 . 11590 1 658 . 1 1 80 80 LEU HD12 H 1 0.550 . . 2 . . . A 199 LEU HD12 . 11590 1 659 . 1 1 80 80 LEU HD13 H 1 0.550 . . 2 . . . A 199 LEU HD13 . 11590 1 660 . 1 1 80 80 LEU HD21 H 1 0.550 . . 2 . . . A 199 LEU HD21 . 11590 1 661 . 1 1 80 80 LEU HD22 H 1 0.550 . . 2 . . . A 199 LEU HD22 . 11590 1 662 . 1 1 80 80 LEU HD23 H 1 0.550 . . 2 . . . A 199 LEU HD23 . 11590 1 663 . 1 1 80 80 LEU C C 13 178.872 . . 1 . . . A 199 LEU C . 11590 1 664 . 1 1 80 80 LEU CA C 13 58.382 . . 1 . . . A 199 LEU CA . 11590 1 665 . 1 1 80 80 LEU CB C 13 41.976 . . 1 . . . A 199 LEU CB . 11590 1 666 . 1 1 80 80 LEU CG C 13 26.399 . . 1 . . . A 199 LEU CG . 11590 1 667 . 1 1 80 80 LEU CD1 C 13 24.640 . . 2 . . . A 199 LEU CD1 . 11590 1 668 . 1 1 80 80 LEU CD2 C 13 24.640 . . 2 . . . A 199 LEU CD2 . 11590 1 669 . 1 1 80 80 LEU N N 15 120.552 . . 1 . . . A 199 LEU N . 11590 1 670 . 1 1 81 81 ASP H H 1 7.841 . . 1 . . . A 200 ASP H . 11590 1 671 . 1 1 81 81 ASP HA H 1 4.147 . . 1 . . . A 200 ASP HA . 11590 1 672 . 1 1 81 81 ASP HB2 H 1 2.450 . . 2 . . . A 200 ASP HB2 . 11590 1 673 . 1 1 81 81 ASP HB3 H 1 2.653 . . 2 . . . A 200 ASP HB3 . 11590 1 674 . 1 1 81 81 ASP C C 13 176.637 . . 1 . . . A 200 ASP C . 11590 1 675 . 1 1 81 81 ASP CA C 13 56.267 . . 1 . . . A 200 ASP CA . 11590 1 676 . 1 1 81 81 ASP CB C 13 41.422 . . 1 . . . A 200 ASP CB . 11590 1 677 . 1 1 81 81 ASP N N 15 115.587 . . 1 . . . A 200 ASP N . 11590 1 678 . 1 1 82 82 HIS H H 1 7.564 . . 1 . . . A 201 HIS H . 11590 1 679 . 1 1 82 82 HIS HA H 1 3.968 . . 1 . . . A 201 HIS HA . 11590 1 680 . 1 1 82 82 HIS HB2 H 1 2.298 . . 2 . . . A 201 HIS HB2 . 11590 1 681 . 1 1 82 82 HIS HB3 H 1 2.338 . . 2 . . . A 201 HIS HB3 . 11590 1 682 . 1 1 82 82 HIS HD2 H 1 6.182 . . 1 . . . A 201 HIS HD2 . 11590 1 683 . 1 1 82 82 HIS C C 13 175.758 . . 1 . . . A 201 HIS C . 11590 1 684 . 1 1 82 82 HIS CA C 13 58.847 . . 1 . . . A 201 HIS CA . 11590 1 685 . 1 1 82 82 HIS CB C 13 29.292 . . 1 . . . A 201 HIS CB . 11590 1 686 . 1 1 82 82 HIS CD2 C 13 121.883 . . 1 . . . A 201 HIS CD2 . 11590 1 687 . 1 1 82 82 HIS N N 15 114.083 . . 1 . . . A 201 HIS N . 11590 1 688 . 1 1 83 83 VAL H H 1 8.147 . . 1 . . . A 202 VAL H . 11590 1 689 . 1 1 83 83 VAL HA H 1 3.258 . . 1 . . . A 202 VAL HA . 11590 1 690 . 1 1 83 83 VAL HB H 1 1.584 . . 1 . . . A 202 VAL HB . 11590 1 691 . 1 1 83 83 VAL HG11 H 1 0.446 . . 2 . . . A 202 VAL HG11 . 11590 1 692 . 1 1 83 83 VAL HG12 H 1 0.446 . . 2 . . . A 202 VAL HG12 . 11590 1 693 . 1 1 83 83 VAL HG13 H 1 0.446 . . 2 . . . A 202 VAL HG13 . 11590 1 694 . 1 1 83 83 VAL HG21 H 1 -0.572 . . 2 . . . A 202 VAL HG21 . 11590 1 695 . 1 1 83 83 VAL HG22 H 1 -0.572 . . 2 . . . A 202 VAL HG22 . 11590 1 696 . 1 1 83 83 VAL HG23 H 1 -0.572 . . 2 . . . A 202 VAL HG23 . 11590 1 697 . 1 1 83 83 VAL C C 13 175.262 . . 1 . . . A 202 VAL C . 11590 1 698 . 1 1 83 83 VAL CA C 13 63.799 . . 1 . . . A 202 VAL CA . 11590 1 699 . 1 1 83 83 VAL CB C 13 31.301 . . 1 . . . A 202 VAL CB . 11590 1 700 . 1 1 83 83 VAL CG1 C 13 22.403 . . 2 . . . A 202 VAL CG1 . 11590 1 701 . 1 1 83 83 VAL CG2 C 13 19.712 . . 2 . . . A 202 VAL CG2 . 11590 1 702 . 1 1 83 83 VAL N N 15 116.574 . . 1 . . . A 202 VAL N . 11590 1 703 . 1 1 84 84 TRP H H 1 7.610 . . 1 . . . A 203 TRP H . 11590 1 704 . 1 1 84 84 TRP HA H 1 4.412 . . 1 . . . A 203 TRP HA . 11590 1 705 . 1 1 84 84 TRP HB2 H 1 3.000 . . 2 . . . A 203 TRP HB2 . 11590 1 706 . 1 1 84 84 TRP HB3 H 1 3.060 . . 2 . . . A 203 TRP HB3 . 11590 1 707 . 1 1 84 84 TRP HD1 H 1 7.029 . . 1 . . . A 203 TRP HD1 . 11590 1 708 . 1 1 84 84 TRP HE1 H 1 9.797 . . 1 . . . A 203 TRP HE1 . 11590 1 709 . 1 1 84 84 TRP HZ2 H 1 6.154 . . 1 . . . A 203 TRP HZ2 . 11590 1 710 . 1 1 84 84 TRP HZ3 H 1 6.557 . . 1 . . . A 203 TRP HZ3 . 11590 1 711 . 1 1 84 84 TRP HH2 H 1 6.532 . . 1 . . . A 203 TRP HH2 . 11590 1 712 . 1 1 84 84 TRP CA C 13 60.204 . . 1 . . . A 203 TRP CA . 11590 1 713 . 1 1 84 84 TRP CB C 13 29.381 . . 1 . . . A 203 TRP CB . 11590 1 714 . 1 1 84 84 TRP CD1 C 13 126.454 . . 1 . . . A 203 TRP CD1 . 11590 1 715 . 1 1 84 84 TRP CZ2 C 13 114.573 . . 1 . . . A 203 TRP CZ2 . 11590 1 716 . 1 1 84 84 TRP CZ3 C 13 119.741 . . 1 . . . A 203 TRP CZ3 . 11590 1 717 . 1 1 84 84 TRP CH2 C 13 122.116 . . 1 . . . A 203 TRP CH2 . 11590 1 718 . 1 1 84 84 TRP N N 15 119.816 . . 1 . . . A 203 TRP N . 11590 1 719 . 1 1 84 84 TRP NE1 N 15 129.081 . . 1 . . . A 203 TRP NE1 . 11590 1 720 . 1 1 85 85 ARG H H 1 7.439 . . 1 . . . A 204 ARG H . 11590 1 721 . 1 1 85 85 ARG HA H 1 4.021 . . 1 . . . A 204 ARG HA . 11590 1 722 . 1 1 85 85 ARG C C 13 176.468 . . 1 . . . A 204 ARG C . 11590 1 723 . 1 1 85 85 ARG CA C 13 57.082 . . 1 . . . A 204 ARG CA . 11590 1 724 . 1 1 85 85 ARG CB C 13 29.386 . . 1 . . . A 204 ARG CB . 11590 1 725 . 1 1 85 85 ARG CG C 13 26.405 . . 1 . . . A 204 ARG CG . 11590 1 726 . 1 1 85 85 ARG CD C 13 42.813 . . 1 . . . A 204 ARG CD . 11590 1 727 . 1 1 85 85 ARG N N 15 118.354 . . 1 . . . A 204 ARG N . 11590 1 728 . 1 1 86 86 TYR H H 1 7.969 . . 1 . . . A 205 TYR H . 11590 1 729 . 1 1 86 86 TYR HA H 1 4.426 . . 1 . . . A 205 TYR HA . 11590 1 730 . 1 1 86 86 TYR HB2 H 1 2.803 . . 2 . . . A 205 TYR HB2 . 11590 1 731 . 1 1 86 86 TYR HB3 H 1 3.003 . . 2 . . . A 205 TYR HB3 . 11590 1 732 . 1 1 86 86 TYR C C 13 175.048 . . 1 . . . A 205 TYR C . 11590 1 733 . 1 1 86 86 TYR CA C 13 57.512 . . 1 . . . A 205 TYR CA . 11590 1 734 . 1 1 86 86 TYR CB C 13 38.129 . . 1 . . . A 205 TYR CB . 11590 1 735 . 1 1 86 86 TYR N N 15 116.835 . . 1 . . . A 205 TYR N . 11590 1 736 . 1 1 87 87 ASP H H 1 7.968 . . 1 . . . A 206 ASP H . 11590 1 737 . 1 1 87 87 ASP HA H 1 4.516 . . 1 . . . A 206 ASP HA . 11590 1 738 . 1 1 87 87 ASP HB2 H 1 2.545 . . 2 . . . A 206 ASP HB2 . 11590 1 739 . 1 1 87 87 ASP HB3 H 1 2.545 . . 2 . . . A 206 ASP HB3 . 11590 1 740 . 1 1 87 87 ASP C C 13 175.606 . . 1 . . . A 206 ASP C . 11590 1 741 . 1 1 87 87 ASP CA C 13 53.333 . . 1 . . . A 206 ASP CA . 11590 1 742 . 1 1 87 87 ASP CB C 13 40.293 . . 1 . . . A 206 ASP CB . 11590 1 743 . 1 1 87 87 ASP N N 15 120.008 . . 1 . . . A 206 ASP N . 11590 1 744 . 1 1 88 88 PHE H H 1 7.841 . . 1 . . . A 207 PHE H . 11590 1 745 . 1 1 88 88 PHE HA H 1 4.450 . . 1 . . . A 207 PHE HA . 11590 1 746 . 1 1 88 88 PHE HB2 H 1 2.929 . . 2 . . . A 207 PHE HB2 . 11590 1 747 . 1 1 88 88 PHE HB3 H 1 3.089 . . 2 . . . A 207 PHE HB3 . 11590 1 748 . 1 1 88 88 PHE C C 13 176.458 . . 1 . . . A 207 PHE C . 11590 1 749 . 1 1 88 88 PHE CA C 13 57.566 . . 1 . . . A 207 PHE CA . 11590 1 750 . 1 1 88 88 PHE CB C 13 38.768 . . 1 . . . A 207 PHE CB . 11590 1 751 . 1 1 88 88 PHE N N 15 120.049 . . 1 . . . A 207 PHE N . 11590 1 752 . 1 1 89 89 GLY H H 1 8.331 . . 1 . . . A 208 GLY H . 11590 1 753 . 1 1 89 89 GLY HA2 H 1 3.713 . . 2 . . . A 208 GLY HA2 . 11590 1 754 . 1 1 89 89 GLY HA3 H 1 3.713 . . 2 . . . A 208 GLY HA3 . 11590 1 755 . 1 1 89 89 GLY C C 13 174.558 . . 1 . . . A 208 GLY C . 11590 1 756 . 1 1 89 89 GLY CA C 13 45.247 . . 1 . . . A 208 GLY CA . 11590 1 757 . 1 1 89 89 GLY N N 15 111.276 . . 1 . . . A 208 GLY N . 11590 1 758 . 1 1 90 90 GLY H H 1 7.045 . . 1 . . . A 209 GLY H . 11590 1 759 . 1 1 90 90 GLY HA2 H 1 3.587 . . 2 . . . A 209 GLY HA2 . 11590 1 760 . 1 1 90 90 GLY HA3 H 1 3.587 . . 2 . . . A 209 GLY HA3 . 11590 1 761 . 1 1 90 90 GLY C C 13 172.844 . . 1 . . . A 209 GLY C . 11590 1 762 . 1 1 90 90 GLY CA C 13 44.713 . . 1 . . . A 209 GLY CA . 11590 1 763 . 1 1 90 90 GLY N N 15 106.870 . . 1 . . . A 209 GLY N . 11590 1 764 . 1 1 91 91 ASP H H 1 7.682 . . 1 . . . A 210 ASP H . 11590 1 765 . 1 1 91 91 ASP HA H 1 4.628 . . 1 . . . A 210 ASP HA . 11590 1 766 . 1 1 91 91 ASP HB2 H 1 2.567 . . 2 . . . A 210 ASP HB2 . 11590 1 767 . 1 1 91 91 ASP HB3 H 1 2.728 . . 2 . . . A 210 ASP HB3 . 11590 1 768 . 1 1 91 91 ASP C C 13 176.469 . . 1 . . . A 210 ASP C . 11590 1 769 . 1 1 91 91 ASP CA C 13 52.893 . . 1 . . . A 210 ASP CA . 11590 1 770 . 1 1 91 91 ASP CB C 13 41.375 . . 1 . . . A 210 ASP CB . 11590 1 771 . 1 1 91 91 ASP N N 15 120.000 . . 1 . . . A 210 ASP N . 11590 1 772 . 1 1 92 92 VAL H H 1 8.248 . . 1 . . . A 211 VAL H . 11590 1 773 . 1 1 92 92 VAL HA H 1 3.888 . . 1 . . . A 211 VAL HA . 11590 1 774 . 1 1 92 92 VAL HB H 1 2.164 . . 1 . . . A 211 VAL HB . 11590 1 775 . 1 1 92 92 VAL HG11 H 1 0.913 . . 2 . . . A 211 VAL HG11 . 11590 1 776 . 1 1 92 92 VAL HG12 H 1 0.913 . . 2 . . . A 211 VAL HG12 . 11590 1 777 . 1 1 92 92 VAL HG13 H 1 0.913 . . 2 . . . A 211 VAL HG13 . 11590 1 778 . 1 1 92 92 VAL HG21 H 1 0.887 . . 2 . . . A 211 VAL HG21 . 11590 1 779 . 1 1 92 92 VAL HG22 H 1 0.887 . . 2 . . . A 211 VAL HG22 . 11590 1 780 . 1 1 92 92 VAL HG23 H 1 0.887 . . 2 . . . A 211 VAL HG23 . 11590 1 781 . 1 1 92 92 VAL C C 13 176.637 . . 1 . . . A 211 VAL C . 11590 1 782 . 1 1 92 92 VAL CA C 13 63.294 . . 1 . . . A 211 VAL CA . 11590 1 783 . 1 1 92 92 VAL CB C 13 31.551 . . 1 . . . A 211 VAL CB . 11590 1 784 . 1 1 92 92 VAL CG1 C 13 20.921 . . 2 . . . A 211 VAL CG1 . 11590 1 785 . 1 1 92 92 VAL CG2 C 13 19.046 . . 2 . . . A 211 VAL CG2 . 11590 1 786 . 1 1 92 92 VAL N N 15 119.006 . . 1 . . . A 211 VAL N . 11590 1 787 . 1 1 93 93 ASN H H 1 8.537 . . 1 . . . A 212 ASN H . 11590 1 788 . 1 1 93 93 ASN HA H 1 4.666 . . 1 . . . A 212 ASN HA . 11590 1 789 . 1 1 93 93 ASN HB2 H 1 2.786 . . 2 . . . A 212 ASN HB2 . 11590 1 790 . 1 1 93 93 ASN HB3 H 1 2.786 . . 2 . . . A 212 ASN HB3 . 11590 1 791 . 1 1 93 93 ASN C C 13 176.637 . . 1 . . . A 212 ASN C . 11590 1 792 . 1 1 93 93 ASN CA C 13 54.267 . . 1 . . . A 212 ASN CA . 11590 1 793 . 1 1 93 93 ASN CB C 13 37.649 . . 1 . . . A 212 ASN CB . 11590 1 794 . 1 1 93 93 ASN N N 15 120.217 . . 1 . . . A 212 ASN N . 11590 1 795 . 1 1 94 94 VAL H H 1 7.552 . . 1 . . . A 213 VAL H . 11590 1 796 . 1 1 94 94 VAL HA H 1 3.835 . . 1 . . . A 213 VAL HA . 11590 1 797 . 1 1 94 94 VAL HB H 1 1.818 . . 1 . . . A 213 VAL HB . 11590 1 798 . 1 1 94 94 VAL HG11 H 1 0.466 . . 2 . . . A 213 VAL HG11 . 11590 1 799 . 1 1 94 94 VAL HG12 H 1 0.466 . . 2 . . . A 213 VAL HG12 . 11590 1 800 . 1 1 94 94 VAL HG13 H 1 0.466 . . 2 . . . A 213 VAL HG13 . 11590 1 801 . 1 1 94 94 VAL HG21 H 1 0.201 . . 2 . . . A 213 VAL HG21 . 11590 1 802 . 1 1 94 94 VAL HG22 H 1 0.201 . . 2 . . . A 213 VAL HG22 . 11590 1 803 . 1 1 94 94 VAL HG23 H 1 0.201 . . 2 . . . A 213 VAL HG23 . 11590 1 804 . 1 1 94 94 VAL C C 13 176.637 . . 1 . . . A 213 VAL C . 11590 1 805 . 1 1 94 94 VAL CA C 13 64.741 . . 1 . . . A 213 VAL CA . 11590 1 806 . 1 1 94 94 VAL CB C 13 31.400 . . 1 . . . A 213 VAL CB . 11590 1 807 . 1 1 94 94 VAL CG1 C 13 20.518 . . 2 . . . A 213 VAL CG1 . 11590 1 808 . 1 1 94 94 VAL CG2 C 13 19.622 . . 2 . . . A 213 VAL CG2 . 11590 1 809 . 1 1 94 94 VAL N N 15 119.682 . . 1 . . . A 213 VAL N . 11590 1 810 . 1 1 95 95 VAL H H 1 7.331 . . 1 . . . A 214 VAL H . 11590 1 811 . 1 1 95 95 VAL HA H 1 3.399 . . 1 . . . A 214 VAL HA . 11590 1 812 . 1 1 95 95 VAL HB H 1 2.073 . . 1 . . . A 214 VAL HB . 11590 1 813 . 1 1 95 95 VAL HG11 H 1 0.961 . . 2 . . . A 214 VAL HG11 . 11590 1 814 . 1 1 95 95 VAL HG12 H 1 0.961 . . 2 . . . A 214 VAL HG12 . 11590 1 815 . 1 1 95 95 VAL HG13 H 1 0.961 . . 2 . . . A 214 VAL HG13 . 11590 1 816 . 1 1 95 95 VAL HG21 H 1 0.961 . . 2 . . . A 214 VAL HG21 . 11590 1 817 . 1 1 95 95 VAL HG22 H 1 0.961 . . 2 . . . A 214 VAL HG22 . 11590 1 818 . 1 1 95 95 VAL HG23 H 1 0.961 . . 2 . . . A 214 VAL HG23 . 11590 1 819 . 1 1 95 95 VAL C C 13 176.733 . . 1 . . . A 214 VAL C . 11590 1 820 . 1 1 95 95 VAL CA C 13 66.868 . . 1 . . . A 214 VAL CA . 11590 1 821 . 1 1 95 95 VAL CB C 13 31.294 . . 1 . . . A 214 VAL CB . 11590 1 822 . 1 1 95 95 VAL CG1 C 13 22.959 . . 2 . . . A 214 VAL CG1 . 11590 1 823 . 1 1 95 95 VAL CG2 C 13 22.959 . . 2 . . . A 214 VAL CG2 . 11590 1 824 . 1 1 95 95 VAL N N 15 119.648 . . 1 . . . A 214 VAL N . 11590 1 825 . 1 1 96 96 GLU H H 1 8.100 . . 1 . . . A 215 GLU H . 11590 1 826 . 1 1 96 96 GLU HA H 1 3.880 . . 1 . . . A 215 GLU HA . 11590 1 827 . 1 1 96 96 GLU HB2 H 1 1.936 . . 2 . . . A 215 GLU HB2 . 11590 1 828 . 1 1 96 96 GLU HB3 H 1 2.095 . . 2 . . . A 215 GLU HB3 . 11590 1 829 . 1 1 96 96 GLU HG2 H 1 2.288 . . 2 . . . A 215 GLU HG2 . 11590 1 830 . 1 1 96 96 GLU HG3 H 1 2.392 . . 2 . . . A 215 GLU HG3 . 11590 1 831 . 1 1 96 96 GLU C C 13 179.709 . . 1 . . . A 215 GLU C . 11590 1 832 . 1 1 96 96 GLU CA C 13 59.357 . . 1 . . . A 215 GLU CA . 11590 1 833 . 1 1 96 96 GLU CB C 13 28.646 . . 1 . . . A 215 GLU CB . 11590 1 834 . 1 1 96 96 GLU CG C 13 35.888 . . 1 . . . A 215 GLU CG . 11590 1 835 . 1 1 96 96 GLU N N 15 118.433 . . 1 . . . A 215 GLU N . 11590 1 836 . 1 1 97 97 SER H H 1 7.951 . . 1 . . . A 216 SER H . 11590 1 837 . 1 1 97 97 SER HA H 1 3.895 . . 1 . . . A 216 SER HA . 11590 1 838 . 1 1 97 97 SER HB2 H 1 3.541 . . 2 . . . A 216 SER HB2 . 11590 1 839 . 1 1 97 97 SER HB3 H 1 3.799 . . 2 . . . A 216 SER HB3 . 11590 1 840 . 1 1 97 97 SER C C 13 179.729 . . 1 . . . A 216 SER C . 11590 1 841 . 1 1 97 97 SER CA C 13 61.163 . . 1 . . . A 216 SER CA . 11590 1 842 . 1 1 97 97 SER CB C 13 61.896 . . 1 . . . A 216 SER CB . 11590 1 843 . 1 1 97 97 SER N N 15 114.674 . . 1 . . . A 216 SER N . 11590 1 844 . 1 1 98 98 TYR H H 1 8.195 . . 1 . . . A 217 TYR H . 11590 1 845 . 1 1 98 98 TYR HA H 1 3.975 . . 1 . . . A 217 TYR HA . 11590 1 846 . 1 1 98 98 TYR HB2 H 1 2.846 . . 2 . . . A 217 TYR HB2 . 11590 1 847 . 1 1 98 98 TYR HB3 H 1 3.234 . . 2 . . . A 217 TYR HB3 . 11590 1 848 . 1 1 98 98 TYR HD1 H 1 7.298 . . 3 . . . A 217 TYR HD1 . 11590 1 849 . 1 1 98 98 TYR HD2 H 1 7.298 . . 3 . . . A 217 TYR HD2 . 11590 1 850 . 1 1 98 98 TYR HE1 H 1 6.915 . . 3 . . . A 217 TYR HE1 . 11590 1 851 . 1 1 98 98 TYR HE2 H 1 6.915 . . 3 . . . A 217 TYR HE2 . 11590 1 852 . 1 1 98 98 TYR C C 13 178.702 . . 1 . . . A 217 TYR C . 11590 1 853 . 1 1 98 98 TYR CA C 13 62.505 . . 1 . . . A 217 TYR CA . 11590 1 854 . 1 1 98 98 TYR CB C 13 38.178 . . 1 . . . A 217 TYR CB . 11590 1 855 . 1 1 98 98 TYR CD1 C 13 132.657 . . 3 . . . A 217 TYR CD1 . 11590 1 856 . 1 1 98 98 TYR CD2 C 13 132.657 . . 3 . . . A 217 TYR CD2 . 11590 1 857 . 1 1 98 98 TYR CE1 C 13 118.300 . . 3 . . . A 217 TYR CE1 . 11590 1 858 . 1 1 98 98 TYR CE2 C 13 118.300 . . 3 . . . A 217 TYR CE2 . 11590 1 859 . 1 1 98 98 TYR N N 15 120.036 . . 1 . . . A 217 TYR N . 11590 1 860 . 1 1 99 99 VAL H H 1 8.730 . . 1 . . . A 218 VAL H . 11590 1 861 . 1 1 99 99 VAL HA H 1 3.378 . . 1 . . . A 218 VAL HA . 11590 1 862 . 1 1 99 99 VAL HB H 1 1.806 . . 1 . . . A 218 VAL HB . 11590 1 863 . 1 1 99 99 VAL HG11 H 1 0.478 . . 2 . . . A 218 VAL HG11 . 11590 1 864 . 1 1 99 99 VAL HG12 H 1 0.478 . . 2 . . . A 218 VAL HG12 . 11590 1 865 . 1 1 99 99 VAL HG13 H 1 0.478 . . 2 . . . A 218 VAL HG13 . 11590 1 866 . 1 1 99 99 VAL HG21 H 1 0.464 . . 2 . . . A 218 VAL HG21 . 11590 1 867 . 1 1 99 99 VAL HG22 H 1 0.464 . . 2 . . . A 218 VAL HG22 . 11590 1 868 . 1 1 99 99 VAL HG23 H 1 0.464 . . 2 . . . A 218 VAL HG23 . 11590 1 869 . 1 1 99 99 VAL C C 13 177.666 . . 1 . . . A 218 VAL C . 11590 1 870 . 1 1 99 99 VAL CA C 13 67.871 . . 1 . . . A 218 VAL CA . 11590 1 871 . 1 1 99 99 VAL CB C 13 30.606 . . 1 . . . A 218 VAL CB . 11590 1 872 . 1 1 99 99 VAL CG1 C 13 20.614 . . 2 . . . A 218 VAL CG1 . 11590 1 873 . 1 1 99 99 VAL CG2 C 13 22.551 . . 2 . . . A 218 VAL CG2 . 11590 1 874 . 1 1 99 99 VAL N N 15 120.841 . . 1 . . . A 218 VAL N . 11590 1 875 . 1 1 100 100 SER H H 1 7.767 . . 1 . . . A 219 SER H . 11590 1 876 . 1 1 100 100 SER HA H 1 4.107 . . 1 . . . A 219 SER HA . 11590 1 877 . 1 1 100 100 SER HB2 H 1 3.883 . . 2 . . . A 219 SER HB2 . 11590 1 878 . 1 1 100 100 SER HB3 H 1 3.940 . . 2 . . . A 219 SER HB3 . 11590 1 879 . 1 1 100 100 SER C C 13 177.667 . . 1 . . . A 219 SER C . 11590 1 880 . 1 1 100 100 SER CA C 13 61.943 . . 1 . . . A 219 SER CA . 11590 1 881 . 1 1 100 100 SER CB C 13 61.931 . . 1 . . . A 219 SER CB . 11590 1 882 . 1 1 100 100 SER N N 15 115.877 . . 1 . . . A 219 SER N . 11590 1 883 . 1 1 101 101 TYR H H 1 8.025 . . 1 . . . A 220 TYR H . 11590 1 884 . 1 1 101 101 TYR HA H 1 4.356 . . 1 . . . A 220 TYR HA . 11590 1 885 . 1 1 101 101 TYR HB2 H 1 3.064 . . 2 . . . A 220 TYR HB2 . 11590 1 886 . 1 1 101 101 TYR HB3 H 1 3.280 . . 2 . . . A 220 TYR HB3 . 11590 1 887 . 1 1 101 101 TYR HD1 H 1 6.670 . . 3 . . . A 220 TYR HD1 . 11590 1 888 . 1 1 101 101 TYR HD2 H 1 6.670 . . 3 . . . A 220 TYR HD2 . 11590 1 889 . 1 1 101 101 TYR HE1 H 1 6.386 . . 3 . . . A 220 TYR HE1 . 11590 1 890 . 1 1 101 101 TYR HE2 H 1 6.386 . . 3 . . . A 220 TYR HE2 . 11590 1 891 . 1 1 101 101 TYR C C 13 179.043 . . 1 . . . A 220 TYR C . 11590 1 892 . 1 1 101 101 TYR CA C 13 58.651 . . 1 . . . A 220 TYR CA . 11590 1 893 . 1 1 101 101 TYR CB C 13 36.592 . . 1 . . . A 220 TYR CB . 11590 1 894 . 1 1 101 101 TYR CD1 C 13 131.662 . . 3 . . . A 220 TYR CD1 . 11590 1 895 . 1 1 101 101 TYR CD2 C 13 131.662 . . 3 . . . A 220 TYR CD2 . 11590 1 896 . 1 1 101 101 TYR CE1 C 13 117.357 . . 3 . . . A 220 TYR CE1 . 11590 1 897 . 1 1 101 101 TYR CE2 C 13 117.357 . . 3 . . . A 220 TYR CE2 . 11590 1 898 . 1 1 101 101 TYR N N 15 122.168 . . 1 . . . A 220 TYR N . 11590 1 899 . 1 1 102 102 LEU H H 1 8.435 . . 1 . . . A 221 LEU H . 11590 1 900 . 1 1 102 102 LEU HA H 1 3.957 . . 1 . . . A 221 LEU HA . 11590 1 901 . 1 1 102 102 LEU HB2 H 1 1.568 . . 2 . . . A 221 LEU HB2 . 11590 1 902 . 1 1 102 102 LEU HB3 H 1 1.835 . . 2 . . . A 221 LEU HB3 . 11590 1 903 . 1 1 102 102 LEU HG H 1 1.693 . . 1 . . . A 221 LEU HG . 11590 1 904 . 1 1 102 102 LEU HD11 H 1 0.924 . . 2 . . . A 221 LEU HD11 . 11590 1 905 . 1 1 102 102 LEU HD12 H 1 0.924 . . 2 . . . A 221 LEU HD12 . 11590 1 906 . 1 1 102 102 LEU HD13 H 1 0.924 . . 2 . . . A 221 LEU HD13 . 11590 1 907 . 1 1 102 102 LEU HD21 H 1 0.870 . . 2 . . . A 221 LEU HD21 . 11590 1 908 . 1 1 102 102 LEU HD22 H 1 0.870 . . 2 . . . A 221 LEU HD22 . 11590 1 909 . 1 1 102 102 LEU HD23 H 1 0.870 . . 2 . . . A 221 LEU HD23 . 11590 1 910 . 1 1 102 102 LEU C C 13 179.733 . . 1 . . . A 221 LEU C . 11590 1 911 . 1 1 102 102 LEU CA C 13 57.549 . . 1 . . . A 221 LEU CA . 11590 1 912 . 1 1 102 102 LEU CB C 13 42.035 . . 1 . . . A 221 LEU CB . 11590 1 913 . 1 1 102 102 LEU CG C 13 27.108 . . 1 . . . A 221 LEU CG . 11590 1 914 . 1 1 102 102 LEU CD1 C 13 25.060 . . 2 . . . A 221 LEU CD1 . 11590 1 915 . 1 1 102 102 LEU CD2 C 13 24.461 . . 2 . . . A 221 LEU CD2 . 11590 1 916 . 1 1 102 102 LEU N N 15 118.454 . . 1 . . . A 221 LEU N . 11590 1 917 . 1 1 103 103 ARG H H 1 8.924 . . 1 . . . A 222 ARG H . 11590 1 918 . 1 1 103 103 ARG HA H 1 3.723 . . 1 . . . A 222 ARG HA . 11590 1 919 . 1 1 103 103 ARG HB2 H 1 1.867 . . 2 . . . A 222 ARG HB2 . 11590 1 920 . 1 1 103 103 ARG HB3 H 1 1.966 . . 2 . . . A 222 ARG HB3 . 11590 1 921 . 1 1 103 103 ARG HD2 H 1 3.160 . . 2 . . . A 222 ARG HD2 . 11590 1 922 . 1 1 103 103 ARG HD3 H 1 3.160 . . 2 . . . A 222 ARG HD3 . 11590 1 923 . 1 1 103 103 ARG C C 13 178.527 . . 1 . . . A 222 ARG C . 11590 1 924 . 1 1 103 103 ARG CA C 13 60.618 . . 1 . . . A 222 ARG CA . 11590 1 925 . 1 1 103 103 ARG CB C 13 29.639 . . 1 . . . A 222 ARG CB . 11590 1 926 . 1 1 103 103 ARG CD C 13 42.948 . . 1 . . . A 222 ARG CD . 11590 1 927 . 1 1 103 103 ARG N N 15 119.778 . . 1 . . . A 222 ARG N . 11590 1 928 . 1 1 104 104 ARG H H 1 7.499 . . 1 . . . A 223 ARG H . 11590 1 929 . 1 1 104 104 ARG HA H 1 3.944 . . 1 . . . A 223 ARG HA . 11590 1 930 . 1 1 104 104 ARG HB3 H 1 1.926 . . 2 . . . A 223 ARG HB3 . 11590 1 931 . 1 1 104 104 ARG C C 13 176.635 . . 1 . . . A 223 ARG C . 11590 1 932 . 1 1 104 104 ARG CA C 13 57.818 . . 1 . . . A 223 ARG CA . 11590 1 933 . 1 1 104 104 ARG CB C 13 29.929 . . 1 . . . A 223 ARG CB . 11590 1 934 . 1 1 104 104 ARG CG C 13 26.649 . . 1 . . . A 223 ARG CG . 11590 1 935 . 1 1 104 104 ARG CD C 13 42.991 . . 1 . . . A 223 ARG CD . 11590 1 936 . 1 1 104 104 ARG N N 15 115.895 . . 1 . . . A 223 ARG N . 11590 1 937 . 1 1 105 105 LYS H H 1 7.413 . . 1 . . . A 224 LYS H . 11590 1 938 . 1 1 105 105 LYS HA H 1 4.285 . . 1 . . . A 224 LYS HA . 11590 1 939 . 1 1 105 105 LYS HB3 H 1 1.580 . . 2 . . . A 224 LYS HB3 . 11590 1 940 . 1 1 105 105 LYS C C 13 177.837 . . 1 . . . A 224 LYS C . 11590 1 941 . 1 1 105 105 LYS CA C 13 58.278 . . 1 . . . A 224 LYS CA . 11590 1 942 . 1 1 105 105 LYS CB C 13 34.766 . . 1 . . . A 224 LYS CB . 11590 1 943 . 1 1 105 105 LYS CE C 13 41.726 . . 1 . . . A 224 LYS CE . 11590 1 944 . 1 1 105 105 LYS N N 15 114.538 . . 1 . . . A 224 LYS N . 11590 1 945 . 1 1 106 106 ILE H H 1 8.436 . . 1 . . . A 225 ILE H . 11590 1 946 . 1 1 106 106 ILE HA H 1 4.702 . . 1 . . . A 225 ILE HA . 11590 1 947 . 1 1 106 106 ILE HB H 1 2.110 . . 1 . . . A 225 ILE HB . 11590 1 948 . 1 1 106 106 ILE HG12 H 1 1.265 . . 2 . . . A 225 ILE HG12 . 11590 1 949 . 1 1 106 106 ILE HG13 H 1 1.468 . . 2 . . . A 225 ILE HG13 . 11590 1 950 . 1 1 106 106 ILE HG21 H 1 0.783 . . 1 . . . A 225 ILE HG21 . 11590 1 951 . 1 1 106 106 ILE HG22 H 1 0.783 . . 1 . . . A 225 ILE HG22 . 11590 1 952 . 1 1 106 106 ILE HG23 H 1 0.783 . . 1 . . . A 225 ILE HG23 . 11590 1 953 . 1 1 106 106 ILE HD11 H 1 0.655 . . 1 . . . A 225 ILE HD11 . 11590 1 954 . 1 1 106 106 ILE HD12 H 1 0.655 . . 1 . . . A 225 ILE HD12 . 11590 1 955 . 1 1 106 106 ILE HD13 H 1 0.655 . . 1 . . . A 225 ILE HD13 . 11590 1 956 . 1 1 106 106 ILE C C 13 175.074 . . 1 . . . A 225 ILE C . 11590 1 957 . 1 1 106 106 ILE CA C 13 58.361 . . 1 . . . A 225 ILE CA . 11590 1 958 . 1 1 106 106 ILE CB C 13 41.156 . . 1 . . . A 225 ILE CB . 11590 1 959 . 1 1 106 106 ILE CG1 C 13 28.441 . . 1 . . . A 225 ILE CG1 . 11590 1 960 . 1 1 106 106 ILE CG2 C 13 20.136 . . 1 . . . A 225 ILE CG2 . 11590 1 961 . 1 1 106 106 ILE CD1 C 13 14.137 . . 1 . . . A 225 ILE CD1 . 11590 1 962 . 1 1 106 106 ILE N N 15 108.418 . . 1 . . . A 225 ILE N . 11590 1 963 . 1 1 107 107 ASP H H 1 8.356 . . 1 . . . A 226 ASP H . 11590 1 964 . 1 1 107 107 ASP HA H 1 5.457 . . 1 . . . A 226 ASP HA . 11590 1 965 . 1 1 107 107 ASP HB2 H 1 1.970 . . 2 . . . A 226 ASP HB2 . 11590 1 966 . 1 1 107 107 ASP HB3 H 1 3.094 . . 2 . . . A 226 ASP HB3 . 11590 1 967 . 1 1 107 107 ASP C C 13 175.603 . . 1 . . . A 226 ASP C . 11590 1 968 . 1 1 107 107 ASP CA C 13 51.607 . . 1 . . . A 226 ASP CA . 11590 1 969 . 1 1 107 107 ASP CB C 13 41.280 . . 1 . . . A 226 ASP CB . 11590 1 970 . 1 1 107 107 ASP N N 15 124.876 . . 1 . . . A 226 ASP N . 11590 1 971 . 1 1 108 108 THR H H 1 7.045 . . 1 . . . A 227 THR H . 11590 1 972 . 1 1 108 108 THR HA H 1 4.276 . . 1 . . . A 227 THR HA . 11590 1 973 . 1 1 108 108 THR HB H 1 4.469 . . 1 . . . A 227 THR HB . 11590 1 974 . 1 1 108 108 THR HG21 H 1 0.983 . . 1 . . . A 227 THR HG21 . 11590 1 975 . 1 1 108 108 THR HG22 H 1 0.983 . . 1 . . . A 227 THR HG22 . 11590 1 976 . 1 1 108 108 THR HG23 H 1 0.983 . . 1 . . . A 227 THR HG23 . 11590 1 977 . 1 1 108 108 THR C C 13 175.603 . . 1 . . . A 227 THR C . 11590 1 978 . 1 1 108 108 THR CA C 13 60.403 . . 1 . . . A 227 THR CA . 11590 1 979 . 1 1 108 108 THR CB C 13 68.990 . . 1 . . . A 227 THR CB . 11590 1 980 . 1 1 108 108 THR CG2 C 13 21.712 . . 1 . . . A 227 THR CG2 . 11590 1 981 . 1 1 108 108 THR N N 15 106.538 . . 1 . . . A 227 THR N . 11590 1 982 . 1 1 109 109 GLY H H 1 8.561 . . 1 . . . A 228 GLY H . 11590 1 983 . 1 1 109 109 GLY HA2 H 1 3.791 . . 2 . . . A 228 GLY HA2 . 11590 1 984 . 1 1 109 109 GLY HA3 H 1 4.245 . . 2 . . . A 228 GLY HA3 . 11590 1 985 . 1 1 109 109 GLY C C 13 173.374 . . 1 . . . A 228 GLY C . 11590 1 986 . 1 1 109 109 GLY CA C 13 43.746 . . 1 . . . A 228 GLY CA . 11590 1 987 . 1 1 109 109 GLY N N 15 110.569 . . 1 . . . A 228 GLY N . 11590 1 988 . 1 1 110 110 GLU H H 1 8.468 . . 1 . . . A 229 GLU H . 11590 1 989 . 1 1 110 110 GLU HA H 1 3.946 . . 1 . . . A 229 GLU HA . 11590 1 990 . 1 1 110 110 GLU HB2 H 1 1.938 . . 2 . . . A 229 GLU HB2 . 11590 1 991 . 1 1 110 110 GLU HB3 H 1 1.938 . . 2 . . . A 229 GLU HB3 . 11590 1 992 . 1 1 110 110 GLU HG2 H 1 2.194 . . 2 . . . A 229 GLU HG2 . 11590 1 993 . 1 1 110 110 GLU HG3 H 1 2.271 . . 2 . . . A 229 GLU HG3 . 11590 1 994 . 1 1 110 110 GLU C C 13 177.151 . . 1 . . . A 229 GLU C . 11590 1 995 . 1 1 110 110 GLU CA C 13 58.180 . . 1 . . . A 229 GLU CA . 11590 1 996 . 1 1 110 110 GLU CB C 13 29.735 . . 1 . . . A 229 GLU CB . 11590 1 997 . 1 1 110 110 GLU CG C 13 36.092 . . 1 . . . A 229 GLU CG . 11590 1 998 . 1 1 110 110 GLU N N 15 118.902 . . 1 . . . A 229 GLU N . 11590 1 999 . 1 1 111 111 LYS H H 1 7.844 . . 1 . . . A 230 LYS H . 11590 1 1000 . 1 1 111 111 LYS HA H 1 4.435 . . 1 . . . A 230 LYS HA . 11590 1 1001 . 1 1 111 111 LYS HB2 H 1 1.521 . . 2 . . . A 230 LYS HB2 . 11590 1 1002 . 1 1 111 111 LYS HB3 H 1 1.674 . . 2 . . . A 230 LYS HB3 . 11590 1 1003 . 1 1 111 111 LYS HG2 H 1 1.274 . . 2 . . . A 230 LYS HG2 . 11590 1 1004 . 1 1 111 111 LYS HG3 H 1 1.358 . . 2 . . . A 230 LYS HG3 . 11590 1 1005 . 1 1 111 111 LYS HD2 H 1 1.596 . . 2 . . . A 230 LYS HD2 . 11590 1 1006 . 1 1 111 111 LYS HD3 H 1 1.596 . . 2 . . . A 230 LYS HD3 . 11590 1 1007 . 1 1 111 111 LYS HE2 H 1 2.873 . . 2 . . . A 230 LYS HE2 . 11590 1 1008 . 1 1 111 111 LYS HE3 H 1 2.873 . . 2 . . . A 230 LYS HE3 . 11590 1 1009 . 1 1 111 111 LYS C C 13 174.915 . . 1 . . . A 230 LYS C . 11590 1 1010 . 1 1 111 111 LYS CA C 13 54.142 . . 1 . . . A 230 LYS CA . 11590 1 1011 . 1 1 111 111 LYS CB C 13 32.896 . . 1 . . . A 230 LYS CB . 11590 1 1012 . 1 1 111 111 LYS CG C 13 24.561 . . 1 . . . A 230 LYS CG . 11590 1 1013 . 1 1 111 111 LYS CD C 13 28.879 . . 1 . . . A 230 LYS CD . 11590 1 1014 . 1 1 111 111 LYS CE C 13 41.512 . . 1 . . . A 230 LYS CE . 11590 1 1015 . 1 1 111 111 LYS N N 15 117.229 . . 1 . . . A 230 LYS N . 11590 1 1016 . 1 1 112 112 ARG H H 1 8.370 . . 1 . . . A 231 ARG H . 11590 1 1017 . 1 1 112 112 ARG HA H 1 4.176 . . 1 . . . A 231 ARG HA . 11590 1 1018 . 1 1 112 112 ARG HB3 H 1 1.637 . . 2 . . . A 231 ARG HB3 . 11590 1 1019 . 1 1 112 112 ARG HG3 H 1 0.981 . . 2 . . . A 231 ARG HG3 . 11590 1 1020 . 1 1 112 112 ARG HD2 H 1 2.999 . . 2 . . . A 231 ARG HD2 . 11590 1 1021 . 1 1 112 112 ARG HD3 H 1 2.999 . . 2 . . . A 231 ARG HD3 . 11590 1 1022 . 1 1 112 112 ARG C C 13 175.607 . . 1 . . . A 231 ARG C . 11590 1 1023 . 1 1 112 112 ARG CA C 13 55.581 . . 1 . . . A 231 ARG CA . 11590 1 1024 . 1 1 112 112 ARG CB C 13 30.368 . . 1 . . . A 231 ARG CB . 11590 1 1025 . 1 1 112 112 ARG CG C 13 26.410 . . 1 . . . A 231 ARG CG . 11590 1 1026 . 1 1 112 112 ARG CD C 13 43.002 . . 1 . . . A 231 ARG CD . 11590 1 1027 . 1 1 112 112 ARG N N 15 126.184 . . 1 . . . A 231 ARG N . 11590 1 1028 . 1 1 113 113 LEU H H 1 10.538 . . 1 . . . A 232 LEU H . 11590 1 1029 . 1 1 113 113 LEU HA H 1 4.990 . . 1 . . . A 232 LEU HA . 11590 1 1030 . 1 1 113 113 LEU HB2 H 1 1.437 . . 2 . . . A 232 LEU HB2 . 11590 1 1031 . 1 1 113 113 LEU HB3 H 1 1.437 . . 2 . . . A 232 LEU HB3 . 11590 1 1032 . 1 1 113 113 LEU HG H 1 1.835 . . 1 . . . A 232 LEU HG . 11590 1 1033 . 1 1 113 113 LEU HD11 H 1 0.995 . . 2 . . . A 232 LEU HD11 . 11590 1 1034 . 1 1 113 113 LEU HD12 H 1 0.995 . . 2 . . . A 232 LEU HD12 . 11590 1 1035 . 1 1 113 113 LEU HD13 H 1 0.995 . . 2 . . . A 232 LEU HD13 . 11590 1 1036 . 1 1 113 113 LEU HD21 H 1 0.840 . . 2 . . . A 232 LEU HD21 . 11590 1 1037 . 1 1 113 113 LEU HD22 H 1 0.840 . . 2 . . . A 232 LEU HD22 . 11590 1 1038 . 1 1 113 113 LEU HD23 H 1 0.840 . . 2 . . . A 232 LEU HD23 . 11590 1 1039 . 1 1 113 113 LEU C C 13 175.608 . . 1 . . . A 232 LEU C . 11590 1 1040 . 1 1 113 113 LEU CA C 13 54.153 . . 1 . . . A 232 LEU CA . 11590 1 1041 . 1 1 113 113 LEU CB C 13 44.206 . . 1 . . . A 232 LEU CB . 11590 1 1042 . 1 1 113 113 LEU CG C 13 26.578 . . 1 . . . A 232 LEU CG . 11590 1 1043 . 1 1 113 113 LEU CD1 C 13 26.227 . . 2 . . . A 232 LEU CD1 . 11590 1 1044 . 1 1 113 113 LEU CD2 C 13 22.535 . . 2 . . . A 232 LEU CD2 . 11590 1 1045 . 1 1 113 113 LEU N N 15 124.729 . . 1 . . . A 232 LEU N . 11590 1 1046 . 1 1 114 114 LEU H H 1 8.542 . . 1 . . . A 233 LEU H . 11590 1 1047 . 1 1 114 114 LEU HA H 1 4.702 . . 1 . . . A 233 LEU HA . 11590 1 1048 . 1 1 114 114 LEU HB2 H 1 0.780 . . 2 . . . A 233 LEU HB2 . 11590 1 1049 . 1 1 114 114 LEU HB3 H 1 1.427 . . 2 . . . A 233 LEU HB3 . 11590 1 1050 . 1 1 114 114 LEU HG H 1 0.879 . . 1 . . . A 233 LEU HG . 11590 1 1051 . 1 1 114 114 LEU HD11 H 1 0.150 . . 2 . . . A 233 LEU HD11 . 11590 1 1052 . 1 1 114 114 LEU HD12 H 1 0.150 . . 2 . . . A 233 LEU HD12 . 11590 1 1053 . 1 1 114 114 LEU HD13 H 1 0.150 . . 2 . . . A 233 LEU HD13 . 11590 1 1054 . 1 1 114 114 LEU HD21 H 1 -0.014 . . 2 . . . A 233 LEU HD21 . 11590 1 1055 . 1 1 114 114 LEU HD22 H 1 -0.014 . . 2 . . . A 233 LEU HD22 . 11590 1 1056 . 1 1 114 114 LEU HD23 H 1 -0.014 . . 2 . . . A 233 LEU HD23 . 11590 1 1057 . 1 1 114 114 LEU C C 13 175.774 . . 1 . . . A 233 LEU C . 11590 1 1058 . 1 1 114 114 LEU CA C 13 53.257 . . 1 . . . A 233 LEU CA . 11590 1 1059 . 1 1 114 114 LEU CB C 13 42.473 . . 1 . . . A 233 LEU CB . 11590 1 1060 . 1 1 114 114 LEU CG C 13 27.428 . . 1 . . . A 233 LEU CG . 11590 1 1061 . 1 1 114 114 LEU CD1 C 13 24.486 . . 2 . . . A 233 LEU CD1 . 11590 1 1062 . 1 1 114 114 LEU CD2 C 13 23.104 . . 2 . . . A 233 LEU CD2 . 11590 1 1063 . 1 1 114 114 LEU N N 15 123.134 . . 1 . . . A 233 LEU N . 11590 1 1064 . 1 1 115 115 HIS H H 1 9.108 . . 1 . . . A 234 HIS H . 11590 1 1065 . 1 1 115 115 HIS HA H 1 4.488 . . 1 . . . A 234 HIS HA . 11590 1 1066 . 1 1 115 115 HIS HB3 H 1 2.856 . . 2 . . . A 234 HIS HB3 . 11590 1 1067 . 1 1 115 115 HIS HD2 H 1 6.951 . . 1 . . . A 234 HIS HD2 . 11590 1 1068 . 1 1 115 115 HIS HE1 H 1 7.696 . . 1 . . . A 234 HIS HE1 . 11590 1 1069 . 1 1 115 115 HIS C C 13 174.575 . . 1 . . . A 234 HIS C . 11590 1 1070 . 1 1 115 115 HIS CA C 13 55.489 . . 1 . . . A 234 HIS CA . 11590 1 1071 . 1 1 115 115 HIS CB C 13 32.537 . . 1 . . . A 234 HIS CB . 11590 1 1072 . 1 1 115 115 HIS CD2 C 13 119.115 . . 1 . . . A 234 HIS CD2 . 11590 1 1073 . 1 1 115 115 HIS CE1 C 13 137.596 . . 1 . . . A 234 HIS CE1 . 11590 1 1074 . 1 1 115 115 HIS N N 15 126.073 . . 1 . . . A 234 HIS N . 11590 1 1075 . 1 1 116 116 THR H H 1 9.071 . . 1 . . . A 235 THR H . 11590 1 1076 . 1 1 116 116 THR HA H 1 4.321 . . 1 . . . A 235 THR HA . 11590 1 1077 . 1 1 116 116 THR HB H 1 4.035 . . 1 . . . A 235 THR HB . 11590 1 1078 . 1 1 116 116 THR HG21 H 1 0.983 . . 1 . . . A 235 THR HG21 . 11590 1 1079 . 1 1 116 116 THR HG22 H 1 0.983 . . 1 . . . A 235 THR HG22 . 11590 1 1080 . 1 1 116 116 THR HG23 H 1 0.983 . . 1 . . . A 235 THR HG23 . 11590 1 1081 . 1 1 116 116 THR C C 13 173.542 . . 1 . . . A 235 THR C . 11590 1 1082 . 1 1 116 116 THR CA C 13 61.818 . . 1 . . . A 235 THR CA . 11590 1 1083 . 1 1 116 116 THR CB C 13 69.376 . . 1 . . . A 235 THR CB . 11590 1 1084 . 1 1 116 116 THR CG2 C 13 21.761 . . 1 . . . A 235 THR CG2 . 11590 1 1085 . 1 1 116 116 THR N N 15 119.760 . . 1 . . . A 235 THR N . 11590 1 1086 . 1 1 117 117 LEU H H 1 8.683 . . 1 . . . A 236 LEU H . 11590 1 1087 . 1 1 117 117 LEU HA H 1 4.586 . . 1 . . . A 236 LEU HA . 11590 1 1088 . 1 1 117 117 LEU HB2 H 1 1.235 . . 2 . . . A 236 LEU HB2 . 11590 1 1089 . 1 1 117 117 LEU HB3 H 1 1.307 . . 2 . . . A 236 LEU HB3 . 11590 1 1090 . 1 1 117 117 LEU HG H 1 1.370 . . 1 . . . A 236 LEU HG . 11590 1 1091 . 1 1 117 117 LEU HD11 H 1 0.698 . . 2 . . . A 236 LEU HD11 . 11590 1 1092 . 1 1 117 117 LEU HD12 H 1 0.698 . . 2 . . . A 236 LEU HD12 . 11590 1 1093 . 1 1 117 117 LEU HD13 H 1 0.698 . . 2 . . . A 236 LEU HD13 . 11590 1 1094 . 1 1 117 117 LEU HD21 H 1 0.688 . . 2 . . . A 236 LEU HD21 . 11590 1 1095 . 1 1 117 117 LEU HD22 H 1 0.688 . . 2 . . . A 236 LEU HD22 . 11590 1 1096 . 1 1 117 117 LEU HD23 H 1 0.688 . . 2 . . . A 236 LEU HD23 . 11590 1 1097 . 1 1 117 117 LEU C C 13 175.605 . . 1 . . . A 236 LEU C . 11590 1 1098 . 1 1 117 117 LEU CA C 13 52.763 . . 1 . . . A 236 LEU CA . 11590 1 1099 . 1 1 117 117 LEU CB C 13 40.874 . . 1 . . . A 236 LEU CB . 11590 1 1100 . 1 1 117 117 LEU CG C 13 27.182 . . 1 . . . A 236 LEU CG . 11590 1 1101 . 1 1 117 117 LEU CD1 C 13 24.000 . . 2 . . . A 236 LEU CD1 . 11590 1 1102 . 1 1 117 117 LEU CD2 C 13 25.406 . . 2 . . . A 236 LEU CD2 . 11590 1 1103 . 1 1 117 117 LEU N N 15 130.519 . . 1 . . . A 236 LEU N . 11590 1 1104 . 1 1 119 119 GLY HA2 H 1 3.671 . . 2 . . . A 238 GLY HA2 . 11590 1 1105 . 1 1 119 119 GLY HA3 H 1 4.091 . . 2 . . . A 238 GLY HA3 . 11590 1 1106 . 1 1 119 119 GLY C C 13 173.697 . . 1 . . . A 238 GLY C . 11590 1 1107 . 1 1 119 119 GLY CA C 13 45.187 . . 1 . . . A 238 GLY CA . 11590 1 1108 . 1 1 120 120 VAL H H 1 8.135 . . 1 . . . A 239 VAL H . 11590 1 1109 . 1 1 120 120 VAL HA H 1 4.097 . . 1 . . . A 239 VAL HA . 11590 1 1110 . 1 1 120 120 VAL HB H 1 1.645 . . 1 . . . A 239 VAL HB . 11590 1 1111 . 1 1 120 120 VAL HG11 H 1 0.747 . . 2 . . . A 239 VAL HG11 . 11590 1 1112 . 1 1 120 120 VAL HG12 H 1 0.747 . . 2 . . . A 239 VAL HG12 . 11590 1 1113 . 1 1 120 120 VAL HG13 H 1 0.747 . . 2 . . . A 239 VAL HG13 . 11590 1 1114 . 1 1 120 120 VAL HG21 H 1 0.710 . . 2 . . . A 239 VAL HG21 . 11590 1 1115 . 1 1 120 120 VAL HG22 H 1 0.710 . . 2 . . . A 239 VAL HG22 . 11590 1 1116 . 1 1 120 120 VAL HG23 H 1 0.710 . . 2 . . . A 239 VAL HG23 . 11590 1 1117 . 1 1 120 120 VAL C C 13 176.123 . . 1 . . . A 239 VAL C . 11590 1 1118 . 1 1 120 120 VAL CA C 13 63.658 . . 1 . . . A 239 VAL CA . 11590 1 1119 . 1 1 120 120 VAL CB C 13 34.318 . . 1 . . . A 239 VAL CB . 11590 1 1120 . 1 1 120 120 VAL CG1 C 13 20.485 . . 2 . . . A 239 VAL CG1 . 11590 1 1121 . 1 1 120 120 VAL CG2 C 13 20.220 . . 2 . . . A 239 VAL CG2 . 11590 1 1122 . 1 1 120 120 VAL N N 15 119.250 . . 1 . . . A 239 VAL N . 11590 1 1123 . 1 1 121 121 GLY H H 1 8.146 . . 1 . . . A 240 GLY H . 11590 1 1124 . 1 1 121 121 GLY HA2 H 1 3.379 . . 2 . . . A 240 GLY HA2 . 11590 1 1125 . 1 1 121 121 GLY HA3 H 1 4.385 . . 2 . . . A 240 GLY HA3 . 11590 1 1126 . 1 1 121 121 GLY C C 13 170.536 . . 1 . . . A 240 GLY C . 11590 1 1127 . 1 1 121 121 GLY CA C 13 45.712 . . 1 . . . A 240 GLY CA . 11590 1 1128 . 1 1 121 121 GLY N N 15 106.711 . . 1 . . . A 240 GLY N . 11590 1 1129 . 1 1 122 122 TYR H H 1 8.854 . . 1 . . . A 241 TYR H . 11590 1 1130 . 1 1 122 122 TYR HA H 1 5.508 . . 1 . . . A 241 TYR HA . 11590 1 1131 . 1 1 122 122 TYR HB2 H 1 2.708 . . 2 . . . A 241 TYR HB2 . 11590 1 1132 . 1 1 122 122 TYR HB3 H 1 3.012 . . 2 . . . A 241 TYR HB3 . 11590 1 1133 . 1 1 122 122 TYR HD1 H 1 6.972 . . 3 . . . A 241 TYR HD1 . 11590 1 1134 . 1 1 122 122 TYR HD2 H 1 6.972 . . 3 . . . A 241 TYR HD2 . 11590 1 1135 . 1 1 122 122 TYR HE1 H 1 6.696 . . 3 . . . A 241 TYR HE1 . 11590 1 1136 . 1 1 122 122 TYR HE2 H 1 6.696 . . 3 . . . A 241 TYR HE2 . 11590 1 1137 . 1 1 122 122 TYR C C 13 173.714 . . 1 . . . A 241 TYR C . 11590 1 1138 . 1 1 122 122 TYR CA C 13 56.098 . . 1 . . . A 241 TYR CA . 11590 1 1139 . 1 1 122 122 TYR CB C 13 44.334 . . 1 . . . A 241 TYR CB . 11590 1 1140 . 1 1 122 122 TYR CD1 C 13 133.214 . . 3 . . . A 241 TYR CD1 . 11590 1 1141 . 1 1 122 122 TYR CD2 C 13 133.214 . . 3 . . . A 241 TYR CD2 . 11590 1 1142 . 1 1 122 122 TYR CE1 C 13 117.903 . . 3 . . . A 241 TYR CE1 . 11590 1 1143 . 1 1 122 122 TYR CE2 C 13 117.903 . . 3 . . . A 241 TYR CE2 . 11590 1 1144 . 1 1 122 122 TYR N N 15 121.653 . . 1 . . . A 241 TYR N . 11590 1 1145 . 1 1 123 123 VAL H H 1 8.935 . . 1 . . . A 242 VAL H . 11590 1 1146 . 1 1 123 123 VAL HA H 1 4.656 . . 1 . . . A 242 VAL HA . 11590 1 1147 . 1 1 123 123 VAL HB H 1 1.861 . . 1 . . . A 242 VAL HB . 11590 1 1148 . 1 1 123 123 VAL HG11 H 1 0.752 . . 2 . . . A 242 VAL HG11 . 11590 1 1149 . 1 1 123 123 VAL HG12 H 1 0.752 . . 2 . . . A 242 VAL HG12 . 11590 1 1150 . 1 1 123 123 VAL HG13 H 1 0.752 . . 2 . . . A 242 VAL HG13 . 11590 1 1151 . 1 1 123 123 VAL HG21 H 1 0.601 . . 2 . . . A 242 VAL HG21 . 11590 1 1152 . 1 1 123 123 VAL HG22 H 1 0.601 . . 2 . . . A 242 VAL HG22 . 11590 1 1153 . 1 1 123 123 VAL HG23 H 1 0.601 . . 2 . . . A 242 VAL HG23 . 11590 1 1154 . 1 1 123 123 VAL C C 13 170.618 . . 1 . . . A 242 VAL C . 11590 1 1155 . 1 1 123 123 VAL CA C 13 59.453 . . 1 . . . A 242 VAL CA . 11590 1 1156 . 1 1 123 123 VAL CB C 13 35.580 . . 1 . . . A 242 VAL CB . 11590 1 1157 . 1 1 123 123 VAL CG1 C 13 18.583 . . 2 . . . A 242 VAL CG1 . 11590 1 1158 . 1 1 123 123 VAL CG2 C 13 20.278 . . 2 . . . A 242 VAL CG2 . 11590 1 1159 . 1 1 123 123 VAL N N 15 117.885 . . 1 . . . A 242 VAL N . 11590 1 1160 . 1 1 124 124 LEU H H 1 8.826 . . 1 . . . A 243 LEU H . 11590 1 1161 . 1 1 124 124 LEU HA H 1 5.246 . . 1 . . . A 243 LEU HA . 11590 1 1162 . 1 1 124 124 LEU HB2 H 1 0.718 . . 2 . . . A 243 LEU HB2 . 11590 1 1163 . 1 1 124 124 LEU HB3 H 1 1.537 . . 2 . . . A 243 LEU HB3 . 11590 1 1164 . 1 1 124 124 LEU HG H 1 0.722 . . 1 . . . A 243 LEU HG . 11590 1 1165 . 1 1 124 124 LEU HD11 H 1 0.396 . . 2 . . . A 243 LEU HD11 . 11590 1 1166 . 1 1 124 124 LEU HD12 H 1 0.396 . . 2 . . . A 243 LEU HD12 . 11590 1 1167 . 1 1 124 124 LEU HD13 H 1 0.396 . . 2 . . . A 243 LEU HD13 . 11590 1 1168 . 1 1 124 124 LEU HD21 H 1 0.193 . . 2 . . . A 243 LEU HD21 . 11590 1 1169 . 1 1 124 124 LEU HD22 H 1 0.193 . . 2 . . . A 243 LEU HD22 . 11590 1 1170 . 1 1 124 124 LEU HD23 H 1 0.193 . . 2 . . . A 243 LEU HD23 . 11590 1 1171 . 1 1 124 124 LEU C C 13 174.922 . . 1 . . . A 243 LEU C . 11590 1 1172 . 1 1 124 124 LEU CA C 13 52.487 . . 1 . . . A 243 LEU CA . 11590 1 1173 . 1 1 124 124 LEU CB C 13 43.147 . . 1 . . . A 243 LEU CB . 11590 1 1174 . 1 1 124 124 LEU CG C 13 26.250 . . 1 . . . A 243 LEU CG . 11590 1 1175 . 1 1 124 124 LEU CD1 C 13 24.171 . . 2 . . . A 243 LEU CD1 . 11590 1 1176 . 1 1 124 124 LEU CD2 C 13 27.140 . . 2 . . . A 243 LEU CD2 . 11590 1 1177 . 1 1 124 124 LEU N N 15 132.041 . . 1 . . . A 243 LEU N . 11590 1 1178 . 1 1 125 125 ARG H H 1 9.559 . . 1 . . . A 244 ARG H . 11590 1 1179 . 1 1 125 125 ARG HA H 1 4.796 . . 1 . . . A 244 ARG HA . 11590 1 1180 . 1 1 125 125 ARG HB2 H 1 1.745 . . 2 . . . A 244 ARG HB2 . 11590 1 1181 . 1 1 125 125 ARG HB3 H 1 1.789 . . 2 . . . A 244 ARG HB3 . 11590 1 1182 . 1 1 125 125 ARG HG2 H 1 1.371 . . 2 . . . A 244 ARG HG2 . 11590 1 1183 . 1 1 125 125 ARG HG3 H 1 1.371 . . 2 . . . A 244 ARG HG3 . 11590 1 1184 . 1 1 125 125 ARG HD2 H 1 2.843 . . 2 . . . A 244 ARG HD2 . 11590 1 1185 . 1 1 125 125 ARG HD3 H 1 2.843 . . 2 . . . A 244 ARG HD3 . 11590 1 1186 . 1 1 125 125 ARG C C 13 174.058 . . 1 . . . A 244 ARG C . 11590 1 1187 . 1 1 125 125 ARG CA C 13 55.163 . . 1 . . . A 244 ARG CA . 11590 1 1188 . 1 1 125 125 ARG CB C 13 32.533 . . 1 . . . A 244 ARG CB . 11590 1 1189 . 1 1 125 125 ARG CG C 13 25.682 . . 1 . . . A 244 ARG CG . 11590 1 1190 . 1 1 125 125 ARG CD C 13 43.338 . . 1 . . . A 244 ARG CD . 11590 1 1191 . 1 1 125 125 ARG N N 15 123.657 . . 1 . . . A 244 ARG N . 11590 1 1192 . 1 1 126 126 GLU H H 1 9.053 . . 1 . . . A 245 GLU H . 11590 1 1193 . 1 1 126 126 GLU HA H 1 4.515 . . 1 . . . A 245 GLU HA . 11590 1 1194 . 1 1 126 126 GLU HB2 H 1 1.830 . . 2 . . . A 245 GLU HB2 . 11590 1 1195 . 1 1 126 126 GLU HB3 H 1 2.037 . . 2 . . . A 245 GLU HB3 . 11590 1 1196 . 1 1 126 126 GLU HG2 H 1 2.064 . . 2 . . . A 245 GLU HG2 . 11590 1 1197 . 1 1 126 126 GLU HG3 H 1 2.229 . . 2 . . . A 245 GLU HG3 . 11590 1 1198 . 1 1 126 126 GLU C C 13 174.741 . . 1 . . . A 245 GLU C . 11590 1 1199 . 1 1 126 126 GLU CA C 13 54.745 . . 1 . . . A 245 GLU CA . 11590 1 1200 . 1 1 126 126 GLU CB C 13 29.211 . . 1 . . . A 245 GLU CB . 11590 1 1201 . 1 1 126 126 GLU CG C 13 37.050 . . 1 . . . A 245 GLU CG . 11590 1 1202 . 1 1 126 126 GLU N N 15 122.096 . . 1 . . . A 245 GLU N . 11590 1 1203 . 1 1 127 127 PRO HA H 1 4.385 . . 1 . . . A 246 PRO HA . 11590 1 1204 . 1 1 127 127 PRO HB2 H 1 1.968 . . 2 . . . A 246 PRO HB2 . 11590 1 1205 . 1 1 127 127 PRO HB3 H 1 2.263 . . 2 . . . A 246 PRO HB3 . 11590 1 1206 . 1 1 127 127 PRO HG2 H 1 2.065 . . 2 . . . A 246 PRO HG2 . 11590 1 1207 . 1 1 127 127 PRO HG3 H 1 2.065 . . 2 . . . A 246 PRO HG3 . 11590 1 1208 . 1 1 127 127 PRO HD2 H 1 3.615 . . 2 . . . A 246 PRO HD2 . 11590 1 1209 . 1 1 127 127 PRO HD3 H 1 4.059 . . 2 . . . A 246 PRO HD3 . 11590 1 1210 . 1 1 127 127 PRO C C 13 175.592 . . 1 . . . A 246 PRO C . 11590 1 1211 . 1 1 127 127 PRO CA C 13 62.892 . . 1 . . . A 246 PRO CA . 11590 1 1212 . 1 1 127 127 PRO CB C 13 31.660 . . 1 . . . A 246 PRO CB . 11590 1 1213 . 1 1 127 127 PRO CG C 13 27.466 . . 1 . . . A 246 PRO CG . 11590 1 1214 . 1 1 127 127 PRO CD C 13 50.267 . . 1 . . . A 246 PRO CD . 11590 1 1215 . 1 1 128 128 ARG H H 1 7.940 . . 1 . . . A 247 ARG H . 11590 1 1216 . 1 1 128 128 ARG HA H 1 4.050 . . 1 . . . A 247 ARG HA . 11590 1 1217 . 1 1 128 128 ARG HB2 H 1 1.610 . . 2 . . . A 247 ARG HB2 . 11590 1 1218 . 1 1 128 128 ARG HB3 H 1 1.738 . . 2 . . . A 247 ARG HB3 . 11590 1 1219 . 1 1 128 128 ARG C C 13 181.105 . . 1 . . . A 247 ARG C . 11590 1 1220 . 1 1 128 128 ARG CA C 13 57.116 . . 1 . . . A 247 ARG CA . 11590 1 1221 . 1 1 128 128 ARG CB C 13 31.260 . . 1 . . . A 247 ARG CB . 11590 1 1222 . 1 1 128 128 ARG CG C 13 27.208 . . 1 . . . A 247 ARG CG . 11590 1 1223 . 1 1 128 128 ARG CD C 13 43.019 . . 1 . . . A 247 ARG CD . 11590 1 1224 . 1 1 128 128 ARG N N 15 126.670 . . 1 . . . A 247 ARG N . 11590 1 stop_ save_